#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iem n PRO 5 N 0.00 1.28 0.23 0.00 -0.02 -1.26 -4.74 135.00 130.49 1iem n PRO 5 Ca 0.00 0.45 0.13 0.00 -2.02 0.00 0.00 63.50 62.06 1iem n PRO 5 Cb 0.00 -1.80 0.76 0.00 -0.02 0.00 0.00 33.50 32.44 1iem n PRO 5 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1iem h GLN 6 N 1.91 0.00 0.17 -0.52 4.15 -2.05 -2.12 115.11 116.64 1iem h GLN 6 Ca -0.39 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.02 1iem h GLN 6 Cb 1.35 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.04 1iem h GLN 6 CO 0.60 0.00 -0.08 0.37 -1.93 0.00 0.00 178.83 177.79 1iem h GLN 7 N 0.00 -0.21 0.51 1.69 4.15 -2.00 0.65 115.11 119.90 1iem h GLN 7 Ca 0.04 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 1iem h GLN 7 Cb 0.21 0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.95 1iem h GLN 7 CO -0.00 -0.12 -0.24 0.82 -1.93 0.00 0.00 178.83 177.36 1iem h ILE 8 N -0.25 0.50 -0.84 2.39 2.04 -1.78 -2.45 117.51 117.12 1iem h ILE 8 Ca -0.02 -0.03 0.14 0.00 1.00 0.00 0.00 64.86 65.94 1iem h ILE 8 Cb 0.19 0.51 -0.14 0.00 -0.74 0.00 0.00 36.82 36.64 1iem h ILE 8 CO 0.04 0.01 -0.36 -1.13 0.00 0.00 0.00 178.15 176.70 1iem h ASN 9 N -0.70 -1.30 -0.04 1.72 -0.73 -1.28 -0.69 115.58 112.57 1iem h ASN 9 Ca -0.07 0.28 -0.00 0.00 1.87 0.00 0.00 56.30 58.38 1iem h ASN 9 Cb 0.53 0.68 -0.00 0.00 0.27 0.00 0.00 38.32 39.80 1iem h ASN 9 CO 0.11 -0.29 0.02 0.44 -0.37 0.00 0.00 177.43 177.34 1iem h ASP 10 N -0.06 0.05 -0.13 1.15 3.45 -0.78 -1.89 116.42 118.21 1iem h ASP 10 Ca 0.31 -0.12 -0.01 0.00 0.43 0.00 0.00 57.03 57.64 1iem h ASP 10 Cb 0.58 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 39.33 1iem h ASP 10 CO -0.87 0.16 0.06 -0.29 -1.57 0.00 0.00 179.24 176.73 1iem h ILE 11 N -0.06 1.14 -0.21 0.35 6.09 -0.90 0.28 117.51 124.19 1iem h ILE 11 Ca 0.01 -0.41 0.05 0.00 -1.37 0.00 0.00 64.86 63.15 1iem h ILE 11 Cb 0.12 1.16 -0.07 0.00 0.47 0.00 0.00 36.82 38.50 1iem h ILE 11 CO -0.00 0.13 -0.37 0.58 -3.07 0.00 0.00 178.15 175.41 1iem h VAL 12 N 0.07 0.20 -0.22 2.19 2.07 -1.12 0.64 116.25 120.08 1iem h VAL 12 Ca 0.05 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.47 1iem h VAL 12 Cb 0.15 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1iem h VAL 12 CO -0.00 0.00 -0.29 0.45 0.02 0.00 0.00 177.57 177.75 1iem h HIS 13 N -0.40 0.50 -0.47 1.57 3.86 -1.25 0.26 115.15 119.22 1iem h HIS 13 Ca 0.11 -0.11 -0.05 0.00 -1.16 0.00 0.00 60.37 59.15 1iem h HIS 13 Cb 0.58 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 1iem h HIS 13 CO -0.49 0.69 0.08 0.00 0.86 0.00 0.00 177.93 179.07 1iem h ARG 14 N 0.39 0.73 0.00 2.45 3.08 -0.39 -2.82 114.38 117.82 1iem h ARG 14 Ca 0.05 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 1iem h ARG 14 Cb 0.71 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 1iem h ARG 14 CO 0.05 0.69 -0.30 1.15 -1.07 0.00 0.00 179.97 180.49 1iem h THR 15 N 0.70 0.59 -0.68 2.04 2.02 -0.54 -3.40 112.91 113.64 1iem h THR 15 Ca 0.15 -1.52 -0.06 0.00 0.77 0.00 0.00 66.41 65.76 1iem h THR 15 Cb 0.32 1.18 -0.03 0.00 -1.74 0.00 0.00 68.15 67.88 1iem h THR 15 CO 0.00 0.20 0.20 0.40 0.37 0.00 0.00 175.52 176.69 1iem h ILE 16 N -1.00 1.25 -0.12 3.11 1.08 -0.60 -3.12 117.51 118.12 1iem h ILE 16 Ca -0.05 -0.88 0.04 0.00 -0.39 0.00 0.00 64.86 63.57 1iem h ILE 16 Cb 0.56 0.52 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 1iem h ILE 16 CO -0.03 0.34 -0.13 0.74 -0.69 0.00 0.00 178.15 178.38 1iem h THR 17 N 1.00 0.64 0.00 -0.27 2.02 -1.70 -0.05 112.91 114.56 1iem h THR 17 Ca 0.22 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.35 1iem h THR 17 Cb 0.31 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1iem h THR 17 CO -0.01 0.00 -0.24 -0.65 0.37 0.00 0.00 175.52 175.00 1iem h PRO 18 N -0.16 0.00 -0.04 6.66 0.11 -1.77 -2.80 132.00 134.01 1iem h PRO 18 Ca 0.09 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 1iem h PRO 18 Cb 0.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.39 1iem h PRO 18 CO -0.22 0.24 0.00 1.25 -0.21 0.00 0.00 178.00 179.06 1iem h LEU 19 N 0.00 0.06 -0.96 2.35 5.85 -1.16 -0.57 115.31 120.88 1iem h LEU 19 Ca -0.00 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.38 1iem h LEU 19 Cb 0.58 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 1iem h LEU 19 CO 0.03 0.35 0.29 0.40 -0.34 0.00 0.00 178.44 179.17 1iem h ILE 20 N -0.23 1.24 -0.09 4.05 2.04 -0.94 -1.29 117.51 122.29 1iem h ILE 20 Ca 0.01 -0.74 -0.20 0.00 1.00 0.00 0.00 64.86 64.93 1iem h ILE 20 Cb 0.32 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 1iem h ILE 20 CO 0.00 0.30 -0.76 -0.08 0.00 0.00 0.00 178.15 177.61 1iem h GLU 21 N 1.02 0.52 -0.11 2.37 4.81 -1.47 0.14 114.58 121.85 1iem h GLU 21 Ca 0.24 -0.43 -0.22 0.00 -0.13 0.00 0.00 59.36 58.82 1iem h GLU 21 Cb 0.18 0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.66 1iem h GLU 21 CO -0.02 1.06 -0.80 1.96 -0.73 0.00 0.00 179.01 180.48 1iem h GLN 22 N 0.35 0.64 -0.02 1.92 1.08 -0.92 -3.24 115.11 114.92 1iem h GLN 22 Ca -0.04 -0.55 0.00 0.00 -1.45 0.00 0.00 58.65 56.61 1iem h GLN 22 Cb 1.35 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.91 1iem h GLN 22 CO 0.14 1.17 -0.23 1.04 -0.95 0.00 0.00 178.83 180.00 1iem n GLN 23 N -3.88 1.44 -3.80 1.46 1.13 -0.50 -4.97 117.38 108.26 1iem n GLN 23 Ca -0.07 -1.06 -0.25 0.00 -1.94 0.00 0.00 57.00 53.68 1iem n GLN 23 Cb 0.75 -1.48 0.03 0.00 0.11 0.00 0.00 30.24 29.65 1iem n GLN 23 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1iem n LYS 24 N 0.15 -5.00 -2.46 -1.09 5.02 0.38 -4.91 118.16 110.25 1iem n LYS 24 Ca 0.13 0.59 -0.43 0.00 -2.02 0.00 0.00 58.31 56.59 1iem n LYS 24 Cb 0.44 -5.23 -0.02 0.00 -0.02 0.00 0.00 35.03 30.20 1iem n LYS 24 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1iem s ILE 25 N -3.57 4.32 0.08 -0.18 1.01 -0.62 -4.95 121.20 117.29 1iem s ILE 25 Ca 0.23 1.57 -0.26 0.00 0.00 0.00 0.00 60.65 62.20 1iem s ILE 25 Cb -0.12 -4.08 -0.16 0.00 0.01 0.00 0.00 42.46 38.11 1iem s ILE 25 CO 0.82 -0.21 1.71 -0.65 0.00 0.00 0.00 174.94 176.61 1iem h PRO 26 N 8.29 -0.23 -4.14 2.79 0.11 -1.89 -3.46 132.00 133.48 1iem h PRO 26 Ca -0.25 0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.73 1iem h PRO 26 Cb 1.09 0.05 -0.18 0.00 0.11 0.00 0.00 31.00 32.08 1iem h PRO 26 CO 0.98 -0.15 -0.69 0.20 -0.21 0.00 0.00 178.00 178.13 1iem s GLY 27 N -2.16 0.37 -0.09 -0.55 0.00 -1.15 -1.14 107.32 102.61 1iem s GLY 27 Ca -0.14 -0.93 -0.30 0.00 0.00 0.00 0.00 44.72 43.34 1iem s GLY 27 CO 0.65 -1.02 0.75 -0.29 0.00 0.00 0.00 173.10 173.18 1iem s MET 28 N -2.80 0.94 -0.02 2.90 1.75 -0.52 -2.81 119.30 118.74 1iem s MET 28 Ca -0.03 0.31 0.02 0.00 -1.25 0.00 0.00 55.69 54.74 1iem s MET 28 Cb -0.00 0.45 0.00 0.00 2.84 0.00 0.00 34.83 38.12 1iem s MET 28 CO -0.06 -0.28 -0.06 0.00 -0.65 0.00 0.00 175.02 173.97 1iem s ALA 29 N -1.01 0.59 -0.02 4.11 0.00 0.13 -0.40 121.76 125.16 1iem s ALA 29 Ca -0.08 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.71 1iem s ALA 29 Cb -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1iem s ALA 29 CO 0.07 0.09 -0.13 0.08 0.00 0.00 0.00 175.76 175.88 1iem s VAL 30 N 0.17 1.04 -0.09 0.00 1.01 -0.34 -0.81 120.40 121.37 1iem s VAL 30 Ca -0.02 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.45 1iem s VAL 30 Cb -0.06 -0.88 0.01 0.00 0.00 0.00 0.00 36.38 35.44 1iem s VAL 30 CO -0.00 0.30 -0.16 0.00 0.00 0.00 0.00 175.10 175.24 1iem s ALA 31 N -0.13 1.67 -0.23 5.51 0.00 -0.41 -1.61 121.76 126.56 1iem s ALA 31 Ca 0.02 -0.69 -0.03 0.00 0.00 0.00 0.00 51.96 51.26 1iem s ALA 31 Cb -0.07 -0.75 0.01 0.00 0.00 0.00 0.00 23.12 22.31 1iem s ALA 31 CO 0.00 0.06 -0.06 0.08 0.00 0.00 0.00 175.76 175.84 1iem s VAL 32 N 0.75 3.05 -0.50 0.00 1.01 0.28 -0.77 120.40 124.23 1iem s VAL 32 Ca -0.12 -0.78 -0.18 0.00 0.00 0.00 0.00 61.98 60.90 1iem s VAL 32 Cb -0.16 -2.46 0.06 0.00 0.00 0.00 0.00 36.38 33.82 1iem s VAL 32 CO 0.02 0.32 0.58 -0.63 0.00 0.00 0.00 175.10 175.39 1iem s ILE 33 N 1.39 4.95 -0.23 2.22 1.09 0.00 -0.99 121.20 129.64 1iem s ILE 33 Ca 0.03 -0.63 -0.05 0.00 -1.10 0.00 0.00 60.65 58.91 1iem s ILE 33 Cb -0.15 -4.26 -0.01 0.00 -1.06 0.00 0.00 42.46 36.97 1iem s ILE 33 CO -0.05 -0.76 -0.02 -0.47 -0.10 0.00 0.00 174.94 173.55 1iem s TYR 34 N 2.41 2.99 -1.43 3.97 6.14 0.01 -1.41 117.35 130.03 1iem s TYR 34 Ca 0.13 -0.87 -0.09 0.00 0.64 0.00 0.00 57.07 56.87 1iem s TYR 34 Cb -0.20 -2.13 0.05 0.00 0.42 0.00 0.00 41.96 40.09 1iem s TYR 34 CO 0.11 -0.52 0.98 1.04 0.64 0.00 0.00 175.55 177.79 1iem n GLN 35 N 4.82 -6.04 -0.69 4.97 6.02 -0.72 -1.66 117.38 124.09 1iem n GLN 35 Ca -0.18 0.67 0.00 0.00 -0.01 0.00 0.00 57.00 57.48 1iem n GLN 35 Cb 0.51 -5.54 0.00 0.00 1.02 0.00 0.00 30.24 26.22 1iem n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1iem n GLY 