#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fpe s TYR 4 N -0.37 3.36 0.53 0.00 2.02 -1.26 -4.92 117.35 116.71 3fpe s TYR 4 Ca 0.19 1.43 0.19 0.00 -0.37 0.00 0.00 57.07 58.51 3fpe s TYR 4 Cb 0.42 -3.48 1.36 0.00 -0.40 0.00 0.00 41.96 39.85 3fpe s TYR 4 CO -0.08 -1.34 2.15 -0.84 -1.57 0.00 0.00 175.55 173.87 3fpe h ILE 5 N 3.51 0.91 0.00 2.71 3.07 -2.03 -2.39 117.51 123.29 3fpe h ILE 5 Ca -0.46 0.00 -0.04 0.00 1.55 0.00 0.00 64.86 65.91 3fpe h ILE 5 Cb 1.22 0.98 -0.01 0.00 -0.27 0.00 0.00 36.82 38.74 3fpe h ILE 5 CO 0.72 0.00 -0.19 1.88 -1.05 0.00 0.00 178.15 179.51 3fpe h TYR 6 N 0.00 0.00 0.52 0.16 0.05 -1.99 -3.04 116.97 112.66 3fpe h TYR 6 Ca 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 3fpe h TYR 6 Cb 0.08 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.81 3fpe h TYR 6 CO 0.00 0.19 -0.41 2.35 -1.05 0.00 0.00 178.16 179.24 3fpe h TRP 7 N 0.00 -1.11 -0.85 4.88 2.91 -1.82 0.15 115.95 120.11 3fpe h TRP 7 Ca -0.00 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.01 3fpe h TRP 7 Cb 0.55 0.42 -0.04 0.00 -0.51 0.00 0.00 29.16 29.58 3fpe h TRP 7 CO 0.00 -0.59 0.49 -0.44 -1.03 0.00 0.00 178.44 176.87 3fpe h ASP 8 N -0.91 1.04 -0.58 2.65 3.32 -1.72 -1.21 116.42 119.01 3fpe h ASP 8 Ca -0.06 -0.07 0.02 0.00 0.02 0.00 0.00 57.03 56.94 3fpe h ASP 8 Cb 0.78 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 3fpe h ASP 8 CO -0.00 0.81 0.36 0.11 -1.72 0.00 0.00 179.24 178.80 3fpe h LYS 9 N 1.18 0.70 -0.24 3.56 1.57 -1.39 0.04 116.57 121.99 3fpe h LYS 9 Ca 0.30 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 59.02 3fpe h LYS 9 Cb -0.01 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 3fpe h LYS 9 CO -0.05 0.46 0.08 0.82 -0.57 0.00 0.00 179.45 180.19 3fpe h ILE 10 N 0.72 1.19 -0.87 1.86 2.04 -0.61 -1.88 117.51 119.95 3fpe h ILE 10 Ca 0.23 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.51 3fpe h ILE 10 Cb -0.01 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 3fpe h ILE 10 CO -0.09 0.20 0.56 0.11 0.00 0.00 0.00 178.15 178.93 3fpe h LYS 11 N 0.22 1.05 -0.18 2.37 1.79 -1.00 -0.73 116.57 120.10 3fpe h LYS 11 Ca 0.08 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.47 3fpe h LYS 11 Cb 0.24 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 3fpe h LYS 11 CO -0.00 0.69 0.06 0.00 -1.08 0.00 0.00 179.45 179.12 3fpe h ARG 12 N 1.08 0.27 -0.39 3.15 2.47 -0.82 -0.75 114.38 119.40 3fpe h ARG 12 Ca 0.35 -0.06 0.05 0.00 -1.26 0.00 0.00 59.98 59.07 3fpe h ARG 12 Cb 0.04 -0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 28.27 3fpe h ARG 12 CO -0.13 0.38 0.11 0.82 0.56 0.00 0.00 179.97 181.71 3fpe h ILE 13 N 0.11 0.84 -0.81 2.04 2.04 -1.10 -2.28 117.51 118.37 3fpe h ILE 13 Ca 0.06 -0.08 0.04 0.00 1.00 0.00 0.00 64.86 65.87 3fpe h ILE 13 Cb 0.22 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.82 3fpe h ILE 13 CO -0.00 0.04 0.53 0.00 0.00 0.00 0.00 178.15 178.72 3fpe h ALA 14 N 1.27 1.54 -0.00 1.87 0.00 -0.92 -0.28 119.26 122.73 3fpe h ALA 14 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3fpe h ALA 14 Cb 0.19 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3fpe h ALA 14 CO -0.21 0.37 0.00 0.66 0.00 0.00 0.00 179.25 180.07 3fpe h SER 15 N 0.96 0.00 0.08 0.00 4.64 -0.54 -0.21 113.55 118.48 3fpe h SER 15 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3fpe h SER 15 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3fpe h SER 15 CO -0.10 0.00 -0.12 0.54 -0.87 0.00 0.00 176.83 176.28 3fpe n ARG 16 N -4.25 1.39 -0.01 4.77 1.74 -0.13 -3.72 116.66 116.45 3fpe n ARG 16 Ca -0.03 -0.88 0.05 0.00 -0.77 0.00 0.00 57.85 56.22 3fpe n ARG 16 Cb 0.09 -1.48 -0.14 0.00 -1.02 0.00 0.00 32.46 29.91 3fpe n ARG 16 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3fpe n LEU 17 N -0.04 0.19 -0.28 0.55 4.77 -0.17 -4.62 117.00 117.41 3fpe n LEU 17 Ca 0.16 0.08 0.08 0.00 -0.03 0.00 0.00 56.01 56.30 3fpe n LEU 17 Cb 0.38 0.12 0.23 0.00 -2.33 0.00 0.00 43.42 41.82 3fpe n LEU 17 CO 0.20 0.12 1.02 -0.08 -1.33 0.00 0.00 177.39 177.32 3fpe h GLU 18 N 0.00 0.41 0.00 3.23 4.57 -1.43 -0.49 114.58 120.87 3fpe h GLU 18 Ca -0.15 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 3fpe h GLU 18 Cb 1.36 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 3fpe h GLU 18 CO 0.01 0.27 0.00 0.41 -1.18 0.00 0.00 179.01 178.52 3fpe n GLY 19 N -1.34 -1.07 0.49 1.92 0.00 -1.26 -1.22 105.19 102.71 3fpe n GLY 19 Ca 0.17 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.35 3fpe n GLY 19 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3fpe n MET 20 N -1.88 1.30 -1.66 1.61 2.81 -0.20 -5.01 117.12 114.09 3fpe n MET 20 Ca 0.02 -0.98 -0.44 0.00 -1.81 0.00 0.00 57.70 54.49 3fpe n MET 20 Cb 0.17 -1.48 -0.01 0.00 -0.71 0.00 0.00 33.22 31.19 3fpe n MET 20 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3fpe n ASN 21 N 0.01 2.27 0.00 7.83 5.15 -0.36 -0.99 115.26 129.17 3fpe n ASN 21 Ca 0.12 1.19 0.00 0.00 -0.60 0.00 0.00 54.58 55.28 3fpe n ASN 21 Cb 0.44 -1.41 0.00 0.00 -0.53 0.00 0.00 39.78 38.29 3fpe n ASN 21 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 3fpe n TYR 22 N 0.57 0.00 -2.24 1.20 4.01 -1.26 -4.76 117.16 114.68 3fpe n TYR 22 Ca 0.08 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.83 3fpe n TYR 22 Cb 0.34 -1.13 0.00 0.00 -0.31 0.00 0.00 39.34 38.24 3fpe n TYR 22 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3fpe n HIS 23 N -2.23 0.00 0.31 -0.72 8.25 -0.16 -4.90 115.22 115.77 3fpe n HIS 23 Ca 0.00 -0.28 0.18 0.00 -0.26 0.00 0.00 57.72 57.36 3fpe n HIS 23 Cb 0.19 -0.04 1.00 0.00 1.12 0.00 0.00 29.99 32.26 3fpe n HIS 23 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 3fpe h PHE 24 N 0.49 0.00 0.00 4.41 0.04 -1.80 -1.63 116.94 118.44 3fpe h PHE 24 Ca -0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.62 3fpe h PHE 24 Cb 1.62 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.77 3fpe h PHE 24 CO 0.10 0.02 0.00 -0.40 -0.60 0.00 0.00 178.31 177.43 3fpe n ASP 25 N -3.39 0.36 -0.48 2.17 5.75 -1.26 -2.03 116.55 117.68 3fpe n ASP 25 Ca -0.02 0.59 0.13 0.00 -0.01 0.00 0.00 54.79 55.48 3fpe n ASP 25 Cb 0.13 -0.67 0.50 0.00 -1.03 0.00 0.00 41.12 40.05 3fpe n ASP 25 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3fpe n GLU 26 N -1.90 1.65 -1.66 0.11 1.02 -0.61 -4.97 120.64 114.28 3fpe n GLU 26 Ca 0.03 -0.96 -0.41 0.00 -0.02 0.00 0.00 57.16 55.80 3fpe n GLU 26 Cb 0.19 -1.46 0.01 0.00 -0.02 0.00 0.00 31.44 30.17 3fpe n GLU 26 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 3fpe n MET 27 N 0.16 1.62 -2.89 3.49 2.81 -0.86 -4.97 117.12 116.49 3fpe n MET 27 Ca 0.18 0.58 -0.42 0.00 -1.81 0.00 0.00 57.70 56.23 3fpe n MET 27 Cb 0.34 -2.24 -0.05 0.00 -0.71 0.00 0.00 33.22 30.57 3fpe n MET 27 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3fpe s ASP 28 N -0.67 6.57 0.12 7.83 -1.08 -1.26 -4.98 116.67 123.20 3fpe s ASP 28 Ca 0.63 0.36 -0.22 0.00 -0.52 0.00 0.00 52.55 52.80 3fpe s ASP 28 Cb -0.52 -2.42 -0.06 0.00 -1.46 0.00 0.00 42.92 38.45 3fpe s ASP 28 CO 0.56 -0.83 1.70 0.74 0.52 0.00 0.00 175.17 177.86 3fpe h THR 29 N 5.84 0.75 -0.73 1.71 2.02 -1.98 -2.06 112.91 118.45 3fpe h THR 29 Ca -0.24 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 66.87 3fpe h THR 29 Cb 1.09 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 68.22 3fpe h THR 29 CO 0.95 0.00 0.21 -1.28 0.37 0.00 0.00 175.52 175.77 3fpe h SER 30 N -0.11 1.09 0.31 4.18 0.87 -2.02 -3.12 113.55 114.74 3fpe h SER 30 Ca 0.06 -0.22 -0.03 0.00 -1.23 0.00 0.00 61.79 60.37 3fpe h SER 30 Cb 0.20 -0.29 -0.00 0.00 -0.44 0.00 0.00 62.40 61.87 3fpe h SER 30 CO -0.15 1.02 -0.15 1.23 -0.53 0.00 0.00 176.83 178.25 3fpe h GLY 31 N 1.11 0.00 -1.89 5.77 0.00 -1.83 -2.99 103.07 103.25 3fpe h GLY 31 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 3fpe h GLY 31 CO -0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 3fpe n VAL 32 N -3.86 0.34 -0.32 4.60 0.24 -0.83 -4.49 118.33 114.00 3fpe n VAL 32 Ca -0.02 -0.67 -0.00 0.00 -2.04 0.00 0.00 64.34 61.61 3fpe n VAL 32 Cb 0.25 1.12 0.13 0.00 -1.47 0.00 0.00 33.84 33.86 3fpe n VAL 32 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 3fpe h MET 33 N 3.93 1.05 -0.86 7.34 2.86 -1.53 -1.77 114.93 125.95 3fpe h MET 33 Ca 0.00 -0.06 0.15 0.00 -2.06 0.00 0.00 59.70 57.73 3fpe h MET 33 Cb 0.88 -0.24 -0.07 0.00 0.06 0.00 0.00 31.60 32.24 3fpe h MET 33 CO 0.00 0.69 0.56 -1.35 1.06 0.00 0.00 176.91 177.87 3fpe h PRO 34 N 1.08 0.59 -0.54 -0.22 0.11 -1.82 -0.72 132.00 130.47 3fpe h PRO 34 Ca 0.36 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.38 3fpe h PRO 34 Cb 0.06 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.01 3fpe h PRO 34 CO -0.14 0.39 0.09 -0.07 -0.21 0.00 0.00 178.00 178.07 3fpe h LEU 35 N 0.61 0.86 -0.80 2.35 3.38 -1.65 -1.42 115.31 118.63 3fpe h LEU 35 Ca 0.43 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 58.16 3fpe h LEU 35 Cb 0.78 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 3fpe h LEU 35 CO -0.18 0.90 0.53 0.25 0.09 0.00 0.00 178.44 180.02 3fpe h LEU 36 N 0.79 0.90 -0.46 1.67 5.85 -1.01 -1.83 115.31 121.21 3fpe h LEU 36 Ca 0.17 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.92 3fpe h LEU 36 Cb 0.40 