#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f9d s SER 2 N 0.00 7.04 1.00 0.00 0.01 -1.22 -4.88 113.70 115.65 1f9d s SER 2 Ca 0.00 1.80 -0.11 0.00 1.31 0.00 0.00 55.95 58.95 1f9d s SER 2 Cb 0.00 -2.56 0.19 0.00 0.21 0.00 0.00 66.02 63.86 1f9d s SER 2 CO 0.00 -0.29 1.11 -0.94 0.41 0.00 0.00 173.24 173.53 1f9d s SER 3 N -1.87 2.26 0.54 2.44 1.04 -1.26 -4.96 113.70 111.89 1f9d s SER 3 Ca 0.57 1.98 -0.20 0.00 0.48 0.00 0.00 55.95 58.78 1f9d s SER 3 Cb -0.15 -2.49 -0.06 0.00 0.10 0.00 0.00 66.02 63.43 1f9d s SER 3 CO 0.19 -3.48 1.14 -2.84 0.98 0.00 0.00 173.24 169.23 1f9d s PRO 4 N -4.58 3.35 0.13 4.02 0.02 -1.26 -5.05 135.00 131.63 1f9d s PRO 4 Ca 0.67 1.64 0.10 0.00 0.02 0.00 0.00 61.00 63.44 1f9d s PRO 4 Cb -0.24 -2.02 -0.04 0.00 0.02 0.00 0.00 34.50 32.22 1f9d s PRO 4 CO 0.60 -0.86 -0.24 0.00 -0.33 0.00 0.00 177.00 176.17 1f9d s ALA 5 N -1.74 2.20 -0.07 -1.55 0.00 -1.26 -4.68 121.76 114.65 1f9d s ALA 5 Ca 0.73 -1.43 -0.29 0.00 0.00 0.00 0.00 51.96 50.97 1f9d s ALA 5 Cb -0.25 -0.32 -0.07 0.00 0.00 0.00 0.00 23.12 22.48 1f9d s ALA 5 CO 0.28 0.45 2.08 1.21 0.00 0.00 0.00 175.76 179.78 1f9d s ASN 6 N -2.14 6.01 0.26 0.00 3.84 0.25 -4.87 114.94 118.29 1f9d s ASN 6 Ca 0.13 2.34 -0.02 0.00 0.21 0.00 0.00 52.86 55.51 1f9d s ASN 6 Cb -0.09 -2.52 0.42 0.00 -0.55 0.00 0.00 41.25 38.50 1f9d s ASN 6 CO 0.06 -1.45 1.87 0.50 -2.79 0.00 0.00 177.10 175.28 1f9d h LYS 7 N 12.57 1.07 0.28 0.43 1.63 -1.90 -1.90 116.57 128.75 1f9d h LYS 7 Ca -0.46 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 59.27 1f9d h LYS 7 Cb 1.24 -0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 32.62 1f9d h LYS 7 CO 0.95 0.71 -0.21 0.28 -3.45 0.00 0.00 179.45 177.72 1f9d h VAL 8 N 1.10 0.55 0.00 2.00 2.07 -1.97 -2.00 116.25 118.00 1f9d h VAL 8 Ca 0.43 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.87 1f9d h VAL 8 Cb 0.23 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1f9d h VAL 8 CO -0.19 0.00 -0.40 1.88 0.02 0.00 0.00 177.57 178.88 1f9d h TYR 9 N -0.50 0.00 -0.34 1.57 0.05 -1.86 -2.53 116.97 113.36 1f9d h TYR 9 Ca -0.02 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.71 1f9d h TYR 9 Cb 0.43 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.16 1f9d h TYR 9 CO -0.12 0.40 0.02 0.37 -1.05 0.00 0.00 178.16 177.78 1f9d h GLN 10 N 0.00 0.59 -0.82 4.88 4.15 -1.26 -0.83 115.11 121.82 1f9d h GLN 10 Ca -0.00 -0.18 0.01 0.00 0.77 0.00 0.00 58.65 59.25 1f9d h GLN 10 Cb 1.07 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.66 1f9d h GLN 10 CO 0.05 0.70 0.54 -0.44 -1.93 0.00 0.00 178.83 177.75 1f9d h ASP 11 N 0.41 0.93 -0.28 -0.69 3.32 -1.18 0.50 116.42 119.43 1f9d h ASP 11 Ca 0.10 -0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.02 1f9d h ASP 11 Cb 0.41 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1f9d h ASP 11 CO 0.01 0.66 -0.21 0.03 -1.72 0.00 0.00 179.24 178.02 1f9d h ARG 12 N 1.09 0.74 0.03 3.56 3.08 -1.11 -0.53 114.38 121.24 1f9d h ARG 12 Ca 0.31 -0.29 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1f9d h ARG 12 Cb -0.09 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 29.92 1f9d h ARG 12 CO -0.07 0.89 -0.01 0.35 -1.07 0.00 0.00 179.97 180.06 1f9d h PHE 13 N 0.65 -0.03 -0.77 3.04 3.57 -0.06 -2.15 116.94 121.20 1f9d h PHE 13 Ca 0.09 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.69 1f9d h PHE 13 Cb 0.71 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.41 1f9d h PHE 13 CO 0.04 0.22 0.50 0.93 -2.23 0.00 0.00 178.31 177.77 1f9d h GLU 14 N -0.28 0.66 -0.19 1.11 5.08 -0.77 0.13 114.58 120.31 1f9d h GLU 14 Ca -0.00 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1f9d h GLU 14 Cb 0.26 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 1f9d h GLU 14 CO 0.01 0.44 -0.09 1.03 -1.00 0.00 0.00 179.01 179.39 1f9d h SER 15 N 0.68 0.42 -0.61 1.42 0.87 -0.96 -2.13 113.55 113.23 1f9d h SER 15 Ca 0.35 -0.41 -0.03 0.00 -1.23 0.00 0.00 61.79 60.47 1f9d h SER 15 Cb 0.46 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.28 1f9d h SER 15 CO -0.13 0.74 0.27 0.24 -0.53 0.00 0.00 176.83 177.42 1f9d h MET 16 N 0.10 0.90 -0.94 2.24 2.86 -0.71 -1.70 114.93 117.67 1f9d h MET 16 Ca 0.04 -0.15 0.06 0.00 -2.06 0.00 0.00 59.70 57.60 1f9d h MET 16 Cb 0.58 -0.15 -0.06 0.00 0.06 0.00 0.00 31.60 32.02 1f9d h MET 16 CO 0.03 0.74 0.60 -0.92 1.06 0.00 0.00 176.91 178.42 1f9d h TYR 17 N 0.84 1.12 -0.46 -0.22 3.20 -0.68 0.82 116.97 121.59 1f9d h TYR 17 Ca 0.21 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.99 1f9d h TYR 17 Cb 0.16 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 1f9d h TYR 17 CO 0.01 0.58 -0.19 0.77 -1.64 0.00 0.00 178.16 177.69 1f9d h SER 18 N 1.10 0.91 -0.31 -2.11 0.02 -0.93 -1.57 113.55 110.67 1f9d h SER 18 Ca 0.41 -0.32 -0.14 0.00 -0.84 0.00 0.00 61.79 60.89 1f9d h SER 18 Cb 0.15 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1f9d h SER 18 CO -0.17 1.08 -0.32 0.11 -1.14 0.00 0.00 176.83 176.39 1f9d h LYS 19 N 0.79 0.84 -0.46 3.45 1.57 -0.56 -0.64 116.57 121.55 1f9d h LYS 19 Ca 0.11 -0.40 -0.14 0.00 -1.87 0.00 0.00 60.65 58.35 1f9d h LYS 19 Cb 0.73 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 1f9d h LYS 19 CO 0.06 1.04 -0.25 0.82 -0.57 0.00 0.00 179.45 180.54 1f9d h ILE 20 N 0.70 1.27 0.00 1.86 2.04 -0.72 -3.13 117.51 119.53 1f9d h ILE 20 Ca 0.07 -1.42 0.00 0.00 1.00 0.00 0.00 64.86 64.51 1f9d h ILE 20 Cb 0.88 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.14 1f9d h ILE 20 CO 0.08 0.49 -0.29 0.29 0.00 0.00 0.00 178.15 178.72 1f9d n LYS 21 N -4.10 0.03 -1.66 2.37 4.76 -0.60 -4.55 118.16 114.40 1f9d n LYS 21 Ca -0.01 0.01 -0.43 0.00 -2.87 0.00 0.00 58.31 55.02 1f9d n LYS 21 Cb 0.48 -1.52 -0.03 0.00 -1.84 0.00 0.00 35.03 32.12 1f9d n LYS 21 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1f9d s ASP 22 N -3.12 5.84 0.51 4.39 -1.08 -0.25 -4.86 116.67 118.10 1f9d s ASP 22 Ca 0.12 2.14 0.28 0.00 -0.52 0.00 0.00 52.55 54.57 1f9d s ASP 22 Cb 0.18 -2.52 1.40 0.00 -1.46 0.00 0.00 42.92 40.51 1f9d s ASP 22 CO 0.63 -1.61 1.89 -0.65 0.52 0.00 0.00 175.17 175.95 1f9d h PRO 23 N 13.29 0.08 0.00 4.34 0.11 -1.89 0.81 132.00 148.74 1f9d h PRO 23 Ca -0.44 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 1f9d h PRO 23 Cb 1.23 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1f9d h PRO 23 CO 0.96 0.05 -0.04 0.00 -0.21 0.00 0.00 178.00 178.76 1f9d h ALA 24 N 1.58 1.00 0.00 -0.75 0.00 -1.96 -3.10 119.26 116.03 1f9d h ALA 24 Ca 0.42 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 1f9d h ALA 24 Cb 1.55 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 1f9d h ALA 24 CO -0.04 0.05 -0.37 -0.91 0.00 0.00 0.00 179.25 177.98 1f9d h ASN 25 N 0.00 0.00 -2.30 0.00 2.35 -1.13 -3.49 115.58 111.02 1f9d h ASN 25 Ca -0.00 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.53 1f9d h ASN 25 Cb 0.67 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.06 1f9d h ASN 25 CO 0.01 0.05 -0.31 0.61 -1.65 0.00 0.00 177.43 176.14 1f9d n GLY 26 N 1.14 0.01 0.20 2.83 0.00 -1.17 -4.94 105.19 103.26 1f9d n GLY 26 Ca 0.02 -0.34 0.10 0.00 0.00 0.00 0.00 46.02 45.80 1f9d n GLY 26 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1f9d h TYR 27 N -0.53 0.00 -3.46 1.61 0.05 -1.82 -3.44 116.97 109.39 1f9d h TYR 27 Ca -0.28 0.00 -0.66 0.00 0.05 0.00 0.00 58.73 57.84 1f9d h TYR 27 Cb 1.19 0.00 -0.17 0.00 1.01 0.00 0.00 36.73 38.76 1f9d h TYR 27 CO 0.28 0.16 -0.78 -0.06 -1.05 0.00 0.00 178.16 176.70 1f9d s PHE 28 N -3.24 2.53 0.94 4.88 0.40 -1.26 -0.69 117.98 121.53 1f9d s PHE 28 Ca 0.05 -0.27 -0.15 0.00 -0.60 0.00 0.00 56.93 55.96 1f9d s PHE 28 Cb 0.07 -1.30 0.18 0.00 0.51 0.00 0.00 43.02 42.47 1f9d s PHE 28 CO 0.67 0.44 1.29 -1.54 0.70 0.00 0.00 175.22 176.78 1f9d s SER 29 N -2.40 3.35 0.54 1.36 1.04 0.36 -4.90 113.70 113.05 1f9d s SER 29 Ca 0.20 0.39 0.32 0.00 0.48 0.00 0.00 55.95 57.34 1f9d s SER 29 Cb -0.10 -0.54 1.51 0.00 0.10 0.00 0.00 66.02 67.00 1f9d s SER 29 CO 0.11 -2.60 2.06 1.05 0.98 0.00 0.00 173.24 174.84 1f9d h GLU 30 N -1.55 0.00 -0.04 4.02 4.11 -1.98 -1.92 114.58 117.21 1f9d h GLU 30 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 1f9d h GLU 30 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1f9d h GLU 30 CO 0.44 0.08 0.00 1.04 0.07 0.00 0.00 179.01 180.64 1f9d n GLN 31 N -3.33 1.44 -0.61 1.06 6.02 -1.26 -4.91 117.38 115.79 1f9d n GLN 31 Ca -0.01 -0.65 0.00 0.00 -0.01 0.00 0.00 57.00 56.33 1f9d n GLN 31 Cb 0.26 -1.44 0.00 0.00 1.02 0.00 0.00 30.24 30.08 1f9d n GLN 31 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1f9d n GLY 32 N 1.08 0.66 3.74 1.08 0.00 -0.72 -5.06 105.19 105.96 1f9d n GLY 32 Ca 0.19 -0.31 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 1f9d n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1f9d s ILE 33 N -2.00 5.26 0.28 -0.61 1.01 -1.26 -4.81 121.20 119.06 1f9d s ILE 33 Ca 0.00 0.68 -0.29 0.00 0.00 0.00 0.00 60.65 61.04 1f9d s ILE 33 Cb 0.00 -3.69 -0.09 0.00 0.01 0.00 0.00 42.46 38.69 1f9d s ILE 33 CO 0.00 0.39 1.04 -2.16 0.00 0.00 0.00 174.94 174.21 1f9d s PRO 34 N 0.37 4.66 0.55 2.79 0.04 -1.26 -0.49 135.00 141.67 1f9d s PRO 34 Ca 0.20 1.66 -0.07 0.00 0.04 0.00 0.00 61.00 62.82 1f9d s PRO 34 Cb -0.14 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.24 1f9d s PRO 34 CO 0.06 0.28 0.89 0.71 0.04 0.00 0.00 177.00 178.98 1f9d s TYR 35 N -1.24 3.49 0.23 0.56 2.02 0.13 -4.59 117.35 117.96 1f9d s TYR 35 Ca 0.45 0.90 -0.06 0.00 -0.37 0.00 0.00 57.07 57.99 1f9d s TYR 35 Cb -0.29 -2.55 0.22 0.00 -0.40 0.00 0.00 41.96 38.95 1f9d s TYR 35 CO 0.36 -0.56 1.84 1.25 -1.57 0.00 0.00 175.55 176.87 1f9d h HIS 36 N -0.05 1.20 -2.63 2.71 -0.00 -1.10 -3.38 115.15 111.89 1f9d h HIS 36 Ca -0.46 -0.05 -0.06 0.00 -0.00 0.00 0.00 60.37 59.80 1f9d h HIS 36 Cb 1.22 -0.37 -0.16 0.00 -0.00 0.00 0.00 27.41 28.09 1f9d h HIS 36 CO 0.57 0.86 0.08 -1.54 -0.00 0.00 0.00 177.93 177.90 1f9d s SER 37 N -6.31 -0.50 0.10 3.26 1.04 -1.07 -0.47 113.70 109.75 1f9d s SER 37 Ca -0.12 0.28 -0.22 0.00 0.48 0.00 0.00 55.95 56.37 1f9d s SER 37 Cb 0.16 0.51 -0.11 0.00 0.10 0.00 0.00 66.02 66.68 1f9d s SER 37 CO 0.83 -0.72 1.72 0.40 0.98 0.00 0.00 173.24 176.46 1f9d h ILE 38 N 2.77 1.05 -3.41 -1.02 2.04 -1.73 -3.41 117.51 113.80 1f9d h ILE 38 Ca -0.30 -0.13 -0.52 0.00 1.00 0.00 0.00 64.86 64.90 1f9d h ILE 38 Cb 1.21 0.97 0.04 0.00 -0.74 0.00 0.00 36.82 38.30 1f9d h ILE 38 CO 0.40 0.05 0.70 -1.61 0.00 0.00 0.00 178.15 177.68 1f9d s GLU 39 N -6.04 4.34 0.02 2.37 8.01 -1.26 -4.91 118.70 121.23 1f9d s GLU 39 Ca -0.13 2.17 -0.06 0.00 0.01 0.00 0.00 54.97 56.96 1f9d s GLU 39 Cb 0.07 -3.15 -0.29 0.00 -4.31 0.00 0.00 34.13 26.44 1f9d s GLU 39 CO 0.68 -0.32 0.92 1.79 0.01 0.00 0.00 175.26 178.34 1f9d h THR 40 N 3.61 1.22 -0.65 3.63 1.35 -1.90 -3.38 112.91 116.78 1f9d h THR 40 Ca -0.45 -2.81 -0.39 0.00 -0.55 0.00 0.00 66.41 62.21 1f9d h THR 40 Cb 1.22 2.84 -0.05 0.00 -1.73 0.00 0.00 68.15 70.42 1f9d h THR 40 CO 0.77 0.84 1.14 -0.22 -0.25 0.00 0.00 175.52 177.80 1f9d s LEU 41 N -7.14 3.22 -0.07 3.87 2.96 -1.26 -1.60 118.68 118.67 1f9d s LEU 41 Ca -0.09 -1.43 -0.03 0.00 -0.22 0.00 0.00 54.13 52.36 1f9d s LEU 41 Cb 0.06 -2.58 0.04 0.00 0.50 0.00 0.00 46.19 44.22 1f9d s LEU 41 CO 0.87 -2.61 0.13 -0.32 -1.32 0.00 0.00 176.35 173.10 1f9d s MET 42 N 6.23 -0.00 -0.04 1.98 -2.45 -1.26 -4.92 119.30 118.84 1f9d s MET 42 Ca 0.65 0.50 -0.01 0.00 -1.25 0.00 0.00 55.69 55.57 1f9d s MET 42 Cb -0.02 -0.35 0.03 0.00 1.25 0.00 0.00 34.83 35.74 1f9d s MET 42 CO 0.06 -0.31 0.04 0.08 1.05 0.00 0.00 175.02 175.94 1f9d s VAL 43 N 2.22 0.00 0.00 10.11 1.01 -1.26 -1.55 120.40 130.93 1f9d s VAL 43 Ca 0.03 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1f9d s VAL 43 Cb -0.12 -0.21 0.00 0.00 0.00 0.00 0.00 36.38 36.05 1f9d s VAL 43 CO -0.05 0.17 0.00 -1.84 0.00 0.00 0.00 175.10 173.39 1f9d n GLU 44 N 4.97 0.00 0.04 2.72 0.28 -1.26 -5.00 120.64 122.39 1f9d n GLU 44 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.90 1f9d n GLU 44 Cb 0.50 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.37 1f9d n GLU 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1f9d n ALA 45 N -0.71 2.21 -1.91 -1.84 0.00 -1.26 -4.89 120.51 112.11 1f9d n ALA 45 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1f9d n ALA 45 Cb 0.00 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.52 1f9d n ALA 45 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1f9d s PRO 46 N -1.23 2.22 -0.14 0.00 0.04 -1.26 -4.86 135.00 129.77 1f9d s PRO 46 Ca 0.00 0.08 0.16 0.00 0.04 0.00 0.00 61.00 61.28 1f9d s PRO 46 Cb 0.00 -2.03 0.39 0.00 0.04 0.00 0.00 34.50 32.90 1f9d s PRO 46 CO 0.00 -1.37 1.28 -0.40 0.04 0.00 0.00 177.00 176.55 1f9d n ASP 47 N -3.13 3.10 -3.69 6.66 5.68 -1.26 -4.37 116.55 119.54 1f9d n ASP 47 Ca 0.08 -2.91 -0.11 0.00 -0.50 0.00 0.00 54.79 51.34 1f9d n ASP 47 Cb 0.60 -0.44 -0.09 0.00 -1.14 0.00 0.00 41.12 40.04 1f9d n ASP 47 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1f9d s TYR 48 N -2.60 -0.66 0.41 2.11 5.04 -0.59 -4.60 117.35 116.45 1f9d s TYR 48 Ca 0.34 1.48 0.10 0.00 -2.44 0.00 0.00 57.07 56.54 1f9d s TYR 48 Cb 0.28 0.29 0.85 0.00 0.35 0.00 0.00 41.96 43.73 1f9d s TYR 48 CO 0.07 -0.34 1.97 0.78 -1.34 0.00 0.00 175.55 176.69 1f9d h GLY 49 N 6.17 0.30 -3.66 8.97 0.00 -1.37 -3.15 103.07 110.33 1f9d h GLY 49 Ca -0.31 -0.16 -0.43 0.00 0.00 0.00 0.00 47.33 46.43 1f9d h GLY 49 CO 0.21 0.15 0.55 1.42 0.00 0.00 0.00 176.54 178.87 1f9d n HIS 50 N -4.35 2.55 -3.11 5.60 8.25 -1.26 -2.57 115.22 120.33 1f9d n HIS 50 Ca -0.00 -1.63 -0.19 0.00 -0.26 0.00 0.00 57.72 55.63 1f9d n HIS 50 Cb 0.20 -0.84 0.01 0.00 1.12 0.00 0.00 29.99 30.48 1f9d n HIS 50 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1f9d s VAL 51 N -2.75 3.48 0.34 1.59 -7.23 -1.19 -3.72 120.40 110.92 1f9d s VAL 51 Ca 0.47 -0.87 0.07 0.00 -1.81 0.00 0.00 61.98 59.85 1f9d s VAL 51 Cb 0.40 -3.22 -0.07 0.00 0.56 0.00 0.00 36.38 34.05 1f9d s VAL 51 CO 0.09 -0.11 -0.04 0.28 -0.31 0.00 0.00 175.10 175.02 1f9d s THR 52 N -2.39 1.86 0.15 5.32 -1.32 0.78 -1.90 115.64 118.15 1f9d s THR 52 Ca 0.51 -2.10 0.03 0.00 -1.21 0.00 0.00 61.69 58.91 1f9d s THR 52 Cb -0.10 -2.70 -0.05 0.00 -1.51 0.00 0.00 72.50 68.15 1f9d s THR 52 CO 0.34 -0.15 -0.05 0.42 -2.21 0.00 0.00 174.62 172.97 1f9d s THR 53 N -2.85 0.88 0.31 5.08 -4.23 -1.26 -0.91 115.64 112.66 1f9d s THR 53 Ca 0.33 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.11 1f9d s THR 53 Cb 0.06 -1.95 0.28 0.00 1.34 0.00 0.00 72.50 72.23 1f9d s THR 53 CO 0.15 -0.65 1.99 0.77 -0.54 0.00 0.00 174.62 176.35 1f9d h SER 54 N 2.76 0.00 -0.56 3.99 4.64 -1.48 -1.60 113.55 121.30 1f9d h SER 54 Ca -0.36 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.92 1f9d h SER 54 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1f9d h SER 54 CO 0.64 0.15 0.21 -0.61 -0.87 0.00 0.00 176.83 176.34 1f9d h GLN 55 N 0.00 0.86 -0.40 4.77 4.15 -1.92 -1.31 115.11 121.26 1f9d h GLN 55 Ca -0.00 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.19 1f9d h GLN 55 Cb 0.48 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.02 1f9d h GLN 55 CO 0.02 0.76 -0.00 0.00 -1.93 0.00 0.00 178.83 177.67 1f9d h ALA 56 N 1.06 0.54 -0.83 3.38 0.00 -1.70 -2.47 119.26 119.23 1f9d h ALA 56 Ca 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1f9d h ALA 56 Cb 0.23 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1f9d h ALA 56 CO -0.01 0.32 0.49 0.52 0.00 0.00 0.00 179.25 180.57 1f9d h MET 57 N 0.53 1.13 0.00 0.00 2.86 -1.23 -0.50 114.93 117.72 1f9d h MET 57 Ca 0.11 -0.11 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 1f9d h MET 57 Cb 0.48 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1f9d h MET 57 CO 0.02 0.80 -0.39 0.66 1.06 0.00 0.00 176.91 179.07 1f9d h SER 58 N 1.14 0.00 0.96 1.22 4.64 -1.12 -1.45 113.55 118.95 1f9d h SER 58 Ca 0.30 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.47 1f9d h SER 58 Cb -0.03 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1f9d h SER 58 CO -0.05 0.39 -0.69 1.88 -0.87 0.00 0.00 176.83 177.48 1f9d h TYR 59 N 0.00 0.00 -0.21 4.77 0.05 -0.93 -2.58 116.97 118.07 1f9d h TYR 59 Ca -0.00 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.65 1f9d h TYR 59 Cb 0.72 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.45 1f9d h TYR 59 CO 0.00 0.69 -0.41 -0.92 -1.05 0.00 0.00 178.16 176.48 1f9d h TYR 60 N 0.00 0.58 -0.39 4.88 3.20 -0.47 -0.95 116.97 123.82 1f9d h TYR 60 Ca -0.01 -0.17 -0.12 0.00 3.14 0.00 0.00 58.73 61.57 1f9d h TYR 60 Cb 1.36 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.50 1f9d h TYR 60 CO 0.00 0.82 -0.24 0.52 -1.64 0.00 0.00 178.16 177.62 1f9d h MET 61 N 0.40 0.86 -0.53 1.82 2.86 -1.13 -2.16 114.93 117.04 1f9d h MET 61 Ca 0.03 -0.40 -0.06 0.00 -2.06 0.00 0.00 59.70 57.21 1f9d h MET 61 Cb 0.89 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.51 1f9d h MET 61 CO 0.08 1.04 0.09 2.35 1.06 0.00 0.00 176.91 181.53 1f9d h TRP 62 N 0.66 0.94 0.29 -0.22 2.91 -1.28 -1.65 115.95 117.60 1f9d h TRP 62 Ca 0.08 -0.13 -0.01 0.00 1.13 0.00 0.00 58.89 59.96 1f9d h TRP 62 Cb 0.81 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.21 1f9d h TRP 62 CO 0.06 0.84 -0.14 1.25 -1.03 0.00 0.00 178.44 179.42 1f9d h LEU 63 N 0.77 -0.33 -1.38 0.65 5.85 -1.10 -2.40 115.31 117.37 1f9d h LEU 63 Ca 0.16 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 1f9d h LEU 63 Cb 0.40 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1f9d h LEU 63 CO 0.01 -0.20 0.10 -0.33 -0.34 0.00 0.00 178.44 177.68 1f9d h GLU 64 N -0.44 0.52 -0.53 1.25 4.39 -1.34 -1.04 114.58 117.39 1f9d h GLU 64 Ca -0.04 -0.08 -0.04 0.00 0.34 0.00 0.00 59.36 59.54 1f9d h GLU 64 Cb 0.33 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 1f9d h GLU 64 CO 0.07 0.47 0.17 0.00 -1.16 0.00 0.00 179.01 178.55 1f9d h ALA 65 N 1.60 0.69 -0.63 3.43 0.00 -1.17 0.90 119.26 124.08 1f9d h ALA 65 Ca 0.12 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1f9d h ALA 65 Cb 0.18 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1f9d h ALA 65 CO -0.01 0.34 0.13 1.98 0.00 0.00 0.00 179.25 181.69 1f9d h MET 66 N 0.72 1.01 -0.59 0.00 1.85 -0.94 -1.35 114.93 115.63 1f9d h MET 66 Ca 0.17 -0.24 -0.05 0.00 -0.61 0.00 0.00 59.70 58.97 1f9d h MET 66 Cb 0.27 -0.13 -0.03 0.00 0.43 0.00 0.00 31.60 32.14 1f9d h MET 66 CO -0.01 0.91 0.19 1.25 -0.40 0.00 0.00 176.91 178.86 1f9d h HIS 67 N 0.96 0.95 -0.80 1.39 6.17 -0.71 -2.10 115.15 121.01 1f9d h HIS 67 Ca 0.20 -0.09 0.02 0.00 0.71 0.00 0.00 60.37 61.21 1f9d h HIS 67 Cb 0.38 -0.28 -0.04 0.00 2.52 0.00 0.00 27.41 29.99 1f9d h HIS 67 CO 0.03 0.78 0.53 0.78 0.71 0.00 0.00 177.93 180.76 1f9d h GLY 68 N 0.84 1.13 0.94 5.26 0.00 -0.23 -0.04 103.07 110.96 1f9d h GLY 68 Ca 0.19 -0.41 0.03 0.00 0.00 0.00 0.00 47.33 47.14 1f9d h GLY 68 CO -0.01 0.38 0.66 -0.09 0.00 0.00 0.00 176.54 177.48 1f9d h ARG 69 N 1.04 1.26 0.00 4.80 9.65 -0.57 0.91 114.38 131.46 1f9d h ARG 69 Ca 0.31 -0.08 -0.20 0.00 -1.10 0.00 0.00 59.98 58.91 1f9d h ARG 69 Cb -0.05 -0.28 -0.04 0.00 -1.39 0.00 0.00 29.97 28.21 1f9d h ARG 69 CO -0.08 0.83 -1.69 1.19 2.80 0.00 0.00 179.97 183.03 1f9d n PHE 70 N -4.42 0.70 0.13 2.20 3.72 -0.93 -4.45 117.46 114.41 1f9d n PHE 70 Ca 0.13 0.24 0.09 0.00 -0.05 0.00 0.00 57.45 57.86 1f9d n PHE 70 Cb 0.07 -1.02 -0.14 0.00 -0.94 0.00 0.00 39.48 37.45 1f9d n PHE 70 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1f9d n SER 71 N -2.81 0.71 0.00 4.37 3.41 -0.07 -4.97 113.62 114.25 1f9d n SER 71 Ca -0.14 -0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.33 1f9d n SER 71 Cb 0.89 1.73 0.00 0.00 -0.26 0.00 0.00 64.21 66.57 1f9d n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f9d n GLY 72 N 1.43 1.17 3.46 5.00 0.00 0.31 -5.01 105.19 111.55 1f9d n GLY 72 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 1f9d n GLY 72 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1f9d s ASP 73 N -3.11 5.52 0.00 1.61 2.15 -1.25 -4.96 116.67 116.63 1f9d s ASP 73 Ca 0.00 -0.41 0.14 0.00 0.43 0.00 0.00 52.55 52.71 1f9d s ASP 73 Cb 0.00 -2.00 0.37 0.00 -0.30 0.00 0.00 42.92 40.99 1f9d s ASP 73 CO 0.00 -0.15 1.29 0.49 -0.17 0.00 0.00 175.17 176.63 1f9d n PHE 74 N 4.98 0.54 0.25 -5.34 3.01 -1.26 -3.84 117.46 115.80 1f9d n PHE 74 Ca -0.14 -0.44 0.08 0.00 1.01 0.00 0.00 57.45 57.96 1f9d n PHE 74 Cb 0.50 -0.02 0.63 0.00 -0.01 0.00 0.00 39.48 40.58 1f9d n PHE 74 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 1f9d h THR 75 N 2.69 0.94 -0.24 4.37 1.35 -1.96 -1.68 112.91 118.38 1f9d h THR 75 Ca 0.00 -0.37 -0.16 0.00 -0.55 0.00 0.00 66.41 65.34 1f9d h THR 75 Cb 0.78 1.20 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 1f9d h THR 75 CO 0.00 0.10 -0.50 1.23 -0.25 0.00 0.00 175.52 176.10 1f9d h GLY 76 N 0.37 0.72 0.84 5.82 0.00 -1.92 -0.54 103.07 108.36 1f9d h GLY 76 Ca -0.00 -0.80 -0.04 0.00 0.00 0.00 0.00 47.33 46.49 1f9d h GLY 76 CO 0.01 0.72 -0.01 -2.75 0.00 0.00 0.00 176.54 174.51 1f9d h PHE 77 N 0.52 0.46 -0.26 5.60 3.57 -1.57 -1.10 116.94 124.16 1f9d h PHE 77 Ca 0.02 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 1f9d h PHE 77 Cb 1.05 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 1f9d h PHE 77 CO 0.05 0.60 0.08 -0.44 -2.23 0.00 0.00 178.31 176.37 1f9d h ASP 78 N 0.19 0.33 0.19 0.41 3.32 -1.27 -2.03 116.42 117.56 1f9d h ASP 78 Ca 0.07 -0.03 -0.14 0.00 0.02 0.00 0.00 57.03 56.94 1f9d h ASP 78 Cb 0.42 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1f9d h ASP 78 CO 0.01 0.33 -0.53 0.50 -1.72 0.00 0.00 179.24 177.83 1f9d h LYS 79 N 0.37 0.37 -0.36 3.56 3.64 -0.65 -1.77 116.57 121.73 1f9d h LYS 79 Ca 0.09 -0.23 -0.05 0.00 -1.27 0.00 0.00 60.65 59.19 1f9d h LYS 79 Cb 0.12 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1f9d h LYS 79 CO -0.01 0.81 0.01 0.66 -2.27 0.00 0.00 179.45 178.65 1f9d h SER 80 N 0.29 0.52 0.03 4.20 4.64 -0.48 -1.06 113.55 121.69 1f9d h SER 80 Ca 0.01 -0.10 -0.17 0.00 -0.47 0.00 0.00 61.79 61.05 1f9d h SER 80 Cb 1.03 