36 N -1.71 1.27 3.66 1.08 0.00 -1.15 -5.01 105.19 103.31 1iem n GLY 36 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 1iem n GLY 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iem s LYS 37 N -0.12 2.79 0.14 1.61 -2.85 -0.66 -5.04 119.74 115.60 1iem s LYS 37 Ca 0.00 -0.58 -0.09 0.00 -1.00 0.00 0.00 55.97 54.30 1iem s LYS 37 Cb 0.00 -2.66 -0.06 0.00 -2.06 0.00 0.00 37.83 33.05 1iem s LYS 37 CO 0.00 0.64 0.45 -1.25 0.10 0.00 0.00 175.35 175.29 1iem s PRO 38 N -1.30 3.76 -0.05 1.78 0.04 -1.26 -0.81 135.00 137.16 1iem s PRO 38 Ca 0.17 0.17 0.00 0.00 0.04 0.00 0.00 61.00 61.38 1iem s PRO 38 Cb -0.11 -2.86 0.02 0.00 0.04 0.00 0.00 34.50 31.59 1iem s PRO 38 CO 0.07 0.47 -0.03 0.71 0.04 0.00 0.00 177.00 178.25 1iem s TYR 39 N -1.58 0.73 0.05 0.56 2.02 -0.16 -4.96 117.35 114.01 1iem s TYR 39 Ca 0.39 -0.21 0.04 0.00 -0.37 0.00 0.00 57.07 56.92 1iem s TYR 39 Cb -0.13 -0.70 -0.04 0.00 -0.40 0.00 0.00 41.96 40.69 1iem s TYR 39 CO 0.21 -0.23 -0.02 0.71 -1.57 0.00 0.00 175.55 174.64 1iem s TYR 40 N 1.20 2.97 -0.03 2.71 1.51 -1.26 -0.56 117.35 123.89 1iem s TYR 40 Ca -0.07 -0.01 -0.06 0.00 -1.01 0.00 0.00 57.07 55.93 1iem s TYR 40 Cb -0.14 -1.58 0.01 0.00 -0.11 0.00 0.00 41.96 40.14 1iem s TYR 40 CO -0.02 0.45 0.13 -0.06 -1.11 0.00 0.00 175.55 174.94 1iem s PHE 41 N -1.17 -0.06 0.02 2.71 0.08 -0.63 -5.01 117.98 113.91 1iem s PHE 41 Ca 0.22 0.14 0.00 0.00 0.12 0.00 0.00 56.93 57.41 1iem s PHE 41 Cb -0.11 0.00 -0.02 0.00 -0.57 0.00 0.00 43.02 42.32 1iem s PHE 41 CO 0.13 -0.16 -0.03 0.95 -0.10 0.00 0.00 175.22 176.02 1iem s THR 42 N -0.55 0.11 0.04 0.64 -4.23 -1.26 -1.20 115.64 109.20 1iem s THR 42 Ca -0.06 -0.73 -0.00 0.00 -1.18 0.00 0.00 61.69 59.72 1iem s THR 42 Cb -0.04 -0.23 -0.03 0.00 1.34 0.00 0.00 72.50 73.54 1iem s THR 42 CO 0.01 -0.39 -0.04 0.26 -0.54 0.00 0.00 174.62 173.92 1iem s TRP 43 N -1.15 0.46 0.00 3.99 0.51 0.47 -5.00 118.94 118.22 1iem s TRP 43 Ca -0.12 -0.80 0.00 0.00 -2.12 0.00 0.00 56.10 53.05 1iem s TRP 43 Cb -0.08 -0.32 0.00 0.00 -0.81 0.00 0.00 33.47 32.26 1iem s TRP 43 CO -0.01 -0.26 0.00 0.41 -0.51 0.00 0.00 176.95 176.58 1iem n GLY 44 N 0.78 1.36 3.60 0.98 0.00 -1.26 -1.44 105.19 109.20 1iem n GLY 44 Ca -0.18 -0.54 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 1iem n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1iem s TYR 45 N 0.00 2.90 -0.09 1.61 2.02 -0.29 -1.44 117.35 122.06 1iem s TYR 45 Ca 0.00 -0.03 0.07 0.00 -0.37 0.00 0.00 57.07 56.74 1iem s TYR 45 Cb 0.00 -1.61 -0.24 0.00 -0.40 0.00 0.00 41.96 39.71 1iem s TYR 45 CO 0.00 0.38 0.48 0.00 -1.57 0.00 0.00 175.55 174.84 1iem n ALA 46 N 1.54 1.31 -3.55 3.71 0.00 0.74 -2.93 120.51 121.33 1iem n ALA 46 Ca -0.15 -0.78 -0.22 0.00 0.00 0.00 0.00 53.44 52.28 1iem n ALA 46 Cb 0.53 -0.71 -0.15 0.00 0.00 0.00 0.00 19.45 19.12 1iem n ALA 46 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1iem s ASP 47 N -6.33 1.91 0.07 0.00 -1.08 -1.03 -0.33 116.67 109.88 1iem s ASP 47 Ca -0.12 -0.44 -0.19 0.00 -0.52 0.00 0.00 52.55 51.28 1iem s ASP 47 Cb 0.07 0.05 -0.10 0.00 -1.46 0.00 0.00 42.92 41.49 1iem s ASP 47 CO 0.80 -0.34 1.48 0.40 0.52 0.00 0.00 175.17 178.03 1iem h ILE 48 N 6.37 1.27 0.36 4.11 2.04 -1.86 -1.84 117.51 127.96 1iem h ILE 48 Ca -0.16 -0.96 -0.00 0.00 1.00 0.00 0.00 64.86 64.73 1iem h ILE 48 Cb 1.15 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 38.68 1iem h ILE 48 CO 0.29 0.30 -0.36 0.00 0.00 0.00 0.00 178.15 178.38 1iem h ALA 49 N 0.77 -0.77 -0.11 1.87 0.00 -1.97 -2.65 119.26 116.40 1iem h ALA 49 Ca 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1iem h ALA 49 Cb 0.45 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1iem h ALA 49 CO 0.02 -0.97 0.00 1.63 0.00 0.00 0.00 179.25 179.92 1iem n LYS 50 N -5.47 1.50 -3.09 0.00 5.02 -1.24 -4.90 118.16 109.98 1iem n LYS 50 Ca -0.10 -0.50 -0.19 0.00 -2.02 0.00 0.00 58.31 55.51 1iem n LYS 50 Cb 0.37 -1.40 -0.01 0.00 -0.02 0.00 0.00 35.03 33.97 1iem n LYS 50 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1iem n LYS 51 N 0.00 -3.01 -3.03 1.97 5.02 -0.97 -4.92 118.16 113.22 1iem n LYS 51 Ca 0.04 0.45 -0.41 0.00 -2.02 0.00 0.00 58.31 56.38 1iem n LYS 51 Cb 0.28 -5.11 -0.05 0.00 -0.02 0.00 0.00 35.03 30.12 1iem n LYS 51 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1iem s GLN 52 N -5.72 4.18 0.63 1.97 -1.52 -0.73 -4.99 119.66 113.48 1iem s GLN 52 Ca 0.28 0.73 -0.12 0.00 -1.95 0.00 0.00 55.36 54.30 1iem s GLN 52 Cb -0.15 -3.62 -0.03 0.00 -0.22 0.00 0.00 33.01 28.99 1iem s GLN 52 CO 0.34 -0.38 1.04 -1.25 -0.25 0.00 0.00 175.29 174.79 1iem s PRO 53 N 2.38 3.40 0.22 2.91 0.04 -1.26 -0.19 135.00 142.51 1iem s PRO 53 Ca 0.31 0.89 -0.30 0.00 0.04 0.00 0.00 61.00 61.93 1iem s PRO 53 Cb -0.16 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 1iem s PRO 53 CO 0.09 -0.73 1.02 0.08 0.04 0.00 0.00 177.00 177.50 1iem s VAL 54 N -3.00 3.92 0.35 -0.36 1.01 -0.52 -4.29 120.40 117.51 1iem s VAL 54 Ca 0.57 1.83 0.06 0.00 0.00 0.00 0.00 61.98 64.44 1iem s VAL 54 Cb -0.12 -4.16 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 1iem s VAL 54 CO 0.50 0.39 0.23 0.42 0.00 0.00 0.00 175.10 176.64 1iem s THR 55 N -0.84 0.17 -0.91 3.92 -4.23 -1.26 -4.68 115.64 107.81 1iem s THR 55 Ca 0.44 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.13 1iem s THR 55 Cb -0.28 -2.45 0.16 0.00 1.34 0.00 0.00 72.50 71.27 1iem s THR 55 CO 0.35 0.00 1.57 0.00 -0.54 0.00 0.00 174.62 176.00 1iem n GLN 56 N -0.70 0.04 0.00 3.99 6.02 -1.26 -2.18 117.38 123.30 1iem n GLN 56 Ca 0.03 0.25 0.11 0.00 -0.01 0.00 0.00 57.00 57.38 1iem n GLN 56 Cb 0.63 -1.57 0.02 0.00 1.02 0.00 0.00 30.24 30.35 1iem n GLN 56 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1iem n GLN 57 N -1.64 1.53 -2.22 -1.09 3.00 -1.26 -3.80 117.38 111.90 1iem n GLN 57 Ca 0.04 -1.23 -0.41 0.00 -0.01 0.00 0.00 57.00 55.38 1iem n GLN 57 Cb 0.21 -1.46 -0.03 0.00 0.00 0.00 0.00 30.24 28.96 1iem n GLN 57 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1iem s THR 58 N -2.29 3.20 -0.08 5.09 2.01 -0.93 -4.84 115.64 117.81 1iem s THR 58 Ca 0.20 1.00 -0.16 0.00 0.31 0.00 0.00 61.69 63.05 1iem s THR 58 Cb 0.18 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.00 1iem s THR 58 CO 0.49 0.16 0.42 -0.76 -0.69 0.00 0.00 174.62 174.23 1iem s LEU 59 N -0.22 4.35 0.15 4.42 1.43 0.13 -4.03 118.68 124.91 1iem s LEU 59 Ca 0.56 0.83 0.11 0.00 -1.03 0.00 0.00 54.13 54.59 1iem s LEU 59 Cb -0.36 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.21 1iem s LEU 59 CO 0.39 0.14 -0.25 -0.36 0.23 0.00 0.00 176.35 176.51 1iem s PHE 60 N -0.07 2.21 -0.02 0.29 0.40 0.17 -1.96 117.98 119.00 1iem s PHE 60 Ca 0.24 -0.38 -0.30 0.00 -0.60 0.00 0.00 56.93 55.88 1iem s PHE 60 Cb -0.15 -1.15 -0.04 0.00 0.51 0.00 0.00 43.02 42.18 1iem s PHE 60 CO 0.11 0.38 1.17 -1.21 0.70 0.00 0.00 175.22 176.37 1iem s GLU 61 N -2.32 4.40 0.44 0.44 2.02 -1.26 -1.62 118.70 120.80 1iem s GLU 61 Ca 0.16 1.66 0.23 0.00 0.02 0.00 0.00 54.97 57.04 1iem s GLU 61 Cb -0.09 -3.48 0.37 0.00 0.10 0.00 0.00 34.13 31.02 1iem s GLU 61 CO 0.07 -0.34 1.62 -0.07 0.02 0.00 0.00 175.26 176.56 1iem h LEU 62 N 7.63 0.00 0.00 1.80 3.38 -0.87 -3.44 115.31 123.81 1iem h LEU 62 Ca -0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1iem h LEU 62 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1iem h LEU 62 CO 0.85 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.99 1iem n GLY 63 N 1.07 2.23 0.15 0.83 0.00 -1.24 -2.69 105.19 105.54 1iem n GLY 63 Ca 0.04 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.69 1iem n GLY 63 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1iem h SER 64 N 7.43 0.00 0.00 1.61 0.02 -1.76 -1.93 113.55 118.91 1iem h SER 64 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1iem h SER 64 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1iem h SER 64 CO 0.00 0.00 0.12 0.58 -1.14 0.00 0.00 176.83 176.39 1iem h VAL 65 N 0.00 0.00 -0.06 2.27 2.07 -1.58 0.49 116.25 119.43 1iem h VAL 65 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1iem h VAL 65 Cb 0.23 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1iem h VAL 65 CO 0.00 0.00 0.06 0.28 0.02 0.00 0.00 177.57 177.93 1iem h SER 66 N 0.00 0.00 0.32 0.57 0.02 -1.56 -0.77 113.55 112.13 1iem h SER 66 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1iem h SER 66 Cb 0.25 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.78 1iem h SER 66 CO 0.00 0.00 -0.10 0.11 -1.14 0.00 0.00 176.83 175.70 1iem h LYS 67 N 0.00 0.00 -0.47 3.45 1.57 -0.21 -1.60 116.57 119.32 1iem h LYS 67 Ca 0.03 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1iem h LYS 67 Cb 0.