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 3fpe h LEU 36 CO 0.01 0.64 0.18 0.44 -0.34 0.00 0.00 178.44 179.37 3fpe h ASP 37 N 1.06 0.22 -0.41 1.25 3.32 -0.75 0.14 116.42 121.25 3fpe h ASP 37 Ca 0.30 0.05 0.05 0.00 0.02 0.00 0.00 57.03 57.45 3fpe h ASP 37 Cb -0.08 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 3fpe h ASP 37 CO -0.08 0.16 0.15 -0.33 -1.72 0.00 0.00 179.24 177.42 3fpe h GLU 38 N 0.37 0.31 -0.33 3.56 5.08 -0.87 -0.38 114.58 122.32 3fpe h GLU 38 Ca 0.21 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.48 3fpe h GLU 38 Cb 0.19 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3fpe h GLU 38 CO -0.20 0.20 -0.08 0.82 -1.00 0.00 0.00 179.01 178.76 3fpe h ILE 39 N 0.32 1.28 0.00 3.13 2.04 -0.86 -3.01 117.51 120.40 3fpe h ILE 39 Ca 0.19 -1.12 -0.06 0.00 1.00 0.00 0.00 64.86 64.87 3fpe h ILE 39 Cb 0.17 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 3fpe h ILE 39 CO -0.19 0.36 -0.28 -0.33 0.00 0.00 0.00 178.15 177.72 3fpe h GLU 40 N 0.41 0.00 -0.76 2.37 5.08 -0.36 -1.32 114.58 120.00 3fpe h GLU 40 Ca 0.08 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.48 3fpe h GLU 40 Cb 0.57 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 3fpe h GLU 40 CO 0.03 0.28 0.50 0.93 -1.00 0.00 0.00 179.01 179.75 3fpe h GLU 41 N 0.00 0.89 0.03 2.33 4.39 -0.94 0.24 114.58 121.53 3fpe h GLU 41 Ca -0.00 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 3fpe h GLU 41 Cb 0.60 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 3fpe h GLU 41 CO 0.04 0.59 -0.17 0.82 -1.16 0.00 0.00 179.01 179.13 3fpe h ILE 42 N 0.92 1.74 -0.98 3.13 2.04 -1.48 -3.18 117.51 119.70 3fpe h ILE 42 Ca 0.31 -2.39 0.10 0.00 1.00 0.00 0.00 64.86 63.88 3fpe h ILE 42 Cb 0.07 3.36 -0.08 0.00 -0.74 0.00 0.00 36.82 39.43 3fpe h ILE 42 CO -0.09 0.63 0.62 0.00 0.00 0.00 0.00 178.15 179.31 3fpe h ALA 43 N 0.02 1.43 -0.17 1.87 0.00 -1.07 -2.47 119.26 118.87 3fpe h ALA 43 Ca -0.03 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3fpe h ALA 43 Cb 1.13 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3fpe h ALA 43 CO 0.03 0.28 0.00 0.72 0.00 0.00 0.00 179.25 180.28 3fpe n HIS 44 N -4.60 0.21 -2.16 0.00 8.25 0.06 -3.82 115.22 113.15 3fpe n HIS 44 Ca 0.17 -0.10 -0.43 0.00 -0.26 0.00 0.00 57.72 57.10 3fpe n HIS 44 Cb 0.29 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.37 3fpe n HIS 44 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3fpe s ASP 45 N -1.68 6.07 0.00 0.41 -1.08 -0.93 -4.88 116.67 114.58 3fpe s ASP 45 Ca 0.34 1.03 0.24 0.00 -0.52 0.00 0.00 52.55 53.64 3fpe s ASP 45 Cb 0.19 -2.53 1.24 0.00 -1.46 0.00 0.00 42.92 40.36 3fpe s ASP 45 CO 0.29 -1.61 1.79 -1.54 0.52 0.00 0.00 175.17 174.61 3fpe n SER 46 N 9.72 0.00 0.02 -0.34 3.41 -1.26 -2.54 113.62 122.63 3fpe n SER 46 Ca 0.20 -0.18 0.13 0.00 -0.26 0.00 0.00 58.87 58.76 3fpe n SER 46 Cb 0.48 -0.23 0.40 0.00 -0.26 0.00 0.00 64.21 64.59 3fpe n SER 46 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3fpe n THR 47 N -1.23 0.14 -2.83 6.66 -2.24 -1.26 -4.74 114.28 108.78 3fpe n THR 47 Ca 0.12 -0.08 -0.43 0.00 -2.27 0.00 0.00 64.05 61.40 3fpe n THR 47 Cb 0.17 -0.22 -0.04 0.00 -2.10 0.00 0.00 70.33 68.14 3fpe n THR 47 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 3fpe s ILE 48 N -3.04 4.59 0.70 2.28 1.10 -1.05 -5.03 121.20 120.75 3fpe s ILE 48 Ca 0.11 1.08 -0.11 0.00 -0.51 0.00 0.00 60.65 61.23 3fpe s ILE 48 Cb 0.17 -4.33 0.01 0.00 0.15 0.00 0.00 42.46 38.46 3fpe s ILE 48 CO 0.62 -0.57 1.06 1.51 -2.11 0.00 0.00 174.94 175.46 3fpe s ASP 49 N 1.94 5.31 0.32 4.50 1.47 -1.26 -4.81 116.67 124.14 3fpe s ASP 49 Ca 0.37 1.59 0.04 0.00 1.18 0.00 0.00 52.55 55.74 3fpe s ASP 49 Cb -0.12 -2.46 0.56 0.00 -0.34 0.00 0.00 42.92 40.57 3fpe s ASP 49 CO 0.20 -1.49 1.83 -0.26 0.68 0.00 0.00 175.17 176.13 3fpe h PHE 50 N -0.75 0.50 -0.68 2.11 -1.00 -1.97 -1.61 116.94 113.54 3fpe h PHE 50 Ca -0.44 -0.07 -0.08 0.00 2.81 0.00 0.00 57.97 60.19 3fpe h PHE 50 Cb 1.21 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 40.61 3fpe h PHE 50 CO 0.61 0.56 0.12 0.93 -1.61 0.00 0.00 178.31 178.93 3fpe h GLU 51 N 0.44 1.12 -0.30 1.51 4.39 -1.99 -1.77 114.58 117.98 3fpe h GLU 51 Ca 0.09 -0.29 -0.13 0.00 0.34 0.00 0.00 59.36 59.37 3fpe h GLU 51 Cb 0.44 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 3fpe h GLU 51 CO 0.02 1.01 -0.33 0.77 -1.16 0.00 0.00 179.01 179.33 3fpe h SER 52 N 1.05 0.69 -0.29 1.42 0.02 -1.86 -1.46 113.55 113.12 3fpe h SER 52 Ca 0.21 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 60.86 3fpe h SER 52 Cb 0.42 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 3fpe h SER 52 CO 0.01 0.96 0.09 0.00 -1.14 0.00 0.00 176.83 176.75 3fpe h ALA 53 N 1.08 0.38 -0.87 3.77 0.00 -1.12 -2.25 119.26 120.25 3fpe h ALA 53 Ca 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3fpe h ALA 53 Cb 0.83 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 3fpe h ALA 53 CO 0.07 0.02 0.47 -0.22 0.00 0.00 0.00 179.25 179.59 3fpe h LYS 54 N 0.31 1.21 -0.29 0.00 3.64 -1.24 -0.12 116.57 120.09 3fpe h LYS 54 Ca 0.09 -0.14 0.05 0.00 -1.27 0.00 0.00 60.65 59.38 3fpe h LYS 54 Cb 0.25 -0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 31.78 3fpe h LYS 54 CO -0.00 0.89 -0.03 1.25 -2.27 0.00 0.00 179.45 179.29 3fpe h HIS 55 N 1.22 -0.08 -0.02 1.91 2.76 -1.00 -0.93 115.15 119.01 3fpe h HIS 55 Ca 0.31 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.49 3fpe h HIS 55 Cb 0.04 0.08 -0.00 0.00 1.55 0.00 0.00 27.41 29.08 3fpe h HIS 55 CO 0.01 -0.08 -0.01 0.82 -1.30 0.00 0.00 177.93 177.37 3fpe h ILE 56 N 0.04 1.29 0.00 6.26 2.04 -0.97 -3.11 117.51 123.06 3fpe h ILE 56 Ca 0.14 -0.88 -0.08 0.00 1.00 0.00 0.00 64.86 65.04 3fpe h ILE 56 Cb 0.20 1.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 3fpe h ILE 56 CO -0.26 0.23 -0.40 -0.07 0.00 0.00 0.00 178.15 177.65 3fpe h LEU 57 N -0.31 0.00 0.00 1.44 3.38 -0.86 -3.05 115.31 115.91 3fpe h LEU 57 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3fpe h LEU 57 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3fpe h LEU 57 CO 0.00 0.40 -0.50 0.47 0.09 0.00 0.00 178.44 178.90 3fpe n ASP 58 N -3.29 0.51 -4.72 -0.43 9.92 -0.37 -4.84 116.55 113.33 3fpe n ASP 58 Ca 0.01 -0.12 -0.42 0.00 -0.53 0.00 0.00 54.79 53.74 3fpe n ASP 58 Cb 0.63 0.19 -0.03 0.00 -0.64 0.00 0.00 41.12 41.27 3fpe n ASP 58 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3fpe s ASP 59 N -3.28 6.62 0.46 -2.24 -1.08 -1.15 -4.90 116.67 111.10 3fpe s ASP 59 Ca 0.10 2.58 0.17 0.00 -0.52 0.00 0.00 52.55 54.87 3fpe s ASP 59 Cb 0.17 -2.59 1.13 0.00 -1.46 0.00 0.00 42.92 40.16 3fpe s ASP 59 CO 0.69 -0.79 1.99 0.00 0.52 0.00 0.00 175.17 177.58 3fpe h ALA 60 N 6.72 2.13 0.00 3.66 0.00 -1.91 -0.34 119.26 129.52 3fpe h ALA 60 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3fpe h ALA 60 Cb 1.21 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3fpe h ALA 60 CO 0.90 -0.27 0.00 0.39 0.00 0.00 0.00 179.25 180.27 3fpe n GLU 61 N -4.46 0.06 0.00 0.00 1.02 -1.26 -2.00 120.64 114.00 3fpe n GLU 61 Ca 0.09 0.32 0.11 0.00 -0.02 0.00 0.00 57.16 57.66 3fpe n GLU 61 Cb 0.42 -1.62 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 3fpe n GLU 61 CO 0.00 0.00 0.00 -0.12 1.18 0.00 0.00 177.13 178.19 3fpe n MET 62 N -1.73 0.46 -0.13 3.49 1.56 -0.14 -4.63 117.12 116.00 3fpe n MET 62 Ca 0.03 -0.37 -0.04 0.00 -0.27 0.00 0.00 57.70 57.05 3fpe n MET 62 Cb 0.18 -1.49 0.04 0.00 2.15 0.00 0.00 33.22 34.09 3fpe n MET 62 CO 0.00 0.00 0.00 -0.97 -0.73 0.00 0.00 175.97 174.27 3fpe h ASN 63 N 0.90 -0.25 -0.27 6.12 -1.24 -1.42 -0.39 115.58 119.03 3fpe h ASN 63 Ca 0.00 0.11 -0.09 0.00 0.71 0.00 0.00 56.30 57.03 3fpe h ASN 63 Cb 0.59 0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.84 3fpe h ASN 63 CO 0.00 -0.09 -0.20 -0.74 -1.29 0.00 0.00 177.43 175.12 3fpe h HIS 64 N 0.07 0.71 -0.60 0.67 2.76 -1.82 -1.28 115.15 115.67 3fpe h HIS 64 Ca 0.22 -0.20 0.01 0.00 -2.20 0.00 0.00 60.37 58.20 3fpe h HIS 64 Cb 0.32 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.10 3fpe h HIS 64 CO -0.32 0.89 0.39 0.00 -1.30 0.00 0.00 177.93 177.60 3fpe h ALA 65 N 0.71 0.76 -0.68 5.26 0.00 -1.81 -1.98 119.26 121.52 3fpe h ALA 65 Ca 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3fpe h ALA 65 Cb 0.74 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3fpe h ALA 65 CO 0.05 0.18 0.41 1.25 0.00 0.00 0.00 179.25 181.14 3fpe h LEU 66 N 0.80 0.83 -0.79 0.00 5.85 -0.91 -1.90 115.31 119.19 3fpe h LEU 66 Ca 0.22 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.88 3fpe h LEU 66 Cb -0.08 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 40.70 3fpe h LEU 66 CO -0.05 0.65 0.52 0.77 -0.34 0.00 0.00 178.44 179.99 3fpe h SER 67 N 0.93 0.91 -0.32 1.25 4.64 -0.73 -0.80 113.55 119.43 3fpe h SER 67 Ca 0.24 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.52 3fpe h SER 67 Cb -0.02 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.83 3fpe h SER 67 CO -0.04 0.66 0.11 -0.07 -0.87 0.00 0.00 176.83 176.62 3fpe h LEU 68 N 1.07 0.45 -0.64 5.97 3.38 -1.06 -0.98 115.31 123.49 3fpe h LEU 68 Ca 0.29 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3fpe h LEU 68 Cb -0.12 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3fpe