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1f9d h SER 80 CO 0.09 0.59 -0.61 -0.50 -0.87 0.00 0.00 176.83 175.52 1f9d h TRP 81 N 0.53 0.74 -0.71 4.77 4.06 -1.19 -2.23 115.95 121.92 1f9d h TRP 81 Ca 0.11 -0.28 -0.07 0.00 2.06 0.00 0.00 58.89 60.71 1f9d h TRP 81 Cb 0.33 -0.13 -0.03 0.00 -1.00 0.00 0.00 29.16 28.34 1f9d h TRP 81 CO 0.01 1.04 0.17 0.77 -3.56 0.00 0.00 178.44 176.87 1f9d h SER 82 N 0.43 1.08 -0.37 -3.49 0.02 -0.72 -1.74 113.55 108.76 1f9d h SER 82 Ca -0.01 -0.23 -0.15 0.00 -0.84 0.00 0.00 61.79 60.56 1f9d h SER 82 Cb 1.18 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 1f9d h SER 82 CO 0.12 1.03 -0.37 0.58 -1.14 0.00 0.00 176.83 177.05 1f9d h VAL 83 N 1.07 1.27 0.26 2.27 2.07 -1.19 -2.07 116.25 119.94 1f9d h VAL 83 Ca 0.22 -1.54 -0.00 0.00 0.82 0.00 0.00 66.70 66.20 1f9d h VAL 83 Cb 0.38 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1f9d h VAL 83 CO 0.00 0.52 -0.22 0.74 0.02 0.00 0.00 177.57 178.63 1f9d h THR 84 N 0.76 0.53 -0.55 2.57 2.02 -1.16 -0.86 112.91 116.21 1f9d h THR 84 Ca 0.07 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.20 1f9d h THR 84 Cb 0.95 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 1f9d h THR 84 CO 0.09 0.00 0.17 -0.08 0.37 0.00 0.00 175.52 176.07 1f9d h GLU 85 N -0.50 0.82 -0.05 6.66 4.81 -1.31 0.23 114.58 125.25 1f9d h GLU 85 Ca -0.01 -0.15 -0.21 0.00 -0.13 0.00 0.00 59.36 58.86 1f9d h GLU 85 Cb 0.45 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1f9d h GLU 85 CO -0.03 0.71 -0.82 0.37 -0.73 0.00 0.00 179.01 178.52 1f9d h GLN 86 N 0.80 0.45 0.00 1.92 4.15 -1.21 -3.36 115.11 117.86 1f9d h GLN 86 Ca 0.18 -0.41 -0.06 0.00 0.77 0.00 0.00 58.65 59.13 1f9d h GLN 86 Cb 0.23 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 1f9d h GLN 86 CO -0.01 1.05 -1.46 0.66 -1.93 0.00 0.00 178.83 177.15 1f9d n TYR 87 N -3.81 0.00 0.25 3.99 4.01 -0.34 -4.80 117.16 116.46 1f9d n TYR 87 Ca -0.06 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.74 1f9d n TYR 87 Cb 0.76 -0.28 -0.07 0.00 -0.31 0.00 0.00 39.34 39.44 1f9d n TYR 87 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1f9d n LEU 88 N -2.02 0.25 -4.40 7.72 4.32 0.79 -4.86 117.00 118.80 1f9d n LEU 88 Ca -0.07 -0.25 -0.40 0.00 -0.02 0.00 0.00 56.01 55.28 1f9d n LEU 88 Cb 0.46 0.00 -0.11 0.00 -1.62 0.00 0.00 43.42 42.15 1f9d n LEU 88 CO 0.17 0.06 -0.16 -0.63 -1.22 0.00 0.00 177.39 175.61 1f9d s ILE 89 N -2.41 4.65 -0.08 -0.08 1.01 -1.06 -1.04 121.20 122.18 1f9d s ILE 89 Ca -0.00 -0.72 -0.39 0.00 0.00 0.00 0.00 60.65 59.54 1f9d s ILE 89 Cb 0.08 -3.53 -0.17 0.00 0.01 0.00 0.00 42.46 38.85 1f9d s ILE 89 CO 0.46 -0.16 1.50 -2.65 0.00 0.00 0.00 174.94 174.08 1f9d n PRO 90 N 5.01 1.05 -1.55 2.79 -0.02 -1.26 -4.75 135.00 136.27 1f9d n PRO 90 Ca -0.12 0.38 -0.26 0.00 -2.02 0.00 0.00 63.50 61.48 1f9d n PRO 90 Cb 0.47 -2.03 0.19 0.00 -0.02 0.00 0.00 33.50 32.11 1f9d n PRO 90 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1f9d n THR 91 N 3.34 0.00 0.09 3.45 -2.24 -1.26 -4.72 114.28 112.95 1f9d n THR 91 Ca 0.22 -0.79 0.13 0.00 -2.27 0.00 0.00 64.05 61.34 1f9d n THR 91 Cb 0.15 -1.52 0.63 0.00 -2.10 0.00 0.00 70.33 67.50 1f9d n THR 91 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1f9d h GLU 92 N 0.00 0.09 0.00 -0.78 4.11 -1.93 -0.57 114.58 115.50 1f9d h GLU 92 Ca -0.37 -0.01 -0.14 0.00 0.07 0.00 0.00 59.36 58.91 1f9d h GLU 92 Cb 1.05 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 1f9d h GLU 92 CO 0.26 0.06 -0.68 0.87 0.07 0.00 0.00 179.01 179.58 1f9d h LYS 93 N 0.09 0.00 0.00 1.06 1.79 -1.99 -2.92 116.57 114.60 1f9d h LYS 93 Ca 0.15 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.46 1f9d h LYS 93 Cb 0.49 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.12 1f9d h LYS 93 CO -0.01 0.68 -1.05 -0.44 -1.08 0.00 0.00 179.45 177.55 1f9d h ASP 94 N 0.00 0.00 -2.02 0.86 3.32 -1.47 -3.38 116.42 113.73 1f9d h ASP 94 Ca -0.01 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.50 1f9d h ASP 94 Cb 1.46 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.61 1f9d h ASP 94 CO 0.09 0.65 -1.09 0.00 -1.72 0.00 0.00 179.24 177.17 1f9d n GLN 95 N -3.09 0.98 -1.63 3.56 10.64 -0.67 -4.92 117.38 122.25 1f9d n GLN 95 Ca -0.05 -3.41 -0.62 0.00 -1.83 0.00 0.00 57.00 51.09 1f9d n GLN 95 Cb 0.84 -1.45 -0.09 0.00 -0.86 0.00 0.00 30.24 28.68 1f9d n GLN 95 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88 1f9d n PRO 96 N 1.01 0.16 0.30 2.61 -0.04 -1.10 -4.76 135.00 133.18 1f9d n PRO 96 Ca 0.23 0.06 0.16 0.00 -0.04 0.00 0.00 63.50 63.91 1f9d n PRO 96 Cb 0.55 -1.58 0.92 0.00 -0.04 0.00 0.00 33.50 33.35 1f9d n PRO 96 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1f9d h ASN 97 N 4.30 0.00 -0.68 3.54 -1.24 -1.96 -1.11 115.58 118.44 1f9d h ASN 97 Ca -0.47 0.00 0.02 0.00 0.71 0.00 0.00 56.30 56.55 1f9d h ASN 97 Cb 1.39 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.40 1f9d h ASN 97 CO 0.83 0.03 0.45 0.71 -1.29 0.00 0.00 177.43 178.16 1f9d h THR 98 N 0.00 1.15 0.15 -3.57 1.35 -1.95 0.37 112.91 110.41 1f9d h THR 98 Ca -0.00 -0.30 -0.33 0.00 -0.55 0.00 0.00 66.41 65.23 1f9d h THR 98 Cb 0.10 0.18 0.00 0.00 -1.73 0.00 0.00 68.15 66.71 1f9d h THR 98 CO 0.00 0.16 -1.67 0.28 -0.25 0.00 0.00 175.52 174.04 1f9d h SER 99 N 0.89 0.50 -0.43 5.36 0.02 -1.54 -3.37 113.55 114.98 1f9d h SER 99 Ca 0.26 -0.91 -0.04 0.00 -0.84 0.00 0.00 61.79 60.26 1f9d h SER 99 Cb -0.05 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 1f9d h SER 99 CO -0.06 1.74 0.13 0.24 -1.14 0.00 0.00 176.83 177.74 1f9d h MET 100 N -0.06 0.74 0.00 3.45 2.07 -1.11 -2.20 114.93 117.83 1f9d h MET 100 Ca -0.34 -0.14 0.00 0.00 -2.07 0.00 0.00 59.70 57.15 1f9d h MET 100 Cb 1.96 -0.12 0.00 0.00 -1.87 0.00 0.00 31.60 31.57 1f9d h MET 100 CO 0.12 0.67 0.00 -1.13 1.07 0.00 0.00 176.91 177.63 1f9d n SER 101 N -4.30 0.00 -0.92 1.22 3.41 0.13 -1.75 113.62 111.41 1f9d n SER 101 Ca 0.03 0.30 0.10 0.00 -0.26 0.00 0.00 58.87 59.05 1f9d n SER 101 Cb 0.21 -0.40 0.27 0.00 -0.26 0.00 0.00 64.21 64.03 1f9d n SER 101 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1f9d n ARG 102 N -1.40 2.18 -1.84 4.33 5.12 -0.83 -4.94 116.66 119.29 1f9d n ARG 102 Ca 0.05 -1.80 -0.41 0.00 -1.93 0.00 0.00 57.85 53.76 1f9d n ARG 102 Cb 0.14 -1.45 -0.01 0.00 -1.16 0.00 0.00 32.46 29.99 1f9d n ARG 102 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1f9d s TYR 103 N -1.52 2.66 -0.34 -1.55 5.04 -0.72 -4.55 117.35 116.38 1f9d s TYR 103 Ca 0.36 1.15 -0.03 0.00 -2.44 0.00 0.00 57.07 56.11 1f9d s TYR 103 Cb 0.20 -3.99 0.07 0.00 0.35 0.00 0.00 41.96 38.59 1f9d s TYR 103 CO 0.28 -2.93 0.09 0.34 -1.34 0.00 0.00 175.55 171.98 1f9d s ASP 104 N -0.10 5.09 0.64 4.32 2.15 -1.26 -4.98 116.67 122.53 1f9d s ASP 104 Ca 0.54 -1.49 0.39 0.00 0.43 0.00 0.00 52.55 52.42 1f9d s ASP 104 Cb -0.46 -1.78 2.20 0.00 -0.30 0.00 0.00 42.92 42.58 1f9d s ASP 104 CO 0.60 -0.36 2.32 0.00 -0.17 0.00 0.00 175.17 177.56 1f9d h ALA 105 N 8.06 1.17 0.00 3.66 0.00 -1.94 -0.67 119.26 129.54 1f9d h ALA 105 Ca -0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1f9d h ALA 105 Cb 1.06 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1f9d h ALA 105 CO 0.60 0.00 -0.34 0.09 0.00 0.00 0.00 179.25 179.60 1f9d n ASN 106 N -3.34 0.38 -3.05 0.00 3.02 -1.26 -0.65 115.26 110.37 1f9d n ASN 106 Ca -0.03 0.06 -0.18 0.00 -0.03 0.00 0.00 54.58 54.39 1f9d n ASN 106 Cb 0.08 -0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 1f9d n ASN 106 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 1f9d n LYS 107 N -1.60 0.76 -0.27 3.52 0.00 -0.29 -4.62 118.16 115.66 1f9d n LYS 107 Ca 0.06 -2.76 0.08 0.00 0.00 0.00 0.00 58.31 55.69 1f9d n LYS 107 Cb 0.35 -1.31 0.22 0.00 0.00 0.00 0.00 35.03 34.29 1f9d n LYS 107 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 1f9d h PRO 108 N 3.90 0.31 -3.13 1.64 0.11 -1.65 -3.41 132.00 129.77 1f9d h PRO 108 Ca 0.00 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 1f9d h PRO 108 Cb 0.94 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.96 1f9d h PRO 108 CO 0.41 0.21 0.21 0.00 -0.21 0.00 0.00 178.00 178.63 1f9d s ALA 109 N -5.99 -0.61 -0.17 -0.75 0.00 -1.26 -2.30 121.76 110.67 1f9d s ALA 109 Ca -0.12 -0.80 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 1f9d s ALA 109 Cb 0.23 0.75 -0.03 0.00 0.00 0.00 0.00 23.12 24.06 1f9d s ALA 109 CO 0.76 -0.97 -0.00 0.99 0.00 0.00 0.00 175.76 176.54 1f9d s THR 110 N -2.55 4.14 0.50 0.00 2.01 -1.26 -4.90 115.64 113.58 1f9d s THR 110 Ca 0.17 -0.26 -0.23 0.00 0.31 0.00 0.00 61.69 61.67 1f9d s THR 110 Cb -0.05 -2.84 -0.06 0.00 0.01 0.00 0.00 72.50 69.56 1f9d s THR 110 CO 0.12 0.47 1.38 -0.47 -0.69 0.00 0.00 174.62 175.43 1f9d s TYR 111 N 0.46 2.39 -0.18 4.92 5.04 -1.26 -4.83 117.35 123.89 1f9d s TYR 111 Ca -0.01 1.33 -0.15 0.00 -2.44 0.00 0.00 57.07 55.79 1f9d s TYR 111 Cb -0.14 -3.83 0.05 0.00 0.35 0.00 0.00 41.96 38.39 1f9d s TYR 111 CO 0.02 -2.85 0.48 0.00 -1.34 0.00 0.00 175.55 171.87 1f9d s ALA 112 N -1.27 -1.20 0.66 3.97 0.00 -1.26 -0.64 121.76 122.02 1f9d s ALA 112 Ca 0.66 1.44 -0.11 0.00 0.00 0.00 0.00 51.96 53.96 1f9d s ALA 112 Cb -0.41 -0.85 -0.01 0.00 0.00 0.00 0.00 23.12 21.85 1f9d s ALA 112 CO 0.51 -0.24 1.05 -1.25 0.00 0.00 0.00 175.76 175.82 1f9d s PRO 113 N 0.51 3.24 0.00 0.00 0.04 -1.26 -5.01 135.00 132.52 1f9d s PRO 113 Ca -0.02 0.80 0.01 0.00 0.04 0.00 0.00 61.00 61.83 1f9d s PRO 113 Cb -0.04 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1f9d s PRO 113 CO -0.03 -0.84 0.02 -1.21 0.04 0.00 0.00 177.00 174.99 1f9d s GLU 114 N -5.14 2.86 0.17 4.56 2.02 -1.05 -4.84 118.70 117.27 1f9d s GLU 114 Ca 0.57 -0.58 0.11 0.00 0.02 0.00 0.00 54.97 55.08 1f9d s GLU 114 Cb -0.12 -2.72 -0.04 0.00 0.10 0.00 0.00 34.13 31.35 1f9d s GLU 114 CO 0.54 0.63 -0.24 -0.06 0.02 0.00 0.00 175.26 176.15 1f9d s PHE 115 N -1.12 2.24 -2.05 1.61 0.08 -1.26 -4.64 117.98 112.84 1f9d s PHE 115 Ca 0.21 -0.38 0.11 0.00 0.12 0.00 0.00 56.93 56.99 1f9d s PHE 115 Cb -0.12 -1.15 0.50 0.00 -0.57 0.00 0.00 43.02 41.69 1f9d s PHE 115 CO 0.12 0.42 1.35 1.04 -0.10 0.00 0.00 175.22 178.05 1f9d n GLN 116 N 0.50 1.31 -3.73 0.44 3.00 -1.26 -4.25 117.38 113.39 1f9d n GLN 116 Ca -0.15 -0.48 -0.12 0.00 -0.01 0.00 0.00 57.00 56.25 1f9d n GLN 116 Cb 0.55 -1.21 -0.12 0.00 0.00 0.00 0.00 30.24 29.46 1f9d n GLN 116 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1f9d s ASP 117 N -1.26 -0.36 0.57 1.08 2.15 -1.26 -4.34 116.67 113.26 1f9d s ASP 117 Ca 0.18 0.67 0.27 0.00 0.43 0.00 0.00 52.55 54.11 1f9d s ASP 117 Cb 0.09 0.59 1.54 0.00 -0.30 0.00 0.00 42.92 44.84 1f9d s ASP 117 CO 0.14 -0.16 2.03 -0.65 -0.17 0.00 0.00 175.17 176.37 1f9d h PRO 118 N 6.74 0.00 0.00 4.34 0.11 -1.86 -1.89 132.00 139.44 1f9d h PRO 118 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1f9d h PRO 118 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1f9d h PRO 118 CO 0.33 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.99 1f9d n SER 119 N -3.96 0.00 -0.11 -2.05 3.41 -1.26 -2.08 113.62 107.57 1f9d n SER 119 Ca 0.05 0.41 0.13 0.00 -0.26 0.00 0.00 58.87 59.20 1f9d n SER 119 Cb 0.45 -0.45 0.48 0.00 -0.26 0.00 0.00 64.21 64.43 1f9d n SER 119 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1f9d n LYS 120 N -1.45 0.50 -3.25 4.33 4.76 -0.71 -4.87 118.16 117.48 1f9d n LYS 120 Ca 0.04 -0.22 -0.27 0.00 -2.87 0.00 0.00 58.31 54.99 1f9d n LYS 120 Cb 0.15 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.83 1f9d n LYS 120 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1f9d s TYR 121 N -2.65 3.49 0.52 2.13 1.51 -0.89 -4.43 117.35 117.04 1f9d s TYR 121 Ca 0.22 0.59 -0.23 0.00 -1.01 0.00 0.00 57.07 56.64 1f9d s TYR 121 Cb 0.19 -2.08 -0.06 0.00 -0.11 0.00 0.00 41.96 39.91 1f9d s TYR 121 CO 0.54 0.10 1.37 -1.25 -1.11 0.00 0.00 175.55 175.20 1f9d s PRO 122 N -3.92 3.30 -0.01 -1.71 0.04 -1.14 -4.80 135.00 126.77 1f9d s PRO 122 Ca 0.43 2.28 -0.23 0.00 0.04 0.00 0.00 61.00 63.52 1f9d s PRO 122 Cb -0.10 -2.37 -0.05 0.00 0.04 0.00 0.00 34.50 32.02 1f9d s PRO 122 CO 0.34 -1.07 0.69 0.45 0.04 0.00 0.00 177.00 177.45 1f9d s SER 123 N -0.84 7.07 -0.04 6.66 0.15 -0.30 -4.68 113.70 121.72 1f9d s SER 123 Ca 0.68 1.28 -0.27 0.00 0.70 0.00 0.00 55.95 58.34 1f9d s SER 123 Cb -0.41 -2.42 -0.03 0.00 -1.71 0.00 0.00 66.02 61.45 1f9d s SER 123 CO 0.50 -0.00 0.87 -2.16 1.20 0.00 0.00 173.24 173.64 1f9d s PRO 124 N 0.20 4.50 0.30 5.44 0.04 -1.26 -0.70 135.00 143.52 1f9d s PRO 124 Ca 0.36 1.19 -0.29 0.00 0.04 0.00 0.00 61.00 62.30 1f9d s PRO 124 Cb -0.19 -3.46 -0.10 0.00 0.04 0.00 0.00 34.50 30.79 1f9d s PRO 124 CO 0.20 -0.03 1.17 -0.51 0.04 0.00 0.00 177.00 177.87 1f9d s LEU 125 N 1.01 4.49 -0.29 -3.56 1.43 -0.43 -4.28 118.68 117.05 1f9d s LEU 125 Ca 0.46 2.41 -0.01 0.00 -1.03 0.00 0.00 54.13 55.96 1f9d s LEU 125 Cb -0.19 -3.66 0.09 0.00 0.03 0.00 0.00 46.19 42.46 1f9d s LEU 125 CO 0.23 -0.30 0.09 -0.62 0.23 0.00 0.00 176.35 175.98 1f9d s ASP 126 N -0.77 3.86 0.19 2.29 -1.08 0.19 -4.92 116.67 116.42 1f9d s ASP 126 Ca 0.47 -1.50 0.18 0.00 -0.52 0.00 0.00 52.55 51.18 1f9d s ASP 126 Cb -0.34 -0.81 0.83 0.00 -1.46 0.00 0.00 42.92 41.14 1f9d s ASP 126 CO 0.45 -0.40 1.55 0.35 0.52 0.00 0.00 175.17 177.64 1f9d n THR 127 N 4.89 1.09 0.17 1.71 -2.24 -1.26 -2.67 114.28 115.98 1f9d n THR 127 Ca -0.03 0.42 0.11 0.00 -2.27 0.00 0.00 64.05 62.28 1f9d n THR 127 Cb 0.43 -1.35 0.10 0.00 -2.10 0.00 0.00 70.33 67.41 1f9d n THR 127 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1f9d h SER 128 N 0.00 0.00 -3.85 3.42 4.64 -1.95 -3.46 113.55 112.36 1f9d h SER 128 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1f9d h SER 128 Cb 0.18 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.31 1f9d h SER 128 CO 0.00 0.02 0.52 -1.10 -0.87 0.00 0.00 176.83 175.41 1f9d s GLN 129 N -3.25 4.49 0.55 4.77 -1.52 -1.09 -4.98 119.66 118.62 1f9d s GLN 129 Ca 0.04 1.92 -0.20 0.00 -1.95 0.00 0.00 55.36 55.18 1f9d s GLN 129 Cb 0.07 -3.09 -0.05 0.00 -0.22 0.00 0.00 33.01 29.72 1f9d s GLN 129 CO 0.72 0.03 1.18 -1.25 -0.25 0.00 0.00 175.29 175.71 1f9d s PRO 130 N -1.66 3.25 -0.02 2.91 0.04 -1.26 -4.71 135.00 133.54 1f9d s PRO 130 Ca 0.47 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.27 1f9d s PRO 130 Cb -0.34 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 32.18 1f9d s PRO 130 CO 0.44 -0.97 -0.00 0.08 0.04 0.00 0.00 177.00 176.59 1f9d s VAL 131 N -1.65 0.15 0.59 -0.36 1.01 -1.26 -4.88 120.40 114.00 1f9d s VAL 131 Ca 0.73 0.04 -0.10 0.00 0.00 0.00 0.00 61.98 62.66 1f9d s VAL 131 Cb -0.28 -0.21 0.14 0.00 0.00 0.00 0.00 36.38 36.03 1f9d s VAL 131 CO 0.31 0.11 0.67 0.61 0.00 0.00 0.00 175.10 176.80 1f9d n GLY 132 N 3.79 -1.87 3.89 4.51 0.00 0.08 -4.75 105.19 110.85 1f9d n GLY 132 Ca -0.23 -1.60 -0.34 0.00 0.00 0.00 0.00 46.02 43.85 1f9d n GLY 132 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1f9d s ARG 133 N -4.48 3.53 -0.43 1.61 0.52 -0.98 -4.40 118.95 114.31 1f9d s ARG 133 Ca 0.40 -0.17 -0.20 0.00 -0.52 0.00 0.00 55.73 55.24 1f9d s ARG 133 Cb -0.02 -3.06 0.02 0.00 0.52 0.00 0.00 34.95 32.41 1f9d s ARG 133 CO 0.29 0.64 0.60 0.34 0.02 0.00 0.00 175.30 177.19 1f9d s ASP 134 N -1.88 6.30 0.02 0.23 2.15 0.18 -3.97 116.67 119.70 1f9d s ASP 134 Ca 0.29 -0.37 0.27 0.00 0.43 0.00 0.00 52.55 53.16 1f9d s ASP 134 Cb -0.13 -2.30 0.80 0.00 -0.30 0.00 0.00 42.92 40.99 1f9d s ASP 134 CO 0.18 -0.72 1.63 -0.81 -0.17 0.00 0.00 175.17 175.28 1f9d n PRO 135 N 6.11 0.03 -0.00 4.34 -0.04 -1.26 -4.24 135.00 139.94 1f9d n PRO 135 Ca -0.03 0.02 0.09 0.00 -0.04 0.00 0.00 63.50 63.54 1f9d n PRO 135 Cb 0.48 -1.53 -0.13 0.00 -0.04 0.00 0.00 33.50 32.28 1f9d n PRO 135 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1f9d n ILE 136 N -1.58 0.00 -0.31 0.52 -5.35 -1.26 -4.53 119.36 106.85 1f9d n ILE 136 Ca 0.06 -0.26 0.02 0.00 -0.27 0.00 0.00 62.75 62.30 1f9d n ILE 136 Cb 0.35 0.51 0.16 0.00 -1.74 0.00 0.00 39.64 38.91 1f9d n ILE 136 CO 0.00 0.00 0.00 -1.13 -1.76 0.00 0.00 176.55 173.66 1f9d h ASN 137 N 0.00 0.82 -0.32 7.28 -0.73 -2.00 -1.33 115.58 119.30 1f9d h ASN 137 Ca 0.00 0.03 -0.04 0.00 1.87 0.00 0.00 56.30 58.15 1f9d h ASN 137 Cb 0.66 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 39.09 1f9d h ASN 137 CO 0.00 0.50 0.07 0.77 -0.37 0.00 0.00 177.43 178.40 1f9d h SER 138 N 0.94 0.57 -0.62 1.15 4.64 -1.85 -1.42 113.55 116.96 1f9d h SER 138 Ca 0.39 -0.09 -0.06 0.00 -0.47 0.00 0.00 61.79 61.56 1f9d h SER 138 Cb 0.24 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 1f9d h SER 138 CO -0.20 0.59 0.16 1.56 -0.87 0.00 0.00 176.83 178.07 1f9d h GLN 139 N 0.59 0.98 -0.08 4.77 4.20 -1.52 -2.50 115.11 121.55 1f9d h GLN 139 Ca 0.13 -0.23 -0.10 0.00 0.06 0.00 0.00 58.65 58.51 1f9d h GLN 139 Cb 0.28 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1f9d h GLN 139 CO 0.00 0.89 -0.34 -0.07 -0.67 0.00 0.00 178.83 178.64 1f9d h LEU 140 N 0.90 0.44 -0.94 1.46 3.38 -0.94 -2.15 115.31 117.47 1f9d h LEU 140 Ca 0.19 -0.63 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 1f9d h LEU 140 Cb 0.34 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1f9d h LEU 140 CO 0.00 1.00 0.11 0.71 0.09 0.00 0.00 178.44 180.35 1f9d h THR 141 N -0.09 1.24 -0.51 0.22 1.35 -1.33 -0.47 112.91 113.32 1f9d h THR 141 Ca -0.02 -0.89 -0.10 0.00 -0.55 0.00 0.00 66.41 64.85 1f9d h THR 141 Cb 0.98 0.69 -0.02 0.00 -1.73 0.00 0.00 68.15 68.07 1f9d h THR 141 CO 0.07 0.33 -0.08 -1.28 -0.25 0.00 0.00 175.52 174.32 1f9d h SER 142 N 0.85 0.95 -0.12 5.36 0.87 -1.49 0.25 113.55 120.22 1f9d h SER 142 Ca 0.18 -0.34 -0.21 0.00 -1.23 0.00 0.00 61.79 60.19 1f9d h SER 142 Cb 0.35 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1f9d h SER 142 CO 0.00 1.07 -0.73 0.00 -0.53 0.00 0.00 176.83 176.64 1f9d h ALA 143 N 0.91 0.25 -0.00 6.23 0.00 -1.12 -3.37 119.26 122.17 1f9d h ALA 143 Ca 0.13 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1f9d h ALA 143 Cb 0.63 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1f9d h ALA 143 CO 0.04 0.60 -0.73 0.66 0.00 0.00 0.00 179.25 179.82 1f9d n TYR 144 N -4.01 0.00 -2.80 0.00 4.01 -0.21 -5.00 117.16 109.15 1f9d n TYR 144 Ca -0.08 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.51 1f9d n TYR 144 Cb 0.72 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.78 1f9d n TYR 144 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1f9d n GLY 145 N 1.38 -0.11 3.47 2.72 0.00 0.89 -5.01 105.19 108.52 1f9d n GLY 145 Ca 0.04 -0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 1f9d n GLY 145 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1f9d s THR 146 N -2.98 0.00 -1.47 2.61 -1.32 -1.24 -5.04 115.64 106.19 1f9d s THR 146 Ca 0.22 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.92 1f9d s THR 146 Cb -0.10 -1.00 -0.12 0.00 -1.51 0.00 0.00 72.50 69.78 1f9d s THR 146 CO 0.27 0.00 1.01 -1.20 -2.21 0.00 0.00 174.62 172.49 1f9d n SER 147 N -0.29 1.45 -4.77 8.08 7.64 -1.26 -4.20 113.62 120.27 1f9d n SER 147 Ca -0.13 -1.21 -0.34 0.00 1.01 0.00 0.00 58.87 58.21 1f9d n SER 147 Cb 0.63 0.74 0.04 0.00 -1.01 0.00 0.00 64.21 64.61 1f9d n SER 147 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1f9d s MET 148 N -2.76 2.88 -0.05 1.43 -1.94 -1.26 -4.80 119.30 112.80 1f9d s MET 148 Ca 0.13 1.47 -0.04 0.00 -1.71 0.00 0.00 55.69 55.54 1f9d s MET 148 Cb 0.17 -1.96 -0.04 0.00 2.01 0.00 0.00 34.83 35.02 1f9d s MET 148 CO 0.73 -1.20 0.15 -0.51 -0.01 0.00 0.00 175.02 174.18 1f9d s LEU 149 N -4.64 4.27 -0.77 -0.03 1.43 -1.26 -5.04 118.68 112.64 1f9d s LEU 149 Ca 0.69 0.35 -0.04 0.00 -1.03 0.00 0.00 54.13 54.09 1f9d s LEU 149 Cb -0.22 -2.35 0.20 0.00 0.03 0.00 0.00 46.19 43.85 1f9d s LEU 149 CO 0.38 0.32 0.64 -0.47 0.23 0.00 0.00 176.35 177.45 1f9d s TYR 150 N -1.19 3.67 0.10 0.29 5.04 -1.26 -4.82 117.35 119.17 1f9d s TYR 150 Ca 0.22 -2.72 -0.15 0.00 -2.44 0.00 0.00 57.07 51.98 1f9d s TYR 150 Cb -0.12 -3.33 0.03 0.00 0.35 0.00 0.00 41.96 38.88 1f9d s TYR 150 CO 0.12 -0.83 0.36 0.20 -1.34 0.00 0.00 175.55 174.06 1f9d s GLY 151 N 0.62 -0.19 0.03 8.97 0.00 -1.26 -4.35 107.32 111.14 1f9d s GLY 151 Ca 0.21 -0.11 -0.26 0.00 0.00 0.00 0.00 44.72 44.57 1f9d s GLY 151 CO -0.08 -0.35 0.81 1.06 0.00 0.00 0.00 173.10 174.54 1f9d s MET 152 N -3.56 4.52 0.39 2.90 -1.94 -1.26 -4.49 119.30 115.86 1f9d s MET 152 Ca 0.02 1.13 -0.25 0.00 -1.71 0.00 0.00 55.69 54.88 1f9d s MET 152 Cb 0.02 -3.40 -0.09 0.00 2.01 0.00 0.00 34.83 33.38 1f9d s MET 152 CO -0.10 0.18 1.10 -1.58 -0.01 0.00 0.00 175.02 174.61 1f9d s HIS 153 N 0.27 3.22 -0.04 -0.03 2.46 -0.21 -4.14 115.29 116.83 1f9d s HIS 153 Ca 0.41 1.62 0.23 0.00 0.47 0.00 0.00 55.06 57.80 1f9d s HIS 153 Cb -0.20 -3.24 0.70 0.00 -0.13 0.00 0.00 32.58 29.71 1f9d s HIS 153 CO 0.24 -0.87 1.73 0.11 -2.47 0.00 0.00 174.74 173.48 1f9d h TRP 154 N 2.65 0.00 -3.77 3.88 5.08 -1.35 -3.39 115.95 119.06 1f9d h TRP 154 Ca -0.48 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.29 1f9d h TRP 154 Cb 1.22 0.00 -0.24 0.00 -3.00 0.00 0.00 29.16 27.14 1f9d h TRP 154 CO 0.57 0.21 -0.67 -1.50 -1.28 0.00 0.00 178.44 175.77 1f9d s ILE 155 N -3.43 0.05 -0.02 0.12 2.07 -1.26 -1.55 121.20 117.18 1f9d s ILE 155 Ca 0.03 -0.43 0.00 0.00 -1.41 0.00 0.00 60.65 58.83 1f9d s ILE 155 Cb 0.09 -0.17 0.02 0.00 0.13 0.00 0.00 42.46 42.52 1f9d s ILE 155 CO 0.65 -0.24 0.01 -0.22 -1.91 0.00 0.00 174.94 173.24 1f9d s LEU 156 N -0.72 1.31 -1.08 8.50 2.96 -0.09 -3.95 118.68 125.62 1f9d s LEU 156 Ca -0.08 0.01 -0.17 0.00 -0.22 0.00 0.00 54.13 53.67 1f9d s LEU 156 Cb -0.05 -0.10 0.13 0.00 0.50 0.00 0.00 46.19 46.68 1f9d s LEU 156 CO -0.00 -0.09 1.33 -0.62 -1.32 0.00 0.00 176.35 175.64 1f9d s ASP 157 N 0.81 6.81 0.22 3.68 -1.08 0.40 -0.15 116.67 127.35 1f9d s ASP 157 Ca -0.07 -2.40 -0.11 0.00 -0.52 0.00 0.00 52.55 49.45 1f9d s ASP 157 Cb -0.10 -2.43 0.31 0.00 -1.46 0.00 0.00 42.92 39.24 1f9d s ASP 157 CO -0.02 -0.99 1.64 0.58 0.52 0.00 0.00 175.17 176.90 1f9d h VAL 158 N 5.44 0.38 -0.44 1.11 2.07 -1.82 -0.30 116.25 122.69 1f9d h VAL 158 Ca 0.25 