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1iem h LYS 67 CO -0.00 0.10 -0.12 1.79 -0.57 0.00 0.00 179.45 180.65 1iem h THR 68 N 0.00 1.27 -0.45 -0.16 1.35 -1.30 0.23 112.91 113.84 1iem h THR 68 Ca -0.00 -1.25 -0.08 0.00 -0.55 0.00 0.00 66.41 64.53 1iem h THR 68 Cb 0.29 1.10 -0.02 0.00 -1.73 0.00 0.00 68.15 67.79 1iem h THR 68 CO 0.01 0.43 -0.06 -0.26 -0.25 0.00 0.00 175.52 175.39 1iem h PHE 69 N 0.75 0.85 -0.15 4.73 -1.00 -1.44 -1.27 116.94 119.40 1iem h PHE 69 Ca 0.12 -0.14 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 1iem h PHE 69 Cb 0.67 -0.22 -0.00 0.00 3.61 0.00 0.00 35.95 40.00 1iem h PHE 69 CO 0.05 0.81 -0.04 1.15 -1.61 0.00 0.00 178.31 178.67 1iem h THR 70 N 0.72 1.29 -0.37 -1.55 2.02 -1.01 0.26 112.91 114.27 1iem h THR 70 Ca 0.13 -1.00 0.04 0.00 0.77 0.00 0.00 66.41 66.35 1iem h THR 70 Cb 0.52 1.65 -0.04 0.00 -1.74 0.00 0.00 68.15 68.54 1iem h THR 70 CO 0.03 0.30 0.12 1.23 0.37 0.00 0.00 175.52 177.57 1iem h GLY 71 N -0.01 0.47 1.13 2.16 0.00 -0.38 0.71 103.07 107.15 1iem h GLY 71 Ca 0.04 -0.07 -0.08 0.00 0.00 0.00 0.00 47.33 47.22 1iem h GLY 71 CO 0.02 0.02 0.06 -2.08 0.00 0.00 0.00 176.54 174.56 1iem h VAL 72 N 0.27 1.26 -0.48 4.60 2.07 -1.19 0.23 116.25 123.01 1iem h VAL 72 Ca 0.17 -1.07 -0.09 0.00 0.82 0.00 0.00 66.70 66.54 1iem h VAL 72 Cb 0.15 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1iem h VAL 72 CO -0.18 0.39 -0.06 0.25 0.02 0.00 0.00 177.57 178.00 1iem h LEU 73 N 0.98 0.82 -0.56 2.57 5.85 -0.53 0.14 115.31 124.58 1iem h LEU 73 Ca 0.19 -0.23 -0.12 0.00 0.84 0.00 0.00 57.88 58.56 1iem h LEU 73 Cb 0.47 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 1iem h LEU 73 CO 0.02 0.92 -0.17 1.23 -0.34 0.00 0.00 178.44 180.10 1iem h GLY 74 N 0.98 1.05 1.22 3.75 0.00 -0.48 -1.20 103.07 108.40 1iem h GLY 74 Ca 0.14 -0.89 -0.05 0.00 0.00 0.00 0.00 47.33 46.53 1iem h GLY 74 CO 0.03 0.81 0.21 -1.33 0.00 0.00 0.00 176.54 176.26 1iem h GLY 75 N 0.92 1.05 1.02 4.60 0.00 0.04 -1.24 103.07 109.47 1iem h GLY 75 Ca 0.12 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 1iem h GLY 75 CO 0.06 0.55 0.39 -1.80 0.00 0.00 0.00 176.54 175.74 1iem h ASP 76 N 0.95 1.03 -0.71 0.19 3.58 -0.36 0.88 116.42 121.98 1iem h ASP 76 Ca 0.21 -0.13 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 1iem h ASP 76 Cb 0.26 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 1iem h ASP 76 CO -0.01 0.87 0.33 0.00 -2.88 0.00 0.00 179.24 177.55 1iem h ALA 77 N 1.21 0.91 0.02 -0.78 0.00 -0.27 0.12 119.26 120.46 1iem h ALA 77 Ca 0.27 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1iem h ALA 77 Cb 0.10 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1iem h ALA 77 CO -0.04 0.48 -0.01 0.82 0.00 0.00 0.00 179.25 180.51 1iem h ILE 78 N 0.99 1.07 -0.74 0.00 2.04 -0.74 -1.93 117.51 118.19 1iem h ILE 78 Ca 0.24 -0.26 0.12 0.00 1.00 0.00 0.00 64.86 65.97 1iem h ILE 78 Cb 0.13 1.24 -0.05 0.00 -0.74 0.00 0.00 36.82 37.41 1iem h ILE 78 CO -0.03 0.07 0.49 0.00 0.00 0.00 0.00 178.15 178.68 1iem h ALA 79 N 0.85 1.99 0.00 1.87 0.00 -0.47 0.19 119.26 123.68 1iem h ALA 79 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1iem h ALA 79 Cb 0.13 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1iem h ALA 79 CO 0.00 -0.17 0.00 0.54 0.00 0.00 0.00 179.25 179.62 1iem n ARG 80 N -4.49 0.09 -0.88 0.00 1.74 -0.00 -4.89 116.66 108.22 1iem n ARG 80 Ca 0.13 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 1iem n ARG 80 Cb 0.44 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.38 1iem n ARG 80 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iem n GLY 81 N 0.96 0.61 0.11 -0.13 0.00 0.66 -4.93 105.19 102.46 1iem n GLY 81 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 1iem n GLY 81 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1iem h GLU 82 N 1.59 0.18 -4.60 1.61 5.08 -1.56 -3.47 114.58 113.40 1iem h GLU 82 Ca 0.00 -0.22 -0.24 0.00 -1.00 0.00 0.00 59.36 57.90 1iem h GLU 82 Cb 0.00 0.07 -0.15 0.00 0.50 0.00 0.00 28.75 29.17 1iem h GLU 82 CO 0.00 0.99 -0.63 0.96 -1.00 0.00 0.00 179.01 179.33 1iem s ILE 83 N -3.07 0.16 -0.01 3.13 -4.36 -1.23 -4.85 121.20 110.98 1iem s ILE 83 Ca -0.02 -1.97 0.02 0.00 -0.26 0.00 0.00 60.65 58.41 1iem s ILE 83 Cb 0.10 -2.37 -0.00 0.00 1.25 0.00 0.00 42.46 41.44 1iem s ILE 83 CO 0.83 -0.16 -0.05 -0.54 0.24 0.00 0.00 174.94 175.26 1iem s LYS 84 N -4.09 0.45 0.55 0.37 1.02 -1.26 -4.32 119.74 112.45 1iem s LYS 84 Ca 0.34 -0.18 0.36 0.00 0.02 0.00 0.00 55.97 56.50 1iem s LYS 84 Cb 0.07 -0.44 1.65 0.00 -0.52 0.00 0.00 37.83 38.59 1iem s LYS 84 CO 0.09 0.10 2.07 -0.07 -0.92 0.00 0.00 175.35 176.62 1iem h LEU 85 N 6.10 0.00 0.00 3.17 3.38 -1.99 -1.33 115.31 124.63 1iem h LEU 85 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1iem h LEU 85 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1iem h LEU 85 CO 0.50 0.00 -0.23 -1.54 0.09 0.00 0.00 178.44 177.26 1iem n SER 86 N -2.98 0.31 -4.77 -0.43 3.41 -1.26 -1.59 113.62 106.31 1iem n SER 86 Ca -0.00 0.21 -0.41 0.00 -0.26 0.00 0.00 58.87 58.40 1iem n SER 86 Cb 0.22 -0.20 -0.02 0.00 -0.26 0.00 0.00 64.21 63.95 1iem n SER 86 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1iem s ASP 87 N -3.24 6.69 0.58 4.04 -0.00 -0.50 -4.82 116.67 119.41 1iem s ASP 87 Ca 0.12 2.76 -0.18 0.00 -0.00 0.00 0.00 52.55 55.25 1iem s ASP 87 Cb 0.17 -2.65 -0.04 0.00 -0.00 0.00 0.00 42.92 40.40 1iem s ASP 87 CO 0.61 -0.60 1.10 -2.16 -0.00 0.00 0.00 175.17 174.13 1iem s PRO 88 N -1.84 3.25 0.28 8.23 0.04 -1.26 -1.75 135.00 141.95 1iem s PRO 88 Ca 0.50 1.47 0.01 0.00 0.04 0.00 0.00 61.00 63.02 1iem s PRO 88 Cb -0.41 -2.00 0.55 0.00 0.04 0.00 0.00 34.50 32.68 1iem s PRO 88 CO 0.55 -0.91 1.84 1.15 0.04 0.00 0.00 177.00 179.67 1iem h THR 89 N 0.82 0.93 0.00 1.26 2.02 -1.02 -2.14 112.91 114.78 1iem h THR 89 Ca -0.49 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.35 1iem h THR 89 Cb 1.25 -0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1iem h THR 89 CO 0.56 0.18 0.00 0.71 0.37 0.00 0.00 175.52 177.35 1iem h THR 90 N 1.01 0.00 -0.04 3.16 1.35 -1.81 -2.41 112.91 114.17 1iem h THR 90 Ca 0.49 -0.07 -0.09 0.00 -0.55 0.00 0.00 66.41 66.20 1iem h THR 90 Cb 0.47 0.65 -0.01 0.00 -1.73 0.00 0.00 68.15 67.53 1iem h THR 90 CO -0.26 0.00 -0.39 0.50 -0.25 0.00 0.00 175.52 175.12 1iem h LYS 91 N 0.00 0.07 -0.02 4.72 3.64 -1.76 -1.95 116.57 121.28 1iem h LYS 91 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1iem h LYS 91 Cb 0.10 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1iem h LYS 91 CO 0.00 0.46 -0.40 0.66 -2.27 0.00 0.00 179.45 177.89 1iem n TYR 92 N -4.06 0.00 -3.04 1.91 4.01 -0.92 -4.54 117.16 110.52 1iem n TYR 92 Ca -0.02 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.54 1iem n TYR 92 Cb 0.44 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.44 1iem n TYR 92 CO 0.00 0.00 0.00 1.87 -0.46 0.00 0.00 176.86 178.27 1iem n TRP 93 N 0.14 -1.33 0.22 -0.72 -0.00 -1.10 -4.97 117.44 109.68 1iem n TRP 93 Ca 0.10 -2.98 0.12 0.00 -0.00 0.00 0.00 57.50 54.74 1iem n TRP 93 Cb 0.47 0.30 0.65 0.00 -0.00 0.00 0.00 31.31 32.73 1iem n TRP 93 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1iem h PRO 94 N 3.89 0.00 0.00 5.87 0.13 -1.59 0.69 132.00 140.99 1iem h PRO 94 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1iem h PRO 94 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1iem h PRO 94 CO 0.41 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.11 1iem h GLU 95 N 0.00 0.00 -6.19 0.86 3.07 -1.93 -3.38 114.58 107.00 1iem h GLU 95 Ca 0.00 0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 58.28 1iem h GLU 95 Cb 0.33 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 28.14 1iem h GLU 95 CO 0.00 0.00 1.33 -0.51 -1.40 0.00 0.00 179.01 178.43 1iem s LEU 96 N -5.08 3.39 0.00 1.33 1.43 0.23 -4.77 118.68 115.21 1iem s LEU 96 Ca 0.04 -1.08 0.18 0.00 -1.03 0.00 0.00 54.13 52.24 1iem s LEU 96 Cb 0.09 -2.56 -0.17 0.00 0.03 0.00 0.00 46.19 43.58 1iem s LEU 96 CO 0.48 -1.63 0.77 0.35 0.23 0.00 0.00 176.35 176.55 1iem n THR 97 N 6.69 0.00 -1.73 5.49 -2.24 -1.26 -4.85 114.28 116.37 1iem n THR 97 Ca 0.22 -0.11 -0.42 0.00 -2.27 0.00 0.00 64.05 61.47 1iem n THR 97 Cb 0.50 1.02 -0.02 0.00 -2.10 0.00 0.00 70.33 69.74 1iem n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iem n ALA 98 N -1.28 2.22 0.32 6.98 0.00 -1.26 -4.88 120.51 122.61 1iem n ALA 98 Ca 0.04 0.38 0.21 0.00 0.00 0.00 0.00 53.44 54.07 1iem n ALA 98 Cb 0.29 -2.42 1.14 0.00 0.00 0.00 0.00 19.45 18.46 1iem n ALA 98 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1iem h LYS 99 N 4.43 0.00 0.00 0.00 6.56 -1.93 -2.38 116.57 123.25 1iem h LYS 99 Ca -0.47 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.12 1iem h LYS 99 Cb 1.24 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.90 1iem h LYS 99 CO 0.77 0.00 0.00 0.00 -2.06 0.00 0.00 179.45 178.16 1iem n GLN 100 N -2.96 0.11 0.00 3.15 0.00 -1.26 -2.58 117.38 113.84 1iem