h LEU 68 CO -0.06 0.51 0.26 0.40 0.09 0.00 0.00 178.44 179.64 3fpe h ILE 69 N 0.36 1.24 -0.56 1.22 2.04 -1.08 -1.30 117.51 119.42 3fpe h ILE 69 Ca 0.10 -0.73 -0.07 0.00 1.00 0.00 0.00 64.86 65.16 3fpe h ILE 69 Cb 0.21 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 3fpe h ILE 69 CO -0.01 0.29 0.07 0.03 0.00 0.00 0.00 178.15 178.53 3fpe h ARG 70 N 0.90 0.95 -0.56 2.37 3.08 -1.03 -1.04 114.38 119.05 3fpe h ARG 70 Ca 0.21 -0.27 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 3fpe h ARG 70 Cb 0.20 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 3fpe h ARG 70 CO -0.02 0.92 0.29 -0.22 -1.07 0.00 0.00 179.97 179.87 3fpe h LYS 71 N 0.84 0.79 -0.22 0.04 1.63 -0.97 -1.32 116.57 117.35 3fpe h LYS 71 Ca 0.17 -0.10 0.02 0.00 -0.85 0.00 0.00 60.65 59.89 3fpe h LYS 71 Cb 0.45 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 3fpe h LYS 71 CO 0.02 0.62 0.08 0.35 -3.45 0.00 0.00 179.45 177.07 3fpe h PHE 72 N 0.75 0.15 -0.30 1.91 3.57 -0.99 -2.26 116.94 119.78 3fpe h PHE 72 Ca 0.19 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 3fpe h PHE 72 Cb 0.07 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.77 3fpe h PHE 72 CO -0.01 0.07 0.18 -0.92 -2.23 0.00 0.00 178.31 175.40 3fpe h TYR 73 N 0.19 0.40 -0.34 0.41 3.20 -0.92 -0.41 116.97 119.49 3fpe h TYR 73 Ca 0.10 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.82 3fpe h TYR 73 Cb 0.06 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 3fpe h TYR 73 CO -0.12 0.30 -0.36 -0.24 -1.64 0.00 0.00 178.16 176.10 3fpe h VAL 74 N 0.38 1.28 -0.22 1.81 3.04 -1.18 -1.72 116.25 119.65 3fpe h VAL 74 Ca 0.11 -1.52 -0.17 0.00 -1.01 0.00 0.00 66.70 64.11 3fpe h VAL 74 Cb 0.02 1.41 -0.00 0.00 -2.01 0.00 0.00 31.29 30.70 3fpe h VAL 74 CO -0.02 0.50 -0.54 0.78 -1.01 0.00 0.00 177.57 177.28 3fpe h ASN 75 N 0.64 0.72 -0.37 3.17 4.21 -1.27 -1.78 115.58 120.90 3fpe h ASN 75 Ca 0.06 -0.38 -0.06 0.00 1.21 0.00 0.00 56.30 57.13 3fpe h ASN 75 Cb 0.91 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.89 3fpe h ASN 75 CO 0.08 1.12 -0.01 0.25 -1.29 0.00 0.00 177.43 177.58 3fpe h LEU 76 N 0.50 0.66 -0.27 1.61 5.85 -0.95 -2.10 115.31 120.61 3fpe h LEU 76 Ca 0.01 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3fpe h LEU 76 Cb 1.10 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 3fpe h LEU 76 CO 0.11 0.82 0.18 1.23 -0.34 0.00 0.00 178.44 180.43 3fpe h GLY 77 N 0.48 0.39 0.99 3.75 0.00 -1.26 -0.83 103.07 106.59 3fpe h GLY 77 Ca 0.10 -0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 3fpe h GLY 77 CO 0.02 0.14 0.33 -0.33 0.00 0.00 0.00 176.54 176.70 3fpe h MET 78 N 0.37 0.74 -0.52 4.80 2.86 -1.27 -1.92 114.93 120.00 3fpe h MET 78 Ca 0.10 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.55 3fpe h MET 78 Cb -0.03 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 3fpe h MET 78 CO -0.02 0.54 -0.14 -0.22 1.06 0.00 0.00 176.91 178.13 3fpe h LYS 79 N 0.73 1.00 -0.58 1.72 3.64 -1.13 -0.92 116.57 121.04 3fpe h LYS 79 Ca 0.20 -0.38 -0.01 0.00 -1.27 0.00 0.00 60.65 59.18 3fpe h LYS 79 Cb -0.01 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 3fpe h LYS 79 CO -0.04 1.06 0.33 -0.07 -2.27 0.00 0.00 179.45 178.46 3fpe h LEU 80 N 0.88 0.71 -0.34 5.20 3.38 -0.99 -0.36 115.31 123.79 3fpe h LEU 80 Ca 0.13 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 3fpe h LEU 80 Cb 0.71 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3fpe h LEU 80 CO 0.05 0.58 0.07 -0.33 0.09 0.00 0.00 178.44 178.91 3fpe h GLU 81 N 0.78 0.55 -0.35 1.13 5.08 -1.17 -1.62 114.58 118.98 3fpe h GLU 81 Ca 0.20 -0.14 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 3fpe h GLU 81 Cb 0.02 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 3fpe h GLU 81 CO -0.03 0.61 0.19 0.52 -1.00 0.00 0.00 179.01 179.30 3fpe h MET 82 N 0.39 0.38 -0.62 2.33 2.86 -0.97 -0.00 114.93 119.30 3fpe h MET 82 Ca 0.10 -0.02 -0.09 0.00 -2.06 0.00 0.00 59.70 57.64 3fpe h MET 82 Cb 0.32 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 3fpe h MET 82 CO 0.00 0.25 0.05 0.93 1.06 0.00 0.00 176.91 179.20 3fpe h GLU 83 N 0.39 1.05 -0.36 1.72 5.08 -0.98 -2.34 114.58 119.14 3fpe h GLU 83 Ca 0.14 -0.30 -0.15 0.00 -1.00 0.00 0.00 59.36 58.05 3fpe h GLU 83 Cb 0.03 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3fpe h GLU 83 CO -0.08 1.00 -0.36 -0.22 -1.00 0.00 0.00 179.01 178.36 3fpe h LYS 84 N 0.98 0.89 -0.36 2.33 1.63 -1.06 -1.62 116.57 119.35 3fpe h LYS 84 Ca 0.18 -0.46 0.06 0.00 -0.85 0.00 0.00 60.65 59.58 3fpe h LYS 84 Cb 0.50 0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.09 3fpe h LYS 84 CO 0.02 1.11 0.03 0.00 -3.45 0.00 0.00 179.45 177.16 3fpe h ALA 85 N 0.76 0.35 -0.73 5.00 0.00 -0.75 0.11 119.26 123.99 3fpe h ALA 85 Ca 0.06 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3fpe h ALA 85 Cb 0.95 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 3fpe h ALA 85 CO 0.09 -0.38 0.34 0.37 0.00 0.00 0.00 179.25 179.67 3fpe h GLN 86 N 0.13 1.06 -0.60 0.00 5.75 -1.31 -2.33 115.11 117.81 3fpe h GLN 86 Ca 0.17 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.52 3fpe h GLN 86 Cb 0.23 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 3fpe h GLN 86 CO -0.27 0.84 0.40 1.49 -2.65 0.00 0.00 178.83 178.64 3fpe h GLU 87 N 1.03 0.78 -0.39 1.69 4.81 -0.60 -2.32 114.58 119.57 3fpe h GLU 87 Ca 0.25 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 3fpe h GLU 87 Cb 0.14 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 3fpe h GLU 87 CO -0.03 0.52 0.23 0.28 -0.73 0.00 0.00 179.01 179.28 3fpe h VAL 88 N 0.80 1.13 -0.36 0.32 2.07 -0.55 -1.69 116.25 117.98 3fpe h VAL 88 Ca 0.22 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 3fpe h VAL 88 Cb -0.08 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3fpe h VAL 88 CO -0.05 0.13 0.06 0.40 0.02 0.00 0.00 177.57 178.13 3fpe h ILE 89 N 0.52 1.18 -0.00 4.57 2.04 -1.30 -2.56 117.51 121.95 3fpe h ILE 89 Ca 0.14 -0.67 0.00 0.00 1.00 0.00 0.00 64.86 65.33 3fpe h ILE 89 Cb 0.01 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 3fpe h ILE 89 CO -0.03 0.24 -0.21 -0.62 0.00 0.00 0.00 178.15 177.54 3fpe n GLU 90 N -4.32 0.64 -3.17 2.37 -0.58 -0.89 -4.96 120.64 109.75 3fpe n GLU 90 Ca 0.02 -0.30 -0.38 0.00 -0.42 0.00 0.00 57.16 56.08 3fpe n GLU 90 Cb 0.21 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.52 3fpe n GLU 90 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3fpe s SER 91 N -2.57 7.12 0.39 1.62 0.15 -0.66 -4.98 113.70 114.77 3fpe s SER 91 Ca 0.24 1.38 0.20 0.00 0.70 0.00 0.00 55.95 58.47 3fpe s SER 91 Cb 0.19 -2.40 0.68 0.00 -1.71 0.00 0.00 66.02 62.78 3fpe s SER 91 CO 0.52 0.18 1.73 0.44 1.20 0.00 0.00 173.24 177.31 3fpe h ASP 92 N 4.10 0.00 -2.20 5.45 3.32 -1.91 -3.35 116.42 121.83 3fpe h ASP 92 Ca -0.48 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 55.97 3fpe h ASP 92 Cb 1.20 0.00 -0.42 0.00 0.22 0.00 0.00 39.33 40.34 3fpe h ASP 92 CO 0.65 0.33 -0.61 -1.20 -1.72 0.00 0.00 179.24 176.69 3fpe n SER 93 N -3.44 3.59 -0.31 6.45 7.64 -1.26 -4.98 113.62 121.31 3fpe n SER 93 Ca 0.00 -3.41 -0.02 0.00 1.01 0.00 0.00 58.87 56.46 3fpe n SER 93 Cb 0.51 -0.67 0.15 0.00 -1.01 0.00 0.00 64.21 63.19 3fpe n SER 93 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3fpe h PRO 94 N 4.19 1.19 -0.52 1.43 0.13 -1.83 -1.12 132.00 135.47 3fpe h PRO 94 Ca 0.19 -0.10 -0.09 0.00 -0.87 0.00 0.00 66.00 65.13 3fpe h PRO 94 Cb 0.67 -0.25 -0.02 0.00 0.13 0.00 0.00 31.00 31.53 3fpe h PRO 94 CO 0.82 0.82 -0.04 -1.49 -0.23 0.00 0.00 178.00 177.88 3fpe h TRP 95 N 1.21 1.01 -0.19 1.56 4.06 -1.92 0.24 115.95 121.92 3fpe h TRP 95 Ca 0.32 -0.17 -0.02 0.00 2.06 0.00 0.00 58.89 61.08 3fpe h TRP 95 Cb -0.07 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 27.82 3fpe h TRP 95 CO 0.00 0.93 0.05 1.49 -3.56 0.00 0.00 178.44 177.35 3fpe h GLU 96 N 0.84 0.30 -0.61 0.49 4.81 -1.87 -0.49 114.58 118.05 3fpe h GLU 96 Ca 0.15 -0.07 0.08 0.00 -0.13 0.00 0.00 59.36 59.39 3fpe h GLU 96 Cb 0.56 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.84 3fpe h GLU 96 CO 0.03 0.43 0.28 1.15 -0.73 0.00 0.00 179.01 180.17 3fpe h THR 97 N 0.13 0.85 -0.54 0.32 2.02 -0.99 -2.23 112.91 112.47 3fpe h THR 97 Ca 0.06 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 3fpe h THR 97 Cb 0.26 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 3fpe h THR 97 CO -0.00 0.09 0.28 0.25 0.37 0.00 0.00 175.52 176.51 3fpe h LEU 98 N 0.50 0.69 -2.57 2.58 5.85 -0.28 -2.45 115.31 119.63 3fpe h LEU 98 Ca 0.30 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 3fpe h LEU 98 Cb 0.30 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 3fpe h LEU 98 CO -0.25 0.61 -0.01 0.03 -0.34 0.00 0.00 178.44 178.48 3fpe h ARG 99 N 0.72 0.00 -0.00 1.25 3.08 -0.52 -0.97 114.38 117.94 3fpe h ARG 99 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 3fpe h ARG 99 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 3fpe h ARG 99 CO -0.03 0.01 -0.09 -1.13 -1.07 0.00 0.00 179.97 177.66 3fpe n SER 100 N -3.18 0.29 -4.63 7.04 3.41 -0.91 -4.80 113.62 110.83 3fpe n SER 100 Ca -0.02 -0.34 -0.48 0.00 -0.26 0.00 0.00 58.87 57.77 3fpe n SER 100 Cb 0.13 -0.15 -0.05 0.00 -0.26 0.00 0.00 