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.75 1f9d h VAL 158 Cb 0.95 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1f9d h VAL 158 CO 1.22 0.01 0.00 0.47 0.02 0.00 0.00 177.57 179.29 1f9d n ASP 159 N -5.37 4.92 -3.73 0.57 8.00 -1.26 -3.89 116.55 115.79 1f9d n ASP 159 Ca 0.10 -2.97 -0.24 0.00 0.71 0.00 0.00 54.79 52.39 1f9d n ASP 159 Cb 0.38 -0.62 0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1f9d n ASP 159 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1f9d n ASN 160 N 0.12 -3.05 -0.25 -2.24 5.15 -0.91 -4.90 115.26 109.19 1f9d n ASN 160 Ca 0.25 -0.75 -0.06 0.00 -0.60 0.00 0.00 54.58 53.41 1f9d n ASN 160 Cb 1.06 -4.22 0.07 0.00 -0.53 0.00 0.00 39.78 36.17 1f9d n ASN 160 CO 0.00 0.00 0.00 -0.25 1.40 0.00 0.00 177.26 178.41 1f9d h TRP 161 N -2.04 1.17 0.00 1.20 7.01 -1.93 -2.77 115.95 118.59 1f9d h TRP 161 Ca -0.59 -0.13 -0.03 0.00 2.11 0.00 0.00 58.89 60.25 1f9d h TRP 161 Cb 1.36 -0.33 -0.00 0.00 -2.10 0.00 0.00 29.16 28.09 1f9d h TRP 161 CO 0.50 0.93 -0.15 1.88 -2.79 0.00 0.00 178.44 178.82 1f9d h TYR 162 N 1.07 0.00 0.00 2.65 0.05 -1.94 -3.48 116.97 115.32 1f9d h TYR 162 Ca 0.23 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.01 1f9d h TYR 162 Cb 0.34 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.08 1f9d h TYR 162 CO 0.03 0.15 0.00 0.41 -1.05 0.00 0.00 178.16 177.69 1f9d n GLY 163 N 0.51 0.73 0.23 3.88 0.00 -1.05 -4.34 105.19 105.16 1f9d n GLY 163 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.15 1f9d n GLY 163 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1f9d h PHE 164 N 0.00 0.00 -0.63 1.61 0.04 -1.85 -3.39 116.94 112.72 1f9d h PHE 164 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1f9d h PHE 164 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1f9d h PHE 164 CO 0.00 0.18 0.00 0.41 -0.60 0.00 0.00 178.31 178.30 1f9d n GLY 165 N 0.07 0.13 3.51 -1.45 0.00 -1.26 -1.96 105.19 104.23 1f9d n GLY 165 Ca 0.00 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.68 1f9d n GLY 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9d s ALA 166 N -1.66 3.19 -1.42 4.61 0.00 -1.24 -4.39 121.76 120.85 1f9d s ALA 166 Ca 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 51.96 50.99 1f9d s ALA 166 Cb 0.00 -1.91 0.01 0.00 0.00 0.00 0.00 23.12 21.22 1f9d s ALA 166 CO 0.00 -0.15 0.50 0.54 0.00 0.00 0.00 175.76 176.66 1f9d n ARG 167 N 4.23 -3.60 -1.38 0.00 1.74 -1.26 -1.96 116.66 114.42 1f9d n ARG 167 Ca -0.17 0.44 -0.13 0.00 -0.77 0.00 0.00 57.85 57.22 1f9d n ARG 167 Cb 0.52 -4.70 -0.06 0.00 -1.02 0.00 0.00 32.46 27.21 1f9d n ARG 167 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1f9d n ALA 168 N -4.39 -0.20 1.33 7.54 0.00 -1.25 -4.89 120.51 118.65 1f9d n ALA 168 Ca -0.27 0.21 0.14 0.00 0.00 0.00 0.00 53.44 53.52 1f9d n ALA 168 Cb 0.67 -1.53 0.54 0.00 0.00 0.00 0.00 19.45 19.13 1f9d n ALA 168 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1f9d n ASP 169 N -0.35 0.58 0.00 0.00 5.68 -0.83 -4.92 116.55 116.71 1f9d n ASP 169 Ca -0.13 -0.59 0.00 0.00 -0.50 0.00 0.00 54.79 53.57 1f9d n ASP 169 Cb 0.46 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.41 1f9d n ASP 169 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1f9d n GLY 170 N 1.31 0.32 0.00 6.12 0.00 -0.83 -4.64 105.19 107.47 1f9d n GLY 170 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1f9d n GLY 170 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1f9d n THR 171 N -2.00 0.00 -1.63 2.61 -2.24 -1.26 -4.10 114.28 105.65 1f9d n THR 171 Ca 0.00 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.47 1f9d n THR 171 Cb 0.00 -0.18 0.05 0.00 -2.10 0.00 0.00 70.33 68.10 1f9d n THR 171 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1f9d s SER 172 N -2.45 5.35 0.01 3.42 0.01 -1.26 -4.93 113.70 113.85 1f9d s SER 172 Ca 0.00 1.50 -0.02 0.00 1.31 0.00 0.00 55.95 58.74 1f9d s SER 172 Cb 0.00 -2.38 -0.01 0.00 0.21 0.00 0.00 66.02 63.84 1f9d s SER 172 CO 0.00 -1.45 0.03 -1.59 0.41 0.00 0.00 173.24 170.64 1f9d s LYS 173 N -5.10 0.30 1.02 12.44 -2.85 -1.26 -3.69 119.74 120.59 1f9d s LYS 173 Ca 0.58 -0.41 -0.16 0.00 -1.00 0.00 0.00 55.97 54.98 1f9d s LYS 173 Cb -0.13 0.11 0.21 0.00 -2.06 0.00 0.00 37.83 35.96 1f9d s LYS 173 CO 0.55 -0.06 1.21 -1.25 0.10 0.00 0.00 175.35 175.90 1f9d s PRO 174 N -1.12 0.20 -0.10 1.78 0.04 -1.25 -5.03 135.00 129.51 1f9d s PRO 174 Ca -0.12 -0.13 0.01 0.00 0.04 0.00 0.00 61.00 60.80 1f9d s PRO 174 Cb -0.07 -1.77 0.02 0.00 0.04 0.00 0.00 34.50 32.72 1f9d s PRO 174 CO -0.00 -2.76 -0.11 0.45 0.04 0.00 0.00 177.00 174.62 1f9d s SER 175 N -4.37 2.14 -0.08 6.66 0.15 -0.17 -4.49 113.70 113.54 1f9d s SER 175 Ca 0.70 -0.34 -0.30 0.00 0.70 0.00 0.00 55.95 56.71 1f9d s SER 175 Cb -0.08 -0.91 -0.03 0.00 -1.71 0.00 0.00 66.02 63.28 1f9d s SER 175 CO 0.54 -0.04 1.30 -0.31 1.20 0.00 0.00 173.24 175.92 1f9d s TYR 176 N 1.23 2.91 0.21 3.44 2.02 -1.26 -0.46 117.35 125.43 1f9d s TYR 176 Ca -0.03 0.98 0.00 0.00 -0.37 0.00 0.00 57.07 57.65 1f9d s TYR 176 Cb -0.14 -3.54 -0.04 0.00 -0.40 0.00 0.00 41.96 37.84 1f9d s TYR 176 CO -0.04 -1.87 0.10 0.96 -1.57 0.00 0.00 175.55 173.13 1f9d s ILE 177 N 2.86 0.26 0.10 2.71 -4.36 -1.25 -2.15 121.20 119.37 1f9d s ILE 177 Ca 0.58 -1.99 -0.05 0.00 -0.26 0.00 0.00 60.65 58.93 1f9d s ILE 177 Cb -0.26 -2.45 -0.02 0.00 1.25 0.00 0.00 42.46 40.98 1f9d s ILE 177 CO 0.21 -0.10 0.12 0.21 0.24 0.00 0.00 174.94 175.61 1f9d s ASN 178 N -3.20 0.24 0.00 4.36 3.84 -0.23 -4.60 114.94 115.36 1f9d s ASN 178 Ca 0.35 -0.89 0.00 0.00 0.21 0.00 0.00 52.86 52.53 1f9d s ASN 178 Cb 0.07 0.31 0.00 0.00 -0.55 0.00 0.00 41.25 41.08 1f9d s ASN 178 CO 0.11 -0.72 0.00 0.35 -2.79 0.00 0.00 177.10 174.04 1f9d n THR 179 N -0.05 0.00 -1.64 -5.21 -2.24 -1.26 -1.42 114.28 102.46 1f9d n THR 179 Ca -0.12 0.00 -0.48 0.00 -2.27 0.00 0.00 64.05 61.19 1f9d n THR 179 Cb 0.62 -0.48 -0.05 0.00 -2.10 0.00 0.00 70.33 68.33 1f9d n THR 179 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1f9d n PHE 180 N -2.02 1.97 0.00 4.78 3.72 -1.26 -4.50 117.46 120.15 1f9d n PHE 180 Ca 0.00 0.42 0.00 0.00 -0.05 0.00 0.00 57.45 57.82 1f9d n PHE 180 Cb 0.00 -2.45 0.00 0.00 -0.94 0.00 0.00 39.48 36.09 1f9d n PHE 180 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1f9d n GLN 181 N 2.89 1.57 -2.24 -1.08 1.13 -1.26 -5.03 117.38 113.36 1f9d n GLN 181 Ca 0.17 0.00 -0.33 0.00 -1.94 0.00 0.00 57.00 54.90 1f9d n GLN 181 Cb 0.26 -0.19 0.02 0.00 0.11 0.00 0.00 30.24 30.44 1f9d n GLN 181 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1f9d n ARG 182 N -0.16 3.15 0.00 -1.09 1.74 -1.26 -5.05 116.66 114.00 1f9d n ARG 182 Ca 0.00 -4.08 0.00 0.00 -0.77 0.00 0.00 57.85 53.00 1f9d n ARG 182 Cb 0.00 -2.26 0.00 0.00 -1.02 0.00 0.00 32.46 29.18 1f9d n ARG 182 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1f9d n GLY 183 N -0.50 -2.30 0.30 -0.13 0.00 -1.26 -4.09 105.19 97.21 1f9d n GLY 183 Ca 0.46 -1.54 0.16 0.00 0.00 0.00 0.00 46.02 45.09 1f9d n GLY 183 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1f9d h GLU 184 N 0.00 0.00 -0.40 1.61 4.11 -1.74 -2.21 114.58 115.96 1f9d h GLU 184 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1f9d h GLU 184 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1f9d h GLU 184 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 179.01 180.12 1f9d n GLN 185 N -3.73 2.42 -3.07 1.06 1.13 -1.26 -1.13 117.38 112.81 1f9d n GLN 185 Ca -0.03 -2.16 -0.45 0.00 -1.94 0.00 0.00 57.00 52.42 1f9d n GLN 185 Cb 0.08 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 28.90 1f9d n GLN 185 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1f9d s GLU 186 N -1.48 3.41 1.12 -1.09 2.12 -0.83 -4.78 118.70 117.16 1f9d s GLU 186 Ca 0.39 -1.75 -0.18 0.00 0.36 0.00 0.00 54.97 53.80 1f9d s GLU 186 Cb 0.22 -4.57 0.25 0.00 0.26 0.00 0.00 34.13 30.29 1f9d s GLU 186 CO 0.31 -1.60 1.15 -1.54 -0.54 0.00 0.00 175.26 173.04 1f9d s SER 187 N 3.28 1.65 0.62 -1.70 1.04 -1.26 -4.84 113.70 112.49 1f9d s SER 187 Ca 0.23 0.63 0.40 0.00 0.48 0.00 0.00 55.95 57.69 1f9d s SER 187 Cb -0.12 -0.90 2.06 0.00 0.10 0.00 0.00 66.02 67.15 1f9d s SER 187 CO -0.04 -3.67 2.25 0.00 0.98 0.00 0.00 173.24 172.76 1f9d h THR 188 N -2.27 0.08 -0.00 2.02 1.03 -1.89 -1.45 112.91 110.42 1f9d h THR 188 Ca -0.46 -0.18 0.00 0.00 -0.01 0.00 0.00 66.41 65.76 1f9d h THR 188 Cb 1.29 1.16 0.00 0.00 -1.07 0.00 0.00 68.15 69.53 1f9d h THR 188 CO 0.39 0.01 -0.32 0.79 -0.01 0.00 0.00 175.52 176.38 1f9d n TRP 189 N -3.17 0.00 -0.61 0.00 7.02 -1.26 -4.15 117.44 115.27 1f9d n TRP 189 Ca -0.02 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.53 1f9d n TRP 189 Cb 0.14 -0.30 0.20 0.00 -2.42 0.00 0.00 31.31 28.93 1f9d n TRP 189 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 1f9d n GLU 190 N -1.39 2.83 -2.62 -0.99 1.02 -0.55 -4.70 120.64 114.24 1f9d n GLU 190 Ca 0.07 -2.43 -0.22 0.00 -0.02 0.00 0.00 57.16 54.56 1f9d n GLU 190 Cb 0.33 -1.55 0.06 0.00 -0.02 0.00 0.00 31.44 30.27 1f9d n GLU 190 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1f9d s THR 191 N -1.97 2.46 -0.32 2.62 -4.23 -1.24 -4.62 115.64 108.33 1f9d s THR 191 Ca 0.32 -0.64 0.00 0.00 -1.18 0.00 0.00 61.69 60.19 1f9d s THR 191 Cb 0.23 -2.82 0.10 0.00 1.34 0.00 0.00 72.50 71.35 1f9d s THR 191 CO 0.11 0.00 0.10 -0.63 -0.54 0.00 0.00 174.62 173.66 1f9d s ILE 192 N -2.90 1.13 0.23 2.99 1.01 -1.26 -5.02 121.20 117.38 1f9d s ILE 192 Ca 0.60 -1.62 -0.31 0.00 0.00 0.00 0.00 60.65 59.32 1f9d s ILE 192 Cb -0.09 -1.85 -0.14 0.00 0.01 0.00 0.00 42.46 40.39 1f9d s ILE 192 CO 0.40 -0.68 1.25 -2.65 0.00 0.00 0.00 174.94 173.27 1f9d n PRO 193 N 4.67 1.62 -4.05 2.79 -0.02 -1.26 -4.81 135.00 133.94 1f9d n PRO 193 Ca -0.00 0.58 -0.08 0.00 -2.02 0.00 0.00 63.50 61.97 1f9d n PRO 193 Cb 0.42 -2.13 -0.10 0.00 -0.02 0.00 0.00 33.50 31.67 1f9d n PRO 193 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1f9d s GLN 194 N -0.67 0.50 0.42 -0.52 0.00 -0.51 -5.01 119.66 113.87 1f9d s GLN 194 Ca 0.68 -1.00 -0.21 0.00 -0.00 0.00 0.00 55.36 54.82 1f9d s GLN 194 Cb -0.72 0.17 -0.11 0.00 0.00 0.00 0.00 33.01 32.35 1f9d s GLN 194 CO 0.53 -0.09 0.95 -1.25 0.00 0.00 0.00 175.29 175.43 1f9d s PRO 195 N -3.04 4.25 0.18 9.60 0.04 -1.26 -1.07 135.00 143.70 1f9d s PRO 195 Ca -0.01 1.12 -0.05 0.00 0.04 0.00 0.00 61.00 62.10 1f9d s PRO 195 Cb 0.02 -2.22 0.07 0.00 0.04 0.00 0.00 34.50 32.40 1f9d s PRO 195 CO -0.07 -0.01 1.48 0.00 0.04 0.00 0.00 177.00 178.45 1f9d s TRP 197 N -4.01 3.21 -0.44 0.00 -0.11 -1.26 -2.23 118.94 114.09 1f9d s TRP 197 Ca -0.08 -0.97 -0.09 0.00 1.22 0.00 0.00 56.10 56.18 1f9d s TRP 197 Cb 0.11 -3.41 0.10 0.00 -1.50 0.00 0.00 33.47 28.77 1f9d s TRP 197 CO 0.85 -0.90 0.30 0.34 -4.62 0.00 0.00 176.95 172.92 1f9d s ASP 198 N 2.91 5.64 -0.16 5.86 -1.08 -0.11 -4.42 116.67 125.30 1f9d s ASP 198 Ca 0.05 -1.76 0.16 0.00 -0.52 0.00 0.00 52.55 50.49 1f9d s ASP 198 Cb -0.25 -1.99 0.74 0.00 -1.46 0.00 0.00 42.92 39.96 1f9d s ASP 198 CO 0.06 -0.62 1.66 -0.62 0.52 0.00 0.00 175.17 176.17 1f9d n GLU 199 N 4.88 4.13 -1.12 4.34 1.02 -1.26 -1.99 120.64 130.65 1f9d n GLU 199 Ca -0.08 -2.98 -0.04 0.00 -0.02 0.00 0.00 57.16 54.03 1f9d n GLU 199 Cb 0.42 -2.03 -0.02 0.00 -0.02 0.00 0.00 31.44 29.79 1f9d n GLU 199 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1f9d n HIS 200 N 0.79 0.00 0.09 -0.32 8.25 -1.26 -4.88 115.22 117.89 1f9d n HIS 200 Ca 0.26 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.68 1f9d n HIS 200 Cb 1.01 -1.38 -0.02 0.00 1.12 0.00 0.00 29.99 30.72 1f9d n HIS 200 CO 0.00 0.00 0.00 0.87 0.64 0.00 0.00 176.34 177.85 1f9d h LYS 201 N 0.31 0.00 -5.88 -0.41 1.79 -1.91 -3.38 116.57 107.09 1f9d h LYS 201 Ca -0.08 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.81 1f9d h LYS 201 Cb 0.56 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.08 1f9d h LYS 201 CO 0.12 0.82 -0.70 -0.06 -1.08 0.00 0.00 179.45 178.55 1f9d s PHE 202 N -2.95 2.22 0.00 -1.35 0.08 -1.26 -5.02 117.98 109.70 1f9d s PHE 202 Ca 0.01 -0.51 0.00 0.00 0.12 0.00 0.00 56.93 56.55 1f9d s PHE 202 Cb 0.10 -1.18 0.00 0.00 -0.57 0.00 0.00 43.02 41.37 1f9d s PHE 202 CO 0.79 0.53 0.00 0.41 -0.10 0.00 0.00 175.22 176.85 1f9d n GLY 203 N -0.67 0.71 0.00 4.36 0.00 -0.17 -3.91 105.19 105.50 1f9d n GLY 203 Ca -0.05 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1f9d n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f9d n GLY 204 N 0.00 1.32 0.34 -0.02 0.00 0.56 -1.69 105.19 105.71 1f9d n GLY 204 Ca 0.00 -1.99 0.08 0.00 0.00 0.00 0.00 46.02 44.11 1f9d n GLY 204 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1f9d h GLN 205 N 0.00 0.52 -1.15 1.61 4.15 -1.91 -2.28 115.11 116.05 1f9d h GLN 205 Ca 0.00 -0.03 -0.57 0.00 0.77 0.00 0.00 58.65 58.82 1f9d h GLN 205 Cb 0.00 -0.12 -0.42 0.00 0.21 0.00 0.00 27.48 27.15 1f9d h GLN 205 CO 0.00 0.35 -0.77 0.66 -1.93 0.00 0.00 178.83 177.14 1f9d n TYR 206 N -4.47 3.10 -1.16 3.99 4.01 -1.26 -4.94 117.16 116.42 1f9d n TYR 206 Ca 0.08 -2.69 0.00 0.00 -0.16 0.00 0.00 57.90 55.13 1f9d n TYR 206 Cb 0.24 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.06 1f9d n TYR 206 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1f9d n GLY 207 N -0.59 2.73 0.31 2.72 0.00 -0.86 -2.97 105.19 106.53 1f9d n GLY 207 Ca 0.41 -0.30 0.05 0.00 0.00 0.00 0.00 46.02 46.18 1f9d n GLY 207 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1f9d n PHE 208 N 13.53 0.00 -0.12 1.61 3.01 -1.26 -0.32 117.46 133.91 1f9d n PHE 208 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.41 1f9d n PHE 208 Cb 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.49 1f9d n PHE 208 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1f9d h LEU 209 N 1.53 -0.56 0.00 4.37 3.38 -1.93 -2.45 115.31 119.66 1f9d h LEU 209 Ca 0.00 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1f9d h LEU 209 Cb 0.37 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1f9d h LEU 209 CO 0.00 -0.20 0.00 -0.90 0.09 0.00 0.00 178.44 177.43 1f9d n ASP 210 N -5.36 0.00 0.08 -0.43 5.75 -1.26 -2.22 116.55 113.11 1f9d n ASP 210 Ca 0.03 -1.65 0.01 0.00 -0.01 0.00 0.00 54.79 53.17 1f9d n ASP 210 Cb 0.27 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.32 1f9d n ASP 210 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1f9d h LEU 211 N 0.00 0.00 0.00 -2.12 3.38 -1.80 -3.41 115.31 111.36 1f9d h LEU 211 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1f9d h LEU 211 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1f9d h LEU 211 CO 0.00 0.53 -1.46 0.49 0.09 0.00 0.00 178.44 178.08 1f9d n PHE 212 N -3.01 0.00 -4.57 1.13 3.72 -0.94 -2.87 117.46 110.91 1f9d n PHE 212 Ca -0.05 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.14 1f9d n PHE 212 Cb 0.79 -0.32 -0.15 0.00 -0.94 0.00 0.00 39.48 38.86 1f9d n PHE 212 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1f9d s THR 213 N -2.16 1.03 -0.16 4.37 2.01 -0.97 -1.15 115.64 118.60 1f9d s THR 213 Ca -0.08 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 61.36 1f9d s THR 213 Cb 0.02 -0.86 0.02 0.00 0.01 0.00 0.00 72.50 71.69 1f9d s THR 213 CO 0.22 0.27 -0.21 -0.75 -0.69 0.00 0.00 174.62 173.47 1f9d s LYS 214 N -0.36 2.99 0.54 4.92 2.20 0.12 -4.20 119.74 125.96 1f9d s LYS 214 Ca 0.05 -0.84 0.03 0.00 -0.36 0.00 0.00 55.97 54.85 1f9d s LYS 214 Cb -0.05 -2.50 0.02 0.00 -1.51 0.00 0.00 37.83 33.80 1f9d s LYS 214 CO -0.00 -0.11 0.25 0.34 -0.36 0.00 0.00 175.35 175.46 1f9d s ASP 215 N 1.06 4.44 -0.01 1.43 -1.08 -1.26 -1.31 116.67 119.93 1f9d s ASP 215 Ca -0.01 -1.43 -0.24 0.00 -0.52 0.00 0.00 52.55 50.35 1f9d s ASP 215 Cb -0.14 0.54 -0.19 0.00 -1.46 0.00 0.00 42.92 41.67 1f9d s ASP 215 CO -0.08 -1.04 1.23 0.74 0.52 0.00 0.00 175.17 176.54 1f9d h THR 216 N 0.95 1.42 -2.37 1.71 2.02 -2.00 -3.47 112.91 111.17 1f9d h THR 216 Ca -0.39 -1.40 0.00 0.00 0.77 0.00 0.00 66.41 65.39 1f9d h THR 216 Cb 1.31 2.21 0.00 0.00 -1.74 0.00 0.00 68.15 69.93 1f9d h THR 216 CO 0.63 0.38 0.00 0.61 0.37 0.00 0.00 175.52 177.52 1f9d n GLY 217 N 0.42 2.10 3.74 2.16 0.00 -1.26 -5.07 105.19 107.27 1f9d n GLY 217 Ca -0.08 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.54 1f9d n GLY 217 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f9d s THR 218 N 2.28 3.62 0.29 2.61 2.01 -1.26 -4.98 115.64 120.21 1f9d s THR 218 Ca 0.00 1.40 -0.30 0.00 0.31 0.00 0.00 61.69 63.10 1f9d s THR 218 Cb 0.00 -3.89 -0.11 0.00 0.01 0.00 0.00 72.50 68.51 1f9d s THR 218 CO 0.00 0.24 1.46 -2.84 -0.69 0.00 0.00 174.62 172.79 1f9d s PRO 219 N -0.41 4.22 0.38 4.92 0.02 -1.26 -4.99 135.00 137.88 1f9d s PRO 219 Ca 0.51 2.39 -0.03 0.00 0.02 0.00 0.00 61.00 63.90 1f9d s PRO 219 Cb -0.32 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.10 1f9d s PRO 219 CO 0.37 -0.45 0.63 0.00 -0.33 0.00 0.00 177.00 177.21 1f9d s ALA 220 N -0.31 3.58 0.22 -1.55 0.00 -1.26 -5.03 121.76 117.41 1f9d s ALA 220 Ca 0.58 -0.69 -0.30 0.00 0.00 0.00 0.00 51.96 51.55 1f9d s ALA 220 Cb -0.44 -2.31 -0.09 0.00 0.00 0.00 0.00 23.12 20.28 1f9d s ALA 220 CO 0.48 -0.07 1.35 0.15 0.00 0.00 0.00 175.76 177.67 1f9d s LYS 221 N -4.28 4.35 0.19 0.00 1.02 -1.26 -4.97 119.74 114.79 1f9d s LYS 221 Ca 0.43 2.14 -0.20 0.00 0.02 0.00 0.00 55.97 58.36 1f9d s LYS 221 Cb -0.10 -3.16 0.04 0.00 -0.52 0.00 0.00 37.83 34.09 1f9d s LYS 221 CO 0.37 -0.30 0.58 1.14 -0.92 0.00 0.00 175.35 176.22 1f9d s GLN 222 N -0.30 1.39 0.29 1.68 -2.07 -0.84 -1.49 119.66 118.33 1f9d s GLN 222 Ca 0.57 -0.72 0.11 0.00 -1.82 0.00 0.00 55.36 53.50 1f9d s GLN 222 Cb -0.38 0.56 -0.05 0.00 -1.09 0.00 0.00 33.01 32.04 1f9d s GLN 222 CO 0.41 -0.60 -0.14 -0.59 -1.32 0.00 0.00 175.29 173.04 1f9d s PHE 223 N -3.83 2.39 -0.22 9.60 -0.12 -0.44 -0.93 117.98 124.43 1f9d s PHE 223 Ca 0.06 -0.35 -0.28 0.00 -0.05 0.00 0.00 56.93 56.31 1f9d s PHE 223 Cb -0.02 -1.13 0.13 0.00 -0.63 0.00 0.00 43.02 41.37 1f9d s PHE 223 CO -0.06 0.66 1.03 -1.59 -0.05 0.00 0.00 175.22 175.21 1f9d s LYS 224 N -3.57 0.53 0.08 1.99 -2.85 -0.94 -1.64 119.74 113.34 1f9d s LYS 224 Ca 0.31 0.35 0.02 0.00 -1.00 0.00 0.00 55.97 55.64 1f9d s LYS 224 Cb -0.03 0.25 -0.04 0.00 -2.06 0.00 0.00 37.83 35.95 1f9d s LYS 224 CO 0.16 -0.12 -0.07 0.71 0.10 0.00 0.00 175.35 176.13 1f9d s TYR 225 N -0.47 0.83 -0.05 1.78 2.02 0.94 -4.69 117.35 117.71 1f9d s TYR 225 Ca 0.01 -0.81 0.01 0.00 -0.37 0.00 0.00 57.07 55.91 1f9d s TYR 225 Cb -0.03 -0.49 0.02 0.00 -0.40 0.00 0.00 41.96 41.07 1f9d s TYR 225 CO -0.03 -0.14 -0.06 0.99 -1.57 0.00 0.00 175.55 174.75 1f9d s THR 226 N -3.04 0.66 0.26 -0.71 2.01 -1.26 -1.88 115.64 111.67 1f9d s THR 226 Ca 0.06 -0.19 -0.10 0.00 0.31 0.00 0.00 61.69 61.77 1f9d s THR 226 Cb 0.01 -0.67 -0.07 0.00 0.01 0.00 0.00 72.50 71.78 1f9d s THR 226 CO -0.03 0.26 0.59 0.21 -0.69 0.00 0.00 174.62 174.95 1f9d s ASN 227 N 0.96 6.63 -0.54 3.53 3.84 -0.31 -0.89 114.94 128.16 1f9d s ASN 227 Ca -0.10 0.97 0.00 0.00 0.21 0.00 0.00 52.86 53.94 1f9d s ASN 227 Cb -0.14 -2.25 0.14 0.00 -0.55 0.00 0.00 41.25 38.45 1f9d s ASN 227 CO 0.00 -0.12 0.31 0.00 -2.79 0.00 0.00 177.10 174.51 1f9d s ALA 228 N -1.89 3.37 0.34 1.71 0.00 -1.26 -4.04 121.76 120.00 1f9d s ALA 228 Ca 0.48 -3.12 0.14 0.00 0.00 0.00 0.00 51.96 49.46 1f9d s ALA 228 Cb -0.11 -2.39 1.07 0.00 0.00 0.00 0.00 23.12 21.70 1f9d s ALA 228 CO 0.22 -2.00 1.65 -1.35 0.00 0.00 0.00 175.76 174.28 1f9d h PRO 229 N 7.01 0.27 0.00 0.00 0.11 -1.80 -1.01 132.00 136.58 1f9d h PRO 229 Ca -0.05 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.00 1f9d h PRO 229 Cb 0.95 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.99 1f9d h PRO 229 CO 0.68 0.18 -0.20 0.38 -0.21 0.00 0.00 178.00 178.83 1f9d h ASP 230 N 0.28 0.00 -0.05 -2.05 2.03 -1.87 -1.50 116.42 113.26 1f9d h ASP 230 Ca 0.73 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 56.95 1f9d h ASP 230 Cb 1.67 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.17 1f9d h ASP 230 CO -0.63 0.20 -0.26 0.00 -1.03 0.00 0.00 179.24 177.53 1f9d h ALA 231 N 1.80 0.10 -0.43 4.15 0.00 -1.52 -1.93 119.26 121.43 1f9d h ALA 231 Ca -0.00 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 1f9d h ALA 231 Cb 0.47 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1f9d h ALA 231 CO 0.03 0.12 0.03 -0.44 0.00 0.00 0.00 179.25 178.99 1f9d h ASP 232 N -0.26 0.63 -0.10 0.00 5.19 -1.46 -1.19 116.42 119.22 1f9d h ASP 232 Ca -0.02 -0.13 -0.13 0.00 -0.62 0.00 0.00 57.03 56.14 1f9d h ASP 232 Cb 0.91 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.24 1f9d h ASP 232 CO 0.05 0.68 -0.36 0.00 -3.12 0.00 0.00 179.24 176.49 1f9d h ALA 233 N 1.40 0.86 -0.22 3.45 0.00 -1.30 -2.51 119.26 120.94 1f9d h ALA 233 Ca 0.14 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1f9d h ALA 233 Cb 0.35 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1f9d h ALA 233 CO 0.01 0.64 -0.20 -0.09 0.00 0.00 0.00 179.25 179.61 1f9d h ARG 234 N 0.51 0.39 -0.51 0.00 2.43 -0.76 -0.97 114.38 115.47 1f9d h ARG 234 Ca 0.05 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.05 1f9d h ARG 234 Cb 0.86 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1f9d h ARG 234 CO 0.07 0.58 0.12 0.00 -1.51 0.00 0.00 179.97 179.23 1f9d h ALA 235 N 1.44 1.25 -0.18 2.80 0.00 -0.82 0.16 119.26 123.91 1f9d h ALA 235 Ca 0.06 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1f9d h ALA 235 Cb 0.55 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1f9d h ALA 235 CO 0.04 0.52 -0.29 0.28 0.00 0.00 0.00 179.25 179.80 1f9d h VAL 236 N 0.76 1.34 -0.41 0.00 2.07 -1.04 -1.70 116.25 117.27 1f9d h VAL 236 Ca 0.17 -1.51 0.04 0.00 0.82 0.00 0.00 66.70 66.22 1f9d h VAL 236 Cb 0.29 1.89 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 1f9d h VAL 236 CO -0.00 0.46 0.18 -0.61 0.02 0.00 0.00 177.57 177.62 1f9d h GLN 237 N 0.15 0.36 -0.55 1.57 4.15 -0.72 -1.41 115.11 118.67 1f9d h GLN 237 Ca 0.01 -0.02 -0.10 0.00 0.77 0.00 0.00 58.65 59.31 1f9d h GLN 237 Cb 0.87 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 1f9d h GLN 237 CO 0.07 0.24 -0.06 0.00 -1.93 0.00 0.00 178.83 