n GLN 100 Ca -0.03 0.37 0.13 0.00 0.00 0.00 0.00 57.00 57.48 1iem n GLN 100 Cb 0.07 -1.72 0.46 0.00 0.00 0.00 0.00 30.24 29.04 1iem n GLN 100 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 1iem n TRP 101 N -1.94 0.03 -1.91 2.61 7.02 -0.90 -4.75 117.44 117.60 1iem n TRP 101 Ca 0.02 0.01 -0.42 0.00 -1.02 0.00 0.00 57.50 56.09 1iem n TRP 101 Cb 0.19 -0.41 -0.03 0.00 -2.42 0.00 0.00 31.31 28.64 1iem n TRP 101 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 1iem s ASN 102 N -3.05 6.57 0.00 -0.99 0.01 -1.07 -1.80 114.94 114.62 1iem s ASN 102 Ca 0.13 2.59 0.00 0.00 -0.71 0.00 0.00 52.86 54.87 1iem s ASN 102 Cb 0.18 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.26 1iem s ASN 102 CO 0.60 -0.86 0.00 0.61 -1.51 0.00 0.00 177.10 175.94 1iem n GLY 103 N 3.88 1.22 3.53 0.66 0.00 -1.26 -5.01 105.19 108.20 1iem n GLY 103 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1iem n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iem s ILE 104 N -2.67 4.99 0.53 -0.61 1.01 -0.74 -4.90 121.20 118.80 1iem s ILE 104 Ca 0.00 0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.84 1iem s ILE 104 Cb 0.00 -4.04 0.06 0.00 0.01 0.00 0.00 42.46 38.49 1iem s ILE 104 CO 0.00 -0.35 0.73 0.42 0.00 0.00 0.00 174.94 175.74 1iem s THR 105 N 2.43 2.54 0.37 2.92 -4.23 -1.26 -0.45 115.64 117.96 1iem s THR 105 Ca 0.18 -0.91 0.11 0.00 -1.18 0.00 0.00 61.69 59.89 1iem s THR 105 Cb -0.15 -2.63 0.11 0.00 1.34 0.00 0.00 72.50 71.17 1iem s THR 105 CO 0.15 0.00 1.85 -0.07 -0.54 0.00 0.00 174.62 176.01 1iem h LEU 106 N 0.26 0.12 -0.21 4.79 3.38 -1.35 -2.09 115.31 120.20 1iem h LEU 106 Ca -0.36 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.59 1iem h LEU 106 Cb 1.28 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.98 1iem h LEU 106 CO 0.44 0.40 0.09 0.25 0.09 0.00 0.00 178.44 179.71 1iem h LEU 107 N 0.11 0.12 -0.22 1.67 5.85 -1.57 -1.02 115.31 120.25 1iem h LEU 107 Ca 0.02 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1iem h LEU 107 Cb 0.56 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 1iem h LEU 107 CO 0.04 0.10 -0.07 0.45 -0.34 0.00 0.00 178.44 178.62 1iem h HIS 108 N 0.20 -0.16 -0.24 1.25 3.86 -1.67 -1.14 115.15 117.25 1iem h HIS 108 Ca 0.09 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1iem h HIS 108 Cb 0.04 0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 1iem h HIS 108 CO -0.11 -0.12 0.15 -0.07 0.86 0.00 0.00 177.93 178.65 1iem h LEU 109 N -0.03 0.26 -1.87 2.43 3.38 -1.20 -1.17 115.31 117.12 1iem h LEU 109 Ca 0.11 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.11 1iem h LEU 109 Cb 0.19 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1iem h LEU 109 CO -0.24 0.19 0.16 0.00 0.09 0.00 0.00 178.44 178.64 1iem h ALA 110 N 1.09 2.01 -0.27 1.53 0.00 -0.87 -2.39 119.26 120.37 1iem h ALA 110 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1iem h ALA 110 Cb -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1iem h ALA 110 CO -0.03 -0.06 0.00 0.25 0.00 0.00 0.00 179.25 179.42 1iem n THR 111 N -4.49 1.65 -2.49 0.00 -2.24 -0.46 -4.53 114.28 101.71 1iem n THR 111 Ca 0.02 -1.48 -0.19 0.00 -2.27 0.00 0.00 64.05 60.13 1iem n THR 111 Cb 0.20 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1iem n THR 111 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1iem n TYR 112 N -0.13 -1.09 -1.53 4.78 4.02 -0.61 -4.82 117.16 117.78 1iem n TYR 112 Ca 0.16 0.11 0.05 0.00 -0.01 0.00 0.00 57.90 58.21 1iem n TYR 112 Cb 0.65 -3.75 0.20 0.00 -0.02 0.00 0.00 39.34 36.42 1iem n TYR 112 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1iem n THR 113 N -4.11 2.22 0.33 -0.72 -2.24 -0.54 -1.19 114.28 108.03 1iem n THR 113 Ca -0.19 -3.10 0.14 0.00 -2.27 0.00 0.00 64.05 58.63 1iem n THR 113 Cb 0.65 -0.25 0.46 0.00 -2.10 0.00 0.00 70.33 69.09 1iem n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iem h ALA 114 N 0.92 1.00 0.00 6.98 0.00 -1.80 0.07 119.26 126.43 1iem h ALA 114 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1iem h ALA 114 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1iem h ALA 114 CO 0.04 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.70 1iem n GLY 115 N 0.54 1.90 0.00 0.00 0.00 -1.26 -4.16 105.19 102.20 1iem n GLY 115 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1iem n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iem n GLY 116 N 0.00 1.73 3.75 -0.02 0.00 -1.26 -0.86 105.19 108.52 1iem n GLY 116 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1iem n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iem s LEU 117 N 0.00 4.35 0.75 0.99 1.43 -1.26 -4.79 118.68 120.15 1iem s LEU 117 Ca 0.00 2.90 -0.15 0.00 -1.03 0.00 0.00 54.13 55.85 1iem s LEU 117 Cb 0.00 -3.63 0.05 0.00 0.03 0.00 0.00 46.19 42.64 1iem s LEU 117 CO 0.00 -0.89 1.23 -2.16 0.23 0.00 0.00 176.35 174.76 1iem s PRO 118 N -0.27 1.98 0.19 1.29 0.04 -1.26 -4.71 135.00 132.26 1iem s PRO 118 Ca 0.64 1.86 -0.10 0.00 0.04 0.00 0.00 61.00 63.44 1iem s PRO 118 Cb -0.47 -1.80 0.11 0.00 0.04 0.00 0.00 34.50 32.37 1iem s PRO 118 CO 0.45 -1.98 1.74 1.25 0.04 0.00 0.00 177.00 178.50 1iem h LEU 119 N -0.37 0.97 -9.06 -3.56 5.85 -1.91 -3.26 115.31 103.97 1iem h LEU 119 Ca -0.48 -0.19 -0.68 0.00 0.84 0.00 0.00 57.88 57.37 1iem h LEU 119 Cb 1.31 -0.25 -0.20 0.00 0.37 0.00 0.00 40.66 41.89 1iem h LEU 119 CO 0.49 0.89 -0.74 -1.10 -0.34 0.00 0.00 178.44 177.64 1iem s GLN 120 N -5.49 2.48 0.00 1.25 -1.52 -1.26 -1.09 119.66 114.03 1iem s GLN 120 Ca -0.13 -0.74 -0.28 0.00 -1.95 0.00 0.00 55.36 52.27 1iem s GLN 120 Cb 0.14 -2.43 -0.04 0.00 -0.22 0.00 0.00 33.01 30.47 1iem s GLN 120 CO 0.82 0.61 0.91 0.08 -0.25 0.00 0.00 175.29 177.45 1iem s VAL 121 N -0.89 4.85 0.32 1.09 1.01 -1.26 -4.84 120.40 120.69 1iem s VAL 121 Ca 0.14 1.91 -0.27 0.00 0.00 0.00 0.00 61.98 63.76 1iem s VAL 121 Cb -0.11 -4.25 -0.13 0.00 0.00 0.00 0.00 36.38 31.89 1iem s VAL 121 CO 0.04 0.21 0.99 -2.65 0.00 0.00 0.00 175.10 173.69 1iem n PRO 122 N 3.67 1.33 -0.28 2.72 -0.02 -1.26 -4.85 135.00 136.31 1iem n PRO 122 Ca 0.04 0.47 0.06 0.00 -2.02 0.00 0.00 63.50 62.05 1iem n PRO 122 Cb 0.51 -1.88 0.21 0.00 -0.02 0.00 0.00 33.50 32.32 1iem n PRO 122 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1iem h ASP 123 N 1.85 0.46 0.00 2.55 3.32 -2.02 -1.29 116.42 121.29 1iem h ASP 123 Ca -0.41 0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.74 1iem h ASP 123 Cb 1.34 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.92 1iem h ASP 123 CO 0.59 0.19 0.00 -1.84 -1.72 0.00 0.00 179.24 176.46 1iem n GLU 124 N -4.91 0.00 -3.12 3.56 0.00 -1.26 -4.47 120.64 110.44 1iem n GLU 124 Ca 0.16 0.22 -0.44 0.00 0.00 0.00 0.00 57.16 57.10 1iem n GLU 124 Cb 0.43 -1.50 -0.05 0.00 0.00 0.00 0.00 31.44 30.31 1iem n GLU 124 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1iem s VAL 125 N -2.45 4.83 -0.04 3.84 1.01 -0.49 -4.87 120.40 122.24 1iem s VAL 125 Ca 0.00 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.27 1iem s VAL 125 Cb 0.00 -4.38 -0.03 0.00 0.00 0.00 0.00 36.38 31.97 1iem s VAL 125 CO 0.00 -0.95 -0.13 0.29 0.00 0.00 0.00 175.10 174.31 1iem n LYS 126 N 6.31 0.21 -1.77 2.72 4.01 -1.26 -4.32 118.16 124.06 1iem n LYS 126 Ca -0.07 0.09 -0.29 0.00 -0.51 0.00 0.00 58.31 57.52 1iem n LYS 126 Cb 0.44 -0.86 0.10 0.00 -0.51 0.00 0.00 35.03 34.21 1iem n LYS 126 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 1iem s SER 127 N -5.96 4.18 0.44 4.39 1.04 -1.26 -4.87 113.70 111.66 1iem s SER 127 Ca -0.12 0.85 0.21 0.00 0.48 0.00 0.00 55.95 57.37 1iem s SER 127 Cb 0.03 -1.38 1.02 0.00 0.10 0.00 0.00 66.02 65.79 1iem s SER 127 CO 0.17 -2.12 1.91 0.77 0.98 0.00 0.00 173.24 174.95 1iem h SER 128 N -1.20 0.00 1.21 7.02 4.64 -2.00 -1.72 113.55 121.50 1iem h SER 128 Ca -0.48 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.68 1iem h SER 128 Cb 1.