64.21 63.88 3fpe n SER 100 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3fpe n PHE 101 N -1.13 1.89 -0.35 7.33 7.35 -0.37 -4.85 117.46 127.34 3fpe n PHE 101 Ca 0.13 0.46 0.16 0.00 -0.76 0.00 0.00 57.45 57.44 3fpe n PHE 101 Cb 0.27 -2.43 0.36 0.00 0.35 0.00 0.00 39.48 38.04 3fpe n PHE 101 CO 0.00 0.00 0.00 -0.92 -0.76 0.00 0.00 176.76 175.08 3fpe h TYR 102 N 4.93 1.02 -0.09 -5.13 3.20 -1.90 -0.98 116.97 118.03 3fpe h TYR 102 Ca -0.46 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.45 3fpe h TYR 102 Cb 1.29 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.26 3fpe h TYR 102 CO 0.60 0.14 0.00 1.19 -1.64 0.00 0.00 178.16 178.45 3fpe n PHE 103 N -4.81 0.09 -0.05 -3.82 3.72 -1.26 -4.62 117.46 106.70 3fpe n PHE 103 Ca 0.25 -0.04 -0.08 0.00 -0.05 0.00 0.00 57.45 57.52 3fpe n PHE 103 Cb 0.67 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.19 3fpe n PHE 103 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 3fpe h TYR 104 N 3.33 -0.72 -0.83 1.38 3.20 -1.48 -1.58 116.97 120.27 3fpe h TYR 104 Ca 0.00 0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.01 3fpe h TYR 104 Cb 0.71 0.35 -0.06 0.00 1.54 0.00 0.00 36.73 39.28 3fpe h TYR 104 CO 0.04 -0.34 0.54 -1.35 -1.64 0.00 0.00 178.16 175.41 3fpe h PRO 105 N -0.27 0.77 -0.65 1.82 0.11 -1.82 -1.89 132.00 130.07 3fpe h PRO 105 Ca 0.14 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 66.11 3fpe h PRO 105 Cb 0.49 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 3fpe h PRO 105 CO -0.41 0.51 0.07 0.00 -0.21 0.00 0.00 178.00 177.96 3fpe h ARG 106 N 0.79 1.09 -1.01 1.05 3.08 -1.64 -2.67 114.38 115.08 3fpe h ARG 106 Ca 0.38 -0.31 0.03 0.00 0.07 0.00 0.00 59.98 60.15 3fpe h ARG 106 Cb 0.43 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.30 3fpe h ARG 106 CO -0.15 1.02 0.66 1.88 -1.07 0.00 0.00 179.97 182.31 3fpe h TYR 107 N 1.01 1.25 -0.89 3.04 0.05 -0.87 0.23 116.97 120.79 3fpe h TYR 107 Ca 0.19 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 59.00 3fpe h TYR 107 Cb 0.48 -0.42 -0.04 0.00 1.01 0.00 0.00 36.73 37.76 3fpe h TYR 107 CO 0.03 0.74 0.52 -0.07 -1.05 0.00 0.00 178.16 178.34 3fpe h LEU 108 N 1.31 1.08 -0.13 3.88 3.38 -1.12 0.32 115.31 124.03 3fpe h LEU 108 Ca 0.39 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 58.14 3fpe h LEU 108 Cb -0.06 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.43 3fpe h LEU 108 CO -0.11 0.84 -0.47 -0.33 0.09 0.00 0.00 178.44 178.45 3fpe h GLU 109 N 1.23 0.55 -0.27 1.13 4.39 -1.13 -1.73 114.58 118.74 3fpe h GLU 109 Ca 0.32 -0.42 0.04 0.00 0.34 0.00 0.00 59.36 59.64 3fpe h GLU 109 Cb -0.03 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 3fpe h GLU 109 CO -0.06 1.04 0.03 1.25 -1.16 0.00 0.00 179.01 180.11 3fpe h LEU 110 N 0.18 -0.05 -0.55 1.33 5.85 -0.35 -0.56 115.31 121.16 3fpe h LEU 110 Ca -0.02 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 3fpe h LEU 110 Cb 1.10 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.20 3fpe h LEU 110 CO 0.10 0.01 0.10 -0.07 -0.34 0.00 0.00 178.44 178.24 3fpe h LEU 111 N 0.12 0.86 -0.39 2.25 -0.00 -0.90 -1.21 115.31 116.03 3fpe h LEU 111 Ca 0.13 -0.25 0.07 0.00 -0.00 0.00 0.00 57.88 57.82 3fpe h LEU 111 Cb 0.15 -0.23 -0.06 0.00 -0.00 0.00 0.00 40.66 40.53 3fpe h LEU 111 CO -0.20 0.89 0.03 0.50 -0.00 0.00 0.00 178.44 179.67 3fpe h LYS 112 N 0.79 0.14 -0.43 1.13 3.64 -1.01 0.11 116.57 120.94 3fpe h LYS 112 Ca 0.17 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.62 3fpe h LYS 112 Cb 0.39 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.10 3fpe h LYS 112 CO 0.01 0.09 -0.10 -0.91 -2.27 0.00 0.00 179.45 176.27 3fpe h ASN 113 N 0.14 -0.38 -0.10 4.20 2.35 -0.70 -2.72 115.58 118.37 3fpe h ASN 113 Ca 0.19 0.13 -0.14 0.00 -0.55 0.00 0.00 56.30 55.92 3fpe h ASN 113 Cb 0.25 0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 3fpe h ASN 113 CO -0.29 -0.14 -0.43 -0.33 -1.65 0.00 0.00 177.43 174.60 3fpe h GLU 114 N 0.01 0.64 -0.66 0.81 5.08 -0.53 -2.00 114.58 117.92 3fpe h GLU 114 Ca 0.21 -0.34 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 3fpe h GLU 114 Cb 0.31 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 3fpe h GLU 114 CO -0.43 0.95 0.16 0.00 -1.00 0.00 0.00 179.01 178.68 3fpe h ALA 115 N 1.00 1.03 -0.02 3.43 0.00 -0.68 0.18 119.26 124.21 3fpe h ALA 115 Ca 0.04 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3fpe h ALA 115 Cb 0.96 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 3fpe h ALA 115 CO 0.09 0.63 -0.00 0.00 0.00 0.00 0.00 179.25 179.97 3fpe h ALA 116 N 1.17 0.02 -0.73 0.00 0.00 -1.38 -0.06 119.26 118.28 3fpe h ALA 116 Ca 0.21 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.02 3fpe h ALA 116 Cb 0.35 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 3fpe h ALA 116 CO 0.00 -0.30 0.41 1.25 0.00 0.00 0.00 179.25 180.61 3fpe h LEU 117 N -0.30 0.61 -2.03 0.00 5.85 -1.04 -2.66 115.31 115.74 3fpe h LEU 117 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 3fpe h LEU 117 Cb 0.35 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.29 3fpe h LEU 117 CO 0.00 0.38 0.00 0.61 -0.34 0.00 0.00 178.44 179.09 3fpe n GLY 118 N -1.30 1.28 3.83 3.75 0.00 0.61 -4.99 105.19 108.37 3fpe n GLY 118 Ca 0.10 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 45.14 3fpe n GLY 118 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3fpe n ARG 119 N 1.30 -2.15 -2.13 1.61 3.00 -0.13 -4.89 116.66 113.26 3fpe n ARG 119 Ca 0.17 0.41 -0.41 0.00 -0.00 0.00 0.00 57.85 58.02 3fpe n ARG 119 Cb 0.57 -4.21 -0.03 0.00 0.00 0.00 0.00 32.46 28.80 3fpe n ARG 119 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 3fpe s PHE 120 N -3.69 3.12 0.09 -0.14 0.08 -0.64 -5.04 117.98 111.77 3fpe s PHE 120 Ca 0.26 1.24 0.07 0.00 0.12 0.00 0.00 56.93 58.61 3fpe s PHE 120 Cb -0.10 -3.69 -0.03 0.00 -0.57 0.00 0.00 43.02 38.63 3fpe s PHE 120 CO 0.88 -2.08 -0.17 1.03 -0.10 0.00 0.00 175.22 174.78 3fpe s ARG 121 N -0.79 1.00 0.30 0.44 0.52 -1.26 -5.01 118.95 114.13 3fpe s ARG 121 Ca 0.55 -1.10 -0.29 0.00 -0.52 0.00 0.00 55.73 54.37 3fpe s ARG 121 Cb -0.39 -1.11 -0.13 0.00 0.52 0.00 0.00 34.95 33.84 3fpe s ARG 121 CO 0.45 0.25 1.29 0.54 0.02 0.00 0.00 175.30 177.84 3fpe n ARG 122 N 1.07 1.97 -0.08 3.54 1.74 -1.23 -1.92 116.66 121.75 3fpe n ARG 122 Ca -0.19 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 57.58 3fpe n ARG 122 Cb 0.54 -2.27 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 3fpe n ARG 122 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fpe n GLY 123 N 1.30 2.81 3.75 -0.13 0.00 0.62 -4.96 105.19 108.58 3fpe n GLY 123 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 3fpe n GLY 123 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fpe s GLU 124 N -0.01 2.46 -0.21 1.61 2.02 -0.81 -4.63 118.70 119.13 3fpe s GLU 124 Ca 0.00 1.44 -0.07 0.00 0.02 0.00 0.00 54.97 56.36 3fpe s GLU 124 Cb 0.00 -1.90 -0.04 0.00 0.10 0.00 0.00 34.13 32.29 3fpe s GLU 124 CO 0.00 -1.52 0.06 1.03 0.02 0.00 0.00 175.26 174.85 3fpe s ARG 125 N -4.22 3.83 0.00 1.61 0.52 -1.26 -1.19 118.95 118.24 3fpe s ARG 125 Ca 0.67 -0.41 0.07 0.00 -0.52 0.00 0.00 55.73 55.55 3fpe s ARG 125 Cb -0.22 -3.25 -0.03 0.00 0.52 0.00 0.00 34.95 31.98 3fpe s ARG 125 CO 0.46 0.08 -0.21 0.00 0.02 0.00 0.00 175.30 175.65 3fpe s ALA 126 N 0.89 2.43 -0.08 2.13 0.00 0.73 -1.11 121.76 126.75 3fpe s ALA 126 Ca 0.04 -1.13 0.05 0.00 0.00 0.00 0.00 51.96 50.91 3fpe s ALA 126 Cb -0.14 -0.69 -0.00 0.00 0.00 0.00 0.00 23.12 22.28 3fpe s ALA 126 CO 0.03 0.55 -0.24 0.08 0.00 0.00 0.00 175.76 176.18 3fpe s VAL 127 N -0.77 2.00 -0.16 0.00 1.01 -0.61 -1.55 120.40 120.32 3fpe s VAL 127 Ca 0.12 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.10 3fpe s VAL 127 Cb -0.10 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.57 3fpe s VAL 127 CO 0.02 0.55 -0.17 0.12 0.00 0.00 0.00 175.10 175.62 3fpe s PHE 128 N 0.15 2.77 -0.29 5.22 5.36 -0.42 -0.68 117.98 130.10 3fpe s PHE 128 Ca -0.13 -1.25 -0.13 0.00 -0.96 0.00 0.00 56.93 54.46 3fpe s PHE 128 Cb -0.16 -1.90 -0.04 0.00 -0.34 0.00 0.00 43.02 40.58 3fpe s PHE 128 CO 0.07 -0.60 0.27 0.42 -1.46 0.00 0.00 175.22 173.91 3fpe s ILE 129 N 1.01 5.25 0.00 3.12 1.01 0.31 -0.38 121.20 131.51 3fpe s ILE 129 Ca -0.02 0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.86 3fpe s ILE 129 Cb -0.15 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.69 3fpe s ILE 129 CO -0.04 0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.67 3fpe n GLY 130 N 4.94 0.62 0.26 6.18 0.00 -0.46 -1.27 105.19 115.47 3fpe n GLY 130 Ca -0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 46.02 45.69 3fpe n GLY 130 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3fpe h GLY 131 N 0.00 1.00 -1.03 -0.02 0.00 -1.56 -3.45 103.07 98.00 3fpe h GLY 131 Ca 0.00 -0.28 0.13 0.00 0.00 0.00 0.00 47.33 47.18 3fpe h GLY 131 CO 0.00 0.18 -0.17 0.61 0.00 0.00 0.00 176.54 177.16 3fpe n GLY 132 N -1.29 -2.00 0.23 4.60 0.00 -1.26 -4.04 105.19 101.43 3fpe n GLY 132 Ca 0.08 -1.35 0.10 0.00 0.00 0.00 0.00 46.02 44.86 3fpe n GLY 132 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fpe h PRO 133 N 0.00 0.00 -3.20 1.61 0.13 -1.90 -3.38 132.00 125.25 3fpe h PRO 133 Ca 0.01 