177.14 1f9d h ALA 238 N 1.23 0.86 -0.08 3.38 0.00 -0.68 -2.95 119.26 121.01 1f9d h ALA 238 Ca 0.18 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1f9d h ALA 238 Cb 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1f9d h ALA 238 CO -0.15 0.66 -0.34 1.15 0.00 0.00 0.00 179.25 180.57 1f9d h THR 239 N 0.89 1.27 -0.31 0.00 2.02 -0.92 -2.01 112.91 113.85 1f9d h THR 239 Ca 0.15 -1.29 -0.01 0.00 0.77 0.00 0.00 66.41 66.02 1f9d h THR 239 Cb 0.61 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.59 1f9d h THR 239 CO 0.04 0.38 0.15 0.22 0.37 0.00 0.00 175.52 176.68 1f9d h TYR 240 N 0.14 0.46 -0.50 3.16 3.20 -1.10 -1.04 116.97 121.28 1f9d h TYR 240 Ca 0.02 -0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 1f9d h TYR 240 Cb 0.67 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.79 1f9d h TYR 240 CO 0.01 0.41 -0.11 -1.49 -1.64 0.00 0.00 178.16 175.34 1f9d h TRP 241 N 0.37 1.03 -0.87 -3.82 4.06 -1.41 -0.89 115.95 114.42 1f9d h TRP 241 Ca 0.11 -0.20 0.01 0.00 2.06 0.00 0.00 58.89 60.86 1f9d h TRP 241 Cb 0.13 -0.26 -0.04 0.00 -1.00 0.00 0.00 29.16 27.99 1f9d h TRP 241 CO -0.02 0.98 0.56 0.00 -3.56 0.00 0.00 178.44 176.41 1f9d h ALA 242 N 1.04 1.10 -0.05 1.49 0.00 -1.16 0.22 119.26 121.90 1f9d h ALA 242 Ca 0.13 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1f9d h ALA 242 Cb 0.64 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1f9d h ALA 242 CO 0.04 0.52 0.02 0.22 0.00 0.00 0.00 179.25 180.06 1f9d h ASP 243 N 1.18 0.06 -0.09 0.00 3.58 -0.84 0.96 116.42 121.27 1f9d h ASP 243 Ca 0.32 -0.17 0.01 0.00 0.42 0.00 0.00 57.03 57.60 1f9d h ASP 243 Cb -0.11 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 40.91 1f9d h ASP 243 CO -0.07 0.22 0.02 1.56 -2.88 0.00 0.00 179.24 178.09 1f9d h GLN 244 N -0.10 0.06 -0.34 0.28 1.08 -0.72 -1.55 115.11 113.82 1f9d h GLN 244 Ca 0.02 -0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.13 1f9d h GLN 244 Cb 0.18 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 1f9d h GLN 244 CO -0.00 0.04 -0.14 -1.49 -0.95 0.00 0.00 178.83 176.29 1f9d h TRP 245 N 0.06 0.67 -0.49 2.96 6.55 -0.51 -2.60 115.95 122.59 1f9d h TRP 245 Ca 0.04 -0.12 -0.07 0.00 0.95 0.00 0.00 58.89 59.70 1f9d h TRP 245 Cb 0.03 -0.17 -0.02 0.00 -0.86 0.00 0.00 29.16 28.14 1f9d h TRP 245 CO -0.11 0.72 0.04 0.00 -1.05 0.00 0.00 178.44 178.04 1f9d h ALA 246 N 1.29 0.65 -0.06 1.49 0.00 -0.54 -3.01 119.26 119.08 1f9d h ALA 246 Ca 0.10 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 1f9d h ALA 246 Cb 0.56 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1f9d h ALA 246 CO 0.04 0.42 -0.33 0.87 0.00 0.00 0.00 179.25 180.25 1f9d h LYS 247 N 0.70 0.12 0.00 0.00 1.57 -1.13 0.24 116.57 118.07 1f9d h LYS 247 Ca 0.14 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1f9d h LYS 247 Cb 0.46 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1f9d h LYS 247 CO 0.02 0.44 0.00 0.39 -0.57 0.00 0.00 179.45 179.73 1f9d n GLU 248 N -4.12 0.18 -0.13 3.15 1.02 -0.99 -2.22 120.64 117.53 1f9d n GLU 248 Ca -0.02 0.48 0.06 0.00 -0.02 0.00 0.00 57.16 57.66 1f9d n GLU 248 Cb 0.39 -1.90 0.11 0.00 -0.02 0.00 0.00 31.44 30.03 1f9d n GLU 248 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1f9d n GLN 249 N -2.25 2.42 -1.24 3.49 6.02 -0.71 -0.51 117.38 124.60 1f9d n GLN 249 Ca 0.01 -2.16 -0.08 0.00 -0.01 0.00 0.00 57.00 54.76 1f9d n GLN 249 Cb 0.18 -1.34 -0.04 0.00 1.02 0.00 0.00 30.24 30.06 1f9d n GLN 249 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1f9d n GLY 250 N -0.63 0.97 3.99 1.08 0.00 -0.94 -5.00 105.19 104.65 1f9d n GLY 250 Ca 0.11 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.65 1f9d n GLY 250 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f9d s LYS 251 N -2.44 2.58 -0.05 1.61 -0.14 0.78 -4.98 119.74 117.09 1f9d s LYS 251 Ca 0.00 -1.46 -0.05 0.00 -1.36 0.00 0.00 55.97 53.09 1f9d s LYS 251 Cb 0.00 -2.62 0.01 0.00 -1.68 0.00 0.00 37.83 33.54 1f9d s LYS 251 CO 0.00 -0.47 0.15 0.45 -0.76 0.00 0.00 175.35 174.72 1f9d s SER 252 N -4.42 -0.14 -0.28 2.83 0.15 -1.26 -3.61 113.70 106.97 1f9d s SER 252 Ca 0.55 0.26 0.15 0.00 0.70 0.00 0.00 55.95 57.61 1f9d s SER 252 Cb -0.07 0.30 0.48 0.00 -1.71 0.00 0.00 66.02 65.02 1f9d s SER 252 CO 0.33 -0.08 1.14 1.33 1.20 0.00 0.00 173.24 177.17 1f9d n VAL 253 N 2.88 1.84 -0.19 4.45 0.24 -1.26 -4.92 118.33 121.38 1f9d n VAL 253 Ca -0.13 -3.55 -0.01 0.00 -2.04 0.00 0.00 64.34 58.60 1f9d n VAL 253 Cb 0.59 0.14 0.06 0.00 -1.47 0.00 0.00 33.84 33.16 1f9d n VAL 253 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1f9d h SER 254 N 2.43 -0.46 -0.75 -1.34 0.87 -1.99 -1.38 113.55 110.94 1f9d h SER 254 Ca 0.10 0.17 0.06 0.00 -1.23 0.00 0.00 61.79 60.88 1f9d h SER 254 Cb 1.37 0.33 -0.06 0.00 -0.44 0.00 0.00 62.40 63.61 1f9d h SER 254 CO 0.46 -0.17 0.45 0.74 -0.53 0.00 0.00 176.83 177.78 1f9d h THR 255 N 0.03 1.01 -0.25 2.23 2.02 -2.00 -1.99 112.91 113.96 1f9d h THR 255 Ca 0.29 -0.28 -0.13 0.00 0.77 0.00 0.00 66.41 67.05 1f9d h THR 255 Cb 0.45 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1f9d h THR 255 CO -0.57 0.15 -0.38 0.28 0.37 0.00 0.00 175.52 175.37 1f9d h SER 256 N 0.82 0.60 -0.74 4.18 0.02 -1.74 -2.67 113.55 114.02 1f9d h SER 256 Ca 0.33 -0.26 0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1f9d h SER 256 Cb 0.17 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 1f9d h SER 256 CO -0.17 0.93 0.48 0.58 -1.14 0.00 0.00 176.83 177.51 1f9d h VAL 257 N 0.48 1.19 -0.58 2.27 2.07 -0.64 -1.18 116.25 119.86 1f9d h VAL 257 Ca 0.04 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 1f9d h VAL 257 Cb 0.88 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1f9d h VAL 257 CO 0.08 0.19 0.03 1.23 0.02 0.00 0.00 177.57 179.11 1f9d h GLY 258 N 1.01 1.08 0.91 2.17 0.00 -1.06 -1.10 103.07 106.08 1f9d h GLY 258 Ca 0.27 -0.78 -0.04 0.00 0.00 0.00 0.00 47.33 46.79 1f9d h GLY 258 CO -0.06 0.72 0.07 0.50 0.00 0.00 0.00 176.54 177.77 1f9d h LYS 259 N 0.90 0.54 -0.81 4.80 1.57 -1.11 -1.91 116.57 120.54 1f9d h LYS 259 Ca 0.17 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1f9d h LYS 259 Cb 0.51 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 1f9d h LYS 259 CO 0.02 0.61 0.41 0.00 -0.57 0.00 0.00 179.45 179.93 1f9d h ALA 260 N 0.91 1.19 -0.51 3.86 0.00 -1.10 -0.48 119.26 123.13 1f9d h ALA 260 Ca 0.10 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1f9d h ALA 260 Cb 0.32 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1f9d h ALA 260 CO 0.00 0.63 -0.03 1.15 0.00 0.00 0.00 179.25 181.00 1f9d h THR 261 N 1.15 1.27 -0.49 0.00 2.02 -1.07 -0.57 112.91 115.21 1f9d h THR 261 Ca 0.28 -1.13 -0.06 0.00 0.77 0.00 0.00 66.41 66.27 1f9d h THR 261 Cb 0.08 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1f9d h THR 261 CO -0.04 0.40 0.09 0.50 0.37 0.00 0.00 175.52 176.84 1f9d h LYS 262 N 0.78 0.80 -0.81 6.66 3.64 -0.97 -1.63 116.57 125.03 1f9d h LYS 262 Ca 0.14 -0.21 0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1f9d h LYS 262 Cb 0.56 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 1f9d h LYS 262 CO 0.03 0.80 0.54 1.98 -2.27 0.00 0.00 179.45 180.53 1f9d h MET 263 N 0.68 1.06 0.00 1.90 4.05 -0.91 -0.97 114.93 120.75 1f9d h MET 263 Ca 0.15 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.48 1f9d h MET 263 Cb 0.38 -0.24 -0.00 0.00 -0.80 0.00 0.00 31.60 30.94 1f9d h MET 263 CO 0.01 0.70 -0.14 0.78 0.23 0.00 0.00 176.91 178.49 1f9d h GLY 264 N 1.09 0.00 0.59 1.39 0.00 -0.79 0.02 103.07 105.38 1f9d h GLY 264 Ca 0.30 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.58 1f9d h GLY 264 CO -0.07 0.00 -0.17 -1.80 0.00 0.00 0.00 176.54 174.51 1f9d h ASP 265 N 0.00 0.25 0.60 0.19 1.82 -0.22 -3.21 116.42 115.85 1f9d h ASP 265 Ca -0.00 -0.60 -0.10 0.00 -0.39 0.00 0.00 57.03 55.94 1f9d h ASP 265 Cb 0.47 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.39 1f9d h ASP 265 CO 0.02 0.81 -0.48 1.88 -1.61 0.00 0.00 179.24 179.85 1f9d h TYR 266 N -0.29 0.00 0.00 0.28 0.05 -1.18 -3.05 116.97 112.78 1f9d h TYR 266 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1f9d h TYR 266 Cb 0.78 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.52 1f9d h TYR 266 CO 0.12 0.48 0.05 1.25 -1.05 0.00 0.00 178.16 179.02 1f9d h LEU 267 N 0.00 0.00 -1.26 3.88 5.85 -0.99 -1.81 115.31 120.98 1f9d h LEU 267 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1f9d h LEU 267 Cb 0.92 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1f9d h LEU 267 CO 0.06 0.00 0.00 0.03 -0.34 0.00 0.00 178.44 178.19 1f9d h ARG 268 N 0.00 0.00 0.00 1.25 3.08 -1.64 -2.28 114.38 114.80 1f9d h ARG 268 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1f9d h ARG 268 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1f9d h ARG 268 CO 0.00 0.00 -0.00 1.88 -1.07 0.00 0.00 179.97 180.78 1f9d h TYR 269 N 0.00 0.00 0.00 3.04 0.05 -1.59 -0.53 116.97 117.94 1f9d h TYR 269 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1f9d h TYR 269 Cb 0.18 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.92 1f9d h TYR 269 CO 0.00 0.00 0.00 -1.13 -1.05 0.00 0.00 178.16 175.98 1f9d n SER 270 N -3.09 0.00 0.03 3.88 3.41 -0.86 -2.77 113.62 114.23 1f9d n SER 270 Ca -0.01 0.25 0.12 0.00 -0.26 0.00 0.00 58.87 58.97 1f9d n SER 270 Cb 0.18 -0.41 0.51 0.00 -0.26 0.00 0.00 64.21 64.23 1f9d n SER 270 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1f9d n PHE 271 N -1.41 0.25 -4.04 7.33 3.72 -0.21 -2.78 117.46 120.32 1f9d n PHE 271 Ca 0.09 0.08 -0.31 0.00 -0.05 0.00 0.00 57.45 57.26 1f9d n PHE 271 Cb 0.26 -0.63 -0.06 0.00 -0.94 0.00 0.00 39.48 38.11 1f9d n PHE 271 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1f9d s PHE 272 N -3.04 3.23 0.48 1.38 0.40 -1.11 -0.34 117.98 118.97 1f9d s PHE 272 Ca 0.11 0.11 -0.24 0.00 -0.60 0.00 0.00 56.93 56.32 1f9d s PHE 272 Cb 0.15 -1.65 -0.08 0.00 0.51 0.00 0.00 43.02 41.96 1f9d s PHE 272 CO 0.49 0.53 1.32 -3.47 0.70 0.00 0.00 175.22 174.79 1f9d n ASP 273 N 0.53 2.69 -0.37 1.36 2.03 -0.66 -0.74 116.55 121.40 1f9d n ASP 273 Ca -0.09 1.06 0.03 0.00 0.52 0.00 0.00 54.79 56.31 1f9d n ASP 273 Cb 0.52 -1.54 0.10 0.00 -0.72 0.00 0.00 41.12 39.47 1f9d n ASP 273 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1f9d h LYS 274 N 1.86 -0.00 -0.30 -0.67 3.64 -1.75 -0.25 116.57 119.11 1f9d h LYS 274 Ca -0.49 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 58.74 1f9d h LYS 274 Cb 1.29 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 33.03 1f9d h LYS 274 CO 0.59 -0.00 -0.13 0.66 -2.27 0.00 0.00 179.45 178.30 1f9d n TYR 275 N -5.57 0.93 -3.80 1.91 4.01 -1.26 -2.46 117.16 110.92 1f9d n TYR 275 Ca 0.14 -1.55 -0.24 0.00 -0.16 0.00 0.00 57.90 56.09 1f9d n TYR 275 Cb 0.46 -0.45 0.02 0.00 -0.31 0.00 0.00 39.34 39.06 1f9d n TYR 275 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1f9d n PHE 276 N -1.10 -1.90 -3.45 -0.72 3.01 -0.10 -0.74 117.46 112.46 1f9d n PHE 276 Ca 0.31 0.83 -0.33 0.00 1.01 0.00 0.00 57.45 59.27 1f9d n PHE 276 Cb 0.98 -4.15 -0.05 0.00 -0.01 0.00 0.00 39.48 36.24 1f9d n PHE 276 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1f9d s ARG 277 N -6.22 3.80 0.31 -1.08 1.81 -1.26 -0.64 118.95 115.68 1f9d s ARG 277 Ca 0.11 0.25 -0.29 0.00 -1.72 0.00 0.00 55.73 54.08 1f9d s ARG 277 Cb -0.06 -2.74 -0.12 0.00 -0.45 0.00 0.00 34.95 31.59 1f9d s ARG 277 CO 0.83 0.38 1.48 1.63 -0.68 0.00 0.00 175.30 178.94 1f9d n LYS 278 N 0.10 2.47 -2.29 3.54 5.02 -0.39 -4.46 118.16 122.14 1f9d n LYS 278 Ca -0.01 0.87 -0.42 0.00 -2.02 0.00 0.00 58.31 56.73 1f9d n LYS 278 Cb 0.52 -2.58 -0.03 0.00 -0.02 0.00 0.00 35.03 32.92 1f9d n LYS 278 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1f9d s ILE 279 N -0.51 3.88 0.00 -0.18 -1.09 -0.67 -2.60 121.20 120.03 1f9d s ILE 279 Ca 0.60 1.24 0.00 0.00 -2.23 0.00 0.00 60.65 60.26 1f9d s ILE 279 Cb -0.53 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 36.55 1f9d s ILE 279 CO 0.55 -0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.86 1f9d n GLY 280 N 3.58 1.50 2.28 6.18 0.00 -1.26 -4.86 105.19 112.61 1f9d n GLY 280 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 1f9d n GLY 280 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1f9d n GLN 281 N -2.00 0.90 0.21 1.61 6.02 -1.07 -4.89 117.38 118.15 1f9d n GLN 281 Ca 0.00 -3.08 0.16 0.00 -0.01 0.00 0.00 57.00 54.07 1f9d n GLN 281 Cb 0.00 -1.48 0.65 0.00 1.02 0.00 0.00 30.24 30.42 1f9d n GLN 281 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1f9d h PRO 282 N 3.32 0.00 0.00 -1.09 0.13 -1.82 -1.90 132.00 130.64 1f9d h PRO 282 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1f9d h PRO 282 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1f9d h PRO 282 CO 0.44 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.08 1f9d n SER 283 N -3.13 0.47 -4.63 1.44 3.41 -1.26 -4.76 113.62 105.16 1f9d n SER 283 Ca 0.04 0.55 -0.35 0.00 -0.26 0.00 0.00 58.87 58.85 1f9d n SER 283 Cb 0.65 -0.67 -0.10 0.00 -0.26 0.00 0.00 64.21 63.83 1f9d n SER 283 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1f9d s GLN 284 N -3.07 3.35 0.37 4.33 -0.21 -0.71 -4.93 119.66 118.78 1f9d s GLN 284 Ca 0.11 -0.41 -0.27 0.00 0.02 0.00 0.00 55.36 54.80 1f9d s GLN 284 Cb 0.14 -2.91 -0.10 0.00 1.00 0.00 0.00 33.01 31.14 1f9d s GLN 284 CO 0.54 0.51 1.32 0.00 -2.12 0.00 0.00 175.29 175.54 1f9d s ALA 285 N -0.35 3.40 0.65 6.09 0.00 -1.26 -1.26 121.76 129.03 1f9d s ALA 285 Ca 0.07 1.27 -0.11 0.00 0.00 0.00 0.00 51.96 53.19 1f9d s ALA 285 Cb -0.12 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.49 1f9d s ALA 285 CO 0.02 -0.75 1.05 0.20 0.00 0.00 0.00 175.76 176.29 1f9d s GLY 286 N -0.57 1.65 -0.16 0.00 0.00 0.19 -4.56 107.32 103.87 1f9d s GLY 286 Ca 0.53 -0.15 0.16 0.00 0.00 0.00 0.00 44.72 45.25 1f9d s GLY 286 CO 0.52 0.15 1.40 -1.30 0.00 0.00 0.00 173.10 173.87 1f9d n THR 287 N -2.85 2.12 0.00 0.90 -2.24 -1.26 -2.33 114.28 108.62 1f9d n THR 287 Ca 0.06 -1.77 0.00 0.00 -2.27 0.00 0.00 64.05 60.07 1f9d n THR 287 Cb 0.55 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 1f9d n THR 287 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f9d n GLY 288 N -0.39 0.66 0.00 3.38 0.00 -1.25 -4.84 105.19 102.75 1f9d n GLY 288 Ca 0.20 -0.71 0.06 0.00 0.00 0.00 0.00 46.02 45.57 1f9d n GLY 288 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1f9d n TYR 289 N 0.00 0.00 1.21 1.61 4.01 -1.26 -2.02 117.16 120.70 1f9d n TYR 289 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 1f9d n TYR 289 Cb 0.00 -0.40 0.60 0.00 -0.31 0.00 0.00 39.34 39.24 1f9d n TYR 289 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1f9d n ASP 290 N -1.40 0.00 -1.12 7.72 5.75 -1.26 -1.89 116.55 124.36 1f9d n ASP 290 Ca 0.04 -0.34 0.10 0.00 -0.01 0.00 0.00 54.79 54.58 1f9d n ASP 290 Cb 0.12 -0.15 0.27 0.00 -1.03 0.00 0.00 41.12 40.32 1f9d n ASP 290 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1f9d n ALA 291 N -1.15 2.32 -2.86 2.12 0.00 -0.86 -1.67 120.51 118.41 1f9d n ALA 291 Ca 0.13 -1.26 -0.36 0.00 0.00 0.00 0.00 53.44 51.96 1f9d n ALA 291 Cb 0.13 -0.76 -0.11 0.00 0.00 0.00 0.00 19.45 18.71 1f9d n ALA 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1f9d s ALA 292 N -1.02 3.34 -0.79 0.00 0.00 -0.79 -1.66 121.76 120.84 1f9d s ALA 292 Ca 0.40 -0.94 0.24 0.00 0.00 0.00 0.00 51.96 51.66 1f9d s ALA 292 Cb 0.21 -2.07 0.29 0.00 0.00 0.00 0.00 23.12 21.55 1f9d s ALA 292 CO 0.27 -0.19 1.25 -2.39 0.00 0.00 0.00 175.76 174.70 1f9d n HIS 293 N 4.30 0.23 -1.63 0.00 1.44 0.54 -4.90 115.22 115.19 1f9d n HIS 293 Ca -0.16 0.07 -0.16 0.00 -2.01 0.00 0.00 57.72 55.46 1f9d n HIS 293 Cb 0.52 -0.40 -0.06 0.00 0.12 0.00 0.00 29.99 30.17 1f9d n HIS 293 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1f9d n TYR 294 N -1.80 -0.15 -4.27 -1.40 4.01 -1.10 -4.98 117.16 107.47 1f9d n TYR 294 Ca 0.04 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.55 1f9d n TYR 294 Cb 0.39 -2.91 -0.07 0.00 -0.31 0.00 0.00 39.34 36.44 1f9d n TYR 294 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1f9d s LEU 295 N -3.87 3.21 -0.60 7.72 1.43 -1.26 -4.38 118.68 120.93 1f9d s LEU 295 Ca 0.00 -0.66 -0.26 0.00 -1.03 0.00 0.00 54.13 52.18 1f9d s LEU 295 Cb 0.00 -1.72 0.04 0.00 0.03 0.00 0.00 46.19 44.53 1f9d s LEU 295 CO 0.00 -0.04 1.09 -0.76 0.23 0.00 0.00 176.35 176.87 1f9d s LEU 296 N -3.70 3.73 0.00 1.79 1.43 -1.26 -3.77 118.68 116.90 1f9d s LEU 296 Ca 0.32 -0.24 -0.16 0.00 -1.03 0.00 0.00 54.13 53.03 1f9d s LEU 296 Cb -0.06 -2.89 0.21 0.00 0.03 0.00 0.00 46.19 43.49 1f9d s LEU 296 CO 0.20 -1.43 1.27 -1.54 0.23 0.00 0.00 176.35 175.08 1f9d n SER 297 N 8.15 0.10 0.30 2.29 3.41 -1.12 -4.53 113.62 122.22 1f9d n SER 297 Ca 0.04 -1.46 0.16 0.00 -0.26 0.00 0.00 58.87 57.35 1f9d n SER 297 Cb 0.48 -0.97 0.93 0.00 -0.26 0.00 0.00 64.21 64.39 1f9d n SER 297 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 1f9d h TRP 298 N -1.73 0.00 0.00 7.33 2.91 -1.65 -3.41 115.95 119.39 1f9d h TRP 298 Ca -0.41 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.61 1f9d h TRP 298 Cb 1.13 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.78 1f9d h TRP 298 CO 0.00 0.01 0.00 2.48 -1.03 0.00 0.00 178.44 179.90 1f9d n TYR 299 N -3.74 0.00 -3.83 2.65 0.18 -1.26 -4.45 117.16 106.70 1f9d n TYR 299 Ca -0.03 0.00 -0.12 0.00 1.88 0.00 0.00 57.90 59.63 1f9d n TYR 299 Cb 0.10 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 38.93 1f9d n TYR 299 CO 0.00 0.00 0.00 1.52 -2.08 0.00 0.00 176.86 176.30 1f9d s TYR 300 N -2.00 -0.13 0.06 -3.48 -0.85 -1.26 -3.06 117.35 106.64 1f9d s TYR 300 Ca 0.00 0.31 -0.00 0.00 -0.52 0.00 0.00 57.07 56.86 1f9d s TYR 300 Cb 0.00 0.04 -0.04 0.00 0.38 0.00 0.00 41.96 42.34 1f9d s TYR 300 CO 0.00 -0.10 -0.04 0.00 -1.52 0.00 0.00 175.55 173.89 1f9d s ALA 301 N -0.12 0.63 0.07 9.51 0.00 -0.42 -1.16 121.76 130.27 1f9d s ALA 301 Ca -0.02 -1.20 -0.16 0.00 0.00 0.00 0.00 51.96 50.57 1f9d s ALA 301 Cb -0.02 0.22 0.03 0.00 0.00 0.00 0.00 23.12 23.35 1f9d s ALA 301 CO 0.00 -0.31 0.38 1.67 0.00 0.00 0.00 175.76 177.50 1f9d s TRP 302 N -3.62 -0.20 0.26 0.00 -2.14 -0.79 -0.62 118.94 111.83 1f9d s TRP 302 Ca 0.07 0.03 -0.20 0.00 2.66 0.00 0.00 56.10 58.66 1f9d s TRP 302 Cb 0.06 0.19 0.07 0.00 -3.10 0.00 0.00 33.47 30.69 1f9d s TRP 302 CO -0.08 -0.60 0.93 0.20 -2.66 0.00 0.00 176.95 174.74 1f9d s GLY 303 N -2.32 0.17 0.11 3.67 0.00 -0.92 -0.04 107.32 107.98 1f9d s GLY 303 Ca -0.02 -0.45 -0.25 0.00 0.00 0.00 0.00 44.72 44.01 1f9d s GLY 303 CO -0.06 1.09 1.14 -0.32 0.00 0.00 0.00 173.10 174.95 1f9d s GLY 304 N -3.22 0.03 0.45 0.20 0.00 -0.65 -1.36 107.32 102.77 1f9d s GLY 304 Ca 0.18 -0.21 -0.16 0.00 0.00 0.00 0.00 44.72 44.54 1f9d s GLY 304 CO 0.07 3.82 0.89 -0.32 0.00 0.00 0.00 173.10 177.56 1f9d s GLY 305 N -3.58 2.13 -0.24 0.20 0.00 -0.68 -1.32 107.32 103.81 1f9d s GLY 305 Ca 0.25 0.10 -0.05 0.00 0.00 0.00 0.00 44.72 45.03 1f9d s GLY 305 CO 0.03 0.35 -0.16 1.39 0.00 0.00 0.00 173.10 174.71 1f9d n ILE 306 N -1.18 1.54 0.47 0.90 5.41 -0.55 -4.54 119.36 121.40 1f9d n ILE 306 Ca 0.05 -0.50 0.09 0.00 1.00 0.00 0.00 62.75 63.39 1f9d n ILE 306 Cb 0.54 -1.61 0.12 0.00 -0.71 0.00 0.00 39.64 37.98 1f9d n ILE 306 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1f9d n ASP 307 N -3.61 2.76 -3.93 4.38 5.75 -1.26 -4.94 116.55 115.70 1f9d n ASP 307 Ca -0.46 -1.81 -0.10 0.00 -0.01 0.00 0.00 54.79 52.42 1f9d n ASP 307 Cb 0.95 -0.10 -0.09 0.00 -1.03 0.00 0.00 41.12 40.85 1f9d n ASP 307 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1f9d s SER 308 N -1.36 0.17 -0.41 -1.12 1.04 -1.26 -5.11 113.70 105.65 1f9d s SER 308 Ca 0.25 -0.50 -0.16 0.00 0.48 0.00 0.00 55.95 56.03 1f9d s SER 308 Cb 0.16 0.22 0.02 0.00 0.10 0.00 0.00 66.02 66.51 1f9d s SER 308 CO 0.23 -0.48 0.35 0.42 0.98 0.00 0.00 173.24 174.74 1f9d s THR 309 N -2.42 5.20 0.03 2.02 -4.23 -1.26 -3.89 115.64 111.09 1f9d s THR 309 Ca -0.07 -0.49 -0.28 0.00 -1.18 0.00 0.00 61.69 59.67 1f9d s THR 309 Cb -0.02 -3.95 0.09 0.00 1.34 0.00 0.00 72.50 69.96 1f9d s THR 309 CO -0.04 -0.32 0.99 -1.66 -0.54 0.00 0.00 174.62 173.05 1f9d s TRP 310 N 1.86 -0.21 0.18 3.99 1.48 -1.25 -4.92 118.94 120.06 1f9d s TRP 310 Ca 0.08 0.02 -0.24 0.00 -1.06 0.00 0.00 56.10 54.90 1f9d s TRP 310 Cb -0.18 0.57 0.05 0.00 -1.16 0.00 0.00 33.47 32.76 1f9d s TRP 310 CO 0.11 -0.59 0.90 -1.54 -4.06 0.00 0.00 176.95 171.78 1f9d s SER 311 N -2.68 -0.20 0.17 -2.66 1.04 -1.25 -1.69 113.70 106.43 1f9d s SER 311 Ca 0.09 -0.45 -0.15 0.00 0.48 0.00 0.00 55.95 55.92 1f9d s SER 311 Cb -0.00 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.68 1f9d s SER 311 CO -0.04 -1.01 0.43 -1.66 0.98 0.00 0.00 173.24 171.94 1f9d s TRP 312 N -3.44 -0.01 -0.06 5.02 1.48 -0.46 -4.60 118.94 116.87 1f9d s TRP 312 Ca 0.12 -0.33 -0.08 0.00 -1.06 0.00 0.00 56.10 54.74 1f9d s TRP 312 Cb -0.02 0.24 0.02 0.00 -1.16 0.00 0.00 33.47 32.54 1f9d s TRP 312 CO 0.03 -0.81 0.21 0.42 -4.06 0.00 0.00 176.95 172.75 1f9d s ILE 313 N -3.88 0.02 0.05 0.66 1.01 -0.98 -2.17 121.20 115.92 1f9d s ILE 313 Ca 0.09 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.57 1f9d s ILE 313 Cb 0.01 -0.37 -0.03 0.00 0.01 0.00 0.00 42.46 42.08 1f9d s ILE 313 CO -0.05 -0.11 -0.07 0.27 0.00 0.00 0.00 174.94 174.98 1f9d s ILE 314 N -0.35 0.56 0.00 2.92 -4.36 0.21 -4.31 121.20 115.87 1f9d s ILE 314 Ca -0.04 -1.26 0.00 0.00 -0.26 0.00 0.00 60.65 59.08 1f9d s ILE 314 Cb -0.03 -0.83 0.00 0.00 1.25 0.00 0.00 42.46 42.84 1f9d s ILE 314 CO 0.01 -0.49 0.00 0.61 0.24 0.00 0.00 174.94 175.30 1f9d n GLY 315 N 1.14 1.88 3.45 6.27 0.00 -1.03 -1.30 105.19 115.60 1f9d n GLY 315 Ca -0.21 -1.75 -0.13 0.00 0.00 0.00 0.00 46.02 43.93 1f9d n GLY 315 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1f9d s SER 316 N -1.00 -0.59 0.07 1.61 0.15 0.08 -4.28 113.70 109.74 1f9d s SER 316 Ca 0.00 1.12 0.24 0.00 0.70 0.00 0.00 55.95 58.01 1f9d s SER 316 Cb 0.00 1.12 0.38 0.00 -1.71 0.00 0.00 66.02 65.81 1f9d s SER 316 CO 0.00 -0.19 1.33 -1.20 1.20 0.00 0.00 173.24 174.37 1f9d n SER 