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.40 1iem h SER 128 CO 0.65 0.25 -0.81 0.77 -0.87 0.00 0.00 176.83 176.82 1iem h SER 129 N 0.00 0.00 0.32 4.97 4.64 -1.99 -2.34 113.55 119.15 1iem h SER 129 Ca -0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.25 1iem h SER 129 Cb 0.58 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 1iem h SER 129 CO 0.03 0.74 -0.30 0.44 -0.87 0.00 0.00 176.83 176.88 1iem h ASP 130 N 0.00 0.00 0.23 4.97 3.45 -1.67 -0.96 116.42 122.43 1iem h ASP 130 Ca -0.02 0.00 -0.30 0.00 0.43 0.00 0.00 57.03 57.14 1iem h ASP 130 Cb 1.59 0.00 0.03 0.00 -0.56 0.00 0.00 39.33 40.39 1iem h ASP 130 CO 0.09 0.30 -1.30 0.25 -1.57 0.00 0.00 179.24 177.01 1iem h LEU 131 N 0.00 0.75 -0.12 1.55 5.85 -1.30 -2.61 115.31 119.42 1iem h LEU 131 Ca -0.00 -0.93 0.02 0.00 0.84 0.00 0.00 57.88 57.81 1iem h LEU 131 Cb 0.54 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1iem h LEU 131 CO 0.04 1.63 -0.02 0.25 -0.34 0.00 0.00 178.44 180.00 1iem h LEU 132 N 0.01 -0.08 -0.64 2.25 5.85 -1.07 -1.97 115.31 119.66 1iem h LEU 132 Ca -0.23 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.62 1iem h LEU 132 Cb 2.03 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 43.05 1iem h LEU 132 CO 0.25 -0.02 0.28 -0.09 -0.34 0.00 0.00 178.44 178.51 1iem h ARG 133 N 0.02 0.47 -0.18 1.25 2.43 -1.26 -0.62 114.38 116.49 1iem h ARG 133 Ca 0.06 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.22 1iem h ARG 133 Cb 0.08 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.50 1iem h ARG 133 CO -0.11 0.31 0.03 0.35 -1.51 0.00 0.00 179.97 179.04 1iem h PHE 134 N 0.48 0.05 -0.30 2.20 3.57 -1.01 -1.43 116.94 120.51 1iem h PHE 134 Ca 0.32 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.70 1iem h PHE 134 Cb 0.37 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 1iem h PHE 134 CO -0.14 0.02 -0.35 1.88 -2.23 0.00 0.00 178.31 177.49 1iem h TYR 135 N 0.10 0.79 -0.76 0.41 0.05 -0.92 -1.02 116.97 115.62 1iem h TYR 135 Ca 0.08 -0.22 -0.04 0.00 0.05 0.00 0.00 58.73 58.61 1iem h TYR 135 Cb 0.07 -0.18 -0.03 0.00 1.01 0.00 0.00 36.73 37.60 1iem h TYR 135 CO -0.14 0.93 0.34 1.96 -1.05 0.00 0.00 178.16 180.20 1iem h GLN 136 N 0.57 1.12 0.00 4.88 1.08 -0.98 -3.08 115.11 118.70 1iem h GLN 136 Ca 0.06 -0.18 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 1iem h GLN 136 Cb 0.86 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 1iem h GLN 136 CO 0.07 0.89 -0.47 -0.91 -0.95 0.00 0.00 178.83 177.46 1iem h ASN 137 N 1.09 0.00 -3.02 1.46 2.35 -1.12 -3.45 115.58 112.89 1iem h ASN 137 Ca 0.26 -0.04 -0.54 0.00 -0.55 0.00 0.00 56.30 55.43 1iem h ASN 137 Cb 0.16 0.00 0.08 0.00 0.05 0.00 0.00 38.32 38.61 1iem h ASN 137 CO -0.03 0.02 0.88 1.87 -1.65 0.00 0.00 177.43 178.52 1iem n TRP 138 N -2.68 2.72 -4.01 1.19 -0.00 -0.40 -4.99 117.44 109.27 1iem n TRP 138 Ca 0.03 0.23 -0.35 0.00 -0.00 0.00 0.00 57.50 57.41 1iem n TRP 138 Cb 0.51 -2.60 -0.14 0.00 -0.00 0.00 0.00 31.31 29.09 1iem n TRP 138 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 1iem s GLN 139 N -0.05 3.40 0.39 5.87 -1.52 -1.26 -4.97 119.66 121.52 1iem s GLN 139 Ca 0.68 -0.62 -0.26 0.00 -1.95 0.00 0.00 55.36 53.21 1iem s GLN 139 Cb -0.52 -2.98 -0.09 0.00 -0.22 0.00 0.00 33.01 29.20 1iem s GLN 139 CO 0.44 -0.13 1.22 -1.25 -0.25 0.00 0.00 175.29 175.33 1iem s PRO 140 N 1.30 4.07 0.07 2.91 0.04 -1.26 -4.91 135.00 137.22 1iem s PRO 140 Ca 0.04 1.98 0.23 0.00 0.04 0.00 0.00 61.00 63.29 1iem s PRO 140 Cb -0.14 -2.76 0.12 0.00 0.04 0.00 0.00 34.50 31.76 1iem s PRO 140 CO -0.02 -0.35 1.10 0.00 0.04 0.00 0.00 177.00 177.77 1iem n ALA 141 N 0.20 3.27 -2.36 8.56 0.00 -0.04 -4.95 120.51 125.19 1iem n ALA 141 Ca 0.04 -0.36 -0.08 0.00 0.00 0.00 0.00 53.44 53.03 1iem n ALA 141 Cb 0.45 -1.02 -0.09 0.00 0.00 0.00 0.00 19.45 18.78 1iem n ALA 141 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1iem s TRP 142 N -3.19 0.37 0.63 0.00 0.51 -0.95 -5.04 118.94 111.25 1iem s TRP 142 Ca 0.04 -0.83 -0.17 0.00 -2.12 0.00 0.00 56.10 53.02 1iem s TRP 142 Cb 0.14 -0.26 -0.02 0.00 -0.81 0.00 0.00 33.47 32.52 1iem s TRP 142 CO 0.78 -0.40 1.15 0.00 -0.51 0.00 0.00 176.95 177.97 1iem s ALA 143 N -3.54 2.49 0.48 0.98 0.00 -1.26 -4.43 121.76 116.48 1iem s ALA 143 Ca 0.03 0.76 -0.24 0.00 0.00 0.00 0.00 51.96 52.52 1iem s ALA 143 Cb 0.05 -3.38 -0.07 0.00 0.00 0.00 0.00 23.12 19.71 1iem s ALA 143 CO -0.09 -1.22 1.37 -0.35 0.00 0.00 0.00 175.76 175.47 1iem n PRO 144 N -2.01 1.97 -2.33 0.00 -0.04 -1.26 -3.15 135.00 128.17 1iem n PRO 144 Ca 0.12 0.71 -0.15 0.00 -0.04 0.00 0.00 63.50 64.14 1iem n PRO 144 Cb 0.51 -2.56 -0.00 0.00 -0.04 0.00 0.00 33.50 31.41 1iem n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1iem n GLY 145 N 0.70 -0.23 0.00 0.55 0.00 0.01 -4.88 105.19 101.34 1iem n GLY 145 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1iem n GLY 145 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iem n THR 146 N -4.03 0.00 -4.21 2.61 -2.24 -1.19 -4.85 114.28 100.37 1iem n THR 146 Ca -0.17 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.45 1iem n THR 146 Cb 0.63 -0.54 -0.13 0.00 -2.10 0.00 0.00 70.33 68.19 1iem n THR 146 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1iem s GLN 147 N -1.71 0.67 -0.21 -0.78 2.00 -1.26 -2.57 119.66 115.80 1iem s GLN 147 Ca 0.00 -0.62 -0.05 0.00 -2.00 0.00 0.00 55.36 52.69 1iem s GLN 147 Cb 0.00 -0.59 -0.02 0.00 0.80 0.00 0.00 33.01 33.20 1iem s GLN 147 CO 0.00 0.14 -0.00 0.50 -0.50 0.00 0.00 175.29 175.43 1iem s ARG 148 N -1.05 3.56 -0.29 1.67 3.52 0.15 -4.20 118.95 122.31 1iem s ARG 148 Ca -0.02 -0.54 -0.02 0.00 -0.13 0.00 0.00 55.73 55.01 1iem s ARG 148 Cb -0.07 -3.09 0.09 0.00 -1.56 0.00 0.00 34.95 30.32 1iem s ARG 148 CO 0.01 -0.07 0.09 -1.17 -0.81 0.00 0.00 175.30 173.35 1iem s LEU 149 N 1.20 1.71 -0.23 -0.88 2.96 -0.33 -1.84 118.68 121.28 1iem s LEU 149 Ca 0.03 -1.42 -0.39 0.00 -0.22 0.00 0.00 54.13 52.13 1iem s LEU 149 Cb -0.15 -0.72 -0.15 0.00 0.50 0.00 0.00 46.19 45.68 1iem s LEU 149 CO 0.01 -0.40 1.75 0.00 -1.32 0.00 0.00 176.35 176.39 1iem n TYR 150 N 4.96 2.08 -3.72 5.38 4.19 -1.26 -4.78 117.16 124.01 1iem n TYR 150 Ca -0.04 0.45 -0.13 0.00 3.31 0.00 0.00 57.90 61.49 1iem n TYR 150 Cb 0.43 -2.49 -0.10 0.00 0.49 0.00 0.00 39.34 37.67 1iem n TYR 150 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1iem s ALA 151 N 3.47 -1.10 0.25 2.98 0.00 -1.26 -4.31 121.76 121.78 1iem s ALA 151 Ca 0.97 1.32 -0.02 0.00 0.00 0.00 0.00 51.96 54.23 1iem s ALA 151 Cb -1.00 -0.77 0.31 0.00 0.00 0.00 0.00 23.12 21.65 1iem s ALA 151 CO 0.62 -0.22 1.71 -0.91 0.00 0.00 0.00 175.76 176.96 1iem h ASN 152 N 5.76 0.70 0.59 0.00 2.35 -1.26 -2.74 115.58 120.97 1iem h ASN 152 Ca -0.29 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 1iem h ASN 152 Cb 1.18 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.36 1iem h ASN 152 CO 0.24 0.85 0.00 0.77 -1.65 0.00 0.00 177.43 177.64 1iem h SER 153 N 0.64 0.00 0.00 5.81 4.64 -1.66 0.18 113.55 123.16 1iem h SER 153 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1iem h SER 153 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1iem h SER 153 CO 0.04 0.00 -0.35 -0.24 -0.87 0.00 0.00 176.83 175.41 1iem n SER 154 N -2.43 1.10 0.24 4.97 2.88 -1.05 -3.70 113.62 115.63 1iem n SER 154 Ca 0.01 0.44 0.12 0.00 -1.33 0.00 0.00 58.87 58.11 1iem n SER 154 Cb 0.19 -0.71 0.55 0.00 -0.75 0.00 0.00 64.21 63.49 1iem n SER 154 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 1iem h ILE 155 N -0.60 0.40 -0.37 2.46 2.10 -1.26 -2.27 117.51 117.98 1iem h ILE 155 Ca 0.00 -0.90 -0.07 0.00 1.08 0.00 0.00 64.86 64.97 1iem h ILE 155 Cb 0.35 1.66 -0.01 0.00 -1.09 0.00 0.00 36.82 37.73 1iem h ILE 155 CO 0.00 0.15 -0.06 1.23 -1.08 0.00 0.00 178.15 178.39 1iem h GLY 156 N 1.95 0.75 1.02 8.18 0.00 -0.85 -1.94 103.07 112.18 1iem h GLY 156 Ca -0.00 -0.60 -0.05 0.00 0.00 0.00 0.00 47.33 46.68 1iem h GLY 156 CO 0.02 0.55 0.21 -2.00 0.00 0.00 0.00 176.54 175.31 1iem h LEU 157 N 0.50 0.94 -0.24 3.11 5.85 -1.51 -1.88 115.31 122.08 1iem h LEU 157 Ca 0.10 -0.20 0.06 0.00 0.84 0.00 0.00 57.88 58.67 1iem h LEU 157 Cb 0.56 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.27 1iem h LEU 157 CO 0.03 0.90 -0.28 0.15 -0.34 0.00 0.00 178.44 178.90 1iem h PHE 158 N 0.94 -0.74 -0.78 1.25 3.57 -1.27 0.43 116.94 120.33 1iem h PHE 158 Ca 0.21 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.82 1iem h PHE 158 Cb 0.29 0.36 -0.06 0.00 2.79 0.00 0.00 35.95 39.33 1iem h PHE 158 CO 0.02 -0.35 0.46 0.78 -2.23 0.00 0.00 178.31 176.99 1iem h GLY 159 N -0.29 1.18 1.06 2.40 0.00 -0.95 0.29 103.07 106.77 1iem h GLY 159 Ca 0.13 -0.32 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 1iem h GLY 159 CO -0.40 0.19 0.13 0.00 0.00 0.00 0.00 176.54 176.46 1iem h ALA 160 N 1.40 0.89 0.03 3.60 0.00 -0.52 -3.13 119.26 121.53 1iem h ALA 160 Ca 0.36 -0.26 -0.25 0.00 0.00 0.00 0.00 54.91 54.75 1iem h ALA 160 Cb 0.23 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1iem h ALA 160 CO -0.20 0.64 -1.04 -0.07 0.00 0.00 0.00 179.25 178.58 1iem h LEU 161 N 1.03 0.71 -1.29 0.00 3.38 -0.36 -3.33 115.31 115.44 1iem h LEU 161 Ca 0.21 -0.59 0.17 0.00 0.09 0.00 0.00 57.88 57.76 1iem h LEU 161 Cb 0.41 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.87 1iem h LEU 161 CO 0.01 1.40 0.59 0.00 0.09 0.00 0.00 178.44 180.53 1iem h ALA 162 N 0.55 1.90 -0.01 1.53 0.00 -0.39 -1.90 119.26 120.94 1iem h ALA 162 Ca -0.12 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1iem h ALA 162 Cb 1.69 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1iem h ALA 162 CO 0.19 -0.19 -0.14 1.33 0.00 0.00 0.00 179.25 180.44 1iem n VAL 163 N -4.59 0.00 -0.15 0.00 0.24 -1.22 -4.43 118.33 108.19 1iem n VAL 