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.51 3fpe h PRO 133 Cb 0.42 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.15 3fpe h PRO 133 CO 0.00 0.21 -0.66 -1.17 -0.23 0.00 0.00 178.00 176.16 3fpe s LEU 134 N -7.06 3.89 -1.59 1.56 2.96 -1.26 -3.83 118.68 113.36 3fpe s LEU 134 Ca -0.01 -3.05 -0.10 0.00 -0.22 0.00 0.00 54.13 50.75 3fpe s LEU 134 Cb 0.12 -1.45 -0.06 0.00 0.50 0.00 0.00 46.19 45.29 3fpe s LEU 134 CO 0.63 -0.22 2.86 -0.81 -1.32 0.00 0.00 176.35 177.49 3fpe n PRO 135 N 3.03 3.69 -0.28 0.98 -0.04 -1.26 -4.68 135.00 136.44 3fpe n PRO 135 Ca 0.09 -2.32 -0.04 0.00 -0.04 0.00 0.00 63.50 61.18 3fpe n PRO 135 Cb 0.34 -2.83 0.07 0.00 -0.04 0.00 0.00 33.50 31.03 3fpe n PRO 135 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3fpe h LEU 136 N 7.17 0.90 0.03 1.53 6.46 -1.96 -0.91 115.31 128.53 3fpe h LEU 136 Ca 0.84 -0.04 -0.00 0.00 -0.12 0.00 0.00 57.88 58.56 3fpe h LEU 136 Cb 0.31 -0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.02 3fpe h LEU 136 CO 1.78 0.67 -0.01 0.74 -0.62 0.00 0.00 178.44 180.99 3fpe h THR 137 N 1.05 1.01 -0.39 1.05 2.02 -1.94 -0.50 112.91 115.21 3fpe h THR 137 Ca 0.28 -0.11 0.08 0.00 0.77 0.00 0.00 66.41 67.43 3fpe h THR 137 Cb -0.09 1.08 -0.08 0.00 -1.74 0.00 0.00 68.15 67.32 3fpe h THR 137 CO -0.06 0.03 -0.11 1.23 0.37 0.00 0.00 175.52 176.98 3fpe h GLY 138 N -0.09 0.27 0.35 2.16 0.00 -1.87 0.67 103.07 104.56 3fpe h GLY 138 Ca -0.00 0.14 0.07 0.00 0.00 0.00 0.00 47.33 47.54 3fpe h GLY 138 CO 0.01 -0.16 -0.01 -2.22 0.00 0.00 0.00 176.54 174.17 3fpe h ILE 139 N -0.01 0.69 -0.13 2.60 2.04 -0.87 -2.47 117.51 119.37 3fpe h ILE 139 Ca 0.19 -0.03 -0.13 0.00 1.00 0.00 0.00 64.86 65.89 3fpe h ILE 139 Cb 0.30 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 3fpe h ILE 139 CO -0.41 0.02 -0.49 -0.07 0.00 0.00 0.00 178.15 177.20 3fpe h LEU 140 N 0.10 0.35 -0.77 1.44 3.38 -0.44 0.23 115.31 119.60 3fpe h LEU 140 Ca 0.20 -0.17 0.06 0.00 0.09 0.00 0.00 57.88 58.06 3fpe h LEU 140 Cb 0.28 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 3fpe h LEU 140 CO -0.33 0.79 0.46 -0.07 0.09 0.00 0.00 178.44 179.37 3fpe h LEU 141 N 0.26 0.71 0.02 1.67 3.38 -0.43 0.23 115.31 121.13 3fpe h LEU 141 Ca 0.01 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3fpe h LEU 141 Cb 0.96 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.59 3fpe h LEU 141 CO 0.08 0.45 -0.01 -1.28 0.09 0.00 0.00 178.44 177.77 3fpe h SER 142 N 0.84 -0.02 -0.53 -0.43 0.87 -1.24 -1.56 113.55 111.48 3fpe h SER 142 Ca 0.34 -0.73 -0.04 0.00 -1.23 0.00 0.00 61.79 60.13 3fpe h SER 142 Cb 0.19 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 3fpe h SER 142 CO -0.18 0.81 0.17 -0.74 -0.53 0.00 0.00 176.83 176.36 3fpe h HIS 143 N -0.94 0.85 0.04 2.24 -0.00 -0.37 -1.83 115.15 115.14 3fpe h HIS 143 Ca -0.00 -0.08 -0.35 0.00 -0.00 0.00 0.00 60.37 59.94 3fpe h HIS 143 Cb 0.75 -0.25 -0.04 0.00 -0.00 0.00 0.00 27.41 27.87 3fpe h HIS 143 CO 0.20 0.72 -1.97 0.28 -0.00 0.00 0.00 177.93 177.17 3fpe n VAL 144 N -4.48 1.61 0.87 5.26 0.31 0.78 -4.64 118.33 118.04 3fpe n VAL 144 Ca 0.02 -0.41 0.10 0.00 -0.01 0.00 0.00 64.34 64.05 3fpe n VAL 144 Cb 0.19 -1.80 0.05 0.00 -0.91 0.00 0.00 33.84 31.38 3fpe n VAL 144 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3fpe n TYR 145 N -3.86 0.00 -2.27 3.52 4.01 -0.99 -4.97 117.16 112.60 3fpe n TYR 145 Ca -0.39 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.17 3fpe n TYR 145 Cb 0.90 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.91 3fpe n TYR 145 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fpe n GLY 146 N 1.22 -0.17 3.90 2.72 0.00 -0.69 -3.48 105.19 108.69 3fpe n GLY 146 Ca 0.10 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 3fpe n GLY 146 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3fpe s MET 147 N -4.79 3.65 -0.16 1.61 -1.94 -0.64 -0.28 119.30 116.75 3fpe s MET 147 Ca 0.00 0.22 -0.15 0.00 -1.71 0.00 0.00 55.69 54.05 3fpe s MET 147 Cb 0.00 -2.46 -0.04 0.00 2.01 0.00 0.00 34.83 34.33 3fpe s MET 147 CO 0.00 -0.02 0.33 1.03 -0.01 0.00 0.00 175.02 176.35 3fpe s ARG 148 N -4.10 4.26 -0.04 2.03 0.52 -0.33 -4.02 118.95 117.25 3fpe s ARG 148 Ca 0.47 0.16 0.02 0.00 -0.52 0.00 0.00 55.73 55.87 3fpe s ARG 148 Cb -0.10 -3.45 0.01 0.00 0.52 0.00 0.00 34.95 31.93 3fpe s ARG 148 CO 0.36 0.18 -0.11 0.08 0.02 0.00 0.00 175.30 175.83 3fpe s VAL 149 N 0.64 0.97 -0.19 3.52 1.01 0.14 -0.19 120.40 126.29 3fpe s VAL 149 Ca 0.18 -0.42 -0.02 0.00 0.00 0.00 0.00 61.98 61.72 3fpe s VAL 149 Cb -0.14 -0.88 -0.00 0.00 0.00 0.00 0.00 36.38 35.36 3fpe s VAL 149 CO 0.05 0.31 -0.09 0.20 0.00 0.00 0.00 175.10 175.57 3fpe s ASN 150 N 0.43 4.03 -0.15 3.32 0.01 -0.59 -1.82 114.94 120.17 3fpe s ASN 150 Ca -0.08 -0.42 -0.09 0.00 -0.71 0.00 0.00 52.86 51.55 3fpe s ASN 150 Cb -0.12 -1.66 -0.05 0.00 0.41 0.00 0.00 41.25 39.83 3fpe s ASN 150 CO 0.02 0.02 0.17 -0.69 -1.51 0.00 0.00 177.10 175.11 3fpe s VAL 151 N 1.20 5.42 -0.13 1.60 1.01 0.62 -1.29 120.40 128.82 3fpe s VAL 151 Ca 0.02 0.28 -0.02 0.00 0.00 0.00 0.00 61.98 62.26 3fpe s VAL 151 Cb -0.14 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 3fpe s VAL 151 CO -0.03 0.53 -0.05 -0.69 0.00 0.00 0.00 175.10 174.85 3fpe s VAL 152 N -0.35 3.80 -0.03 2.92 1.01 0.48 0.03 120.40 128.27 3fpe s VAL 152 Ca 0.13 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.70 3fpe s VAL 152 Cb -0.12 -2.63 0.03 0.00 0.00 0.00 0.00 36.38 33.66 3fpe s VAL 152 CO 0.02 0.53 0.05 -0.70 0.00 0.00 0.00 175.10 175.00 3fpe s GLU 153 N 0.04 -0.05 0.24 2.72 2.56 -0.64 -1.35 118.70 122.22 3fpe s GLU 153 Ca -0.00 0.28 0.12 0.00 0.00 0.00 0.00 54.97 55.37 3fpe s GLU 153 Cb -0.13 -0.34 0.12 0.00 2.00 0.00 0.00 34.13 35.77 3fpe s GLU 153 CO 0.03 -0.23 1.46 0.97 -0.56 0.00 0.00 175.26 176.93 3fpe h ILE 154 N 6.34 1.24 -3.59 -3.70 2.10 -1.84 -1.43 117.51 116.64 3fpe h ILE 154 Ca -0.33 -2.50 -0.65 0.00 1.08 0.00 0.00 64.86 62.46 3fpe h ILE 154 Cb 1.12 2.45 -0.15 0.00 -1.09 0.00 0.00 36.82 39.15 3fpe h ILE 154 CO 0.35 0.65 0.01 -1.61 -1.08 0.00 0.00 178.15 176.47 3fpe s GLU 155 N -3.07 3.56 0.26 2.19 0.41 -1.26 -4.45 118.70 116.34 3fpe s GLU 155 Ca 0.02 -0.17 -0.01 0.00 -0.41 0.00 0.00 54.97 54.39 3fpe s GLU 155 Cb 0.10 -3.84 0.55 0.00 -1.78 0.00 0.00 34.13 29.17 3fpe s GLU 155 CO 0.76 -0.73 1.72 -1.35 -0.49 0.00 0.00 175.26 175.17 3fpe h PRO 156 N 8.53 0.41 -0.17 0.39 0.11 -1.99 0.15 132.00 139.43 3fpe h PRO 156 Ca -0.27 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.65 3fpe h PRO 156 Cb 1.12 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 3fpe h PRO 156 CO 0.81 0.27 -0.60 -0.44 -0.21 0.00 0.00 178.00 177.83 3fpe h ASP 157 N 0.42 0.62 -0.29 -2.05 3.32 -1.98 -1.31 116.42 115.16 3fpe h ASP 157 Ca 0.47 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 3fpe h ASP 157 Cb 0.78 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 3fpe h ASP 157 CO -0.46 1.08 -0.02 0.40 -1.72 0.00 0.00 179.24 178.52 3fpe h ILE 158 N 0.41 1.27 -0.46 0.35 1.08 -1.79 -2.22 117.51 116.15 3fpe h ILE 158 Ca -0.00 -0.98 0.08 0.00 -0.39 0.00 0.00 64.86 63.57 3fpe h ILE 158 Cb 1.15 1.34 -0.07 0.00 -3.07 0.00 0.00 36.82 36.17 3fpe h ILE 158 CO 0.11 0.31 0.05 0.00 -0.69 0.00 0.00 178.15 177.93 3fpe h ALA 159 N 0.81 0.47 -0.79 1.87 0.00 -0.52 -0.83 119.26 120.27 3fpe h ALA 159 Ca 0.08 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.12 3fpe h ALA 159 Cb 0.47 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 3fpe h ALA 159 CO 0.02 -0.35 0.52 0.93 0.00 0.00 0.00 179.25 180.37 3fpe h GLU 160 N 0.17 1.02 -0.23 0.00 5.08 -1.13 -1.33 114.58 118.16 3fpe h GLU 160 Ca 0.23 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3fpe h GLU 160 Cb 0.32 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3fpe h GLU 160 CO -0.34 0.68 0.14 1.25 -1.00 0.00 0.00 179.01 179.74 3fpe h LEU 161 N 1.05 0.27 -1.24 1.33 6.46 -1.05 -2.69 115.31 119.45 3fpe h LEU 161 Ca 0.29 -0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.99 3fpe h LEU 161 Cb -0.10 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 39.74 3fpe h LEU 161 CO -0.07 0.23 0.17 0.77 -0.62 0.00 0.00 178.44 178.91 3fpe h SER 162 N 0.29 0.63 -0.68 1.25 4.64 -0.69 -1.58 113.55 117.41 3fpe h SER 162 Ca 0.08 -0.08 -0.07 0.00 -0.47 0.00 0.00 61.79 61.26 3fpe h SER 162 Cb -0.00 -0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 61.90 3fpe h SER 162 CO -0.02 0.59 0.17 0.03 -0.87 0.00 0.00 176.83 176.74 3fpe h ARG 163 N 0.68 1.10 -0.15 4.77 3.08 -1.11 -1.96 114.38 120.80 3fpe h ARG 163 Ca 0.16 -0.26 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 3fpe h ARG 163 Cb 0.18 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 3fpe h ARG 163 CO -0.01 0.97 -0.16 0.87 -1.07 0.00 0.00 179.97 180.57 3fpe h LYS 164 N 1.05 0.24 -0.01 0.04 1.57 -0.99 -0.92 116.57 117.54 3fpe h LYS 164 Ca 0.22 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3fpe h LYS 164 Cb 0.36 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 3fpe h LYS 164 CO 0.00 0.40 -0.00 0.28 -0.57 0.00 0.00 179.45 179.56 3fpe h VAL 165 N 0.22 1.32 -0.67 0.50 2.07 -0.92 -1.03 116.25 117.74 3fpe h VAL 165 Ca 0.04 -0.96 0.09 0.00 0.82 0.00 0.00 66.70 66.69 3fpe h VAL 165 