317 N 2.90 0.60 -4.70 5.45 7.64 -1.26 -3.84 113.62 120.42 1f9d n SER 317 Ca -0.14 -0.05 -0.37 0.00 1.01 0.00 0.00 58.87 59.32 1f9d n SER 317 Cb 0.56 0.26 -0.07 0.00 -1.01 0.00 0.00 64.21 63.95 1f9d n SER 317 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1f9d s HIS 318 N -3.11 3.42 -0.12 1.43 3.76 -1.26 -1.38 115.29 118.03 1f9d s HIS 318 Ca 0.08 0.59 0.03 0.00 -0.15 0.00 0.00 55.06 55.60 1f9d s HIS 318 Cb 0.15 -2.42 0.01 0.00 1.11 0.00 0.00 32.58 31.43 1f9d s HIS 318 CO 0.72 0.13 -0.20 -0.80 -0.85 0.00 0.00 174.74 173.74 1f9d s ASN 319 N 0.74 2.80 -0.09 1.40 0.01 0.12 -1.73 114.94 118.19 1f9d s ASN 319 Ca 0.17 -0.52 0.02 0.00 -0.71 0.00 0.00 52.86 51.83 1f9d s ASN 319 Cb -0.14 -1.28 -0.02 0.00 0.41 0.00 0.00 41.25 40.22 1f9d s ASN 319 CO 0.06 0.07 -0.15 -2.28 -1.51 0.00 0.00 177.10 173.29 1f9d s HIS 320 N 0.75 2.72 0.48 2.20 2.46 -1.26 -1.65 115.29 120.99 1f9d s HIS 320 Ca -0.10 -0.45 0.16 0.00 0.47 0.00 0.00 55.06 55.13 1f9d s HIS 320 Cb -0.16 -1.72 1.15 0.00 -0.13 0.00 0.00 32.58 31.72 1f9d s HIS 320 CO 0.01 -0.05 2.07 0.27 -2.47 0.00 0.00 174.74 174.57 1f9d h PHE 321 N 6.05 0.00 0.00 3.88 -0.00 -1.54 -2.29 116.94 123.04 1f9d h PHE 321 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.62 1f9d h PHE 321 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.13 1f9d h PHE 321 CO 0.49 0.09 0.00 0.78 -0.00 0.00 0.00 178.31 179.67 1f9d h GLY 322 N 0.29 0.00 0.80 6.09 0.00 -1.84 -2.39 103.07 106.02 1f9d h GLY 322 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1f9d h GLY 322 CO 0.01 0.00 -0.90 -1.72 0.00 0.00 0.00 176.54 173.93 1f9d n TYR 323 N -3.08 0.40 -1.74 5.60 4.02 -0.86 -4.34 117.16 117.15 1f9d n TYR 323 Ca -0.03 0.12 -0.35 0.00 -0.01 0.00 0.00 57.90 57.62 1f9d n TYR 323 Cb 0.08 -0.54 0.06 0.00 -0.02 0.00 0.00 39.34 38.92 1f9d n TYR 323 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 1f9d s GLN 324 N -3.20 2.59 -0.44 -0.72 -1.52 -0.90 -4.46 119.66 111.01 1f9d s GLN 324 Ca 0.04 1.81 0.05 0.00 -1.95 0.00 0.00 55.36 55.31 1f9d s GLN 324 Cb 0.14 -1.88 0.17 0.00 -0.22 0.00 0.00 33.01 31.22 1f9d s GLN 324 CO 0.77 -1.50 0.48 1.21 -0.25 0.00 0.00 175.29 176.00 1f9d s ASN 325 N -1.78 0.37 0.45 5.90 3.84 -1.26 -4.83 114.94 117.63 1f9d s ASN 325 Ca 0.77 -2.23 0.11 0.00 0.21 0.00 0.00 52.86 51.71 1f9d s ASN 325 Cb -0.30 0.61 1.01 0.00 -0.55 0.00 0.00 41.25 42.01 1f9d s ASN 325 CO 0.39 -0.15 2.07 -0.65 -2.79 0.00 0.00 177.10 175.97 1f9d h PRO 326 N 5.81 0.36 -0.17 0.43 0.11 -1.93 -2.47 132.00 134.14 1f9d h PRO 326 Ca 0.14 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.21 1f9d h PRO 326 Cb 1.02 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1f9d h PRO 326 CO 0.21 0.24 0.00 0.35 -0.21 0.00 0.00 178.00 178.59 1f9d h PHE 327 N 0.37 0.33 -0.61 0.65 3.57 -1.95 0.07 116.94 119.37 1f9d h PHE 327 Ca 0.13 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1f9d h PHE 327 Cb 0.08 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1f9d h PHE 327 CO -0.00 0.51 0.30 0.00 -2.23 0.00 0.00 178.31 176.88 1f9d h ALA 328 N 0.78 1.37 -0.44 2.41 0.00 -1.79 -0.59 119.26 121.00 1f9d h ALA 328 Ca 0.05 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 1f9d h ALA 328 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1f9d h ALA 328 CO 0.01 0.49 -0.15 0.00 0.00 0.00 0.00 179.25 179.60 1f9d h ALA 329 N 1.47 0.90 -0.42 0.00 0.00 -1.20 -1.88 119.26 118.13 1f9d h ALA 329 Ca 0.21 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1f9d h ALA 329 Cb 0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1f9d h ALA 329 CO -0.03 0.63 0.14 2.35 0.00 0.00 0.00 179.25 182.34 1f9d h TRP 330 N 0.74 0.68 0.65 0.00 7.01 -0.06 -2.28 115.95 122.68 1f9d h TRP 330 Ca 0.12 -0.07 -0.03 0.00 2.11 0.00 0.00 58.89 61.02 1f9d h TRP 330 Cb 0.66 -0.20 -0.00 0.00 -2.10 0.00 0.00 29.16 27.52 1f9d h TRP 330 CO 0.04 0.62 -0.36 0.28 -2.79 0.00 0.00 178.44 176.22 1f9d h VAL 331 N 0.54 0.26 0.00 2.65 2.07 -0.93 -0.92 116.25 119.92 1f9d h VAL 331 Ca 0.14 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.66 1f9d h VAL 331 Cb 0.26 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1f9d h VAL 331 CO -0.00 0.00 -0.01 -0.07 0.02 0.00 0.00 177.57 177.51 1f9d h LEU 332 N -0.94 0.00 0.00 2.57 3.38 -1.37 -1.48 115.31 117.48 1f9d h LEU 332 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1f9d h LEU 332 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1f9d h LEU 332 CO 0.11 0.01 -1.12 -1.54 0.09 0.00 0.00 178.44 175.99 1f9d n SER 333 N -3.13 0.83 0.00 -0.43 3.41 -0.86 -4.42 113.62 109.02 1f9d n SER 333 Ca -0.02 -0.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.94 1f9d n SER 333 Cb 0.17 1.24 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1f9d n SER 333 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1f9d n THR 334 N -1.62 0.00 -2.89 6.66 -2.24 -0.36 -4.89 114.28 108.94 1f9d n THR 334 Ca 0.01 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.37 1f9d n THR 334 Cb 0.33 -0.50 -0.04 0.00 -2.10 0.00 0.00 70.33 68.02 1f9d n THR 334 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1f9d s ASP 335 N -2.24 6.76 0.47 3.42 -1.08 -0.57 -4.93 116.67 118.50 1f9d s ASP 335 Ca 0.00 0.85 0.19 0.00 -0.52 0.00 0.00 52.55 53.07 1f9d s ASP 335 Cb 0.00 -2.43 1.19 0.00 -1.46 0.00 0.00 42.92 40.22 1f9d s ASP 335 CO 0.00 -0.61 1.96 0.00 0.52 0.00 0.00 175.17 177.04 1f9d h ALA 336 N 7.95 2.26 0.00 3.66 0.00 -1.95 -0.57 119.26 130.61 1f9d h ALA 336 Ca -0.23 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1f9d h ALA 336 Cb 1.09 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1f9d h ALA 336 CO 0.90 -0.43 -0.18 -0.91 0.00 0.00 0.00 179.25 178.63 1f9d h ASN 337 N 0.24 0.00 -0.39 0.00 2.35 -1.94 -3.05 115.58 112.80 1f9d h ASN 337 Ca 0.30 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.91 1f9d h ASN 337 Cb 0.86 0.00 -0.09 0.00 0.05 0.00 0.00 38.32 39.15 1f9d h ASN 337 CO -0.06 0.18 0.02 0.49 -1.65 0.00 0.00 177.43 176.41 1f9d n PHE 338 N -3.41 1.25 -2.44 1.19 3.01 -0.24 -4.91 117.46 111.92 1f9d n PHE 338 Ca -0.00 -1.35 -0.42 0.00 1.01 0.00 0.00 57.45 56.69 1f9d n PHE 338 Cb 0.38 -0.47 -0.03 0.00 -0.01 0.00 0.00 39.48 39.35 1f9d n PHE 338 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1f9d s LYS 339 N -3.09 4.33 0.51 -1.08 2.20 -1.12 -4.52 119.74 116.97 1f9d s LYS 339 Ca 0.45 1.68 -0.22 0.00 -0.36 0.00 0.00 55.97 57.53 1f9d s LYS 339 Cb 0.39 -3.59 -0.06 0.00 -1.51 0.00 0.00 37.83 33.06 1f9d s LYS 339 CO 0.04 -0.49 1.24 -2.14 -0.36 0.00 0.00 175.35 173.64 1f9d s PRO 340 N 2.41 3.42 0.43 4.03 0.02 -1.26 -4.93 135.00 139.11 1f9d s PRO 340 Ca 0.56 1.94 0.21 0.00 0.02 0.00 0.00 61.00 63.73 1f9d s PRO 340 Cb -0.25 -2.28 0.96 0.00 0.02 0.00 0.00 34.50 32.96 1f9d s PRO 340 CO 0.21 -0.88 1.87 0.87 -0.33 0.00 0.00 177.00 178.74 1f9d h LYS 341 N 1.65 0.00 -7.19 5.54 1.57 -1.94 -3.43 116.57 112.77 1f9d h LYS 341 Ca -0.50 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 57.75 1f9d h LYS 341 Cb 1.27 0.00 0.15 0.00 0.08 0.00 0.00 32.23 33.73 1f9d h LYS 341 CO 0.58 0.27 0.37 -1.54 -0.57 0.00 0.00 179.45 178.57 1f9d s SER 342 N -6.41 4.24 0.23 0.86 1.04 -1.26 -4.91 113.70 107.48 1f9d s SER 342 Ca -0.01 2.27 -0.07 0.00 0.48 0.00 0.00 55.95 58.62 1f9d s SER 342 Cb 0.12 -2.58 0.25 0.00 0.10 0.00 0.00 66.02 63.91 1f9d s SER 342 CO 0.66 -2.23 1.89 0.77 0.98 0.00 0.00 173.24 175.30 1f9d h SER 343 N -0.40 0.95 -0.31 7.02 4.64 -1.87 -3.19 113.55 120.39 1f9d h SER 343 Ca -0.47 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1f9d h SER 343 Cb 1.28 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1f9d h SER 343 CO 0.50 0.66 0.00 0.59 -0.87 0.00 0.00 176.83 177.71 1f9d n ASN 344 N -4.52 2.89 0.08 4.97 5.03 -1.26 -4.75 115.26 117.69 1f9d n ASN 344 Ca 0.11 -1.87 -0.16 0.00 0.87 0.00 0.00 54.58 53.53 1f9d n ASN 344 Cb 0.07 -0.20 -0.10 0.00 -1.02 0.00 0.00 39.78 38.53 1f9d n ASN 344 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1f9d h GLY 345 N 2.72 -1.15 1.01 7.41 0.00 -1.85 -0.54 103.07 110.67 1f9d h GLY 345 Ca 0.00 0.66 0.01 0.00 0.00 0.00 0.00 47.33 47.99 1f9d h GLY 345 CO 0.00 -0.25 0.49 0.00 0.00 0.00 0.00 176.54 176.78 1f9d h ALA 346 N -0.50 0.95 -0.31 3.60 0.00 -1.83 -2.29 119.26 118.88 1f9d h ALA 346 Ca 0.00 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1f9d h ALA 346 Cb 0.72 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1f9d h ALA 346 CO -0.32 0.37 -0.33 0.66 0.00 0.00 0.00 179.25 179.63 1f9d h SER 347 N 1.01 0.70 -0.55 0.00 4.64 -1.85 -1.72 113.55 115.77 1f9d h SER 347 Ca 0.27 -0.28 -0.07 0.00 -0.47 0.00 0.00 61.79 61.24 1f9d h SER 347 Cb -0.11 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.76 1f9d h SER 347 CO -0.06 0.97 0.09 0.44 -0.87 0.00 0.00 176.83 177.40 1f9d h ASP 348 N 0.57 0.92 0.67 4.97 3.32 -0.91 -1.72 116.42 124.23 1f9d h ASP 348 Ca 0.06 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 1f9d h ASP 348 Cb 0.83 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.13 1f9d h ASP 348 CO 0.07 0.93 -0.28 -0.50 -1.72 0.00 0.00 179.24 177.74 1f9d h TRP 349 N 0.91 0.00 -0.30 4.55 4.06 -1.17 -0.69 115.95 123.30 1f9d h TRP 349 Ca 0.18 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.02 1f9d h TRP 349 Cb 0.41 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.57 1f9d h TRP 349 CO 0.03 0.28 -0.26 0.00 -3.56 0.00 0.00 178.44 174.93 1f9d h ALA 350 N 1.72 0.44 -0.57 1.49 0.00 -0.53 -1.23 119.26 120.57 1f9d h ALA 350 Ca -0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.42 1f9d h ALA 350 Cb 0.69 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1f9d h ALA 350 CO 0.04 0.43 -0.03 0.87 0.00 0.00 0.00 179.25 180.55 1f9d h LYS 351 N 0.46 1.01 -0.64 0.00 1.57 -0.91 -2.91 116.57 115.15 1f9d h LYS 351 Ca 0.05 -0.33 -0.04 0.00 -1.87 0.00 0.00 60.65 58.47 1f9d h LYS 351 Cb 0.82 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1f9d h LYS 351 CO 0.07 1.01 0.25 1.03 -0.57 0.00 0.00 179.45 181.23 1f9d h SER 352 N 0.91 0.88 -0.30 0.86 0.87 -0.98 -0.96 113.55 114.83 1f9d h SER 352 Ca 0.16 -0.17 0.05 0.00 -1.23 0.00 0.00 61.79 60.59 1f9d h SER 352 Cb 0.58 -0.23 -0.04 0.00 -0.44 0.00 0.00 62.40 62.27 1f9d h SER 352 CO 0.03 0.81 0.03 0.25 -0.53 0.00 0.00 176.83 177.43 1f9d h LEU 353 N 0.89 -0.05 -0.50 2.23 5.85 -1.04 0.36 115.31 123.06 1f9d h LEU 353 Ca 0.21 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.91 1f9d h LEU 353 Cb 0.21 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1f9d h LEU 353 CO -0.02 0.01 0.02 0.44 -0.34 0.00 0.00 178.44 178.55 1f9d h ASP 354 N 0.13 0.85 -0.69 1.25 3.32 -1.36 -2.58 116.42 117.34 1f9d h ASP 354 Ca 0.14 -0.30 -0.06 0.00 0.02 0.00 0.00 57.03 56.83 1f9d h ASP 354 Cb 0.17 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 1f9d h ASP 354 CO -0.21 0.94 0.19 -0.09 -1.72 0.00 0.00 179.24 178.35 1f9d h ARG 355 N 0.73 1.09 -0.60 3.56 9.65 -0.73 -2.54 114.38 125.54 1f9d h ARG 355 Ca 0.14 -0.25 -0.01 0.00 -1.10 0.00 0.00 59.98 58.76 1f9d h ARG 355 Cb 0.49 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.90 1f9d h ARG 355 CO 0.02 0.96 0.34 1.96 2.80 0.00 0.00 179.97 186.05 1f9d h GLN 356 N 1.03 0.82 -0.06 0.20 4.20 -0.18 -1.08 115.11 120.04 1f9d h GLN 356 Ca 0.22 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.76 1f9d h GLN 356 Cb 0.34 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1f9d h GLN 356 CO -0.00 0.62 -0.34 -0.07 -0.67 0.00 0.00 178.83 178.37 1f9d h LEU 357 N 0.81 0.11 -0.43 1.46 3.38 -1.34 -1.53 115.31 117.77 1f9d h LEU 357 Ca 0.21 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 1f9d h LEU 357 Cb 0.02 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1f9d h LEU 357 CO -0.04 0.45 -0.25 -0.33 0.09 0.00 0.00 178.44 178.37 1f9d h GLU 358 N 0.10 0.92 -0.16 1.13 5.08 -1.04 -2.60 114.58 118.01 1f9d h GLU 358 Ca 0.01 -0.42 0.03 0.00 -1.00 0.00 0.00 59.36 57.98 1f9d h GLU 358 Cb 0.65 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 1f9d h GLU 358 CO 0.05 1.08 -0.01 0.35 -1.00 0.00 0.00 179.01 179.48 1f9d h PHE 359 N 0.75 -0.02 -0.19 4.33 3.57 -0.53 -0.23 116.94 124.62 1f9d h PHE 359 Ca 0.09 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.63 1f9d h PHE 359 Cb 0.83 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.58 1f9d h PHE 359 CO 0.06 -0.03 0.03 1.88 -2.23 0.00 0.00 178.31 178.02 1f9d h TYR 360 N 0.04 0.06 -0.73 0.41 0.05 -1.27 -2.29 116.97 113.23 1f9d h TYR 360 Ca 0.07 0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.82 1f9d h TYR 360 Cb 0.09 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 1f9d h TYR 360 CO -0.16 0.02 0.28 0.37 -1.05 0.00 0.00 178.16 177.62 1f9d h GLN 361 N 0.11 1.11 -0.76 4.88 5.75 -1.18 -2.22 115.11 122.79 1f9d h GLN 361 Ca 0.09 -0.21 0.03 0.00 -0.15 0.00 0.00 58.65 58.41 1f9d h GLN 361 Cb 0.08 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 28.41 1f9d h GLN 361 CO -0.12 0.91 0.50 2.35 -2.65 0.00 0.00 178.83 179.83 1f9d h TRP 362 N 1.06 0.91 -0.02 3.99 7.01 -0.83 -2.63 115.95 125.44 1f9d h TRP 362 Ca 0.24 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.27 1f9d h TRP 362 Cb 0.23 -0.30 0.00 0.00 -2.10 0.00 0.00 29.16 26.99 1f9d h TRP 362 CO 0.02 0.54 0.00 1.28 -2.79 0.00 0.00 178.44 177.49 1f9d n LEU 363 N -4.45 1.17 -4.63 0.65 4.77 -0.88 -4.71 117.00 108.93 1f9d n LEU 363 Ca 0.09 -0.40 -0.43 0.00 -0.03 0.00 0.00 56.01 55.25 1f9d n LEU 363 Cb 0.10 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1f9d n LEU 363 CO 0.35 0.20 1.15 -1.58 -1.33 0.00 0.00 177.39 176.18 1f9d s GLN 364 N -1.99 3.90 1.09 3.23 0.74 -0.90 -0.28 119.66 125.45 1f9d s GLN 364 Ca 0.40 1.27 -0.12 0.00 0.05 0.00 0.00 55.36 56.96 1f9d s GLN 364 Cb 0.21 -3.89 0.24 0.00 1.10 0.00 0.00 33.01 30.67 1f9d s GLN 364 CO 0.34 -1.14 1.06 -1.54 -0.55 0.00 0.00 175.29 173.45 1f9d s SER 365 N 2.91 1.69 0.33 6.67 1.04 -0.25 -4.59 113.70 121.51 1f9d s SER 365 Ca 0.57 1.50 0.06 0.00 0.48 0.00 0.00 55.95 58.57 1f9d s SER 365 Cb -0.17 -2.22 0.71 0.00 0.10 0.00 0.00 66.02 64.44 1f9d s SER 365 CO 0.24 -3.76 1.89 0.00 0.98 0.00 0.00 173.24 172.59 1f9d h ALA 366 N -2.32 1.70 0.08 5.32 0.00 -0.85 -2.41 119.26 120.78 1f9d h ALA 366 Ca -0.57 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.08 1f9d h ALA 366 Cb 1.32 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1f9d h ALA 366 CO 0.51 0.10 -1.13 0.93 0.00 0.00 0.00 179.25 179.66 1f9d h GLU 367 N 0.81 0.36 0.00 0.00 3.07 -1.90 -3.49 114.58 113.43 1f9d h GLU 367 Ca 0.42 -0.49 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 1f9d h GLU 367 Cb 0.51 0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.59 1f9d h GLU 367 CO -0.19 1.19 0.00 0.41 -1.40 0.00 0.00 179.01 179.02 1f9d n GLY 368 N 1.29 1.27 3.75 -3.84 0.00 -0.91 -4.53 105.19 102.21 1f9d n GLY 368 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 1f9d n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9d s ALA 369 N -0.27 2.30 -0.19 4.61 0.00 -1.26 -4.33 121.76 122.61 1f9d s ALA 369 Ca 0.00 0.68 -0.15 0.00 0.00 0.00 0.00 51.96 52.49 1f9d s ALA 369 Cb 0.00 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 1f9d s ALA 369 CO 0.00 -1.57 0.35 0.42 0.00 0.00 0.00 175.76 174.97 1f9d s ILE 370 N -2.20 5.24 0.90 0.00 -1.09 -1.26 -1.09 121.20 121.69 1f9d s ILE 370 Ca 0.70 0.63 -0.12 0.00 -2.23 0.00 0.00 60.65 59.63 1f9d s ILE 370 Cb -0.24 -3.69 0.13 0.00 -1.58 0.00 0.00 42.46 37.08 1f9d s ILE 370 CO 0.43 0.30 1.12 0.00 -1.23 0.00 0.00 174.94 175.56 1f9d s ALA 371 N 1.06 1.72 0.00 9.38 0.00 0.62 -4.97 121.76 129.57 1f9d s ALA 371 Ca 0.18 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1f9d s ALA 371 Cb -0.14 -3.08 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1f9d s ALA 371 CO 0.07 -2.26 0.31 0.41 0.00 0.00 0.00 175.76 174.29 1f9d n GLY 372 N -1.89 -2.31 0.00 0.00 0.00 -1.25 -4.64 105.19 95.10 1f9d n GLY 372 Ca 0.06 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1f9d n GLY 372 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f9d n GLY 373 N -0.60 -0.74 3.43 -0.02 0.00 -0.90 -1.53 105.19 104.83 1f9d n GLY 373 Ca 0.00 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1f9d n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f9d s ALA 374 N -1.00 -0.66 0.03 4.61 0.00 -0.66 -1.60 121.76 122.48 1f9d s ALA 374 Ca 0.00 -0.39 0.01 0.00 0.00 0.00 0.00 51.96 51.58 1f9d s ALA 374 Cb 0.00 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 23.91 1f9d s ALA 374 CO 0.00 -0.72 -0.05 -0.08 0.00 0.00 0.00 175.76 174.91 1f9d s THR 375 N -3.89 0.31 -2.91 0.00 -1.32 -0.63 -0.70 115.64 106.50 1f9d s THR 375 Ca 0.10 -0.94 0.24 0.00 -1.21 0.00 0.00 61.69 59.88 1f9d s THR 375 Cb 0.01 -0.41 0.23 0.00 -1.51 0.00 0.00 72.50 70.82 1f9d s THR 375 CO -0.04 -0.42 1.29 -3.20 -2.21 0.00 0.00 174.62 170.04 1f9d n ASN 376 N 1.61 3.05 -3.63 8.08 5.15 -0.48 -2.22 115.26 126.82 1f9d n ASN 376 Ca -0.23 -1.99 -0.28 0.00 -0.60 0.00 0.00 54.58 51.48 1f9d n ASN 376 Cb 0.55 -0.04 -0.11 0.00 -0.53 0.00 0.00 39.78 39.65 1f9d n ASN 376 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1f9d s SER 377 N -1.92 3.08 0.06 1.20 0.15 -1.26 -4.69 113.70 110.31 1f9d s SER 377 Ca 0.30 -3.16 -0.34 0.00 0.70 0.00 0.00 55.95 53.44 1f9d s SER 377 Cb 0.20 -0.95 -0.13 0.00 -1.71 0.00 0.00 66.02 63.43 1f9d s SER 377 CO 0.30 -0.17 1.66 1.87 1.20 0.00 0.00 173.24 178.10 1f9d n TRP 378 N 2.80 2.22 -1.26 3.44 -0.00 -1.26 0.31 117.44 123.68 1f9d n TRP 378 Ca 0.21 0.22 -0.09 0.00 -0.00 0.00 0.00 57.50 57.84 1f9d n TRP 378 Cb 0.40 -2.56 -0.04 0.00 -0.00 0.00 0.00 31.31 29.11 1f9d n TRP 378 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1f9d n ASN 379 N 4.44 -5.57 -0.48 5.87 3.02 -1.26 -2.30 115.26 118.98 1f9d n ASN 379 Ca 0.19 0.22 -0.06 0.00 -0.03 0.00 0.00 54.58 54.90 1f9d n ASN 379 Cb 0.27 -3.87 -0.03 0.00 -0.61 0.00 0.00 39.78 35.55 1f9d n ASN 379 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1f9d n GLY 380 N 0.09 0.80 0.77 7.41 0.00 0.15 -4.62 105.19 109.79 1f9d n GLY 380 Ca -0.09 -0.29 0.03 0.00 0.00 0.00 0.00 46.02 45.67 1f9d n GLY 380 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f9d n ARG 381 N -1.90 0.36 -4.02 1.61 1.74 -0.97 -2.52 116.66 110.96 1f9d n ARG 381 Ca -0.06 -1.81 -0.32 0.00 -0.77 0.00 0.00 57.85 54.89 1f9d n ARG 381 Cb 0.32 -0.61 0.01 0.00 -1.02 0.00 0.00 32.46 31.16 1f9d n ARG 381 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1f9d n TYR 382 N -0.18 -2.06 -1.76 -1.55 4.01 -1.19 -4.93 117.16 109.50 1f9d n TYR 382 Ca 0.06 0.86 -0.29 0.00 -0.16 0.00 0.00 57.90 58.37 1f9d n TYR 382 Cb 0.83 -3.62 0.13 0.00 -0.31 0.00 0.00 39.34 36.37 1f9d n TYR 382 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1f9d s GLU 383 N -6.70 1.29 0.22 -0.72 2.02 -1.00 -4.80 118.70 109.01 1f9d s GLU 383 Ca 0.63 0.04 -0.30 0.00 0.02 0.00 0.00 54.97 55.36 1f9d s GLU 383 Cb -0.33 -1.88 -0.09 0.00 0.10 0.00 0.00 34.13 31.93 1f9d s GLU 383 CO 0.87 -2.05 1.30 0.00 0.02 0.00 0.00 175.26 175.41 1f9d s ALA 384 N -3.53 3.52 -0.08 5.21 0.00 -1.26 -4.32 121.76 121.30 1f9d s ALA 384 Ca 0.66 1.13 -0.30 0.00 0.00 0.00 0.00 51.96 53.45 1f9d s ALA 384 Cb -0.10 -3.48 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 1f9d s ALA 384 CO 0.51 -0.54 1.24 0.08 0.00 0.00 0.00 175.76 177.06 1f9d s VAL 385 N -0.11 4.19 0.41 0.00 1.01 -1.26 -4.96 120.40 119.67 1f9d s VAL 385 Ca 0.55 1.50 -0.23 0.00 0.00 0.00 0.00 61.98 63.81 1f9d s VAL 385 Cb -0.37 -3.97 -0.13 0.00 0.00 0.00 0.00 36.38 31.92 1f9d s VAL 385 CO 0.40 -0.03 0.58 -2.65 0.00 0.00 0.00 175.10 173.39 1f9d n PRO 386 N 5.58 0.61 -2.24 2.72 -0.02 -1.26 -4.87 135.00 135.51 1f9d n PRO 386 Ca 0.12 0.22 -0.40 0.00 -2.02 0.00 0.00 63.50 61.42 1f9d n PRO 386 Cb 0.46 -1.52 -0.02 0.00 -0.02 0.00 0.00 33.50 32.39 1f9d n PRO 386 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1f9d s SER 387 N -0.93 6.80 0.00 2.55 0.15 -1.26 -2.62 113.70 118.39 1f9d s SER 387 Ca 0.63 2.50 0.00 0.00 0.70 0.00 0.00 55.95 59.78 1f9d s SER 387 Cb -0.62 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.06 1f9d s SER 387 CO 0.58 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 175.14 1f9d n GLY 388 N 0.85 0.88 3.71 9.45 0.00 -1.26 -5.04 105.19 113.77 1f9d n GLY 388 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1f9d n GLY 388 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f9d s THR 389 N -2.32 4.89 0.58 2.61 2.01 -1.08 -5.03 115.64 117.31 1f9d s THR 389 Ca 0.00 1.91 -0.18 0.00 0.31 0.00 0.00 61.69 63.72 1f9d s THR 389 Cb 0.00 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 1f9d s THR 389 CO 0.00 0.14 1.16 -0.44 -0.69 0.00 0.00 174.62 174.79 1f9d s SER 390 N 0.99 5.39 0.13 3.53 0.01 -1.26 -4.86 113.70 117.63 1f9d s SER 390 Ca 0.48 2.23 0.04 0.00 1.31 0.00 0.00 55.95 60.01 1f9d s SER 390 Cb -0.20 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.41 1f9d s SER 390 CO 0.23 -1.45 -0.10 0.42 0.41 0.00 0.00 173.24 172.75 1f9d s THR 391 N -1.80 1.12 -0.28 1.44 -4.23 -1.26 -1.03 115.64 109.60 1f9d s THR 391 Ca 0.74 -1.93 -0.01 0.00 -1.18 0.00 0.00 61.69 59.31 1f9d s THR 391 Cb -0.26 -1.70 0.09 0.00 1.34 0.00 0.00 72.50 71.97 1f9d s THR 391 CO 0.32 -0.68 0.07 0.12 -0.54 0.00 0.00 174.62 173.91 1f9d s PHE 392 N -3.02 1.73 -1.39 3.99 5.36 0.74 -1.79 117.98 123.59 1f9d s PHE 392 Ca 0.13 -1.63 -0.09 0.00 -0.96 0.00 0.00 56.93 54.38 1f9d s PHE 392 Cb 0.01 -1.62 0.03 0.00 -0.34 0.00 0.00 43.02 41.09 1f9d s PHE 392 CO 0.00 -0.82 1.10 0.66 -1.46 0.00 0.00 175.22 174.71 1f9d n TYR 393 N 4.84 -2.65 -0.22 10.12 4.02 -1.26 -1.67 117.16 130.34 1f9d n TYR 393 Ca -0.04 0.98 0.00 0.00 -0.01 0.00 0.00 57.90 58.83 1f9d n TYR 393 Cb 0.43 -4.75 0.00 0.00 -0.02 0.00 0.00 39.34 35.00 1f9d n TYR 393 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1f9d n GLY 394 N -1.85 1.94 3.79 2.72 0.00 -1.26 -3.98 105.19 106.56 1f9d n GLY 394 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 1f9d n GLY 394 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1f9d s MET 395 N -0.21 4.06 0.23 