163 Ca 0.19 -0.12 -0.07 0.00 -2.04 0.00 0.00 64.34 62.30 1iem n VAL 163 Cb 0.56 0.21 0.02 0.00 -1.47 0.00 0.00 33.84 33.16 1iem n VAL 163 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1iem h LYS 164 N 1.16 0.55 -0.25 7.34 1.57 -1.47 -2.36 116.57 123.11 1iem h LYS 164 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1iem h LYS 164 Cb 0.43 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1iem h LYS 164 CO 0.00 0.37 0.16 -1.35 -0.57 0.00 0.00 179.45 178.05 1iem h PRO 165 N 0.57 0.33 0.00 3.15 0.11 -1.78 -0.58 132.00 133.80 1iem h PRO 165 Ca 0.18 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.25 1iem h PRO 165 Cb -0.01 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.02 1iem h PRO 165 CO -0.07 0.23 -0.09 0.66 -0.21 0.00 0.00 178.00 178.52 1iem h SER 166 N 0.34 0.00 0.00 -2.05 4.64 -1.71 -3.45 113.55 111.32 1iem h SER 166 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1iem h SER 166 Cb -0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 1iem h SER 166 CO -0.02 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 176.64 1iem n GLY 167 N -0.74 1.66 3.93 -0.77 0.00 -0.23 -5.01 105.19 104.04 1iem n GLY 167 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 1iem n GLY 167 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iem s LEU 168 N 0.00 3.66 0.50 0.99 1.43 -1.25 -5.07 118.68 118.94 1iem s LEU 168 Ca 0.00 0.65 -0.13 0.00 -1.03 0.00 0.00 54.13 53.62 1iem s LEU 168 Cb 0.00 -3.54 -0.06 0.00 0.03 0.00 0.00 46.19 42.61 1iem s LEU 168 CO 0.00 -0.61 0.91 -0.94 0.23 0.00 0.00 176.35 175.94 1iem s SER 169 N -4.14 6.48 0.21 2.29 1.04 -1.26 -4.67 113.70 113.65 1iem s SER 169 Ca 0.47 1.35 -0.09 0.00 0.48 0.00 0.00 55.95 58.16 1iem s SER 169 Cb -0.10 -2.42 0.31 0.00 0.10 0.00 0.00 66.02 63.91 1iem s SER 169 CO 0.41 -0.59 1.71 0.15 0.98 0.00 0.00 173.24 175.91 1iem h PHE 170 N 0.70 0.25 0.00 5.02 3.57 -1.93 0.16 116.94 124.71 1iem h PHE 170 Ca -0.46 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.07 1iem h PHE 170 Cb 1.19 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.91 1iem h PHE 170 CO 0.63 -0.01 -0.00 1.49 -2.23 0.00 0.00 178.31 178.18 1iem h GLU 171 N 0.29 -0.00 -0.52 1.11 4.81 -1.99 -0.46 114.58 117.82 1iem h GLU 171 Ca 0.33 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.62 1iem h GLU 171 Cb 0.48 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.81 1iem h GLU 171 CO -0.40 0.17 0.22 0.37 -0.73 0.00 0.00 179.01 178.64 1iem h GLN 172 N -0.17 0.41 -0.15 1.92 5.75 -1.82 0.46 115.11 121.52 1iem h GLN 172 Ca -0.00 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1iem h GLN 172 Cb 0.17 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.62 1iem h GLN 172 CO 0.00 0.27 0.09 0.00 -2.65 0.00 0.00 178.83 176.55 1iem h ALA 173 N 1.32 0.19 -0.44 3.38 0.00 -0.56 -0.90 119.26 122.24 1iem h ALA 173 Ca 0.24 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.18 1iem h ALA 173 Cb 0.22 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1iem h ALA 173 CO -0.22 -0.32 0.18 1.98 0.00 0.00 0.00 179.25 180.88 1iem h MET 174 N 0.19 0.36 0.43 0.00 1.85 -0.42 0.27 114.93 117.61 1iem h MET 174 Ca 0.05 -0.02 -0.02 0.00 -0.61 0.00 0.00 59.70 59.10 1iem h MET 174 Cb -0.01 -0.08 0.00 0.00 0.43 0.00 0.00 31.60 31.94 1iem h MET 174 CO -0.01 0.24 -0.21 1.96 -0.40 0.00 0.00 176.91 178.49 1iem h GLN 175 N 0.37 -0.55 -0.44 0.39 4.20 -0.72 -0.04 115.11 118.31 1iem h GLN 175 Ca 0.20 0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.86 1iem h GLN 175 Cb 0.16 0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1iem h GLN 175 CO -0.18 -0.31 -0.07 1.15 -0.67 0.00 0.00 178.83 178.75 1iem h THR 176 N -0.69 1.25 0.00 -0.54 2.02 -1.06 -0.04 112.91 113.86 1iem h THR 176 Ca -0.06 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.02 1iem h THR 176 Cb 0.50 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 1iem h THR 176 CO 0.10 0.38 -1.83 0.54 0.37 0.00 0.00 175.52 175.07 1iem n ARG 177 N -4.18 0.59 0.07 6.66 1.74 0.07 -4.49 116.66 117.11 1iem n ARG 177 Ca 0.02 -0.16 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 1iem n ARG 177 Cb 0.34 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 1iem n ARG 177 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1iem n VAL 178 N -2.21 0.82 0.11 1.55 0.31 -0.14 -4.75 118.33 114.03 1iem n VAL 178 Ca -0.03 0.27 -0.13 0.00 -0.01 0.00 0.00 64.34 64.44 1iem n VAL 178 Cb 0.54 -1.31 -0.07 0.00 -0.91 0.00 0.00 33.84 32.10 1iem n VAL 178 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1iem h PHE 179 N 0.00 -0.29 0.26 3.52 0.04 -1.21 -2.97 116.94 116.30 1iem h PHE 179 Ca 0.00 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 1iem h PHE 179 Cb 0.09 0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.35 1iem h PHE 179 CO 0.00 -0.18 -0.13 1.96 -0.60 0.00 0.00 178.31 179.37 1iem h GLN 180 N -0.27 -0.34 -0.98 1.51 4.20 -1.25 0.15 115.11 118.13 1iem h GLN 180 Ca -0.00 0.02 0.15 0.00 0.06 0.00 0.00 58.65 58.88 1iem h GLN 180 Cb 0.24 0.08 -0.10 0.00 0.30 0.00 0.00 27.48 28.00 1iem h GLN 180 CO -0.01 -0.10 0.60 -1.35 -0.67 0.00 0.00 178.83 177.29 1iem h PRO 181 N -0.53 0.83 -0.06 1.46 0.11 -1.79 0.93 132.00 132.96 1iem h PRO 181 Ca -0.04 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.02 1iem h PRO 181 Cb 0.39 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 31.31 1iem h PRO 181 CO 0.06 0.55 0.00 1.28 -0.21 0.00 0.00 178.00 179.67 1iem n LEU 182 N -4.71 0.85 -3.70 2.35 4.77 -1.12 -4.93 117.00 110.50 1iem n LEU 182 Ca 0.20 -0.33 -0.25 0.00 -0.03 0.00 0.00 56.01 55.60 1iem n LEU 182 Cb 0.45 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.56 1iem n LEU 182 CO 0.24 0.17 0.15 0.29 -1.33 0.00 0.00 177.39 176.90 1iem n LYS 183 N -0.26 -6.65 -3.06 3.23 5.02 0.32 -4.90 118.16 111.86 1iem n LYS 183 Ca 0.17 0.73 -0.44 0.00 -2.02 0.00 0.00 58.31 56.75 1iem n LYS 183 Cb 0.22 -5.67 0.00 0.00 -0.02 0.00 0.00 35.03 29.56 1iem n LYS 183 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1iem n LEU 184 N -4.72 5.54 -0.48 -0.35 4.77 0.47 -4.80 117.00 117.43 1iem n LEU 184 Ca -0.05 -4.76 0.05 0.00 -0.03 0.00 0.00 56.01 51.22 1iem n LEU 184 Cb 0.57 -1.53 0.17 0.00 -2.33 0.00 0.00 43.42 40.31 1iem n LEU 184 CO 0.69 1.10 0.64 0.59 -1.33 0.00 0.00 177.39 179.07 1iem n ASN 185 N 4.00 1.39 -2.72 -1.43 3.02 -1.26 -3.69 115.26 114.58 1iem n ASN 185 Ca 0.31 -1.93 -0.06 0.00 -0.03 0.00 0.00 54.58 52.87 1iem n ASN 185 Cb 0.40 -0.16 0.04 0.00 -0.61 0.00 0.00 39.78 39.45 1iem n ASN 185 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1iem n HIS 186 N 0.24 1.33 -3.93 3.10 8.25 -1.26 -5.02 115.22 117.92 1iem n HIS 186 Ca 0.10 -2.46 -0.26 0.00 -0.26 0.00 0.00 57.72 54.84 1iem n HIS 186 Cb 0.23 -0.30 -0.17 0.00 1.12 0.00 0.00 29.99 30.88 1iem n HIS 186 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1iem s THR 187 N -3.59 0.94 0.03 1.59 2.01 -1.24 -3.39 115.64 111.99 1iem s THR 187 Ca 0.29 -0.24 0.02 0.00 0.31 0.00 0.00 61.69 62.06 1iem s THR 187 Cb 0.39 -0.97 -0.02 0.00 0.01 0.00 0.00 72.50 71.90 1iem s THR 187 CO -0.01 0.35 -0.06 0.26 -0.69 0.00 0.00 174.62 174.47 1iem s TRP 188 N 1.67 0.54 -0.03 4.92 0.52 -0.12 -4.97 118.94 121.46 1iem s TRP 188 Ca 0.04 -0.49 0.01 0.00 0.02 0.00 0.00 56.10 55.68 1iem s TRP 188 Cb -0.13 -0.33 -0.26 0.00 -1.15 0.00 0.00 33.47 31.61 1iem s TRP 188 CO -0.07 -0.11 0.71 0.82 0.02 0.00 0.00 176.95 178.31 1iem h ILE 189 N 4.56 0.96 -3.42 2.03 2.04 -1.86 0.18 117.51 122.01 1iem h ILE 189 Ca -0.34 -2.69 -0.60 0.00 1.00 0.00 0.00 64.86 62.23 1iem h ILE 189 Cb 1.20 2.60 -0.37 0.00 -0.74 0.00 0.00 36.82 39.51 1iem h ILE 189 CO 0.41 0.74 -0.80 0.20 0.00 0.00 0.00 178.15 178.70 1iem s ASN 190 N -6.71 3.29 -0.21 1.72 0.01 -1.26 -4.78 114.94 107.01 1iem s ASN 190 Ca -0.10 -0.86 -0.29 0.00 -0.71 0.00 0.00 52.86 50.90 1iem s ASN 190 Cb 0.07 -1.14 -0.03 0.00 0.41 0.00 0.00 41.25 40.57 1iem s ASN 190 CO 0.82 -0.17 1.55 -0.69 -1.51 0.00 0.00 177.10 177.11 1iem s VAL 191 N 1.46 3.79 0.58 1.60 1.01 -1.26 -4.97 120.40 122.61 1iem s VAL 191 Ca -0.01 0.91 -0.19 0.00 0.00 0.00 0.00 61.98 62.69 1iem s VAL 191 Cb -0.16 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1iem s VAL 191 CO -0.08 -0.27 1.17 -2.16 0.00 0.00 0.00 175.10 173.75 1iem s PRO 192 N 4.43 3.11 0.34 2.72 0.04 -1.26 -4.83 135.00 139.55 1iem s PRO 192 Ca 0.68 1.70 0.12 0.00 0.04 0.00 0.00 61.00 63.54 1iem s PRO 192 Cb -0.25 -1.96 0.97 0.00 0.04 0.00 0.00 34.50 33.31 1iem s PRO 192 CO 0.27 -1.06 1.72 -1.35 0.04 0.00 0.00 177.00 176.62 1iem h PRO 193 N 0.94 0.48 -0.06 0.56 0.11 -2.01 0.18 132.00 132.20 1iem h PRO 193 Ca -0.50 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.60 1iem h PRO 193 Cb 1.28 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1iem h PRO 193 CO 0.56 0.32 0.05 0.00 -0.21 0.00 0.00 178.00 178.71 1iem h ALA 194 N 1.73 1.78 -0.00 -0.75 0.00 -2.02 -2.68 119.26 117.31 1iem h ALA 194 Ca 0.66 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.57 1iem h ALA 194 Cb 1.