Cb 0.42 1.96 -0.07 0.00 -1.52 0.00 0.00 31.29 32.08 3fpe h VAL 165 CO 0.03 0.25 0.32 0.40 0.02 0.00 0.00 177.57 178.59 3fpe h ILE 166 N -0.39 0.84 -0.19 4.57 2.04 -1.16 -2.10 117.51 121.12 3fpe h ILE 166 Ca 0.00 -0.19 -0.13 0.00 1.00 0.00 0.00 64.86 65.54 3fpe h ILE 166 Cb 0.41 0.24 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 3fpe h ILE 166 CO 0.00 0.10 -0.40 -0.33 0.00 0.00 0.00 178.15 177.52 3fpe h GLU 167 N 0.55 0.61 -1.00 2.37 5.08 -1.14 -2.56 114.58 118.49 3fpe h GLU 167 Ca 0.33 -0.40 0.16 0.00 -1.00 0.00 0.00 59.36 58.45 3fpe h GLU 167 Cb 0.35 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 29.56 3fpe h GLU 167 CO -0.27 1.01 0.61 0.78 -1.00 0.00 0.00 179.01 180.15 3fpe h GLY 168 N 0.28 1.71 2.00 -3.84 0.00 -0.93 -0.74 103.07 101.54 3fpe h GLY 168 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 46.95 3fpe h GLY 168 CO 0.09 0.04 0.00 1.41 0.00 0.00 0.00 176.54 178.08 3fpe h LEU 169 N 0.87 0.00 1.28 3.11 3.38 -1.22 -3.45 115.31 119.27 3fpe h LEU 169 Ca 0.54 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.28 3fpe h LEU 169 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3fpe h LEU 169 CO -0.33 0.00 -0.31 0.61 0.09 0.00 0.00 178.44 178.51 3fpe n GLY 170 N 1.08 -0.07 3.73 0.83 0.00 -0.29 -4.94 105.19 105.54 3fpe n GLY 170 Ca 0.04 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 3fpe n GLY 170 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fpe s VAL 171 N -2.66 4.65 0.16 1.61 1.01 -1.08 -5.06 120.40 119.03 3fpe s VAL 171 Ca 0.05 1.90 0.01 0.00 0.00 0.00 0.00 61.98 63.93 3fpe s VAL 171 Cb -0.02 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 3fpe s VAL 171 CO 0.06 0.31 0.32 -0.62 0.00 0.00 0.00 175.10 175.17 3fpe s ASP 172 N 0.14 6.36 -0.55 3.32 -1.08 -1.26 -4.60 116.67 119.01 3fpe s ASP 172 Ca 0.44 0.28 0.00 0.00 -0.52 0.00 0.00 52.55 52.75 3fpe s ASP 172 Cb -0.22 -1.96 0.00 0.00 -1.46 0.00 0.00 42.92 39.28 3fpe s ASP 172 CO 0.27 0.02 0.00 0.61 0.52 0.00 0.00 175.17 176.59 3fpe n GLY 173 N -0.52 0.66 2.92 2.66 0.00 -1.26 -4.80 105.19 104.85 3fpe n GLY 173 Ca -0.06 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 3fpe n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fpe s VAL 174 N -2.22 1.25 0.07 1.61 1.01 -1.26 -0.69 120.40 120.17 3fpe s VAL 174 Ca 0.00 -0.74 0.09 0.00 0.00 0.00 0.00 61.98 61.33 3fpe s VAL 174 Cb 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 3fpe s VAL 174 CO 0.00 0.12 -0.23 0.21 0.00 0.00 0.00 175.10 175.20 3fpe s ASN 175 N 1.57 3.45 -0.18 3.32 3.84 -0.76 -5.02 114.94 121.16 3fpe s ASN 175 Ca -0.00 -0.57 -0.04 0.00 0.21 0.00 0.00 52.86 52.45 3fpe s ASN 175 Cb -0.16 -0.39 -0.03 0.00 -0.55 0.00 0.00 41.25 40.13 3fpe s ASN 175 CO -0.08 0.23 -0.02 -0.69 -2.79 0.00 0.00 177.10 173.76 3fpe s VAL 176 N -0.92 3.91 -0.25 -5.21 1.01 -1.26 -0.28 120.40 117.40 3fpe s VAL 176 Ca 0.14 -0.34 -0.09 0.00 0.00 0.00 0.00 61.98 61.69 3fpe s VAL 176 Cb -0.10 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.50 3fpe s VAL 176 CO 0.05 0.46 0.11 -0.63 0.00 0.00 0.00 175.10 175.09 3fpe s ILE 177 N 0.68 4.71 -0.20 2.22 1.01 0.10 -4.94 121.20 124.79 3fpe s ILE 177 Ca -0.01 -0.04 -0.29 0.00 0.00 0.00 0.00 60.65 60.31 3fpe s ILE 177 Cb -0.14 -3.21 -0.00 0.00 0.01 0.00 0.00 42.46 39.11 3fpe s ILE 177 CO 0.02 0.32 1.18 -0.89 0.00 0.00 0.00 174.94 175.57 3fpe s THR 178 N 1.54 4.43 -3.96 2.92 2.01 -1.26 -1.62 115.64 119.69 3fpe s THR 178 Ca 0.06 1.72 0.00 0.00 0.31 0.00 0.00 61.69 63.78 3fpe s THR 178 Cb -0.15 -4.12 0.00 0.00 0.01 0.00 0.00 72.50 68.24 3fpe s THR 178 CO 0.06 -0.17 0.00 0.61 -0.69 0.00 0.00 174.62 174.43 3fpe n GLY 179 N 3.53 -2.40 3.36 4.40 0.00 -0.54 -4.94 105.19 108.60 3fpe n GLY 179 Ca 0.13 -1.25 -0.22 0.00 0.00 0.00 0.00 46.02 44.69 3fpe n GLY 179 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fpe n ASP 180 N 2.38 0.82 0.26 1.61 5.68 -1.26 -2.99 116.55 123.04 3fpe n ASP 180 Ca 0.00 -1.80 0.17 0.00 -0.50 0.00 0.00 54.79 52.66 3fpe n ASP 180 Cb 0.00 -0.67 0.88 0.00 -1.14 0.00 0.00 41.12 40.19 3fpe n ASP 180 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3fpe h GLU 181 N 0.00 0.00 0.00 0.11 9.09 -1.98 -2.30 114.58 119.50 3fpe h GLU 181 Ca -0.31 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.10 3fpe h GLU 181 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.15 3fpe h GLU 181 CO 0.29 0.00 0.00 1.15 0.05 0.00 0.00 179.01 180.50 3fpe h THR 182 N 0.00 0.00 0.00 -1.06 2.02 -1.94 -2.58 112.91 109.35 3fpe h THR 182 Ca 0.00 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 66.89 3fpe h THR 182 Cb 0.13 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.62 3fpe h THR 182 CO 0.00 0.00 0.00 -0.37 0.37 0.00 0.00 175.52 175.52 3fpe h VAL 183 N 0.00 0.00 0.00 3.16 -1.51 -1.79 -2.09 116.25 114.02 3fpe h VAL 183 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 3fpe h VAL 183 Cb 0.44 0.90 0.00 0.00 -2.13 0.00 0.00 31.29 30.49 3fpe h VAL 183 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 177.57 178.64 3fpe n ILE 184 N -2.78 0.99 -0.33 7.19 -5.35 -0.97 -2.84 119.36 115.27 3fpe n ILE 184 Ca -0.02 0.39 0.06 0.00 -0.27 0.00 0.00 62.75 62.91 3fpe n ILE 184 Cb 0.09 -1.32 0.21 0.00 -1.74 0.00 0.00 39.64 36.88 3fpe n ILE 184 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 3fpe h ASP 185 N 0.00 0.77 -0.53 7.28 3.58 -1.63 -2.14 116.42 123.75 3fpe h ASP 185 Ca 0.00 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.51 3fpe h ASP 185 Cb 0.23 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.18 3fpe h ASP 185 CO 0.00 0.41 0.00 0.61 -2.88 0.00 0.00 179.24 177.38 3fpe n GLY 186 N -1.33 2.13 3.76 -0.78 0.00 -1.13 -4.92 105.19 102.92 3fpe n GLY 186 Ca 0.17 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.27 3fpe n GLY 186 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fpe s LEU 187 N -1.50 3.64 -0.13 0.99 1.43 -0.81 -5.12 118.68 117.18 3fpe s LEU 187 Ca 0.41 -0.27 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 3fpe s LEU 187 Cb 0.26 -2.23 0.01 0.00 0.03 0.00 0.00 46.19 44.26 3fpe s LEU 187 CO 0.20 0.04 -0.18 -1.61 0.23 0.00 0.00 176.35 175.03 3fpe s GLU 188 N -3.31 2.60 0.08 1.70 2.02 -1.26 -5.02 118.70 115.51 3fpe s GLU 188 Ca 0.31 -0.70 -0.19 0.00 0.02 0.00 0.00 54.97 54.41 3fpe s GLU 188 Cb -0.09 -2.16 0.04 0.00 0.10 0.00 0.00 34.13 32.02 3fpe s GLU 188 CO 0.22 -0.06 0.46 -0.59 0.02 0.00 0.00 175.26 175.32 3fpe s PHE 189 N 0.95 -0.33 -0.22 1.61 -0.71 -1.26 -4.94 117.98 113.08 3fpe s PHE 189 Ca -0.06 0.21 0.08 0.00 -1.04 0.00 0.00 56.93 56.12 3fpe s PHE 189 Cb -0.15 0.31 -0.21 0.00 -1.21 0.00 0.00 43.02 41.76 3fpe s PHE 189 CO -0.03 -0.67 -0.03 -0.25 -1.34 0.00 0.00 175.22 172.91 3fpe n ASP 190 N 0.14 1.18 -4.03 1.98 8.00 -0.27 -4.95 116.55 118.60 3fpe n ASP 190 Ca -0.17 -0.03 -0.23 0.00 0.71 0.00 0.00 54.79 55.06 3fpe n ASP 190 Cb 0.62 0.11 -0.16 0.00 -0.02 0.00 0.00 41.12 41.67 3fpe n ASP 190 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3fpe s VAL 191 N -2.52 0.99 -0.11 2.53 -7.23 -0.83 -2.58 120.40 110.65 3fpe s VAL 191 Ca -0.23 -0.45 0.03 0.00 -1.81 0.00 0.00 61.98 59.52 3fpe s VAL 191 Cb 0.08 -0.89 -0.00 0.00 0.56 0.00 0.00 36.38 36.13 3fpe s VAL 191 CO 0.71 0.31 -0.21 -0.22 -0.31 0.00 0.00 175.10 175.38 3fpe s LEU 192 N 0.34 2.25 0.03 1.32 2.96 -0.08 -1.57 118.68 123.93 3fpe s LEU 192 Ca -0.07 -0.51 0.08 0.00 -0.22 0.00 0.00 54.13 53.41 3fpe s LEU 192 Cb -0.12 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.08 3fpe s LEU 192 CO 0.02 0.15 -0.22 -0.04 -1.32 0.00 0.00 176.35 174.93 3fpe s MET 193 N 0.43 1.99 -0.16 1.98 -1.94 0.14 -0.73 119.30 121.00 3fpe s MET 193 Ca -0.15 -1.02 0.01 0.00 -1.71 0.00 0.00 55.69 52.83 3fpe s MET 193 Cb -0.17 -2.10 0.01 0.00 2.01 0.00 0.00 34.83 34.58 3fpe s MET 193 CO 0.06 0.54 -0.19 0.08 -0.01 0.00 0.00 175.02 175.50 3fpe s VAL 194 N -0.84 2.24 0.67 -6.03 1.01 -0.22 -0.53 120.40 116.70 3fpe s VAL 194 Ca 0.13 -0.90 -0.17 0.00 0.00 0.00 0.00 61.98 61.04 3fpe s VAL 194 Cb -0.10 -1.93 -0.00 0.00 0.00 0.00 0.00 36.38 34.34 3fpe s VAL 194 CO 0.03 0.53 1.24 0.00 0.00 0.00 0.00 175.10 176.90 3fpe n ALA 195 N 4.34 0.86 -0.25 5.51 0.00 -0.40 -2.55 120.51 128.03 3fpe n ALA 195 Ca -0.20 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.27 3fpe n ALA 195 Cb 0.51 -2.29 0.34 0.00 0.00 0.00 0.00 19.45 18.01 3fpe n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fpe h ALA 196 N 0.31 1.72 -0.01 0.00 0.00 -1.91 -2.65 119.26 116.71 3fpe h ALA 196 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3fpe h ALA 196 Cb 1.34 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3fpe h ALA 196 CO 0.52 0.11 -0.00 1.28 0.00 0.00 0.00 179.25 181.15 3fpe n LEU 197 N -4.52 1.26 -4.67 0.00 4.32 -1.26 -4.89 117.00 107.24 3fpe n LEU 197 Ca 0.14 -0.42 -0.42 0.00 -0.02 0.00 0.00 56.01 55.29 3fpe n LEU 197 Cb 0.33 -0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.09 3fpe n LEU 197 CO 0.32 0.21 1.38 0.00 -1.22 0.00 0.00 177.39 178.08 3fpe s ALA 198 N -2.01 3.63 0.04 -1.18 0.00 -1.00 -4.99 121.76 116.25 3fpe s ALA 198 Ca 0.39 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.42 3fpe s ALA 198 Cb 0.21 -3.74 -0.03 0.00 0.00 0.00 0.00 23.12 19.56 3fpe s ALA 198 