1.61 -1.94 -0.67 -4.34 119.30 118.03 1f9d s MET 395 Ca 0.00 0.36 -0.30 0.00 -1.71 0.00 0.00 55.69 54.04 1f9d s MET 395 Cb 0.00 -3.30 -0.09 0.00 2.01 0.00 0.00 34.83 33.45 1f9d s MET 395 CO 0.00 0.50 0.95 0.20 -0.01 0.00 0.00 175.02 176.65 1f9d s GLY 396 N -0.43 3.11 0.20 -0.03 0.00 -0.94 -0.18 107.32 109.04 1f9d s GLY 396 Ca 0.23 0.62 -0.31 0.00 0.00 0.00 0.00 44.72 45.26 1f9d s GLY 396 CO 0.11 1.22 1.50 -0.47 0.00 0.00 0.00 173.10 175.46 1f9d s TYR 397 N -1.07 3.05 -0.09 1.90 5.04 -0.19 -1.60 117.35 124.38 1f9d s TYR 397 Ca 0.42 0.83 0.01 0.00 -2.44 0.00 0.00 57.07 55.89 1f9d s TYR 397 Cb -0.26 -3.87 0.02 0.00 0.35 0.00 0.00 41.96 38.20 1f9d s TYR 397 CO 0.32 -3.01 -0.12 0.14 -1.34 0.00 0.00 175.55 171.54 1f9d s VAL 398 N 0.59 1.22 0.21 3.14 -7.23 -0.63 -4.90 120.40 112.79 1f9d s VAL 398 Ca 0.65 -0.48 -0.08 0.00 -1.81 0.00 0.00 61.98 60.26 1f9d s VAL 398 Cb -0.43 -1.14 0.14 0.00 0.56 0.00 0.00 36.38 35.52 1f9d s VAL 398 CO 0.37 0.38 1.76 -0.08 -0.31 0.00 0.00 175.10 177.23 1f9d h GLU 399 N 7.44 1.17 -2.73 4.82 4.81 -1.95 -2.40 114.58 125.74 1f9d h GLU 399 Ca -0.31 -0.23 -0.60 0.00 -0.13 0.00 0.00 59.36 58.09 1f9d h GLU 399 Cb 1.17 -0.18 -0.40 0.00 0.63 0.00 0.00 28.75 29.97 1f9d h GLU 399 CO 0.46 0.97 -0.80 -0.80 -0.73 0.00 0.00 179.01 178.11 1f9d s ASN 400 N -6.36 3.01 0.28 1.04 0.01 -1.26 -3.81 114.94 107.85 1f9d s ASN 400 Ca -0.12 -3.17 -0.29 0.00 -0.71 0.00 0.00 52.86 48.57 1f9d s ASN 400 Cb 0.15 -0.92 -0.13 0.00 0.41 0.00 0.00 41.25 40.75 1f9d s ASN 400 CO 0.84 -0.17 1.21 -2.65 -1.51 0.00 0.00 177.10 174.81 1f9d n PRO 401 N 2.79 1.74 0.00 -0.60 -0.02 -1.26 -3.96 135.00 133.70 1f9d n PRO 401 Ca 0.21 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1f9d n PRO 401 Cb 0.41 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 1f9d n PRO 401 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1f9d n VAL 402 N 0.77 0.00 -4.89 -1.45 0.31 -1.26 -4.54 118.33 107.27 1f9d n VAL 402 Ca 0.09 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.14 1f9d n VAL 402 Cb 0.32 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.11 1f9d n VAL 402 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 1f9d s TYR 403 N 0.00 1.98 -0.04 3.52 2.02 -1.25 -3.61 117.35 119.97 1f9d s TYR 403 Ca 0.00 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.32 1f9d s TYR 403 Cb 0.00 -1.22 -0.00 0.00 -0.40 0.00 0.00 41.96 40.34 1f9d s TYR 403 CO 0.00 0.04 0.19 0.00 -1.57 0.00 0.00 175.55 174.21 1f9d n ALA 404 N 2.14 2.21 -3.74 3.71 0.00 -0.28 -2.19 120.51 122.35 1f9d n ALA 404 Ca -0.16 -0.18 -0.28 0.00 0.00 0.00 0.00 53.44 52.82 1f9d n ALA 404 Cb 0.53 -0.02 -0.11 0.00 0.00 0.00 0.00 19.45 19.84 1f9d n ALA 404 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1f9d s ASP 405 N -0.71 3.76 0.74 0.00 2.15 -1.22 -2.92 116.67 118.48 1f9d s ASP 405 Ca 0.00 -3.58 -0.05 0.00 0.43 0.00 0.00 52.55 49.35 1f9d s ASP 405 Cb 0.00 -1.26 0.11 0.00 -0.30 0.00 0.00 42.92 41.48 1f9d s ASP 405 CO 0.01 -0.12 1.04 -2.16 -0.17 0.00 0.00 175.17 173.78 1f9d s PRO 406 N -0.95 1.72 0.13 4.34 0.04 -1.26 -4.35 135.00 134.67 1f9d s PRO 406 Ca 0.27 -0.70 -0.32 0.00 0.04 0.00 0.00 61.00 60.30 1f9d s PRO 406 Cb -0.03 -2.21 -0.11 0.00 0.04 0.00 0.00 34.50 32.19 1f9d s PRO 406 CO -0.17 -1.49 1.80 0.41 0.04 0.00 0.00 177.00 177.59 1f9d n GLY 407 N -2.98 1.60 0.32 0.56 0.00 -1.15 -4.83 105.19 98.71 1f9d n GLY 407 Ca 0.12 0.71 0.17 0.00 0.00 0.00 0.00 46.02 47.02 1f9d n GLY 407 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1f9d h SER 408 N 8.12 0.00 -0.35 1.61 4.64 -1.68 -1.87 113.55 124.02 1f9d h SER 408 Ca -0.46 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.62 1f9d h SER 408 Cb 1.22 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.13 1f9d h SER 408 CO 0.94 0.00 -0.53 -3.20 -0.87 0.00 0.00 176.83 173.17 1f9d n ASN 409 N -2.87 3.16 -0.08 4.97 5.15 -1.26 -4.51 115.26 119.81 1f9d n ASN 409 Ca -0.02 -3.83 0.08 0.00 -0.60 0.00 0.00 54.58 50.20 1f9d n ASN 409 Cb 0.27 -0.48 -0.07 0.00 -0.53 0.00 0.00 39.78 38.96 1f9d n ASN 409 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1f9d n THR 410 N -0.96 0.00 -3.45 -0.44 -2.24 -0.70 -4.83 114.28 101.65 1f9d n THR 410 Ca 0.31 -0.17 -0.38 0.00 -2.27 0.00 0.00 64.05 61.55 1f9d n THR 410 Cb 0.83 1.04 -0.08 0.00 -2.10 0.00 0.00 70.33 70.03 1f9d n THR 410 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1f9d s TRP 411 N -2.38 3.37 0.54 4.78 -0.00 -1.26 -0.29 118.94 123.70 1f9d s TRP 411 Ca 0.08 0.54 0.21 0.00 -0.00 0.00 0.00 56.10 56.93 1f9d s TRP 411 Cb 0.12 -2.46 1.40 0.00 -0.00 0.00 0.00 33.47 32.53 1f9d s TRP 411 CO 0.60 0.03 2.13 0.35 -0.00 0.00 0.00 176.95 180.06 1f9d h PHE 412 N 7.32 0.00 -0.97 5.86 3.57 -1.60 -3.12 116.94 128.00 1f9d h PHE 412 Ca -0.37 0.00 0.26 0.00 3.53 0.00 0.00 57.97 61.39 1f9d h PHE 412 Cb 1.16 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 39.77 1f9d h PHE 412 CO 0.67 0.00 0.52 0.78 -2.23 0.00 0.00 178.31 178.05 1f9d h GLY 413 N 0.00 1.84 1.08 2.40 0.00 -1.90 -0.16 103.07 106.34 1f9d h GLY 413 Ca 0.06 -0.24 0.06 0.00 0.00 0.00 0.00 47.33 47.21 1f9d h GLY 413 CO -0.00 -0.34 0.48 -0.33 0.00 0.00 0.00 176.54 176.35 1f9d h MET 414 N 0.44 0.76 0.03 4.80 2.86 -1.91 -2.25 114.93 119.66 1f9d h MET 414 Ca 0.65 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 58.27 1f9d h MET 414 Cb 1.32 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 32.78 1f9d h MET 414 CO -0.54 0.51 -0.19 1.96 1.06 0.00 0.00 176.91 179.70 1f9d h GLN 415 N 0.79 -0.32 0.00 1.72 1.08 -1.24 -2.35 115.11 114.79 1f9d h GLN 415 Ca 0.31 0.02 -0.23 0.00 -1.45 0.00 0.00 58.65 57.30 1f9d h GLN 415 Cb 0.20 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 1f9d h GLN 415 CO -0.10 -0.21 -0.96 -0.39 -0.95 0.00 0.00 178.83 176.22 1f9d h VAL 416 N -0.33 1.39 -0.36 -0.54 -1.51 -1.59 -1.52 116.25 111.79 1f9d h VAL 416 Ca 0.05 -2.44 0.01 0.00 -1.23 0.00 0.00 66.70 63.09 1f9d h VAL 416 Cb 0.39 2.43 -0.02 0.00 -2.13 0.00 0.00 31.29 31.95 1f9d h VAL 416 CO -0.16 0.73 0.22 -0.50 -1.23 0.00 0.00 177.57 176.63 1f9d h TRP 417 N 0.24 0.42 -0.01 5.19 6.55 -1.40 -1.45 115.95 125.48 1f9d h TRP 417 Ca -0.08 0.01 -0.09 0.00 0.95 0.00 0.00 58.89 59.68 1f9d h TRP 417 Cb 1.60 -0.14 0.01 0.00 -0.86 0.00 0.00 29.16 29.77 1f9d h TRP 417 CO 0.06 0.25 -0.35 1.03 -1.05 0.00 0.00 178.44 178.38 1f9d h SER 418 N 0.45 0.33 0.59 -3.49 0.87 -1.48 -3.29 113.55 107.53 1f9d h SER 418 Ca 0.14 -0.74 -0.02 0.00 -1.23 0.00 0.00 61.79 59.94 1f9d h SER 418 Cb -0.01 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 61.84 1f9d h SER 418 CO -0.06 1.03 -0.08 0.24 -0.53 0.00 0.00 176.83 177.44 1f9d h MET 419 N -0.33 0.00 -0.55 2.24 2.86 -1.28 -2.39 114.93 115.48 1f9d h MET 419 Ca -0.04 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 1f9d h MET 419 Cb 1.07 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.71 1f9d h MET 419 CO 0.07 0.08 0.20 0.37 1.06 0.00 0.00 176.91 178.69 1f9d h GLN 420 N 0.00 0.80 -0.18 1.72 -0.00 -1.33 -0.33 115.11 115.80 1f9d h GLN 420 Ca -0.00 -0.13 -0.14 0.00 -0.00 0.00 0.00 58.65 58.38 1f9d h GLN 420 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.72 1f9d h GLN 420 CO 0.01 0.67 -0.48 0.00 0.00 0.00 0.00 178.83 179.04 1f9d h ARG 421 N 0.79 0.47 -0.47 1.69 3.08 -1.55 -1.72 114.38 116.68 1f9d h ARG 421 Ca 0.19 -0.27 -0.10 0.00 0.07 0.00 0.00 59.98 59.87 1f9d h ARG 421 Cb 0.19 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1f9d h ARG 421 CO -0.01 0.85 -0.11 0.28 -1.07 0.00 0.00 179.97 179.91 1f9d h VAL 422 N 0.38 1.26 -0.63 2.04 2.07 -1.34 -2.35 116.25 117.68 1f9d h VAL 422 Ca 0.02 -1.20 -0.06 0.00 0.82 0.00 0.00 66.70 66.28 1f9d h VAL 422 Cb 0.98 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 1f9d h VAL 422 CO 0.09 0.42 0.15 0.00 0.02 0.00 0.00 177.57 178.24 1f9d h ALA 423 N 1.10 0.83 -0.52 1.67 0.00 -0.69 -0.84 119.26 120.81 1f9d h ALA 423 Ca 0.13 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1f9d h ALA 423 Cb 0.62 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1f9d h ALA 423 CO 0.04 0.54 0.23 0.93 0.00 0.00 0.00 179.25 181.00 1f9d h GLU 424 N 0.93 0.76 -0.43 0.00 5.08 -1.15 -0.06 114.58 119.71 1f9d h GLU 424 Ca 0.20 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1f9d h GLU 424 Cb 0.36 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1f9d h GLU 424 CO 0.00 0.65 0.27 1.25 -1.00 0.00 0.00 179.01 180.18 1f9d h LEU 425 N 0.69 0.51 -0.75 1.33 5.85 -1.18 -1.06 115.31 120.70 1f9d h LEU 425 Ca 0.18 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1f9d h LEU 425 Cb 0.15 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1f9d h LEU 425 CO -0.02 0.40 0.39 0.22 -0.34 0.00 0.00 178.44 179.08 1f9d h TYR 426 N 0.57 1.06 -0.55 1.25 3.20 -0.94 -0.02 116.97 121.55 1f9d h TYR 426 Ca 0.15 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 1f9d h TYR 426 Cb -0.03 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 37.88 1f9d h TYR 426 CO -0.04 0.76 0.27 -0.92 -1.64 0.00 0.00 178.16 176.60 1f9d h TYR 427 N 1.05 0.78 0.07 -3.82 3.20 -0.58 0.17 116.97 117.83 1f9d h TYR 427 Ca 0.26 -0.03 -0.25 0.00 3.14 0.00 0.00 58.73 61.85 1f9d h TYR 427 Cb 0.08 -0.24 0.01 0.00 1.54 0.00 0.00 36.73 38.11 1f9d h TYR 427 CO 0.00 0.60 -1.10 0.87 -1.64 0.00 0.00 178.16 176.90 1f9d h LYS 428 N 0.74 0.36 0.00 1.82 1.79 -0.90 -3.39 116.57 116.99 1f9d h LYS 428 Ca 0.19 -0.48 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 1f9d h LYS 428 Cb 0.10 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1f9d h LYS 428 CO -0.03 1.17 -0.84 0.25 -1.08 0.00 0.00 179.45 178.93 1f9d n THR 429 N -3.66 0.00 -1.15 -0.16 -2.24 -0.05 -4.99 114.28 102.03 1f9d n THR 429 Ca -0.08 -0.23 -0.05 0.00 -2.27 0.00 0.00 64.05 61.42 1f9d n THR 429 Cb 0.93 0.63 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 1f9d n THR 429 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f9d n GLY 430 N 1.76 0.70 3.63 3.38 0.00 0.58 -4.91 105.19 110.34 1f9d n GLY 430 Ca -0.00 -0.25 -0.56 0.00 0.00 0.00 0.00 46.02 45.21 1f9d n GLY 430 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1f9d n ASP 431 N -0.16 1.62 -0.17 1.61 -0.08 -1.26 -4.85 116.55 113.26 1f9d n ASP 431 Ca -0.05 1.12 -0.01 0.00 -1.51 0.00 0.00 54.79 54.34 1f9d n ASP 431 Cb 0.31 -1.11 0.24 0.00 2.34 0.00 0.00 41.12 42.89 1f9d n ASP 431 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1f9d h ALA 432 N 5.26 1.38 -0.46 -1.67 0.00 -1.98 -1.54 119.26 120.25 1f9d h ALA 432 Ca -0.47 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.29 1f9d h ALA 432 Cb 1.35 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1f9d h ALA 432 CO 0.84 0.50 0.15 0.00 0.00 0.00 0.00 179.25 180.74 1f9d h ARG 433 N 0.91 0.71 -0.64 0.00 3.08 -2.00 -1.77 114.38 114.67 1f9d h ARG 433 Ca 0.23 -0.15 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 1f9d h ARG 433 Cb 0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1f9d h ARG 433 CO -0.04 0.67 0.06 0.00 -1.07 0.00 0.00 179.97 179.60 1f9d h ALA 434 N 1.00 0.90 -0.10 0.04 0.00 -1.85 -2.56 119.26 116.69 1f9d h ALA 434 Ca 0.15 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1f9d h ALA 434 Cb 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1f9d h ALA 434 CO -0.01 0.67 0.06 -0.22 0.00 0.00 0.00 179.25 179.75 1f9d h LYS 435 N 1.00 0.14 -0.77 0.00 3.64 -1.09 -1.66 116.57 117.83 1f9d h LYS 435 Ca 0.19 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.65 1f9d h LYS 435 Cb 0.49 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.21 1f9d h LYS 435 CO 0.02 0.16 0.42 -0.22 -2.27 0.00 0.00 179.45 177.56 1f9d h LYS 436 N 0.08 0.69 -0.33 1.90 3.64 -1.19 0.49 116.57 121.85 1f9d h LYS 436 Ca 0.04 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 1f9d h LYS 436 Cb 0.06 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1f9d h LYS 436 CO -0.01 0.46 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.56 1f9d h LEU 437 N 0.71 0.58 -0.38 5.20 3.38 -1.23 -3.23 115.31 120.34 1f9d h LEU 437 Ca 0.37 -0.31 -0.17 0.00 0.09 0.00 0.00 57.88 57.86 1f9d h LEU 437 Cb 0.35 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1f9d h LEU 437 CO -0.25 0.75 -0.42 -0.07 0.09 0.00 0.00 178.44 178.54 1f9d h LEU 438 N 0.39 1.00 -0.67 1.67 3.38 -0.79 -1.47 115.31 118.82 1f9d h LEU 438 Ca 0.09 -0.47 0.09 0.00 0.09 0.00 0.00 57.88 57.68 1f9d h LEU 438 Cb 0.45 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 1f9d h LEU 438 CO 0.02 1.28 0.32 0.44 0.09 0.00 0.00 178.44 180.58 1f9d h ASP 439 N 0.75 0.40 0.03 -0.43 3.32 -0.97 0.32 116.42 119.84 1f9d h ASP 439 Ca 0.05 0.06 -0.27 0.00 0.02 0.00 0.00 57.03 56.89 1f9d h ASP 439 Cb 1.02 -0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.59 1f9d h ASP 439 CO 0.10 0.24 -1.06 0.50 -1.72 0.00 0.00 179.24 177.29 1f9d h LYS 440 N 0.55 0.67 -0.29 3.56 3.64 -1.56 -2.99 116.57 120.15 1f9d h LYS 440 Ca 0.33 -0.76 -0.07 0.00 -1.27 0.00 0.00 60.65 58.87 1f9d h LYS 440 Cb 0.34 0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1f9d h LYS 440 CO -0.26 1.33 -0.10 2.35 -2.27 0.00 0.00 179.45 180.50 1f9d h TRP 441 N 0.34 0.66 -0.76 1.91 7.01 -0.90 -2.65 115.95 121.56 1f9d h TRP 441 Ca -0.14 -0.15 -0.02 0.00 2.11 0.00 0.00 58.89 60.69 1f9d h TRP 441 Cb 1.73 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 28.59 1f9d h TRP 441 CO 0.11 0.80 0.39 0.00 -2.79 0.00 0.00 178.44 176.94 1f9d h ALA 442 N 0.77 1.26 -0.20 2.65 0.00 -0.48 -1.44 119.26 121.82 1f9d h ALA 442 Ca 0.07 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1f9d h ALA 442 Cb 0.60 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1f9d h ALA 442 CO 0.04 0.59 -0.24 -0.22 0.00 0.00 0.00 179.25 179.41 1f9d h LYS 443 N 1.06 0.36 0.38 0.00 3.64 -1.46 -0.62 116.57 119.94 1f9d h LYS 443 Ca 0.26 -0.13 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1f9d h LYS 443 Cb 0.07 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1f9d h LYS 443 CO -0.04 0.59 -0.18 2.35 -2.27 0.00 0.00 179.45 179.90 1f9d h TRP 444 N 0.33 -0.48 -0.13 1.91 7.01 -1.00 -3.19 115.95 120.40 1f9d h TRP 444 Ca 0.05 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 60.97 1f9d h TRP 444 Cb 0.61 0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.82 1f9d h TRP 444 CO 0.02 -0.15 -0.23 0.97 -2.79 0.00 0.00 178.44 176.26 1f9d h ILE 445 N -0.87 1.23 0.00 2.65 6.09 -1.22 -2.57 117.51 122.81 1f9d h ILE 445 Ca -0.05 -1.05 -0.03 0.00 -1.37 0.00 0.00 64.86 62.36 1f9d h ILE 445 Cb 0.54 1.38 -0.00 0.00 0.47 0.00 0.00 36.82 39.21 1f9d h ILE 445 CO 0.09 0.32 -0.15 0.78 -3.07 0.00 0.00 178.15 176.12 1f9d h ASN 446 N 0.21 0.00 -0.06 2.19 2.35 -1.18 -0.93 115.58 118.16 1f9d h ASN 446 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1f9d h ASN 446 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1f9d h ASN 446 CO 0.04 0.15 0.00 0.61 -1.65 0.00 0.00 177.43 176.57 1f9d n GLY 447 N -0.72 -0.18 0.23 2.83 0.00 -0.97 -3.75 105.19 102.62 1f9d n GLY 447 Ca -0.02 -0.36 0.02 0.00 0.00 0.00 0.00 46.02 45.66 1f9d n GLY 447 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1f9d n GLU 448 N -0.07 2.56 -3.50 1.61 -0.58 -0.36 -4.97 120.64 115.32 1f9d n GLU 448 Ca 0.18 -1.59 -0.38 0.00 -0.42 0.00 0.00 57.16 54.95 1f9d n GLU 448 Cb 0.27 -1.10 -0.09 0.00 -0.57 0.00 0.00 31.44 29.96 1f9d n GLU 448 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1f9d s ILE 449 N -0.92 5.26 -0.20 -3.67 1.01 -1.17 -4.22 121.20 117.28 1f9d s ILE 449 Ca 0.08 0.44 -0.02 0.00 0.00 0.00 0.00 60.65 61.15 1f9d s ILE 449 Cb 0.04 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1f9d s ILE 449 CO 0.06 0.26 -0.12 -0.54 0.00 0.00 0.00 174.94 174.60 1f9d s LYS 450 N 1.46 3.20 -0.17 2.79 1.02 -0.18 -5.00 119.74 122.86 1f9d s LYS 450 Ca 0.13 -0.72 -0.08 0.00 0.02 0.00 0.00 55.97 55.32 1f9d s LYS 450 Cb -0.15 -2.80 -0.04 0.00 -0.52 0.00 0.00 37.83 34.32 1f9d s LYS 450 CO 0.08 -0.19 0.10 -0.06 -0.92 0.00 0.00 175.35 174.35 1f9d s PHE 451 N 1.36 3.36 0.20 3.18 0.08 -1.26 -0.50 117.98 124.40 1f9d s PHE 451 Ca 0.05 0.26 0.02 0.00 0.12 0.00 0.00 56.93 57.38 1f9d s PHE 451 Cb -0.14 -2.07 -0.03 0.00 -0.57 0.00 0.00 43.02 40.21 1f9d s PHE 451 CO -0.07 0.33 0.35 -0.80 -0.10 0.00 0.00 175.22 174.92 1f9d s ASN 452 N 0.05 6.34 0.58 1.36 0.01 0.41 -4.99 114.94 118.69 1f9d s ASN 452 Ca 0.08 0.20 0.27 0.00 -0.71 0.00 0.00 52.86 52.70 1f9d s ASN 452 Cb -0.12 -1.92 1.64 0.00 0.41 0.00 0.00 41.25 41.26 1f9d s ASN 452 CO 0.00 -0.03 2.15 0.00 -1.51 0.00 0.00 177.10 177.72 1f9d h ALA 453 N 1.73 1.79 -0.36 0.60 0.00 -1.99 -1.66 119.26 119.36 1f9d h ALA 453 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1f9d h ALA 453 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1f9d h ALA 453 CO 0.66 -0.18 0.00 -0.40 0.00 0.00 0.00 179.25 179.33 1f9d n ASP 454 N -3.97 2.02 0.00 0.00 5.75 -1.26 -4.90 116.55 114.19 1f9d n ASP 454 Ca -0.00 -2.02 0.00 0.00 -0.01 0.00 0.00 54.79 52.76 1f9d n ASP 454 Cb 0.23 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 1f9d n ASP 454 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1f9d n GLY 455 N 1.05 0.92 3.94 6.12 0.00 -0.62 -5.06 105.19 111.53 1f9d n GLY 455 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 1f9d n GLY 455 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1f9d s THR 456 N -2.30 2.22 0.24 2.61 -4.23 -1.26 -4.78 115.64 108.14 1f9d s THR 456 Ca 0.00 -0.27 -0.12 0.00 -1.18 0.00 0.00 61.69 60.12 1f9d s THR 456 Cb 0.00 -2.94 -0.01 0.00 1.34 0.00 0.00 72.50 70.89 1f9d s THR 456 CO 0.00 0.00 0.46 0.72 -0.54 0.00 0.00 174.62 175.26 1f9d s PHE 457 N -3.32 0.40 0.00 3.99 -0.71 -1.26 -0.44 117.98 116.63 1f9d s PHE 457 Ca 0.63 -0.75 -0.03 0.00 -1.04 0.00 0.00 56.93 55.73 1f9d s PHE 457 Cb -0.09 0.15 -0.01 0.00 -1.21 0.00 0.00 43.02 41.86 1f9d s PHE 457 CO 0.46 -0.97 0.06 -0.65 -1.34 0.00 0.00 175.22 172.78 1f9d s GLN 458 N -4.02 0.34 0.09 1.99 -0.21 0.34 -4.60 119.66 113.59 1f9d s GLN 458 Ca 0.23 -0.38 -0.01 0.00 0.02 0.00 0.00 55.36 55.22 1f9d s GLN 458 Cb -0.00 0.13 -0.04 0.00 1.00 0.00 0.00 33.01 34.10 1f9d s GLN 458 CO 0.09 -0.07 0.02 0.96 -2.12 0.00 0.00 175.29 174.17 1f9d s ILE 459 N -1.13 0.16 0.37 1.08 -4.36 -0.54 -1.02 121.20 115.77 1f9d s ILE 459 Ca -0.12 -1.86 -0.26 0.00 -0.26 0.00 0.00 60.65 58.15 1f9d s ILE 459 Cb -0.07 -1.81 -0.12 0.00 1.25 0.00 0.00 42.46 41.71 1f9d s ILE 459 CO 0.00 -0.71 1.02 -2.65 0.24 0.00 0.00 174.94 172.85 1f9d n PRO 460 N -0.00 1.41 0.04 0.37 -0.02 -1.26 -1.11 135.00 134.42 1f9d n PRO 460 Ca -0.09 0.50 -0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1f9d n PRO 460 Cb 0.62 -1.99 -0.00 0.00 -0.02 0.00 0.00 33.50 32.11 1f9d n PRO 460 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1f9d n SER 461 N 0.78 1.03 -4.51 2.55 2.88 -0.03 -4.64 113.62 111.68 1f9d n SER 461 Ca 0.09 0.13 -0.33 0.00 -1.33 0.00 0.00 58.87 57.43 1f9d n SER 461 Cb 0.37 -0.32 -0.12 0.00 -0.75 0.00 0.00 64.21 63.38 1f9d n SER 461 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1f9d s THR 462 N -1.93 3.53 0.19 2.46 2.01 -1.07 -1.66 115.64 119.17 1f9d s THR 462 Ca -0.01 -0.52 0.05 0.00 0.31 0.00 0.00 61.69 61.51 1f9d s THR 462 Cb 0.00 -2.46 -0.05 0.00 0.01 0.00 0.00 72.50 70.00 1f9d s THR 462 CO 0.02 0.56 -0.09 0.27 -0.69 0.00 0.00 174.62 174.70 1f9d s ILE 463 N -0.36 1.31 0.17 1.82 -4.36 0.60 -0.39 121.20 119.98 1f9d s ILE 463 Ca 0.05 -2.10 0.01 0.00 -0.26 0.00 0.00 60.65 58.36 1f9d s ILE 463 Cb -0.12 -2.05 -0.05 0.00 1.25 0.00 0.00 42.46 41.49 1f9d s ILE 463 CO 0.02 -0.59 0.01 -0.62 0.24 0.00 0.00 174.94 174.00 1f9d s ASP 464 N -3.25 1.12 0.14 4.36 2.15 0.13 -4.47 116.67 116.84 1f9d s ASP 464 Ca 0.22 -1.17 0.06 0.00 0.43 0.00 0.00 52.55 52.08 1f9d s ASP 464 Cb 0.03 0.14 -0.04 0.00 -0.30 0.00 0.00 42.92 42.74 1f9d s ASP 464 CO 0.05 -0.58 -0.13 0.26 -0.17 0.00 0.00 175.17 174.59 1f9d s TRP 465 N -3.70 1.40 -0.02 -5.34 0.52 -1.26 -0.37 118.94 110.16 1f9d s TRP 465 Ca 0.24 -0.60 -0.02 0.00 0.02 0.00 0.00 56.10 55.74 1f9d s TRP 465 Cb 0.06 -0.72 0.01 0.00 -1.15 0.00 0.00 33.47 31.68 1f9d s TRP 465 CO 0.03 0.15 0.06 -1.21 0.02 0.00 0.00 176.95 176.01 1f9d s GLU 466 N -2.99 0.06 2.09 4.98 2.02 -0.64 -5.00 118.70 119.21 1f9d s GLU 466 Ca 0.12 0.11 0.00 0.00 0.02 0.00 0.00 54.97 55.22 1f9d s GLU 466 Cb -0.03 0.00 0.00 0.00 0.10 0.00 0.00 34.13 34.20 1f9d s GLU 466 CO 0.03 -0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.69 1f9d n GLY 467 N 3.19 -1.30 3.40 -1.39 0.00 -1.26 -1.34 105.19 106.50 1f9d n GLY 467 Ca -0.14 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.45 1f9d n GLY 467 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1f9d s GLN 468 N 0.00 1.20 0.82 1.61 -2.07 -1.21 -4.91 119.66 115.10 1f9d s GLN 468 Ca 0.00 -0.46 -0.11 0.00 -1.82 0.00 0.00 55.36 52.97 1f9d s GLN 468 Cb 0.00 0.55 0.08 0.00 -1.09 0.00 0.00 33.01 32.55 1f9d s GLN 468 CO 0.00 -0.50 1.09 -1.25 -1.32 0.00 0.00 175.29 173.31 1f9d s PRO 469 N -3.50 1.88 0.48 9.60 0.04 -1.26 -4.02 135.00 138.22 1f9d s PRO 469 Ca 0.00 0.84 -0.20 0.00 0.04 0.00 0.00 61.00 61.68 1f9d s PRO 469 Cb -0.00 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 1f9d s PRO 469 CO -0.10 -1.81 1.01 -0.51 0.04 0.00 0.00 177.00 175.62 1f9d s ASP 470 N -3.61 6.52 0.29 6.66 1.01 -1.26 -4.69 116.67 121.58 1f9d s ASP 470 Ca 0.62 1.81 -0.30 0.00 0.71 0.00 0.00 52.55 55.39 1f9d s ASP 470 Cb -0.16 -2.55 -0.13 0.00 1.01 0.00 0.00 42.92 41.09 1f9d s ASP 470 CO 0.56 -0.65 1.38 0.41 0.21 0.00 0.00 175.17 177.08 1f9d n THR 471 N -0.98 1.38 -2.53 -1.27 -1.04 -1.26 -4.83 114.28 103.75 1f9d n THR 471 Ca 0.08 -0.35 -0.43 0.00 -2.04 0.00 0.00 64.05 61.32 1f9d n THR 471 Cb 0.53 -1.57 -0.02 0.00 -1.82 0.00 0.00 70.33 67.45 1f9d n THR 471 CO 0.00 0.00 0.00 0.86 -0.64 0.00 0.00 175.07 175.29 1f9d s TRP 472 N -0.47 3.20 -0.31 -1.42 -0.11 -0.74 -4.96 118.94 114.12 1f9d s TRP 472 Ca 0.62 1.28 0.03 0.00 1.22 0.00 0.00 56.10 59.26 1f9d s TRP 472 Cb -0.60 -3.37 0.09 0.00 -1.50 0.00 0.00 33.47 28.09 1f9d s TRP 472 CO 0.55 -1.06 -0.00 1.21 -4.62 0.00 0.00 176.95 173.02 1f9d s ASN 473 N 1.48 4.63 0.54 5.86 3.84 -1.26 -4.70 114.94 125.33 1f9d s ASN 473 Ca 0.52 -1.89 0.35 0.00 0.21 0.00 0.00 52.86 52.06 1f9d s ASN 473 Cb -0.21 -1.58 1.53 0.00 -0.55 0.00 0.00 41.25 40.44 1f9d s ASN 473 CO 0.17 -0.32 1.82 -0.65 -2.79 0.00 0.00 177.10 175.33 1f9d h PRO 474 N 7.68 0.00 0.00 0.43 0.11 -1.94 0.15 132.00 138.42 1f9d h PRO 474 Ca -0.09 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.97 1f9d h PRO 474 Cb 1.