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1iem h ALA 194 CO -0.47 -0.08 -0.80 0.39 0.00 0.00 0.00 179.25 178.29 1iem n GLU 195 N -4.09 0.25 -0.34 0.00 -0.58 0.60 -4.52 120.64 111.96 1iem n GLU 195 Ca -0.02 -0.20 0.22 0.00 -0.42 0.00 0.00 57.16 56.74 1iem n GLU 195 Cb 0.15 -1.50 0.45 0.00 -0.57 0.00 0.00 31.44 29.97 1iem n GLU 195 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1iem h GLU 196 N 0.49 0.40 0.00 3.49 5.08 -1.22 0.11 114.58 122.93 1iem h GLU 196 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1iem h GLU 196 Cb 0.55 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1iem h GLU 196 CO 0.00 0.27 0.06 1.57 -1.00 0.00 0.00 179.01 179.91 1iem h LYS 197 N 0.41 0.00 -0.01 2.33 2.10 -1.80 -0.55 116.57 119.05 1iem h LYS 197 Ca 0.70 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.35 1iem h LYS 197 Cb 1.52 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.85 1iem h LYS 197 CO -0.56 0.00 -0.41 0.09 -2.00 0.00 0.00 179.45 176.57 1iem n ASN 198 N -2.74 1.77 -4.60 7.07 5.03 0.38 -4.92 115.26 117.25 1iem n ASN 198 Ca -0.02 -1.38 -0.43 0.00 0.87 0.00 0.00 54.58 53.61 1iem n ASN 198 Cb 0.11 0.49 -0.02 0.00 -1.02 0.00 0.00 39.78 39.34 1iem n ASN 198 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1iem s TYR 199 N -2.17 2.68 0.69 3.10 6.04 -0.22 0.17 117.35 127.65 1iem s TYR 199 Ca 0.15 0.72 -0.14 0.00 0.04 0.00 0.00 57.07 57.85 1iem s TYR 199 Cb 0.15 -4.35 0.01 0.00 -1.04 0.00 0.00 41.96 36.73 1iem s TYR 199 CO 0.49 -1.51 1.11 0.00 -1.54 0.00 0.00 175.55 174.09 1iem s ALA 200 N 4.76 2.42 -0.01 3.97 0.00 -0.83 -4.93 121.76 127.14 1iem s ALA 200 Ca 0.53 0.48 -0.15 0.00 0.00 0.00 0.00 51.96 52.82 1iem s ALA 200 Cb -0.10 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.66 1iem s ALA 200 CO 0.31 -1.40 0.41 -1.58 0.00 0.00 0.00 175.76 173.50 1iem s TRP 201 N -2.47 3.72 0.61 0.00 0.52 0.55 -4.92 118.94 116.94 1iem s TRP 201 Ca 0.66 0.99 -0.08 0.00 0.02 0.00 0.00 56.10 57.68 1iem s TRP 201 Cb -0.20 -2.30 -0.00 0.00 -1.15 0.00 0.00 33.47 29.82 1iem s TRP 201 CO 0.45 0.62 0.95 0.20 0.02 0.00 0.00 176.95 179.20 1iem s GLY 202 N -0.99 1.60 -0.06 0.98 0.00 0.10 -4.81 107.32 104.14 1iem s GLY 202 Ca 0.24 -0.49 0.01 0.00 0.00 0.00 0.00 44.72 44.47 1iem s GLY 202 CO 0.13 -0.21 -0.06 -0.19 0.00 0.00 0.00 173.10 172.77 1iem s TYR 203 N -3.08 0.98 -0.20 1.90 1.51 -0.63 -0.71 117.35 117.12 1iem s TYR 203 Ca 0.54 -0.34 -0.02 0.00 -1.01 0.00 0.00 57.07 56.25 1iem s TYR 203 Cb -0.11 -0.83 0.06 0.00 -0.11 0.00 0.00 41.96 40.97 1iem s TYR 203 CO 0.48 -0.26 0.01 0.50 -1.11 0.00 0.00 175.55 175.17 1iem s ARG 204 N 1.03 0.96 -1.40 -0.62 3.00 -0.38 -4.29 118.95 117.25 1iem s ARG 204 Ca -0.09 -0.59 -0.03 0.00 -1.00 0.00 0.00 55.73 54.02 1iem s ARG 204 Cb -0.14 -2.24 0.02 0.00 0.00 0.00 0.00 34.95 32.59 1iem s ARG 204 CO -0.00 -0.62 0.68 0.39 0.00 0.00 0.00 175.30 175.74 1iem n GLU 205 N 4.94 -4.49 0.00 5.12 1.02 -1.26 -1.57 120.64 124.40 1iem n GLU 205 Ca -0.10 0.54 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 1iem n GLU 205 Cb 0.46 -5.05 0.00 0.00 -0.02 0.00 0.00 31.44 26.83 1iem n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iem n GLY 206 N -1.70 2.93 3.80 0.62 0.00 -1.26 -5.01 105.19 104.57 1iem n GLY 206 Ca -0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 1iem n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iem s LYS 207 N -0.05 4.01 -0.04 1.61 1.02 -0.61 -5.06 119.74 120.62 1iem s LYS 207 Ca 0.00 0.26 -0.30 0.00 0.02 0.00 0.00 55.97 55.95 1iem s LYS 207 Cb 0.00 -3.30 -0.03 0.00 -0.52 0.00 0.00 37.83 33.98 1iem s LYS 207 CO 0.00 0.51 1.05 0.00 -0.92 0.00 0.00 175.35 175.98 1iem s ALA 208 N -0.41 3.33 0.02 5.17 0.00 -1.26 -1.25 121.76 127.36 1iem s ALA 208 Ca 0.21 0.52 -0.09 0.00 0.00 0.00 0.00 51.96 52.60 1iem s ALA 208 Cb -0.15 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1iem s ALA 208 CO 0.09 -0.48 0.18 0.14 0.00 0.00 0.00 175.76 175.70 1iem s VAL 209 N 1.58 0.09 0.24 0.00 -7.23 0.11 -4.93 120.40 110.27 1iem s VAL 209 Ca 0.52 -0.78 0.11 0.00 -1.81 0.00 0.00 61.98 60.02 1iem s VAL 209 Cb -0.21 -0.70 -0.05 0.00 0.56 0.00 0.00 36.38 35.98 1iem s VAL 209 CO 0.23 -0.43 -0.19 -1.00 -0.31 0.00 0.00 175.10 173.40 1iem s HIS 210 N -1.98 2.12 0.42 2.82 3.76 -1.26 -0.72 115.29 120.45 1iem s HIS 210 Ca -0.10 -0.40 -0.26 0.00 -0.15 0.00 0.00 55.06 54.15 1iem s HIS 210 Cb -0.04 -0.97 -0.09 0.00 1.11 0.00 0.00 32.58 32.59 1iem s HIS 210 CO -0.01 0.57 1.43 0.54 -0.85 0.00 0.00 174.74 176.42 1iem s VAL 211 N -2.41 2.13 0.07 -0.90 0.11 -1.26 -5.00 120.40 113.14 1iem s VAL 211 Ca 0.25 0.12 -0.07 0.00 -2.93 0.00 0.00 61.98 59.35 1iem s VAL 211 Cb -0.05 -3.07 -0.05 0.00 -1.53 0.00 0.00 36.38 31.68 1iem s VAL 211 CO 0.12 0.02 0.34 -0.44 -3.33 0.00 0.00 175.10 171.81 1iem s SER 212 N -0.40 6.54 0.61 3.54 0.01 -1.26 -5.06 113.70 117.68 1iem s SER 212 Ca 0.57 0.64 -0.19 0.00 1.31 0.00 0.00 55.95 58.29 1iem s SER 212 Cb -0.44 -2.12 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 1iem s SER 212 CO 0.58 0.18 1.21 -2.65 0.41 0.00 0.00 173.24 172.96 1iem n PRO 213 N 0.79 1.17 -3.53 12.44 -0.02 -1.26 -5.00 135.00 139.58 1iem n PRO 213 Ca -0.08 0.45 -0.09 0.00 -2.02 0.00 0.00 63.50 61.76 1iem n PRO 213 Cb 0.52 -2.43 -0.02 0.00 -0.02 0.00 0.00 33.50 31.56 1iem n PRO 213 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1iem s GLY 214 N -1.23 -0.47 0.30 -1.23 0.00 -1.26 -5.08 107.32 98.35 1iem s GLY 214 Ca 0.78 0.52 -0.29 0.00 0.00 0.00 0.00 44.72 45.73 1iem s GLY 214 CO 0.44 0.17 1.37 0.00 0.00 0.00 0.00 173.10 175.08 1iem s ALA 215 N -3.53 3.55 -1.97 3.20 0.00 -1.26 -2.24 121.76 119.52 1iem s ALA 215 Ca 0.05 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1iem s ALA 215 Cb -0.02 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1iem s ALA 215 CO -0.08 -0.70 0.00 1.28 0.00 0.00 0.00 175.76 176.26 1iem n LEU 216 N 1.41 -1.51 -0.20 0.00 4.77 -1.26 -4.88 117.00 115.33 1iem n LEU 216 Ca 0.03 0.37 -0.08 0.00 -0.03 0.00 0.00 56.01 56.30 1iem n LEU 216 Cb 0.41 -2.73 0.02 0.00 -2.33 0.00 0.00 43.42 38.79 1iem n LEU 216 CO 0.60 -0.82 0.94 -2.24 -1.33 0.00 0.00 177.39 174.54 1iem h ASP 217 N 0.00 0.83 -0.18 -1.43 3.04 -1.87 -2.00 116.42 114.80 1iem h ASP 217 Ca -0.41 -0.20 0.00 0.00 -3.24 0.00 0.00 57.03 53.18 1iem h ASP 217 Cb 1.29 -0.22 -0.01 0.00 -1.04 0.00 0.00 39.33 39.35 1iem h ASP 217 CO 0.57 0.81 0.12 0.00 -2.04 0.00 0.00 179.24 178.70 1iem h ALA 218 N 1.05 0.23 -0.00 4.15 0.00 -1.89 0.35 119.26 123.15 1iem h ALA 218 Ca 0.18 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1iem h ALA 218 Cb 0.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1iem h ALA 218 CO -0.01 -0.29 -0.40 0.93 0.00 0.00 0.00 179.25 179.48 1iem h GLU 219 N 0.24 0.00 0.00 0.00 3.07 -1.88 -3.27 114.58 112.74 1iem h GLU 219 Ca 0.07 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1iem h GLU 219 Cb -0.02 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1iem h GLU 219 CO -0.02 0.40 -1.53 0.00 -1.40 0.00 0.00 179.01 176.46 1iem n ALA 220 N -2.46 2.45 -1.55 3.43 0.00 -0.76 -4.59 120.51 117.02 1iem n ALA 220 Ca -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 53.44 53.13 1iem n ALA 220 Cb 0.43 -0.41 -0.01 0.00 0.00 0.00 0.00 19.45 19.47 1iem n ALA 220 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1iem n TYR 221 N -1.91 0.00 -0.66 0.00 0.18 -0.22 -4.37 117.16 110.19 1iem n TYR 221 Ca -0.02 -0.05 0.09 0.00 1.88 0.00 0.00 57.90 59.80 1iem n TYR 221 Cb 0.31 0.23 0.36 0.00 -0.38 0.00 0.00 39.34 39.86 1iem n TYR 221 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1iem n GLY 222 N 0.00 2.82 3.80 -7.48 0.00 0.11 -3.67 105.19 100.76 1iem n GLY 222 Ca -0.03 -0.86 -0.38 0.00 0.00 0.00 0.00 46.02 44.75 1iem n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iem s VAL 223 N -1.94 4.95 0.05 1.61 1.01 -1.26 -4.46 120.40 120.36 1iem s VAL 223 Ca 0.51 1.02 0.06 0.00 0.00 0.00 0.00 61.98 63.57 1iem s VAL 223 Cb 0.34 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.87 1iem s VAL 223 CO 0.23 0.51 -0.14 -0.54 0.00 0.00 0.00 175.10 175.16 1iem s LYS 224 N -0.70 2.16 0.22 2.72 3.01 0.63 -0.19 119.74 127.60 1iem s LYS 224 Ca 0.26 -0.95 -0.19 0.00 -1.01 0.00 0.00 55.97 54.08 1iem s LYS 224 Cb -0.17 -2.27 0.03 0.00 -1.01 0.00 0.00 37.83 34.40 1iem s LYS 224 CO 0.15 0.54 0.59 0.45 0.51 0.00 0.00 175.35 177.59 1iem s SER 225 N -1.63 -0.30 0.46 2.83 0.15 -0.64 -0.94 113.70 113.63 1iem s SER 225 Ca 0.17 -0.47 0.07 0.00 0.70 0.00 0.00 55.95 56.41 1iem s SER 225 Cb -0.11 0.63 0.02 0.00 -1.71 0.00 0.00 66.02 