CO 0.34 -1.32 -0.04 -1.21 0.00 0.00 0.00 175.76 173.53 3fpe s GLU 199 N 3.65 0.50 0.06 0.00 0.41 -1.26 -4.27 118.70 117.79 3fpe s GLU 199 Ca 0.75 -0.92 -0.25 0.00 -0.41 0.00 0.00 54.97 54.14 3fpe s GLU 199 Cb -0.36 0.06 -0.06 0.00 -1.78 0.00 0.00 34.13 31.99 3fpe s GLU 199 CO 0.32 -0.05 0.78 -1.25 -0.49 0.00 0.00 175.26 174.56 3fpe s PRO 200 N -2.58 4.51 0.22 0.39 0.04 -1.26 -4.96 135.00 131.36 3fpe s PRO 200 Ca -0.04 1.10 -0.08 0.00 0.04 0.00 0.00 61.00 62.01 3fpe s PRO 200 Cb -0.02 -3.36 0.35 0.00 0.04 0.00 0.00 34.50 31.52 3fpe s PRO 200 CO -0.04 0.30 1.71 0.87 0.04 0.00 0.00 177.00 179.88 3fpe h LYS 201 N 5.55 0.29 0.14 4.56 1.79 -1.99 -1.82 116.57 125.09 3fpe h LYS 201 Ca -0.44 -0.02 0.01 0.00 -2.18 0.00 0.00 60.65 58.02 3fpe h LYS 201 Cb 1.21 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 31.77 3fpe h LYS 201 CO 0.70 0.19 -0.17 -0.09 -1.08 0.00 0.00 179.45 179.01 3fpe h ARG 202 N 0.30 -0.34 -0.51 3.15 2.43 -1.96 -0.58 114.38 116.86 3fpe h ARG 202 Ca 0.35 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.54 3fpe h ARG 202 Cb 0.54 0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.14 3fpe h ARG 202 CO -0.42 -0.23 0.32 -0.09 -1.51 0.00 0.00 179.97 178.04 3fpe h ARG 203 N -0.35 0.69 0.04 0.20 2.43 -1.86 -1.55 114.38 113.97 3fpe h ARG 203 Ca 0.01 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3fpe h ARG 203 Cb 0.35 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 3fpe h ARG 203 CO -0.06 0.49 -0.02 0.28 -1.51 0.00 0.00 179.97 179.15 3fpe h VAL 204 N 0.69 0.98 -0.33 0.20 2.07 -1.07 -1.45 116.25 117.34 3fpe h VAL 204 Ca 0.18 -0.06 -0.11 0.00 0.82 0.00 0.00 66.70 67.53 3fpe h VAL 204 Cb -0.03 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 3fpe h VAL 204 CO -0.04 0.02 -0.24 -0.26 0.02 0.00 0.00 177.57 177.07 3fpe h PHE 205 N -0.08 0.73 -0.66 1.57 0.04 -1.03 -0.29 116.94 117.21 3fpe h PHE 205 Ca -0.01 -0.16 -0.02 0.00 2.80 0.00 0.00 57.97 60.58 3fpe h PHE 205 Cb 0.07 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.01 3fpe h PHE 205 CO -0.07 0.83 0.32 0.00 -0.60 0.00 0.00 178.31 178.79 3fpe h ARG 206 N 0.56 0.94 -0.14 1.51 3.08 -1.17 -0.45 114.38 118.71 3fpe h ARG 206 Ca 0.08 -0.12 -0.08 0.00 0.07 0.00 0.00 59.98 59.93 3fpe h ARG 206 Cb 0.72 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.59 3fpe h ARG 206 CO 0.06 0.73 -0.21 -0.91 -1.07 0.00 0.00 179.97 178.56 3fpe h ASN 207 N 0.94 0.43 -0.56 7.04 -0.26 -0.90 -3.16 115.58 119.11 3fpe h ASN 207 Ca 0.23 -0.52 0.10 0.00 -0.56 0.00 0.00 56.30 55.55 3fpe h ASN 207 Cb 0.10 -0.12 -0.08 0.00 -1.06 0.00 0.00 38.32 37.15 3fpe h ASN 207 CO -0.03 0.87 0.09 0.40 -1.06 0.00 0.00 177.43 177.70 3fpe h ILE 208 N 0.00 0.65 -0.91 2.81 2.04 -0.83 -1.71 117.51 119.55 3fpe h ILE 208 Ca 0.01 -0.08 0.16 0.00 1.00 0.00 0.00 64.86 65.96 3fpe h ILE 208 Cb 0.77 0.40 -0.07 0.00 -0.74 0.00 0.00 36.82 37.18 3fpe h ILE 208 CO 0.05 0.04 0.59 -0.74 0.00 0.00 0.00 178.15 178.09 3fpe h HIS 209 N 0.22 0.80 0.00 1.37 2.76 -1.07 -0.62 115.15 118.62 3fpe h HIS 209 Ca 0.29 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.44 3fpe h HIS 209 Cb 0.42 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 3fpe h HIS 209 CO -0.26 0.26 -0.20 0.00 -1.30 0.00 0.00 177.93 176.44 3fpe h ARG 210 N 0.65 0.00 -0.01 5.26 3.08 -1.28 -3.33 114.38 118.75 3fpe h ARG 210 Ca 0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.52 3fpe h ARG 210 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.88 3fpe h ARG 210 CO -0.22 0.20 0.00 0.66 -1.07 0.00 0.00 179.97 179.53 3fpe n TYR 211 N -3.53 0.01 -3.96 3.04 4.01 -0.28 -5.02 117.16 111.44 3fpe n TYR 211 Ca -0.01 -0.02 -0.22 0.00 -0.16 0.00 0.00 57.90 57.49 3fpe n TYR 211 Cb 0.35 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.33 3fpe n TYR 211 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 3fpe s VAL 212 N -0.44 3.02 0.30 -0.72 -7.23 -0.98 -4.89 120.40 109.46 3fpe s VAL 212 Ca 0.06 -1.57 0.03 0.00 -1.81 0.00 0.00 61.98 58.70 3fpe s VAL 212 Cb 0.04 -3.03 0.03 0.00 0.56 0.00 0.00 36.38 33.98 3fpe s VAL 212 CO 0.06 -0.14 0.26 -0.90 -0.31 0.00 0.00 175.10 174.08 3fpe n ASP 213 N -1.27 1.79 0.00 4.85 5.68 -1.26 -4.98 116.55 121.36 3fpe n ASP 213 Ca -0.02 -1.98 0.10 0.00 -0.50 0.00 0.00 54.79 52.39 3fpe n ASP 213 Cb 0.61 -0.06 0.43 0.00 -1.14 0.00 0.00 41.12 40.96 3fpe n ASP 213 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3fpe n THR 214 N -1.29 0.62 0.57 2.12 -2.24 -1.26 -2.81 114.28 110.00 3fpe n THR 214 Ca 0.01 0.15 0.11 0.00 -2.27 0.00 0.00 64.05 62.05 3fpe n THR 214 Cb 0.33 -0.81 -0.01 0.00 -2.10 0.00 0.00 70.33 67.74 3fpe n THR 214 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3fpe n GLU 215 N -1.52 0.28 -2.04 -0.78 -0.58 -1.26 -4.56 120.64 110.18 3fpe n GLU 215 Ca 0.05 -0.02 -0.42 0.00 -0.42 0.00 0.00 57.16 56.35 3fpe n GLU 215 Cb 0.24 -1.58 -0.03 0.00 -0.57 0.00 0.00 31.44 29.50 3fpe n GLU 215 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3fpe s THR 216 N -3.20 3.50 -0.15 2.62 2.01 -1.12 -4.97 115.64 114.33 3fpe s THR 216 Ca 0.03 0.75 -0.29 0.00 0.31 0.00 0.00 61.69 62.49 3fpe s THR 216 Cb 0.15 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 69.16 3fpe s THR 216 CO 0.82 -0.04 1.16 -0.13 -0.69 0.00 0.00 174.62 175.73 3fpe s ARG 217 N 3.38 4.29 -0.17 4.92 3.00 -1.07 -4.66 118.95 128.64 3fpe s ARG 217 Ca 0.71 1.55 -0.00 0.00 0.00 0.00 0.00 55.73 57.99 3fpe s ARG 217 Cb -0.34 -3.66 0.01 0.00 0.00 0.00 0.00 34.95 30.95 3fpe s ARG 217 CO 0.29 -0.59 -0.16 0.42 0.00 0.00 0.00 175.30 175.27 3fpe s ILE 218 N 2.97 2.52 -0.14 1.52 1.01 -1.03 -0.90 121.20 127.16 3fpe s ILE 218 Ca 0.51 -0.80 0.02 0.00 0.00 0.00 0.00 60.65 60.38 3fpe s ILE 218 Cb -0.20 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.20 3fpe s ILE 218 CO 0.14 0.51 -0.20 -0.63 0.00 0.00 0.00 174.94 174.76 3fpe s ILE 219 N 1.11 2.26 0.24 2.92 1.01 0.09 -0.43 121.20 128.40 3fpe s ILE 219 Ca 0.00 -0.92 0.11 0.00 0.00 0.00 0.00 60.65 59.84 3fpe s ILE 219 Cb -0.14 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.36 3fpe s ILE 219 CO -0.05 0.54 -0.19 -0.72 0.00 0.00 0.00 174.94 174.52 3fpe s TYR 220 N 0.73 2.11 -0.06 3.97 1.13 -0.41 -1.05 117.35 123.75 3fpe s TYR 220 Ca -0.08 -0.41 -0.00 0.00 -1.41 0.00 0.00 57.07 55.17 3fpe s TYR 220 Cb -0.16 -0.95 -0.03 0.00 -1.10 0.00 0.00 41.96 39.72 3fpe s TYR 220 CO 0.01 0.57 -0.03 1.03 -2.51 0.00 0.00 175.55 174.61 3fpe s ARG 221 N -3.37 2.85 0.00 -3.49 0.52 -1.06 -1.10 118.95 113.31 3fpe s ARG 221 Ca 0.26 -0.50 0.00 0.00 -0.52 0.00 0.00 55.73 54.97 3fpe s ARG 221 Cb -0.04 -2.69 0.00 0.00 0.52 0.00 0.00 34.95 32.74 3fpe s ARG 221 CO 0.12 0.67 0.00 -2.37 0.02 0.00 0.00 175.30 173.74 3fpe n THR 222 N 2.06 0.00 -4.03 0.02 5.66 0.28 -4.33 114.28 113.93 3fpe n THR 222 Ca -0.18 0.00 -0.17 0.00 -3.05 0.00 0.00 64.05 60.66 3fpe n THR 222 Cb 0.53 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.16 3fpe n THR 222 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 3fpe s TYR 223 N -3.06 0.39 0.15 1.09 1.51 -1.26 -1.48 117.35 114.69 3fpe s TYR 223 Ca 0.00 -0.06 0.04 0.00 -1.01 0.00 0.00 57.07 56.04 3fpe s TYR 223 Cb 0.00 -0.37 -0.04 0.00 -0.11 0.00 0.00 41.96 41.43 3fpe s TYR 223 CO 0.00 -0.09 -0.08 0.95 -1.11 0.00 0.00 175.55 175.22 3fpe s THR 224 N 0.54 1.05 0.00 -0.71 -4.23 -1.26 -4.52 115.64 106.52 3fpe s THR 224 Ca -0.06 -2.03 0.00 0.00 -1.18 0.00 0.00 61.69 58.42 3fpe s THR 224 Cb -0.09 -1.89 0.00 0.00 1.34 0.00 0.00 72.50 71.86 3fpe s THR 224 CO -0.01 -0.71 0.00 0.61 -0.54 0.00 0.00 174.62 173.97 3fpe n GLY 225 N -0.20 1.26 0.23 3.99 0.00 -1.26 -2.43 105.19 106.78 3fpe n GLY 225 Ca -0.10 -0.61 0.16 0.00 0.00 0.00 0.00 46.02 45.47 3fpe n GLY 225 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3fpe h MET 226 N 0.00 0.00 0.00 1.61 1.85 -1.87 -2.16 114.93 114.36 3fpe h MET 226 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 3fpe h MET 226 Cb 0.00 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.03 3fpe h MET 226 CO 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 176.91 176.51 3fpe h ARG 227 N 0.00 0.00 0.00 0.39 3.08 -1.58 -1.44 114.38 114.84 3fpe h ARG 227 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3fpe h ARG 227 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.45 3fpe h ARG 227 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 3fpe n ALA 228 N -1.94 1.47 0.28 0.04 0.00 -0.81 -1.51 120.51 118.03 3fpe n ALA 228 Ca -0.00 -0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.54 3fpe n ALA 228 Cb 0.18 -1.17 0.81 0.00 0.00 0.00 0.00 19.45 19.27 3fpe n ALA 228 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3fpe h ILE 229 N 0.00 0.55 0.00 0.00 2.10 -1.47 -3.10 117.51 115.59 3fpe h ILE 229 Ca 0.00 -0.31 -0.20 0.00 1.08 0.00 0.00 64.86 65.44 3fpe h ILE 229 Cb 0.18 1.20 -0.03 0.00 -1.09 0.00 0.00 36.82 37.08 3fpe h ILE 229 CO 0.00 0.07 -0.94 -0.07 -1.08 0.00 0.00 178.15 176.13 3fpe h LEU 230 N 0.00 0.00 -7.00 2.19 3.38 -1.50 -3.37 115.31 109.01 3fpe h LEU 230 Ca -0.00 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 3fpe h LEU 230 Cb 0.19 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.67 3fpe h LEU 230 CO 0.01 0.94 0.66 -0.47 