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1f9d h PRO 474 CO 0.50 0.00 -0.82 0.00 -0.21 0.00 0.00 178.00 177.47 1f9d h THR 475 N 0.00 0.19 0.12 -1.15 1.03 -2.03 -3.34 112.91 107.73 1f9d h THR 475 Ca 0.52 -1.32 -0.32 0.00 -0.01 0.00 0.00 66.41 65.28 1f9d h THR 475 Cb 2.13 1.81 -0.01 0.00 -1.07 0.00 0.00 68.15 71.01 1f9d h THR 475 CO -0.01 0.11 -1.67 -0.61 -0.01 0.00 0.00 175.52 173.33 1f9d h GLN 476 N 0.00 0.26 0.00 0.00 4.15 -1.29 -3.50 115.11 114.73 1f9d h GLN 476 Ca -0.03 -0.45 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1f9d h GLN 476 Cb 1.16 0.17 0.00 0.00 0.21 0.00 0.00 27.48 29.01 1f9d h GLN 476 CO 0.02 1.21 0.00 0.41 -1.93 0.00 0.00 178.83 178.54 1f9d n GLY 477 N 1.82 -1.65 3.70 2.39 0.00 0.26 -4.86 105.19 106.85 1f9d n GLY 477 Ca -0.28 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 1f9d n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1f9d s TYR 478 N 0.00 2.39 -0.79 1.61 5.04 -1.26 -4.71 117.35 119.63 1f9d s TYR 478 Ca 0.00 0.09 0.22 0.00 -2.44 0.00 0.00 57.07 54.94 1f9d s TYR 478 Cb 0.00 -4.17 -0.05 0.00 0.35 0.00 0.00 41.96 38.09 1f9d s TYR 478 CO 0.00 -4.71 0.97 0.25 -1.34 0.00 0.00 175.55 170.72 1f9d n THR 479 N 4.49 0.05 0.00 4.34 -2.24 -1.26 -4.96 114.28 114.70 1f9d n THR 479 Ca 0.17 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1f9d n THR 479 Cb 0.37 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 1f9d n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f9d n GLY 480 N 1.44 1.07 4.06 3.38 0.00 -1.26 -4.69 105.19 109.18 1f9d n GLY 480 Ca 0.03 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.58 1f9d n GLY 480 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1f9d n ASN 481 N 0.00 -4.21 0.34 1.61 3.02 -1.26 -3.99 115.26 110.77 1f9d n ASN 481 Ca 0.00 -1.29 0.23 0.00 -0.03 0.00 0.00 54.58 53.49 1f9d n ASN 481 Cb 0.00 -1.75 1.21 0.00 -0.61 0.00 0.00 39.78 38.63 1f9d n ASN 481 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1f9d h ALA 482 N 1.62 1.00 -0.62 5.41 0.00 -1.93 -2.06 119.26 122.69 1f9d h ALA 482 Ca -0.71 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1f9d h ALA 482 Cb 1.41 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1f9d h ALA 482 CO 0.52 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.86 1f9d n ASN 483 N -3.08 3.78 -4.30 0.00 3.02 -1.26 -4.86 115.26 108.55 1f9d n ASN 483 Ca -0.03 -2.06 -0.36 0.00 -0.03 0.00 0.00 54.58 52.10 1f9d n ASN 483 Cb 0.08 -0.43 -0.13 0.00 -0.61 0.00 0.00 39.78 38.68 1f9d n ASN 483 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1f9d s LEU 484 N -1.12 3.48 0.03 3.41 2.96 -0.78 -3.31 118.68 123.35 1f9d s LEU 484 Ca 0.42 -0.69 0.06 0.00 -0.22 0.00 0.00 54.13 53.71 1f9d s LEU 484 Cb 0.23 -1.79 -0.02 0.00 0.50 0.00 0.00 46.19 45.10 1f9d s LEU 484 CO 0.27 -0.14 -0.17 -1.00 -1.32 0.00 0.00 176.35 174.00 1f9d s HIS 485 N 1.45 1.49 0.04 5.38 3.76 -0.45 -0.75 115.29 126.20 1f9d s HIS 485 Ca 0.02 -0.34 0.02 0.00 -0.15 0.00 0.00 55.06 54.61 1f9d s HIS 485 Cb -0.16 -0.90 -0.04 0.00 1.11 0.00 0.00 32.58 32.59 1f9d s HIS 485 CO -0.01 0.05 0.04 0.54 -0.85 0.00 0.00 174.74 174.51 1f9d s VAL 486 N -0.73 4.36 -0.05 -0.90 0.11 -1.26 -1.62 120.40 120.30 1f9d s VAL 486 Ca 0.05 -0.67 0.02 0.00 -2.93 0.00 0.00 61.98 58.44 1f9d s VAL 486 Cb -0.08 -3.02 0.02 0.00 -1.53 0.00 0.00 36.38 31.77 1f9d s VAL 486 CO 0.01 0.26 -0.07 -0.54 -3.33 0.00 0.00 175.10 171.43 1f9d s LYS 487 N -1.96 1.05 -0.37 1.54 1.02 0.50 -4.97 119.74 116.55 1f9d s LYS 487 Ca 0.24 -0.21 -0.24 0.00 0.02 0.00 0.00 55.97 55.78 1f9d s LYS 487 Cb -0.12 -0.97 0.01 0.00 -0.52 0.00 0.00 37.83 36.24 1f9d s LYS 487 CO 0.16 -0.03 0.85 0.08 -0.92 0.00 0.00 175.35 175.49 1f9d s VAL 488 N 0.74 4.65 -0.08 3.17 1.01 -1.26 0.21 120.40 128.84 1f9d s VAL 488 Ca -0.11 0.98 -0.27 0.00 0.00 0.00 0.00 61.98 62.58 1f9d s VAL 488 Cb -0.14 -4.28 -0.23 0.00 0.00 0.00 0.00 36.38 31.73 1f9d s VAL 488 CO 0.01 -0.51 1.01 0.58 0.00 0.00 0.00 175.10 176.19 1f9d h VAL 489 N 5.81 1.60 -3.67 2.92 2.07 -1.04 -3.48 116.25 120.45 1f9d h VAL 489 Ca -0.24 -1.80 -0.07 0.00 0.82 0.00 0.00 66.70 65.40 1f9d h VAL 489 Cb 1.09 2.81 -0.12 0.00 -1.52 0.00 0.00 31.29 33.54 1f9d h VAL 489 CO 0.95 0.47 -0.23 0.54 0.02 0.00 0.00 177.57 179.32 1f9d s ASN 490 N -6.01 -0.04 0.31 0.57 2.20 -1.12 -4.99 114.94 105.85 1f9d s ASN 490 Ca -0.17 -0.65 0.08 0.00 -0.94 0.00 0.00 52.86 51.18 1f9d s ASN 490 Cb -0.01 0.44 -0.04 0.00 -2.00 0.00 0.00 41.25 39.65 1f9d s ASN 490 CO 0.69 -0.87 0.13 -0.31 -2.94 0.00 0.00 177.10 173.80 1f9d s TYR 491 N -3.90 2.78 0.00 1.54 1.51 -1.26 -0.85 117.35 117.17 1f9d s TYR 491 Ca 0.10 -0.30 0.00 0.00 -1.01 0.00 0.00 57.07 55.86 1f9d s TYR 491 Cb 0.03 -1.52 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 1f9d s TYR 491 CO -0.05 0.41 0.00 0.41 -1.11 0.00 0.00 175.55 175.21 1f9d n GLY 492 N -1.12 2.01 2.52 0.71 0.00 -0.27 -4.74 105.19 104.31 1f9d n GLY 492 Ca -0.04 -1.01 -0.21 0.00 0.00 0.00 0.00 46.02 44.76 1f9d n GLY 492 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1f9d n THR 493 N 0.00 1.26 -2.42 2.61 -1.04 -1.26 -1.46 114.28 111.97 1f9d n THR 493 Ca 0.00 -4.93 -0.43 0.00 -2.04 0.00 0.00 64.05 56.65 1f9d n THR 493 Cb 0.00 -0.70 -0.02 0.00 -1.82 0.00 0.00 70.33 67.79 1f9d n THR 493 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1f9d s ASP 494 N -2.92 6.47 0.46 8.00 -1.08 -1.26 -4.88 116.67 121.45 1f9d s ASP 494 Ca 0.43 0.84 0.20 0.00 -0.52 0.00 0.00 52.55 53.50 1f9d s ASP 494 Cb 0.33 -2.54 1.10 0.00 -1.46 0.00 0.00 42.92 40.35 1f9d s ASP 494 CO -0.10 -1.32 1.96 -0.07 0.52 0.00 0.00 175.17 176.16 1f9d h LEU 495 N 11.71 0.00 -0.05 -1.34 3.38 -1.98 -0.10 115.31 126.93 1f9d h LEU 495 Ca -0.26 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 1f9d h LEU 495 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1f9d h LEU 495 CO 1.08 0.22 -0.20 1.23 0.09 0.00 0.00 178.44 180.86 1f9d h GLY 496 N 0.97 0.24 1.03 0.83 0.00 -1.90 -2.00 103.07 102.23 1f9d h GLY 496 Ca -0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 47.33 46.96 1f9d h GLY 496 CO 0.03 0.29 0.24 0.00 0.00 0.00 0.00 176.54 177.10 1f9d h ALA 498 N 1.11 1.31 -0.13 0.00 0.00 -1.05 0.13 119.26 120.62 1f9d h ALA 498 Ca 0.22 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1f9d h ALA 498 Cb 0.26 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1f9d h ALA 498 CO -0.01 0.48 -0.11 0.77 0.00 0.00 0.00 179.25 180.39 1f9d h SER 499 N 0.67 0.32 -0.89 0.00 0.02 -0.97 -1.30 113.55 111.39 1f9d h SER 499 Ca 0.15 -0.46 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 1f9d h SER 499 Cb 0.28 -0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.69 1f9d h SER 499 CO 0.00 0.71 0.57 -1.28 -1.14 0.00 0.00 176.83 175.69 1f9d h SER 500 N -0.07 1.05 -0.56 3.07 0.87 -1.02 -1.28 113.55 115.61 1f9d h SER 500 Ca 0.02 -0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 1f9d h SER 500 Cb 0.61 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 1f9d h SER 500 CO 0.03 0.78 0.22 0.25 -0.53 0.00 0.00 176.83 177.59 1f9d h LEU 501 N 1.23 0.77 -0.69 2.23 5.85 -0.85 -1.25 115.31 122.59 1f9d h LEU 501 Ca 0.33 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.88 1f9d h LEU 501 Cb -0.10 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 1f9d h LEU 501 CO -0.07 0.73 0.45 0.00 -0.34 0.00 0.00 178.44 179.22 1f9d h ALA 502 N 1.07 0.88 0.06 1.25 0.00 -0.59 -1.33 119.26 120.60 1f9d h ALA 502 Ca 0.19 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1f9d h ALA 502 Cb 0.20 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1f9d h ALA 502 CO -0.02 0.31 -0.18 -0.97 0.00 0.00 0.00 179.25 178.40 1f9d h ASN 503 N 0.94 -0.50 -0.13 0.00 -0.73 -0.88 -0.39 115.58 113.89 1f9d h ASN 503 Ca 0.25 0.06 0.04 0.00 1.87 0.00 0.00 56.30 58.52 1f9d h ASN 503 Cb -0.10 0.20 -0.04 0.00 0.27 0.00 0.00 38.32 38.65 1f9d h ASN 503 CO -0.05 -0.25 -0.10 0.74 -0.37 0.00 0.00 177.43 177.40 1f9d h THR 504 N -0.32 0.70 -0.40 -3.57 2.02 -0.89 -2.24 112.91 108.22 1f9d h THR 504 Ca 0.04 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 1f9d h THR 504 Cb 0.36 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1f9d h THR 504 CO -0.13 0.00 0.09 -0.07 0.37 0.00 0.00 175.52 175.79 1f9d h LEU 505 N -0.11 0.54 0.07 2.58 3.38 -1.07 -1.91 115.31 118.78 1f9d h LEU 505 Ca 0.08 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1f9d h LEU 505 Cb 0.24 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1f9d h LEU 505 CO -0.20 0.54 -0.03 0.74 0.09 0.00 0.00 178.44 179.58 1f9d h THR 506 N 0.57 1.11 -0.80 0.22 2.02 -0.64 0.17 112.91 115.55 1f9d h THR 506 Ca 0.13 -0.62 0.01 0.00 0.77 0.00 0.00 66.41 66.71 1f9d h THR 506 Cb 0.23 1.51 -0.04 0.00 -1.74 0.00 0.00 68.15 68.10 1f9d h THR 506 CO -0.00 0.15 0.53 1.88 0.37 0.00 0.00 175.52 178.45 1f9d h TYR 507 N -0.37 1.00 -0.21 3.16 0.05 -1.31 0.09 116.97 119.37 1f9d h TYR 507 Ca -0.01 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 1f9d h TYR 507 Cb 0.32 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.72 1f9d h TYR 507 CO 0.02 0.61 0.05 -0.92 -1.05 0.00 0.00 178.16 176.87 1f9d h TYR 508 N 1.07 0.36 -0.32 4.88 3.20 -1.24 -2.85 116.97 122.06 1f9d h TYR 508 Ca 0.30 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.12 1f9d h TYR 508 Cb -0.09 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.07 1f9d h TYR 508 CO -0.02 0.45 0.17 0.00 -1.64 0.00 0.00 178.16 177.13 1f9d h ALA 509 N 0.86 0.41 -0.95 1.82 0.00 -0.34 0.37 119.26 121.42 1f9d h ALA 509 Ca 0.07 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.07 1f9d h ALA 509 Cb 0.28 -0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 1f9d h ALA 509 CO 0.00 -0.06 0.60 0.00 0.00 0.00 0.00 179.25 179.80 1f9d h ALA 510 N 1.04 1.81 0.16 0.00 0.00 -0.94 0.33 119.26 121.66 1f9d h ALA 510 Ca 0.11 0.04 -0.35 0.00 0.00 0.00 0.00 54.91 54.71 1f9d h ALA 510 Cb 0.07 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1f9d h ALA 510 CO -0.02 -0.11 -1.81 -0.22 0.00 0.00 0.00 179.25 177.09 1f9d h LYS 511 N 0.70 0.33 0.00 0.00 1.63 -1.24 -3.39 116.57 114.60 1f9d h LYS 511 Ca 0.51 -0.57 -0.04 0.00 -0.85 0.00 0.00 60.65 59.70 1f9d h LYS 511 Cb 0.85 0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 1f9d h LYS 511 CO -0.27 1.27 -1.08 0.66 -3.45 0.00 0.00 179.45 176.58 1f9d h SER 512 N 0.04 0.00 0.00 4.20 4.64 -0.72 -3.48 113.55 118.23 1f9d h SER 512 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1f9d h SER 512 Cb 2.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.13 1f9d h SER 512 CO 0.13 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 176.83 1f9d n GLY 513 N 1.23 0.77 3.58 -0.77 0.00 0.12 -4.98 105.19 105.13 1f9d n GLY 513 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1f9d n GLY 513 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1f9d s ASP 514 N -2.56 5.36 0.21 1.61 2.15 -1.25 -4.86 116.67 117.34 1f9d s ASP 514 Ca 0.00 1.30 -0.07 0.00 0.43 0.00 0.00 52.55 54.20 1f9d s ASP 514 Cb 0.00 -2.52 0.16 0.00 -0.30 0.00 0.00 42.92 40.27 1f9d s ASP 514 CO 0.00 -2.13 1.76 -0.33 -0.17 0.00 0.00 175.17 174.30 1f9d h GLU 515 N 15.27 1.16 -0.69 4.34 4.39 -1.93 -2.67 114.58 134.44 1f9d h GLU 515 Ca -0.33 -0.23 0.08 0.00 0.34 0.00 0.00 59.36 59.22 1f9d h GLU 515 Cb 1.21 -0.18 -0.07 0.00 -0.10 0.00 0.00 28.75 29.62 1f9d h GLU 515 CO 1.06 0.97 0.35 1.15 -1.16 0.00 0.00 179.01 181.38 1f9d h THR 516 N 1.12 0.87 -0.45 1.13 2.02 -1.99 0.90 112.91 116.51 1f9d h THR 516 Ca 0.25 -0.21 -0.09 0.00 0.77 0.00 0.00 66.41 67.13 1f9d h THR 516 Cb 0.28 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1f9d h THR 516 CO -0.01 0.11 -0.06 0.28 0.37 0.00 0.00 175.52 176.21 1f9d h SER 517 N 0.61 0.83 -0.45 4.18 0.02 -1.87 -1.76 113.55 115.11 1f9d h SER 517 Ca 0.33 -0.34 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 1f9d h SER 517 Cb 0.32 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1f9d h SER 517 CO -0.25 0.97 0.10 -0.09 -1.14 0.00 0.00 176.83 176.43 1f9d h ARG 518 N 0.67 0.72 -0.05 3.45 2.43 -1.01 -1.28 114.38 119.32 1f9d h ARG 518 Ca 0.12 -0.18 -0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1f9d h ARG 518 Cb 0.59 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1f9d h ARG 518 CO 0.04 0.73 -0.59 -0.56 -1.51 0.00 0.00 179.97 178.08 1f9d h GLN 519 N 0.59 0.15 -0.49 0.20 3.07 -0.82 -1.93 115.11 115.88 1f9d h GLN 519 Ca 0.14 -0.10 -0.13 0.00 0.09 0.00 0.00 58.65 58.65 1f9d h GLN 519 Cb 0.33 0.01 -0.01 0.00 0.08 0.00 0.00 27.48 27.89 1f9d h GLN 519 CO 0.00 0.69 -0.20 -0.91 0.09 0.00 0.00 178.83 178.51 1f9d h ASN 520 N 0.11 1.03 -0.24 0.06 2.35 -1.19 -0.46 115.58 117.23 1f9d h ASN 520 Ca -0.00 -0.39 -0.00 0.00 -0.55 0.00 0.00 56.30 55.35 1f9d h ASN 520 Cb 1.06 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 39.14 1f9d h ASN 520 CO 0.09 1.19 0.15 0.00 -1.65 0.00 0.00 177.43 177.20 1f9d h ALA 521 N 0.87 0.31 -0.47 -0.83 0.00 -1.06 -0.72 119.26 117.36 1f9d h ALA 521 Ca 0.11 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1f9d h ALA 521 Cb 0.78 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1f9d h ALA 521 CO 0.06 -0.18 0.06 0.37 0.00 0.00 0.00 179.25 179.56 1f9d h GLN 522 N 0.31 0.78 -0.68 0.00 4.15 -1.26 -1.94 115.11 116.47 1f9d h GLN 522 Ca 0.09 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 59.28 1f9d h GLN 522 Cb 0.02 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.59 1f9d h GLN 522 CO -0.02 0.81 0.37 0.87 -1.93 0.00 0.00 178.83 178.93 1f9d h LYS 523 N 0.64 0.93 -0.08 1.69 1.57 -0.89 0.50 116.57 120.93 1f9d h LYS 523 Ca 0.14 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1f9d h LYS 523 Cb 0.41 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.53 1f9d h LYS 523 CO 0.01 0.69 0.02 -0.07 -0.57 0.00 0.00 179.45 179.53 1f9d h LEU 524 N 0.94 0.12 -0.76 2.94 3.38 -0.89 0.18 115.31 121.22 1f9d h LEU 524 Ca 0.24 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1f9d h LEU 524 Cb 0.02 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1f9d h LEU 524 CO -0.04 0.30 0.36 -0.07 0.09 0.00 0.00 178.44 179.09 1f9d h LEU 525 N -0.06 1.00 -0.16 1.67 3.38 -0.95 -1.79 115.31 118.39 1f9d h LEU 525 Ca 0.03 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1f9d h LEU 525 Cb 0.22 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1f9d h LEU 525 CO -0.00 0.85 -0.03 0.44 0.09 0.00 0.00 178.44 179.79 1f9d h ASP 526 N 1.07 0.31 -0.74 -0.43 3.32 -0.80 -1.37 116.42 117.78 1f9d h ASP 526 Ca 0.26 -0.36 0.06 0.00 0.02 0.00 0.00 57.03 57.01 1f9d h ASP 526 Cb 0.12 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.53 1f9d h ASP 526 CO -0.03 0.60 0.44 0.00 -1.72 0.00 0.00 179.24 178.52 1f9d h ALA 527 N 0.72 1.00 -0.40 3.45 0.00 -0.85 0.24 119.26 123.41 1f9d h ALA 527 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1f9d h ALA 527 Cb 0.46 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1f9d h ALA 527 CO 0.01 0.15 -0.14 0.52 0.00 0.00 0.00 179.25 179.80 1f9d h MET 528 N 0.81 0.80 -0.14 0.00 2.86 -1.25 -0.39 114.93 117.62 1f9d h MET 528 Ca 0.32 -0.33 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1f9d h MET 528 Cb 0.16 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1f9d h MET 528 CO -0.17 0.95 0.01 2.35 1.06 0.00 0.00 176.91 181.11 1f9d h TRP 529 N 0.61 0.26 -0.13 -0.22 2.91 -0.73 -1.93 115.95 116.72 1f9d h TRP 529 Ca 0.10 -0.04 -0.21 0.00 1.13 0.00 0.00 58.89 59.87 1f9d h TRP 529 Cb 0.68 -0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.26 1f9d h TRP 529 CO 0.05 0.45 -0.75 -0.91 -1.03 0.00 0.00 178.44 176.26 1f9d h ASN 530 N -0.00 0.78 -0.00 2.65 2.35 -0.55 -3.33 115.58 117.47 1f9d h ASN 530 Ca 0.04 -0.51 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1f9d h ASN 530 Cb 0.34 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1f9d h ASN 530 CO 0.01 1.28 -0.60 0.59 -1.65 0.00 0.00 177.43 177.06 1f9d n ASN 531 N -3.90 0.77 0.00 5.81 3.02 -0.16 -4.67 115.26 116.13 1f9d n ASN 531 Ca -0.06 -0.88 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 1f9d n ASN 531 Cb 0.73 0.93 0.00 0.00 -0.61 0.00 0.00 39.78 40.82 1f9d n ASN 531 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1f9d n TYR 532 N -1.16 0.00 -2.45 3.10 4.02 -0.73 -5.04 117.16 114.90 1f9d n TYR 532 Ca 0.03 -0.41 -0.36 0.00 -0.01 0.00 0.00 57.90 57.15 1f9d n TYR 532 Cb 0.23 -0.04 -0.03 0.00 -0.02 0.00 0.00 39.34 39.48 1f9d n TYR 532 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1f9d s SER 533 N -0.82 6.50 0.31 7.72 0.01 -1.23 -1.34 113.70 124.85 1f9d s SER 533 Ca 0.00 2.11 0.04 0.00 1.31 0.00 0.00 55.95 59.41 1f9d s SER 533 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.63 1f9d s SER 533 CO 0.00 -0.68 0.34 -0.90 0.41 0.00 0.00 173.24 172.41 1f9d n ASP 534 N -0.34 -0.91 0.00 2.44 5.68 -0.52 -4.87 116.55 118.04 1f9d n ASP 534 Ca 0.06 -2.92 0.06 0.00 -0.50 0.00 0.00 54.79 51.49 1f9d n ASP 534 Cb 0.49 1.88 0.26 0.00 -1.14 0.00 0.00 41.12 42.61 1f9d n ASP 534 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1f9d n SER 535 N -1.74 0.01 -0.38 -1.12 3.41 -1.26 -2.76 113.62 109.79 1f9d n SER 535 Ca 0.05 0.50 0.05 0.00 -0.26 0.00 0.00 58.87 59.21 1f9d n SER 535 Cb 0.55 -0.51 0.03 0.00 -0.26 0.00 0.00 64.21 64.03 1f9d n SER 535 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1f9d n LYS 536 N -1.51 0.86 0.00 4.33 5.02 -1.26 -4.95 118.16 120.65 1f9d n LYS 536 Ca 0.03 -1.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.32 1f9d n LYS 536 Cb 0.14 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 1f9d n LYS 536 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1f9d n GLY 537 N 0.67 0.48 3.09 0.72 0.00 -1.11 -4.62 105.19 104.41 1f9d n GLY 537 Ca 0.06 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.61 1f9d n GLY 537 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1f9d s ILE 538 N 0.00 0.37 0.04 -0.61 -4.36 -1.26 -1.44 121.20 113.94 1f9d s ILE 538 Ca 0.00 -1.61 -0.28 0.00 -0.26 0.00 0.00 60.65 58.50 1f9d s ILE 538 Cb 0.00 -1.24 0.10 0.00 1.25 0.00 0.00 42.46 42.56 1f9d s ILE 538 CO 0.00 -0.81 1.09 -0.94 0.24 0.00 0.00 174.94 174.52 1f9d s SER 539 N -2.55 -0.16 0.20 4.36 1.04 -0.45 -4.82 113.70 111.33 1f9d s SER 539 Ca 0.02 -0.21 -0.15 0.00 0.48 0.00 0.00 55.95 56.09 1f9d s SER 539 Cb 0.02 0.33 0.01 0.00 0.10 0.00 0.00 66.02 66.48 1f9d s SER 539 CO -0.06 -0.59 0.47 0.28 0.98 0.00 0.00 173.24 174.32 1f9d s THR 540 N -2.88 0.03 -0.05 2.02 -1.32 -1.26 -4.74 115.64 107.44 1f9d s THR 540 Ca 0.11 -1.04 -0.22 0.00 -1.21 0.00 0.00 61.69 59.33 1f9d s THR 540 Cb 0.01 -1.77 -0.04 0.00 -1.51 0.00 0.00 72.50 69.19 1f9d s THR 540 CO -0.02 -0.13 0.66 -0.69 -2.21 0.00 0.00 174.62 172.22 1f9d s VAL 541 N -3.92 5.01 0.07 5.08 1.01 -1.26 -4.14 120.40 122.25 1f9d s VAL 541 Ca 0.13 1.36 0.04 0.00 0.00 0.00 0.00 61.98 63.51 1f9d s VAL 541 Cb -0.00 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 1f9d s VAL 541 CO 0.00 0.30 -0.12 -1.83 0.00 0.00 0.00 175.10 173.46 1f9d s GLU 542 N 0.51 0.78 0.18 2.72 -1.05 -0.22 -4.96 118.70 116.66 1f9d s GLU 542 Ca 0.35 -0.97 -0.24 0.00 -0.15 0.00 0.00 54.97 53.96 1f9d s GLU 542 Cb -0.18 -0.67 -0.08 0.00 -0.44 0.00 0.00 34.13 32.77 1f9d s GLU 542 CO 0.17 0.14 0.77 -0.65 0.95 0.00 0.00 175.26 176.64 1f9d s GLN 543 N -1.97 4.49 -0.87 -4.83 -0.21 -1.26 -1.18 119.66 113.83 1f9d s GLN 543 Ca -0.02 1.10 0.01 0.00 0.02 0.00 0.00 55.36 56.47 1f9d s GLN 543 Cb -0.08 -3.16 0.27 0.00 1.00 0.00 0.00 33.01 31.03 1f9d s GLN 543 CO 0.01 0.53 1.04 0.54 -2.12 0.00 0.00 175.29 175.29 1f9d n ARG 544 N 1.37 3.32 0.17 2.91 5.12 0.28 -4.91 116.66 124.91 1f9d n ARG 544 Ca -0.05 -4.59 0.18 0.00 -1.93 0.00 0.00 57.85 51.46 1f9d n ARG 544 Cb 0.49 -2.39 0.80 0.00 -1.16 0.00 0.00 32.46 30.21 1f9d n ARG 544 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 1f9d h GLY 545 N 5.03 0.00 -0.20 -0.13 0.00 -1.95 -2.17 103.07 103.65 1f9d h GLY 545 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1f9d h GLY 545 CO 1.04 0.00 -0.33 1.22 0.00 0.00 0.00 176.54 178.47 1f9d n ASP 546 N -3.67 1.38 0.17 0.19 8.00 -1.26 -4.40 116.55 116.96 1f9d n ASP 546 Ca 0.04 -1.12 0.11 0.00 0.71 0.00 0.00 54.79 54.53 1f9d n ASP 546 Cb 0.45 0.25 0.59 0.00 -0.02 0.00 0.00 41.12 42.39 1f9d n ASP 546 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 1f9d h TYR 547 N 1.65 0.00 0.00 1.24 -1.99 -1.79 -0.88 116.97 115.21 1f9d h TYR 547 Ca 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1f9d h TYR 547 Cb 0.59 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.32 1f9d h TYR 547 CO 0.00 0.00 -0.07 1.12 -0.00 0.00 0.00 178.16 179.21 1f9d h HIS 548 N 0.00 0.00 0.00 4.88 2.07 -1.82 -1.69 115.15 118.60 1f9d h HIS 548 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1f9d h HIS 548 Cb 0.07 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.05 1f9d h HIS 548 CO 0.00 0.07 0.00 0.00 -3.07 0.00 0.00 177.93 174.93 1f9d h ARG 549 N 0.00 0.00 -0.91 5.12 3.08 -1.50 -1.52 114.38 118.65 1f9d h ARG 549 Ca -0.00 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.11 1f9d h ARG 549 Cb 0.28 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.27 1f9d h ARG 549 CO 0.01 0.00 0.57 0.74 -1.07 0.00 0.00 179.97 180.22 1f9d h PHE 550 N 0.00 1.06 0.00 3.04 0.04 -1.51 -2.25 116.94 117.33 1f9d h PHE 550 Ca 0.00 0.03 -0.35 0.00 2.80 0.00 0.00 57.97 60.45 1f9d h PHE 550 Cb 0.28 -0.35 -0.07 0.00 2.20 0.00 0.00 35.95 38.02 1f9d h PHE 550 CO 0.00 0.55 -2.33 1.28 -0.60 0.00 0.00 178.31 177.21 1f9d n LEU 551 N -4.57 0.69 -0.79 1.54 4.77 -0.84 -2.26 117.00 115.54 1f9d n LEU 551 Ca 0.13 -0.03 0.09 0.00 -0.03 0.00 0.00 56.01 56.17 1f9d n LEU 551 Cb 0.17 0.17 0.12 0.00 -2.33 0.00 0.00 43.42 41.55 1f9d n LEU 551 CO 0.32 0.57 0.58 -0.90 -1.33 0.00 0.00 177.39 176.63 1f9d n ASP 552 N -2.82 2.75 -4.59 -1.43 5.68 -0.63 -4.83 116.55 110.67 1f9d n ASP 552 Ca -0.34 -1.81 -0.42 0.00 -0.50 0.00 0.00 54.79 51.72 1f9d n ASP 552 Cb 1.09 -0.10 -0.05 0.00 -1.14 0.00 0.00 41.12 40.91 1f9d n ASP 552 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 1f9d s GLN 553 N -1.34 3.82 0.24 0.11 2.00 -0.85 -4.98 119.66 118.66 1f9d s GLN 553 Ca 0.25 0.38 -0.29 0.00 -2.00 0.00 0.00 55.36 53.70 1f9d s GLN 553 Cb 0.16 -3.78 -0.09 0.00 0.80 0.00 0.00 33.01 30.10 1f9d s GLN 553 CO 0.23 -0.78 0.91 -2.00 -0.50 0.00 0.00 175.29 173.15 1f9d s GLU 554 N 3.01 4.77 -0.18 1.67 2.12 -1.26 -1.23 118.70 127.60 1f9d s GLU 554 Ca 0.31 1.41 -0.06 0.00 0.36 0.00 0.00 54.97 56.99 1f9d s GLU 554 Cb -0.14 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.02 1f9d s GLU 554 CO 0.15 0.49 0.04 0.08 -0.54 0.00 0.00 175.26 175.48 1f9d s VAL 555 N -1.24 4.48 0.18 3.70 1.01 -0.08 -4.88 120.40 123.56 1f9d s VAL 555 Ca 0.42 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 1f9d s VAL 555 Cb -0.24 -3.01 -0.08 0.00 0.00 0.00 0.00 36.38 33.04 1f9d s VAL 555 CO 0.30 0.45 1.18 0.12 0.00 0.00 0.00 175.10 177.16 1f9d s PHE 556 N 0.53 3.45 -0.03 5.22 5.36 -1.26 -4.44 117.98 126.82 1f9d s PHE 556 Ca 0.01 1.44 0.00 0.00 -0.96 0.00 0.00 56.93 57.43 1f9d s PHE 556 Cb -0.13 -3.41 0.03 0.00 -0.34 0.00 0.00 43.02 39.17 1f9d s PHE 556 CO 0.01 -1.12 0.01 0.08 -1.46 0.00 0.00 175.22 172.74 1f9d s VAL 557 N -0.05 0.10 0.47 3.12 1.01 -1.26 -5.02 120.40 118.77 1f9d s VAL 557 Ca 0.52 0.15 -0.23 0.00 0.00 0.00 0.00 61.98 62.42 1f9d s VAL 557 Cb -0.32 -0.22 -0.08 0.00 0.00 0.00 0.00 36.38 35.75 1f9d s VAL 557 CO 0.36 0.14 1.13 -2.65 0.00 0.00 0.00 175.10 174.08 1f9d n PRO 558 N 4.29 1.48 -1.66 2.72 -0.02 -1.26 -4.44 135.00 136.12 1f9d n PRO 558 Ca -0.24 0.54 -0.47 0.00 -2.02 0.00 0.00 63.50 61.31 1f9d n PRO 558 Cb 0.50 -2.24 -0.04 0.00 -0.02 0.00 0.00 33.50 31.70 1f9d n PRO 558 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1f9d n ALA 559 N -0.73 1.09 -0.05 3.55 0.00 -1.26 -1.64 120.51 121.46 1f9d n ALA 559 Ca 0.09 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1f9d n ALA 559 Cb 0.42 -2.33 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1f9d n ALA 559 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f9d n GLY 560 N 3.40 2.15 3.69 0.00 0.00 -1.26 -5.02 105.19 108.16 1f9d n GLY 560 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1f9d n GLY 560 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1f9d s TRP 561 N -2.80 3.50 0.02 1.61 -0.00 -0.65 -5.05 118.94 115.55 1f9d s TRP 561 Ca 0.00 1.16 0.02 0.00 -0.00 0.00 0.00 56.10 57.28 1f9d s TRP 561 Cb 0.00 -2.83 -0.01 0.00 -0.00 0.00 0.00 33.47 30.62 1f9d s TRP 561 CO 0.00 -0.03 -0.06 0.95 -0.00 0.00 0.00 176.95 177.81 1f9d s THR 562 N 1.30 0.45 0.28 5.86 -4.23 -1.26 -4.46 115.64 113.58 1f9d s THR 562 Ca 0.35 -0.66 -0.19 0.00 -1.18 0.00 0.00 61.69 60.01 1f9d s THR 562 Cb -0.17 -0.46 0.07 0.00 1.34 0.00 0.00 72.50 73.28 1f9d s THR 562 CO 0.15 -0.16 0.91 -0.83 -0.54 0.00 0.00 174.62 174.16 1f9d s GLY 563 N -0.88 0.22 0.02 3.99 0.00 -0.60 -4.47 107.32 105.59 1f9d s GLY 563 Ca -0.05 -0.52 0.04 0.00 0.00 0.00 0.00 44.72 44.19 1f9d s GLY 563 CO 0.00 1.02 -0.11 0.54 0.00 0.00 0.00 173.10 174.55 1f9d s LYS 564 N -2.30 0.84 0.56 2.90 1.02 -0.68 0.65 119.74 122.73 1f9d s LYS 564 Ca 0.18 -0.55 -0.13 0.00 0.02 0.00 0.00 55.97 55.49 1f9d s LYS 564 Cb -0.04 -0.81 -0.06 0.00 -0.52 0.00 0.00 37.83 36.40 1f9d s LYS 564 CO 0.08 0.21 0.99 -1.64 -0.92 0.00 0.00 175.35 174.07 1f9d s MET 565 N -0.71 3.77 0.42 1.68 -1.94 0.12 -1.00 119.30 121.63 1f9d s MET 565 Ca 0.02 0.81 0.24 0.00 -1.71 0.00 0.00 55.69 55.05 1f9d s MET 565 Cb -0.06 -2.13 1.26 0.00 2.01 0.00 0.00 34.83 35.91 1f9d s MET 565 CO 0.00 -0.40 1.69 -1.35 -0.01 0.00 0.00 175.02 174.96 1f9d h PRO 566 N 0.34 0.23 -0.02 2.03 0.11 -1.90 0.26 132.00 133.04 1f9d h PRO 566 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1f9d h PRO 566 Cb 1.19 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1f9d h PRO 566 CO 0.62 0.15 0.00 0.27 -0.21 0.00 0.00 178.00 178.83 1f9d n ASN 567 N -4.68 0.25 0.00 -2.05 6.94 -1.26 -4.89 115.26 109.57 1f9d n ASN 567 Ca 0.31 -1.33 0.00 0.00 -0.02 0.00 0.00 54.58 53.54 1f9d n ASN 567 Cb 1.16 -0.01 0.00 0.00 -2.36 0.00 0.00 39.78 38.57 1f9d n ASN 567 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1f9d n GLY 568 N 0.91 0.11 3.69 4.83 0.00 0.91 -5.05 105.19 110.59 1f9d n GLY 568 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.75 1f9d n GLY 568 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f9d n ASP 569 N 0.00 3.61 -4.72 1.61 8.00 -1.25 -4.66 116.55 119.13 1f9d n ASP 569 Ca 0.00 1.04 -0.41 0.00 0.71 0.00 0.00 54.79 56.13 1f9d n ASP 569 Cb 0.00 -1.49 -0.04 0.00 -0.02 0.00 0.00 41.12 39.57 1f9d n ASP 569 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1f9d s VAL 570 N 1.82 4.46 -0.25 2.53 1.01 -1.26 -0.70 120.40 128.02 1f9d s VAL 570 Ca 0.80 1.94 -0.07 0.00 0.00 0.00 0.00 61.98 64.66 1f9d s VAL 570 Cb -0.59 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.53 1f9d s VAL 570 CO 0.38 0.25 0.05 -0.63 0.00 0.00 0.00 175.10 175.15 1f9d s ILE 571 N 0.35 4.07 0.07 2.22 1.01 0.21 -4.79 121.20 124.33 1f9d s ILE 571 Ca 0.50 -0.30 -0.27 0.00 0.00 0.00 0.00 60.65 60.58 1f9d s ILE 571 Cb -0.24 -2.92 0.08 0.00 0.01 0.00 0.00 42.46 39.39 1f9d s ILE 571 CO 0.30 0.32 0.89 -1.59 0.00 0.00 0.00 174.94 174.87 1f9d s LYS 572 N 1.57 1.01 0.22 2.79 -2.85 -1.26 -1.56 119.74 119.67 1f9d s LYS 572 Ca 0.06 -0.46 -0.31 0.00 -1.00 0.00 0.00 55.97 54.25 1f9d s LYS 572 Cb -0.15 0.41 -0.14 0.00 -2.06 0.00 0.00 37.83 35.88 1f9d s LYS 572 CO 0.02 -0.45 1.25 0.43 0.10 0.00 0.00 175.35 176.70 1f9d n SER 573 N -0.34 1.96 0.00 0.03 7.64 -1.26 -2.47 113.62 119.18 1f9d n SER 573 Ca -0.08 1.15 0.00 0.00 1.01 0.00 0.00 58.87 60.95 1f9d n SER 573 Cb 0.62 -1.32 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 1f9d n SER 573 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1f9d n GLY 574 N 1.92 2.53 3.76 0.23 0.00 -1.26 -5.05 105.19 107.32 1f9d n GLY 574 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1f9d n GLY 574 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f9d s VAL 575 N -2.57 2.84 0.40 1.61 -7.23 -1.03 -4.85 120.40 109.56 1f9d s VAL 575 Ca 0.00 0.50 0.08 0.00 -1.81 0.00 0.00 61.98 60.75 1f9d s VAL 575 Cb 0.00 -3.16 -0.01 0.00 0.56 0.00 0.00 36.38 33.76 1f9d s VAL 575 CO 0.00 -0.14 0.41 -0.54 -0.31 0.00 0.00 175.10 174.53 1f9d s LYS 576 N -3.44 2.68 0.19 4.82 -0.14 -1.26 -0.91 119.74 121.69 1f9d s LYS 576 Ca 0.75 -1.38 -0.19 0.00 -1.36 0.00 0.00 55.97 53.78 1f9d s LYS 576 Cb -0.27 -2.52 0.16 0.00 -1.68 0.00 0.00 37.83 33.52 1f9d s LYS 576 CO 0.33 -0.14 1.60 0.35 -0.76 0.00 0.00 175.35 176.72 1f9d h PHE 577 N 0.97 -0.76 0.00 3.18 3.57 -1.33 -0.14 116.94 122.42 1f9d h PHE 577 Ca -0.42 0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.12 1f9d h PHE 577 Cb 1.27 0.43 -0.00 0.00 2.79 0.00 0.00 35.95 40.43 1f9d h PHE 577 CO 0.48 -0.36 -0.14 0.97 -2.23 0.00 0.00 178.31 177.03 1f9d h ILE 578 N -0.12 0.73 -0.07 1.41 6.09 -1.75 -3.11 117.51 120.69 1f9d h ILE 578 Ca 0.25 -0.57 -0.02 0.00 -1.37 0.00 0.00 64.86 63.15 1f9d h ILE 578 Cb 0.54 1.35 -0.01 0.00 0.47 0.00 0.00 36.82 39.17 1f9d h ILE 578 CO -0.68 0.14 -0.05 0.44 -3.07 0.00 0.00 178.15 174.94 1f9d h ASP 579 N 0.00 0.09 -0.52 2.19 3.32 -1.32 -2.18 116.42 117.99 1f9d h ASP 579 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1f9d h ASP 579 Cb 0.34 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1f9d h ASP 579 CO 0.02 0.15 0.00 2.30 -1.72 0.00 0.00 179.24 179.99 1f9d n ILE 580 N -4.42 1.82 -2.69 0.35 -5.35 -1.17 -4.32 119.36 103.57 1f9d n ILE 580 Ca -0.02 -1.30 -0.07 0.00 -0.27 0.00 0.00 62.75 61.08 1f9d n ILE 580 Cb 0.16 0.10 0.05 0.00 -1.74 0.00 0.00 39.64 38.22 1f9d n ILE 580 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1f9d n ARG 581 N 0.69 1.22 0.29 6.28 1.74 -0.85 -4.97 116.66 121.06 1f9d n ARG 581 Ca 0.23 -2.94 0.20 0.00 -0.77 0.00 0.00 57.85 54.56 1f9d n ARG 581 Cb 0.82 -1.00 1.04 0.00 -1.02 0.00 0.00 32.46 32.31 1f9d n ARG 581 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1f9d h SER 582 N 2.71 0.00 0.53 0.55 4.64 -1.67 -1.84 113.55 118.48 1f9d h SER 582 Ca -0.15 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.17 1f9d h SER 582 Cb 1.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1f9d h SER 582 CO 0.34 0.00 -0.03 0.11 -0.87 0.00 0.00 176.83 176.38 1f9d h LYS 583 N 0.00 0.00 -0.00 4.77 1.57 -1.93 -2.31 116.57 118.67 1f9d h LYS 583 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1f9d h LYS 583 Cb 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 1f9d h LYS 583 CO 0.00 0.03 0.01 1.88 -0.57 0.00 0.00 179.45 180.80 1f9d h TYR 584 N 0.00 0.00 0.00 -1.35 0.05 -1.70 -1.40 116.97 112.58 1f9d h TYR 584 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1f9d h TYR 584 Cb 0.30 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.04 1f9d h TYR 584 CO 0.00 0.00 0.00 1.63 -1.05 0.00 0.00 178.16 178.74 1f9d n LYS 585 N -3.55 0.15 -0.02 4.88 5.02 -0.87 -1.74 118.16 122.04 1f9d n LYS 585 Ca -0.03 0.40 0.13 0.00 -2.02 0.00 0.00 58.31 56.79 1f9d n LYS 585 Cb 0.09 -1.80 0.34 0.00 -0.02 0.00 0.00 35.03 33.63 1f9d n LYS 585 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1f9d n GLN 586 N -2.09 1.97 -2.16 1.97 6.02 -0.53 -4.85 117.38 117.72 1f9d n GLN 586 Ca 0.02 -1.41 -0.41 0.00 -0.01 0.00 0.00 57.00 55.19 1f9d n GLN 586 Cb 0.20 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.97 1f9d n GLN 586 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1f9d s ASP 587 N -1.94 6.83 0.43 1.08 -1.08 -0.71 -4.91 116.67 116.36 1f9d s ASP 587 Ca 0.34 2.53 0.19 0.00 -0.52 0.00 0.00 52.55 55.09 1f9d s ASP 587 Cb 0.20 -2.62 1.12 0.00 -1.46 0.00 0.00 42.92 40.16 1f9d s ASP 587 CO 0.32 -0.55 1.86 -0.65 0.52 0.00 0.00 175.17 176.67 1f9d h PRO 588 N 4.66 0.35 -0.01 4.34 0.11 -1.91 -1.00 132.00 138.53 1f9d h PRO 588 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1f9d h PRO 588 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1f9d h PRO 588 CO 0.73 0.23 -0.13 0.39 -0.21 0.00 0.00 178.00 179.02 1f9d n GLU 589 N -4.49 1.22 0.22 1.05 1.02 -1.26 -4.50 120.64 113.90 1f9d n GLU 589 Ca 0.19 -0.70 -0.16 0.00 -0.02 0.00 0.00 57.16 56.47 1f9d n GLU 589 Cb 0.71 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 30.57 1f9d n GLU 589 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 1f9d h TRP 590 N 1.71 -0.99 -0.82 -0.32 2.91 -1.46 -1.21 115.95 115.77 1f9d h TRP 590 Ca 0.00 0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.12 1f9d h TRP 590 Cb 0.50 0.39 -0.07 0.00 -0.51 0.00 0.00 29.16 29.46 1f9d h TRP 590 CO 0.00 -0.51 0.48 1.96 -1.03 0.00 0.00 178.44 179.34 1f9d h GLN 591 N -0.74 0.80 -0.47 2.65 1.08 -1.79 -0.24 115.11 116.39 1f9d h GLN 591 Ca -0.02 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.12 1f9d h GLN 591 Cb 0.67 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.90 1f9d h GLN 591 CO -0.08 0.53 0.24 1.15 -0.95 0.00 0.00 178.83 179.72 1f9d h THR 592 N 0.82 1.18 0.10 -0.54 2.02 -1.79 -0.61 112.91 114.08 1f9d h THR 592 Ca 0.39 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 1f9d h THR 592 Cb 0.32 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1f9d h THR 592 CO -0.23 0.19 -0.05 -0.03 0.37 0.00 0.00 175.52 175.77 1f9d h MET 593 N 0.62 -0.12 -0.81 6.66 1.85 -0.42 -2.66 114.93 120.04 1f9d h MET 593 Ca 0.16 0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 59.25 1f9d h MET 593 Cb 0.09 0.03 -0.04 0.00 0.43 0.00 0.00 31.60 32.11 1f9d h MET 593 CO -0.02 0.03 0.46 0.28 -0.40 0.00 0.00 176.91 177.25 1f9d h VAL 594 N -0.25 1.23 -0.81 -5.77 2.07 -0.98 -2.17 116.25 109.56 1f9d h VAL 594 Ca -0.01 -0.56 0.03 0.00 0.82 0.00 0.00 66.70 66.98 1f9d h VAL 594 Cb 0.21 0.12 -0.05 0.00 -1.52 0.00 0.00 31.29 30.05 1f9d h VAL 594 CO 0.02 0.26 0.52 0.00 0.02 0.00 0.00 177.57 178.39 1f9d h ALA 595 N 1.38 1.07 -0.61 1.67 0.00 -0.99 -0.14 119.26 121.64 1f9d h ALA 595 Ca 0.29 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1f9d h ALA 595 Cb 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1f9d h ALA 595 CO -0.05 0.35 0.10 0.00 0.00 0.00 0.00 179.25 179.65 1f9d h ALA 596 N 1.34 0.80 -0.57 0.00 0.00 -1.08 -2.09 119.26 117.66 1f9d h ALA 596 Ca 0.32 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1f9d h ALA 596 Cb -0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1f9d h ALA 596 CO -0.11 0.56 0.00 -0.07 0.00 0.00 0.00 179.25 179.63 1f9d h LEU 597 N 0.91 0.96 -1.38 0.00 3.38 -0.80 0.30 115.31 118.69 1f9d h LEU 597 Ca 0.18 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1f9d h LEU 597 Cb 0.43 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1f9d h LEU 597 CO 0.01 1.02 -0.18 1.56 0.09 0.00 0.00 178.44 180.94 1f9d h GLN 598 N 0.91 0.18 -0.32 1.13 1.08 -0.81 -1.93 115.11 115.35 1f9d h GLN 598 Ca 0.17 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 1f9d h GLN 598 Cb 0.53 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1f9d h GLN 598 CO 0.03 0.37 0.00 0.00 -0.95 0.00 0.00 178.83 178.28 1f9d n ALA 599 N -2.49 2.47 -1.27 3.87 0.00 -0.81 -4.89 120.51 117.39 1f9d n ALA 599 Ca -0.01 -0.54 -0.09 0.00 0.00 0.00 0.00 53.44 52.79 1f9d n ALA 599 Cb 0.29 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.73 1f9d n ALA 599 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1f9d n GLY 600 N 0.97 1.10 3.94 0.00 0.00 -0.73 -5.01 105.19 105.45 1f9d n GLY 600 Ca 0.10 -0.48 -0.21 0.00 0.00 0.00 0.00 46.02 45.43 1f9d n GLY 600 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1f9d s GLN 601 N -2.69 3.18 -0.13 1.61 -0.21 0.07 -5.02 119.66 116.46 1f9d s GLN 601 Ca 0.00 -0.94 -0.22 0.00 0.02 0.00 0.00 55.36 54.22 1f9d s GLN 601 Cb 0.00 -2.76 -0.03 0.00 1.00 0.00 0.00 33.01 31.21 1f9d s GLN 601 CO 0.00 0.29 0.64 0.08 -2.12 0.00 0.00 175.29 174.18 1f9d s VAL 602 N -2.10 5.05 0.64 1.09 1.01 -1.26 -4.02 120.40 120.82 1f9d s VAL 602 Ca 0.38 1.27 -0.17 0.00 0.00 0.00 0.00 61.98 63.46 1f9d s VAL 602 Cb -0.09 -3.97 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 1f9d s VAL 602 CO 0.29 0.20 1.15 -2.84 0.00 0.00 0.00 175.10 173.89 1f9d s PRO 603 N 1.29 2.78 0.16 2.72 0.02 -1.26 -4.84 135.00 135.87 1f9d s PRO 603 Ca 0.32 1.60 0.07 0.00 0.02 0.00 0.00 61.00 63.01 1f9d s PRO 603 Cb -0.16 -1.93 -0.04 0.00 0.02 0.00 0.00 34.50 32.39 1f9d s PRO 603 CO 0.13 -1.31 -0.15 0.95 -0.33 0.00 0.00 177.00 176.29 1f9d s THR 604 N -2.01 1.62 0.07 0.99 -4.23 -1.26 -0.56 115.64 110.26 1f9d s THR 604 Ca 0.72 -1.97 -0.09 0.00 -1.18 0.00 0.00 61.69 59.17 1f9d s THR 604 Cb -0.25 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.77 1f9d s THR 604 CO 0.38 -0.46 0.19 -1.10 -0.54 0.00 0.00 174.62 173.09 1f9d s GLN 605 N -3.10 0.80 -0.32 3.99 -0.21 -0.33 -4.93 119.66 115.56 1f9d s GLN 605 Ca 0.16 -0.85 0.02 0.00 0.02 0.00 0.00 55.36 54.71 1f9d s GLN 605 Cb -0.03 0.33 0.09 0.00 1.00 0.00 0.00 33.01 34.39 1f9d s GLN 605 CO 0.05 -0.25 0.02 0.50 -2.12 0.00 0.00 175.29 173.50 1f9d s ARG 606 N -3.44 1.86 -0.01 2.91 3.52 -1.26 -1.05 118.95 121.48 1f9d s ARG 606 Ca 0.02 -1.66 0.01 0.00 -0.13 0.00 0.00 55.73 53.97 1f9d s ARG 606 Cb 0.03 -3.17 -0.04 0.00 -1.56 0.00 0.00 34.95 30.21 1f9d s ARG 606 CO -0.09 -0.82 -0.01 -0.51 -0.81 0.00 0.00 175.30 173.07 1f9d s LEU 607 N 1.03 3.49 -0.65 -0.88 1.43 -1.26 -4.98 118.68 116.85 1f9d s LEU 607 Ca 0.03 0.00 0.03 0.00 -1.03 0.00 0.00 54.13 53.17 1f9d s LEU 607 Cb -0.20 -1.97 0.16 0.00 0.03 0.00 0.00 46.19 44.21 1f9d s LEU 607 CO -0.06 0.29 0.43 -1.00 0.23 0.00 0.00 176.35 176.25 1f9d s HIS 608 N -1.05 3.45 0.02 0.29 3.76 -1.26 -4.71 115.29 115.79 1f9d s HIS 608 Ca 0.18 -3.19 -0.30 0.00 -0.15 0.00 0.00 55.06 51.60 1f9d s HIS 608 Cb -0.11 -2.85 -0.04 0.00 1.11 0.00 0.00 32.58 30.69 1f9d s HIS 608 CO 0.09 -0.66 0.98 1.03 -0.85 0.00 0.00 174.74 175.32 1f9d s ARG 609 N -0.89 4.59 0.16 1.40 0.52 -1.26 -2.23 118.95 121.24 1f9d s ARG 609 Ca 0.21 1.43 -0.17 0.00 -0.52 0.00 0.00 55.73 56.68 1f9d s ARG 609 Cb -0.14 -3.44 0.09 0.00 0.52 0.00 0.00 34.95 31.97 1f9d s ARG 609 CO -0.09 0.00 1.67 0.35 0.02 0.00 0.00 175.30 177.25 1f9d h PHE 610 N 6.57 -0.20 -0.34 -0.53 3.57 -0.96 -1.74 116.94 123.32 1f9d h PHE 610 Ca -0.41 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.10 1f9d h PHE 610 Cb 1.22 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 40.09 1f9d h PHE 610 CO 0.67 -0.16 0.12 0.11 -2.23 0.00 0.00 178.31 176.82 1f9d h TRP 611 N 0.00 0.47 -0.20 0.41 5.08 -1.88 -1.78 115.95 118.05 1f9d h TRP 611 Ca 0.19 -0.02 -0.06 0.00 1.08 0.00 0.00 58.89 60.08 1f9d h TRP 611 Cb 0.28 -0.15 -0.01 0.00 -3.00 0.00 0.00 29.16 26.29 1f9d h TRP 611 CO -0.34 0.39 -0.10 0.00 -1.28 0.00 0.00 178.44 177.10 1f9d h ALA 612 N 1.66 0.28 -0.48 0.11 0.00 -1.72 0.33 119.26 119.45 1f9d h ALA 612 Ca 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1f9d h ALA 612 Cb 0.13 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1f9d h ALA 612 CO -0.01 0.12 0.26 1.96 0.00 0.00 0.00 179.25 181.58 1f9d h GLN 613 N 0.12 0.68 -0.70 0.00 1.08 -1.12 -1.16 115.11 114.01 1f9d h GLN 613 Ca 0.04 -0.08 -0.07 0.00 -1.45 0.00 0.00 58.65 57.09 1f9d h GLN 613 Cb 0.60 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.87 1f9d h GLN 613 CO 0.03 0.54 0.15 0.77 -0.95 0.00 0.00 178.83 179.37 1f9d h SER 614 N 0.63 1.08 -0.55 1.46 0.02 -1.29 -1.08 113.55 113.83 1f9d h SER 614 Ca 0.17 -0.24 0.04 0.00 -0.84 0.00 0.00 61.79 60.92 1f9d h SER 614 Cb 0.07 -0.29 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 1f9d h SER 614 CO -0.03 1.05 0.30 -0.08 -1.14 0.00 0.00 176.83 176.94 1f9d h GLU 615 N 1.07 0.57 -0.21 3.45 4.57 -0.51 0.17 114.58 123.70 1f9d h GLU 615 Ca 0.22 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.34 1f9d h GLU 615 Cb 0.40 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1f9d h GLU 615 CO 0.01 0.38 0.05 0.35 -1.18 0.00 0.00 179.01 178.62 1f9d h PHE 616 N 0.59 0.35 0.37 0.92 3.57 -0.83 -0.77 116.94 121.13 1f9d h PHE 616 Ca 0.24 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 1f9d h PHE 616 Cb 0.11 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1f9d h PHE 616 CO -0.08 0.44 -0.35 0.00 -2.23 0.00 0.00 178.31 176.09 1f9d h ALA 617 N 0.87 -0.76 -0.88 2.41 0.00 -0.74 -2.04 119.26 118.12 1f9d h ALA 617 Ca 0.07 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.95 1f9d h ALA 617 Cb 0.26 0.49 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 1f9d h ALA 617 CO 0.00 -0.96 0.52 0.28 0.00 0.00 0.00 179.25 179.09 1f9d h VAL 618 N -0.74 0.93 -0.78 0.00 2.07 -0.63 -0.71 116.25 116.39 1f9d h VAL 618 Ca -0.03 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.20 1f9d h VAL 618 Cb 0.66 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 1f9d h VAL 618 CO -0.05 0.16 0.51 0.00 0.02 0.00 0.00 177.57 178.21 1f9d h ALA 619 N 1.47 1.44 -0.46 1.67 0.00 -0.82 0.59 119.26 123.15 1f9d h ALA 619 Ca 0.42 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.20 1f9d h ALA 619 Cb 0.37 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1f9d h ALA 619 CO -0.24 0.52 -0.00 -0.91 0.00 0.00 0.00 179.25 178.61 1f9d h ASN 620 N 1.06 0.80 -0.50 0.00 2.35 -0.43 -2.15 115.58 116.71 1f9d h ASN 620 Ca 0.28 -0.31 -0.03 0.00 -0.55 0.00 0.00 56.30 55.70 1f9d h ASN 620 Cb -0.12 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.02 1f9d h ASN 620 CO -0.06 0.92 0.21 1.23 -1.65 0.00 0.00 177.43 178.07 1f9d h GLY 621 N 0.67 0.79 0.89 2.83 0.00 -0.52 -1.15 103.07 106.57 1f9d h GLY 621 Ca 0.13 -0.42 0.02 0.00 0.00 0.00 0.00 47.33 47.06 1f9d h GLY 621 CO 0.02 0.40 0.24 -2.08 0.00 0.00 0.00 176.54 175.12 1f9d h VAL 622 N 0.66 1.03 -0.60 4.60 2.07 -0.85 -1.60 116.25 121.57 1f9d h VAL 622 Ca 0.17 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1f9d h VAL 622 Cb 0.18 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1f9d h VAL 622 CO -0.02 0.09 0.24 0.22 0.02 0.00 0.00 177.57 178.12 1f9d h TYR 623 N 0.48 0.91 -0.98 1.57 3.20 -1.17 -1.40 116.97 119.58 1f9d h TYR 623 Ca 0.16 -0.07 0.07 0.00 3.14 0.00 0.00 58.73 62.03 1f9d h TYR 623 Cb 0.02 -0.27 -0.07 0.00 1.54 0.00 0.00 36.73 37.95 1f9d h TYR 623 CO -0.07 0.73 0.63 0.00 -1.64 0.00 0.00 178.16 177.80 1f9d h ALA 624 N 1.09 1.44 0.04 1.82 0.00 -0.71 -1.08 119.26 121.86 1f9d h ALA 624 Ca 0.20 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.85 1f9d h ALA 624 Cb 0.20 -0.29 0.02 0.00 0.00 0.00 0.00 17.79 17.71 1f9d h ALA 624 CO -0.02 0.41 -0.94 0.82 0.00 0.00 0.00 179.25 179.52 1f9d h ILE 625 N 1.13 1.34 0.00 0.00 2.04 -0.95 0.74 117.51 121.80 1f9d h ILE 625 Ca 0.42 -2.26 -0.06 0.00 1.00 0.00 0.00 64.86 63.96 1f9d h ILE 625 Cb 0.18 2.57 -0.01 0.00 -0.74 0.00 0.00 36.82 38.83 1f9d h ILE 625 CO -0.17 0.68 -0.35 -0.07 0.00 0.00 0.00 178.15 178.25 1f9d h LEU 626 N 0.17 0.00 -6.00 1.44 3.38 -1.13 -3.37 115.31 109.79 1f9d h LEU 626 Ca -0.13 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.28 1f9d h LEU 626 Cb 1.63 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.98 1f9d h LEU 626 CO 0.18 0.26 -0.92 0.49 0.09 0.00 0.00 178.44 178.54 1f9d n PHE 627 N -3.13 1.33 0.29 1.13 3.72 -0.42 -4.95 117.46 115.43 1f9d n PHE 627 Ca 0.02 -3.82 0.14 0.00 -0.05 0.00 0.00 57.45 53.75 1f9d n PHE 627 Cb 0.64 -0.44 0.86 0.00 -0.94 0.00 0.00 39.48 39.60 1f9d n PHE 627 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1f9d h PRO 628 N 3.85 0.00 -0.02 -1.08 0.13 -1.73 -3.41 132.00 129.74 1f9d h PRO 628 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1f9d h PRO 628 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1f9d h PRO 628 CO 0.61 0.04 0.00 -0.25 -0.23 0.00 0.00 178.00 178.18