0.09 0.00 0.00 178.44 179.66 3fpe s TYR 231 N -2.85 -0.28 0.16 1.13 5.04 -1.17 -4.46 117.35 114.92 3fpe s TYR 231 Ca 0.01 0.62 -0.31 0.00 -2.44 0.00 0.00 57.07 54.94 3fpe s TYR 231 Cb 0.10 0.43 -0.10 0.00 0.35 0.00 0.00 41.96 42.75 3fpe s TYR 231 CO 0.81 -0.17 1.54 0.00 -1.34 0.00 0.00 175.55 176.39 3fpe s ALA 232 N -0.30 3.75 0.64 3.97 0.00 -1.26 -4.65 121.76 123.91 3fpe s ALA 232 Ca 0.04 1.33 -0.17 0.00 0.00 0.00 0.00 51.96 53.16 3fpe s ALA 232 Cb -0.03 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 3fpe s ALA 232 CO -0.07 -0.76 1.20 -2.14 0.00 0.00 0.00 175.76 173.99 3fpe s PRO 233 N 1.15 2.71 0.19 0.00 0.02 -1.26 -4.78 135.00 133.02 3fpe s PRO 233 Ca 0.69 1.76 -0.33 0.00 0.02 0.00 0.00 61.00 63.14 3fpe s PRO 233 Cb -0.43 -1.90 -0.13 0.00 0.02 0.00 0.00 34.50 32.06 3fpe s PRO 233 CO 0.31 -1.40 1.60 0.28 -0.33 0.00 0.00 177.00 177.46 3fpe n VAL 234 N -2.01 0.14 -2.38 3.83 0.31 -1.26 -4.98 118.33 111.97 3fpe n VAL 234 Ca 0.13 -0.04 -0.27 0.00 -0.01 0.00 0.00 64.34 64.15 3fpe n VAL 234 Cb 0.50 -1.66 0.02 0.00 -0.91 0.00 0.00 33.84 31.79 3fpe n VAL 234 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3fpe s SER 235 N 0.89 5.81 0.29 4.52 1.04 -1.26 -4.98 113.70 120.02 3fpe s SER 235 Ca 0.76 0.86 0.02 0.00 0.48 0.00 0.00 55.95 58.07 3fpe s SER 235 Cb -0.63 -1.93 0.45 0.00 0.10 0.00 0.00 66.02 64.02 3fpe s SER 235 CO 0.38 -0.94 1.76 0.44 0.98 0.00 0.00 173.24 175.87 3fpe h ASP 236 N -0.11 0.51 -0.76 7.02 5.19 -1.99 -2.64 116.42 123.64 3fpe h ASP 236 Ca -0.46 -0.15 0.00 0.00 -0.62 0.00 0.00 57.03 55.81 3fpe h ASP 236 Cb 1.24 -0.14 -0.04 0.00 0.18 0.00 0.00 39.33 40.57 3fpe h ASP 236 CO 0.61 0.70 0.49 0.44 -3.12 0.00 0.00 179.24 178.36 3fpe h ASP 237 N 0.48 0.89 -1.10 6.45 3.32 -2.01 -2.92 116.42 121.53 3fpe h ASP 237 Ca 0.08 -0.04 0.30 0.00 0.02 0.00 0.00 57.03 57.40 3fpe h ASP 237 Cb 0.56 -0.22 -0.10 0.00 0.22 0.00 0.00 39.33 39.79 3fpe h ASP 237 CO 0.04 0.66 0.71 0.44 -1.72 0.00 0.00 179.24 179.37 3fpe h ASP 238 N 1.04 0.38 -0.43 6.45 3.32 -1.85 -2.51 116.42 122.82 3fpe h ASP 238 Ca 0.28 0.09 -0.12 0.00 0.02 0.00 0.00 57.03 57.30 3fpe h ASP 238 Cb -0.09 0.04 -0.07 0.00 0.22 0.00 0.00 39.33 39.42 3fpe h ASP 238 CO -0.06 0.02 0.07 2.30 -1.72 0.00 0.00 179.24 179.85 3fpe n ILE 239 N -4.62 2.56 -1.73 0.35 -5.35 -1.10 -4.68 119.36 104.77 3fpe n ILE 239 Ca 0.28 -2.06 -0.42 0.00 -0.27 0.00 0.00 62.75 60.28 3fpe n ILE 239 Cb 1.01 -0.31 -0.01 0.00 -1.74 0.00 0.00 39.64 38.59 3fpe n ILE 239 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3fpe n THR 240 N -0.60 1.76 -0.21 7.28 -2.24 -0.95 -1.90 114.28 117.42 3fpe n THR 240 Ca 0.31 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3fpe n THR 240 Cb 1.08 -1.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.54 3fpe n THR 240 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fpe n GLY 241 N 0.97 0.99 3.44 3.38 0.00 -1.26 -4.95 105.19 107.76 3fpe n GLY 241 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 3fpe n GLY 241 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fpe s PHE 242 N -2.64 2.27 -0.07 1.61 0.08 -0.80 -1.38 117.98 117.04 3fpe s PHE 242 Ca 0.00 -0.35 0.04 0.00 0.12 0.00 0.00 56.93 56.74 3fpe s PHE 242 Cb 0.00 -1.05 -0.01 0.00 -0.57 0.00 0.00 43.02 41.39 3fpe s PHE 242 CO 0.00 0.60 -0.20 -0.98 -0.10 0.00 0.00 175.22 174.54 3fpe s ARG 243 N -3.13 2.75 0.12 0.44 1.70 0.26 -4.86 118.95 116.22 3fpe s ARG 243 Ca 0.25 -0.81 -0.30 0.00 -0.47 0.00 0.00 55.73 54.40 3fpe s ARG 243 Cb -0.06 -2.32 -0.06 0.00 -0.57 0.00 0.00 34.95 31.94 3fpe s ARG 243 CO 0.12 0.39 1.07 1.03 -1.08 0.00 0.00 175.30 176.83 3fpe s ARG 244 N -0.15 4.59 -0.00 3.89 0.52 -1.26 -1.27 118.95 125.26 3fpe s ARG 244 Ca -0.03 1.62 0.00 0.00 -0.52 0.00 0.00 55.73 56.81 3fpe s ARG 244 Cb -0.14 -3.34 -0.01 0.00 0.52 0.00 0.00 34.95 31.99 3fpe s ARG 244 CO 0.04 0.03 0.01 0.00 0.02 0.00 0.00 175.30 175.40 3fpe n ALA 245 N 2.96 2.03 0.00 2.13 0.00 0.27 -4.96 120.51 122.94 3fpe n ALA 245 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3fpe n ALA 245 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.91 3fpe n ALA 245 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fpe n GLY 246 N 1.81 0.81 2.99 0.00 0.00 -1.19 -4.98 105.19 104.63 3fpe n GLY 246 Ca -0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 3fpe n GLY 246 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fpe s VAL 247 N -2.00 0.03 -0.19 1.61 1.01 -1.26 -0.82 120.40 118.78 3fpe s VAL 247 Ca 0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 61.98 61.73 3fpe s VAL 247 Cb 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 36.38 36.19 3fpe s VAL 247 CO 0.00 -0.13 -0.12 -0.69 0.00 0.00 0.00 175.10 174.16 3fpe s VAL 248 N -0.39 2.81 0.04 2.92 1.01 -0.17 -5.01 120.40 121.61 3fpe s VAL 248 Ca -0.05 -0.70 -0.18 0.00 0.00 0.00 0.00 61.98 61.05 3fpe s VAL 248 Cb -0.03 -2.23 -0.06 0.00 0.00 0.00 0.00 36.38 34.06 3fpe s VAL 248 CO 0.00 0.48 0.53 -0.76 0.00 0.00 0.00 175.10 175.36 3fpe s LEU 249 N 1.21 4.50 0.72 3.92 1.43 -1.26 -1.75 118.68 127.45 3fpe s LEU 249 Ca 0.02 1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 54.17 3fpe s LEU 249 Cb -0.14 -2.82 0.03 0.00 0.03 0.00 0.00 46.19 43.29 3fpe s LEU 249 CO -0.05 0.26 1.09 -2.16 0.23 0.00 0.00 176.35 175.72 3fpe s PRO 250 N -0.95 2.71 0.27 1.29 0.04 -1.26 -5.02 135.00 132.07 3fpe s PRO 250 Ca 0.28 0.54 0.01 0.00 0.04 0.00 0.00 61.00 61.87 3fpe s PRO 250 Cb -0.19 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 3fpe s PRO 250 CO 0.17 -1.16 0.25 -1.54 0.04 0.00 0.00 177.00 174.76 3fpe s SER 251 N -4.21 0.75 1.41 6.66 1.04 -1.26 -5.01 113.70 113.07 3fpe s SER 251 Ca 0.59 -1.49 0.00 0.00 0.48 0.00 0.00 55.95 55.53 3fpe s SER 251 Cb -0.12 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.49 3fpe s SER 251 CO 0.53 -1.00 0.00 0.61 0.98 0.00 0.00 173.24 174.36 3fpe n GLY 252 N -0.44 2.64 0.85 7.32 0.00 -1.26 -2.81 105.19 111.49 3fpe n GLY 252 Ca 0.03 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.84 3fpe n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fpe n LYS 253 N 13.50 2.14 -2.09 1.61 5.02 -1.26 -4.92 118.16 132.16 3fpe n LYS 253 Ca 0.00 -1.70 -0.41 0.00 -2.02 0.00 0.00 58.31 54.17 3fpe n LYS 253 Cb 0.00 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.52 3fpe n LYS 253 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3fpe s VAL 254 N -2.03 2.91 -0.16 -0.18 1.01 -1.12 -4.95 120.40 115.88 3fpe s VAL 254 Ca 0.29 0.74 -0.01 0.00 0.00 0.00 0.00 61.98 63.00 3fpe s VAL 254 Cb 0.20 -3.47 -0.23 0.00 0.00 0.00 0.00 36.38 32.88 3fpe s VAL 254 CO 0.32 0.10 0.18 0.59 0.00 0.00 0.00 175.10 176.30 3fpe n ASN 255 N 2.77 1.87 -4.77 3.32 3.02 -1.26 -4.51 115.26 115.70 3fpe n ASN 255 Ca 0.08 0.10 -0.38 0.00 -0.03 0.00 0.00 54.58 54.34 3fpe n ASN 255 Cb 0.41 -0.56 -0.06 0.00 -0.61 0.00 0.00 39.78 38.96 3fpe n ASN 255 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3fpe s ASN 256 N -6.72 7.44 -0.05 6.41 0.02 -1.26 -4.76 114.94 116.02 3fpe s ASN 256 Ca -0.24 1.82 -0.18 0.00 -1.02 0.00 0.00 52.86 53.24 3fpe s ASN 256 Cb 0.07 -2.57 -0.05 0.00 0.02 0.00 0.00 41.25 38.73 3fpe s ASN 256 CO 0.72 0.06 0.50 -0.89 0.02 0.00 0.00 177.10 177.52 3fpe s THR 257 N -1.38 5.05 -0.15 1.60 2.01 -0.55 -4.12 115.64 118.10 3fpe s THR 257 Ca 0.44 1.02 -0.05 0.00 0.31 0.00 0.00 61.69 63.42 3fpe s THR 257 Cb -0.22 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 68.43 3fpe s THR 257 CO 0.27 0.42 0.01 -0.44 -0.69 0.00 0.00 174.62 174.18 3fpe s SER 258 N -0.04 5.18 -0.10 3.53 0.01 -0.72 -0.56 113.70 121.01 3fpe s SER 258 Ca 0.27 -0.01 0.03 0.00 1.31 0.00 0.00 55.95 57.55 3fpe s SER 258 Cb -0.17 -1.80 0.01 0.00 0.21 0.00 0.00 66.02 64.27 3fpe s SER 258 CO 0.13 0.20 -0.20 -0.69 0.41 0.00 0.00 173.24 173.10 3fpe s VAL 259 N 0.16 1.77 -0.23 3.43 1.01 -0.25 -1.00 120.40 125.30 3fpe s VAL 259 Ca 0.01 -0.84 -0.12 0.00 0.00 0.00 0.00 61.98 61.04 3fpe s VAL 259 Cb -0.13 -1.56 -0.05 0.00 0.00 0.00 0.00 36.38 34.64 3fpe s VAL 259 CO 0.02 0.50 0.22 -0.22 0.00 0.00 0.00 175.10 175.61 3fpe s LEU 260 N 0.57 4.13 0.15 3.92 2.96 0.00 -1.29 118.68 129.13 3fpe s LEU 260 Ca -0.15 0.22 0.06 0.00 -0.22 0.00 0.00 54.13 54.05 3fpe s LEU 260 Cb -0.17 -2.20 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 3fpe s LEU 260 CO 0.05 0.04 -0.14 0.68 -1.32 0.00 0.00 176.35 175.67 3fpe s VAL 261 N 1.05 1.41 0.04 1.68 -7.23 0.43 -0.56 120.40 117.21 3fpe s VAL 261 Ca 0.10 -1.91 0.07 0.00 -1.81 0.00 0.00 61.98 58.43 3fpe s VAL 261 Cb -0.14 -1.73 -0.02 0.00 0.56 0.00 0.00 36.38 35.05 3fpe s VAL 261 CO 0.05 -0.52 -0.20 -0.36 -0.31 0.00 0.00 175.10 173.76 3fpe s PHE 262 N -2.57 1.72 0.33 2.82 0.08 -0.40 -2.46 117.98 117.51 3fpe s PHE 262 Ca 0.14 -0.37 -0.29 0.00 0.12 0.00 0.00 56.93 56.53 3fpe s PHE 262 Cb -0.02 -1.03 -0.11 0.00 -0.57 0.00 0.00 43.02 41.28 3fpe s PHE 262 CO 0.03 0.07 1.55 0.21 -0.10 0.00 0.00 175.22 176.99 3fpe s LYS 263 N -1.10 4.11 0.36 0.44 2.20 -1.26 -0.57 119.74 123.91 3fpe s LYS 263 Ca 0.07 2.58 -0.27 0.00 -0.36 0.00 0.00 55.97 57.99 3fpe s LYS 263 Cb -0.09 -3.00 -0.09 0.00 -1.51 0.00 0.00 37.83 33.15 3fpe s LYS 263 CO 0.01 -0.59 1.24 0.00 -0.36 0.00 0.00 175.35 175.65