64.85 1iem s SER 225 CO 0.08 -1.13 0.63 0.42 1.20 0.00 0.00 173.24 174.43 1iem s THR 226 N -3.88 2.88 0.29 6.45 -4.23 -1.22 -0.66 115.64 115.28 1iem s THR 226 Ca 0.09 -0.93 0.05 0.00 -1.18 0.00 0.00 61.69 59.72 1iem s THR 226 Cb -0.02 -2.95 0.06 0.00 1.34 0.00 0.00 72.50 70.93 1iem s THR 226 CO -0.01 0.00 1.73 -0.29 -0.54 0.00 0.00 174.62 175.51 1iem h ILE 227 N 0.49 1.27 -0.25 2.99 6.09 -1.71 -1.89 117.51 124.51 1iem h ILE 227 Ca -0.40 -1.33 -0.03 0.00 -1.37 0.00 0.00 64.86 61.73 1iem h ILE 227 Cb 1.28 1.48 -0.01 0.00 0.47 0.00 0.00 36.82 40.04 1iem h ILE 227 CO 0.46 0.41 0.04 -0.33 -3.07 0.00 0.00 178.15 175.66 1iem h GLU 228 N 0.32 0.42 -0.59 2.19 5.08 -1.93 -1.16 114.58 118.90 1iem h GLU 228 Ca 0.04 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 1iem h GLU 228 Cb 0.71 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1iem h GLU 228 CO 0.05 0.55 0.00 -0.44 -1.00 0.00 0.00 179.01 178.17 1iem h ASP 229 N 0.23 1.02 -0.64 1.42 3.45 -1.86 -2.05 116.42 117.98 1iem h ASP 229 Ca 0.08 -0.30 -0.03 0.00 0.43 0.00 0.00 57.03 57.20 1iem h ASP 229 Cb 0.33 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 38.80 1iem h ASP 229 CO 0.01 1.07 0.29 0.24 -1.57 0.00 0.00 179.24 179.28 1iem h MET 230 N 0.93 0.96 -0.82 3.56 2.86 -1.22 0.32 114.93 121.51 1iem h MET 230 Ca 0.17 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1iem h MET 230 Cb 0.55 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 32.00 1iem h MET 230 CO 0.03 0.76 0.53 0.00 1.06 0.00 0.00 176.91 179.29 1iem h ALA 231 N 1.37 1.05 -0.12 6.32 0.00 -0.94 0.44 119.26 127.38 1iem h ALA 231 Ca 0.23 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1iem h ALA 231 Cb 0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1iem h ALA 231 CO -0.03 0.48 -0.33 -0.09 0.00 0.00 0.00 179.25 179.28 1iem h ARG 232 N 1.12 0.23 -0.42 0.00 2.43 -0.47 -1.00 114.38 116.28 1iem h ARG 232 Ca 0.30 -0.09 -0.11 0.00 -0.81 0.00 0.00 59.98 59.27 1iem h ARG 232 Cb -0.10 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1iem h ARG 232 CO -0.06 0.55 -0.17 2.35 -1.51 0.00 0.00 179.97 181.13 1iem h TRP 233 N 0.20 0.97 -0.33 2.20 -0.00 0.11 -2.12 115.95 116.98 1iem h TRP 233 Ca 0.03 -0.23 -0.01 0.00 -0.00 0.00 0.00 58.89 58.67 1iem h TRP 233 Cb 0.69 -0.23 -0.02 0.00 -0.00 0.00 0.00 29.16 29.61 1iem h TRP 233 CO 0.01 0.99 0.16 0.28 -0.00 0.00 0.00 178.44 179.88 1iem h VAL 234 N 0.66 1.16 -0.74 2.65 2.07 -0.64 -2.31 116.25 119.11 1iem h VAL 234 Ca 0.10 -0.47 0.11 0.00 0.82 0.00 0.00 66.70 67.25 1iem h VAL 234 Cb 0.72 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 31.30 1iem h VAL 234 CO 0.05 0.17 0.49 1.56 0.02 0.00 0.00 177.57 179.87 1iem h GLN 235 N 0.40 0.57 -0.20 1.57 4.20 -0.99 -0.17 115.11 120.49 1iem h GLN 235 Ca 0.11 -0.03 -0.17 0.00 0.06 0.00 0.00 58.65 58.62 1iem h GLN 235 Cb 0.13 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 1iem h GLN 235 CO -0.01 0.38 -0.56 0.77 -0.67 0.00 0.00 178.83 178.73 1iem h SER 236 N 0.59 0.68 1.68 1.46 0.02 -0.92 -2.37 113.55 114.69 1iem h SER 236 Ca 0.35 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1iem h SER 236 Cb 0.56 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1iem h SER 236 CO -0.12 1.09 -0.08 0.78 -1.14 0.00 0.00 176.83 177.36 1iem h ASN 237 N 0.46 0.00 0.02 3.07 2.35 -0.85 -2.63 115.58 118.01 1iem h ASN 237 Ca 0.01 -0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 1iem h ASN 237 Cb 1.11 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.49 1iem h ASN 237 CO 0.11 0.01 -0.39 -0.07 -1.65 0.00 0.00 177.43 175.43 1iem h LEU 238 N 0.00 0.30 -6.53 1.61 3.38 -0.95 -3.41 115.31 109.71 1iem h LEU 238 Ca 0.00 -0.83 -0.60 0.00 0.09 0.00 0.00 57.88 56.54 1iem h LEU 238 Cb 0.88 -0.09 -0.41 0.00 0.09 0.00 0.00 40.66 41.13 1iem h LEU 238 CO 0.00 1.10 -0.75 0.29 0.09 0.00 0.00 178.44 179.17 1iem n LYS 239 N -4.39 1.49 0.27 1.13 5.02 -0.90 -4.81 118.16 115.96 1iem n LYS 239 Ca -0.11 -4.07 0.18 0.00 -2.02 0.00 0.00 58.31 52.30 1iem n LYS 239 Cb 0.59 -1.99 0.91 0.00 -0.02 0.00 0.00 35.03 34.53 1iem n LYS 239 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1iem h PRO 240 N 4.91 0.00 0.00 1.97 0.13 -1.70 -2.66 132.00 134.66 1iem h PRO 240 Ca 0.18 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.25 1iem h PRO 240 Cb 0.78 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 1iem h PRO 240 CO 0.64 0.00 -0.25 -0.07 -0.23 0.00 0.00 178.00 178.09 1iem h LEU 241 N 0.00 0.00 -0.03 1.56 3.38 -1.91 -2.20 115.31 116.11 1iem h LEU 241 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iem h LEU 241 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1iem h LEU 241 CO 0.00 0.25 0.00 0.47 0.09 0.00 0.00 178.44 179.25 1iem n ASP 242 N -3.47 0.04 -4.67 -0.43 10.43 -1.00 -4.72 116.55 112.73 1iem n ASP 242 Ca -0.00 0.51 -0.43 0.00 2.57 0.00 0.00 54.79 57.44 1iem n ASP 242 Cb 0.42 -0.52 -0.02 0.00 1.84 0.00 0.00 41.12 42.84 1iem n ASP 242 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1iem s ILE 243 N -3.01 4.72 0.23 0.53 1.01 -0.83 -4.97 121.20 118.88 1iem s ILE 243 Ca 0.09 2.00 -0.03 0.00 0.00 0.00 0.00 60.65 62.71 1iem s ILE 243 Cb 0.13 -4.29 0.05 0.00 0.01 0.00 0.00 42.46 38.35 1iem s ILE 243 CO 0.36 -0.13 1.66 0.78 0.00 0.00 0.00 174.94 177.61 1iem h ASN 244 N 7.38 0.74 -3.10 3.58 2.35 -1.87 -3.43 115.58 121.23 1iem h ASN 244 Ca -0.22 -0.25 -0.57 0.00 -0.55 0.00 0.00 56.30 54.71 1iem h ASN 244 Cb 1.08 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 39.21 1iem h ASN 244 CO 0.94 0.93 1.06 -1.61 -1.65 0.00 0.00 177.43 177.10 1iem s GLU 245 N -4.64 3.70 0.14 0.81 8.01 -1.26 -4.92 118.70 120.54 1iem s GLU 245 Ca -0.09 1.20 -0.31 0.00 0.01 0.00 0.00 54.97 55.78 1iem s GLU 245 Cb 0.13 -3.99 -0.07 0.00 -4.31 0.00 0.00 34.13 25.89 1iem s GLU 245 CO 0.83 -1.40 1.56 1.57 0.01 0.00 0.00 175.26 177.83 1iem h LYS 246 N 10.41 -0.38 0.00 1.61 -0.00 -2.00 -0.93 116.57 125.28 1iem h LYS 246 Ca -0.29 0.03 -0.05 0.00 -0.00 0.00 0.00 60.65 60.35 1iem h LYS 246 Cb 1.12 0.09 -0.01 0.00 -0.00 0.00 0.00 32.23 33.43 1iem h LYS 246 CO 1.05 -0.26 -0.22 1.79 -0.00 0.00 0.00 179.45 181.82 1iem h THR 247 N -0.40 1.12 -0.27 0.07 1.35 -1.91 -1.94 112.91 110.93 1iem h THR 247 Ca 0.09 -0.75 -0.11 0.00 -0.55 0.00 0.00 66.41 65.09 1iem h THR 247 Cb 0.61 1.41 -0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1iem h THR 247 CO -0.56 0.21 -0.27 0.25 -0.25 0.00 0.00 175.52 174.90 1iem h LEU 248 N 0.00 0.70 -0.52 3.87 5.85 -1.72 -1.10 115.31 122.40 1iem h LEU 248 Ca -0.00 -0.47 0.04 0.00 0.84 0.00 0.00 57.88 58.29 1iem h LEU 248 Cb 0.39 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1iem h LEU 248 CO 0.03 1.03 0.27 -0.61 -0.34 0.00 0.00 178.44 178.82 1iem h GLN 249 N 0.39 0.52 -0.44 1.25 4.15 -0.70 -1.73 115.11 118.54 1iem h GLN 249 Ca 0.04 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.39 1iem h GLN 249 Cb 0.83 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.39 1iem h GLN 249 CO 0.07 0.34 0.09 1.96 -1.93 0.00 0.00 178.83 179.36 1iem h GLN 250 N 0.53 0.71 -0.33 1.69 4.20 -1.26 -2.88 115.11 117.78 1iem h GLN 250 Ca 0.22 -0.18 0.06 0.00 0.06 0.00 0.00 58.65 58.82 1iem h GLN 250 Cb 0.11 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 27.74 1iem h GLN 250 CO -0.14 0.72 -0.07 0.78 -0.67 0.00 0.00 178.83 179.45 1iem h GLY 251 N 0.58 0.25 0.41 3.46 0.00 -0.65 0.16 103.07 107.28 1iem h GLY 251 Ca 0.14 0.09 0.08 0.00 0.00 0.00 0.00 47.33 47.64 1iem h GLY 251 CO 0.00 -0.12 0.12 -2.22 0.00 0.00 0.00 176.54 174.33 1iem h ILE 252 N 0.02 0.76 -0.79 2.60 2.04 -1.28 0.96 117.51 121.80 1iem h ILE 252 Ca 0.16 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.88 1iem h ILE 252 Cb 0.24 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.75 1iem h ILE 252 CO -0.32 0.05 0.32 1.56 0.00 0.00 0.00 178.15 179.75 1iem h GLN 253 N 0.26 1.18 -0.06 2.37 4.20 -1.10 -2.05 115.11 119.91 1iem h GLN 253 Ca 0.24 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1iem h GLN 253 Cb 0.31 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1iem h GLN 253 CO -0.30 0.96 -0.12 -0.07 -0.67 0.00 0.00 178.83 178.63 1iem h LEU 254 N 1.15 0.08 -1.22 1.46 3.38 0.65 -1.42 115.31 119.40 1iem h LEU 254 Ca 0.26 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 1iem h LEU 254 Cb 0.22 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1iem h LEU 254 CO -0.02 0.22 -0.23 0.00 0.09 0.00 0.00 178.44 178.50 1iem h ALA 255 N 1.80 1.06 -0.66 1.53 0.00 -0.14 -2.77 119.26 120.07 1iem h ALA 255 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1iem h ALA 255 Cb 0.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1iem h ALA 255 CO 0.02 0.28 0.00 1.04 0.00 0.00 0.00 179.25 180.59 1iem n GLN 256 N -3.45 2.60 -1.89 0.00 6.02 -0.56 -1.19 117.38 118.92 1iem n GLN 256 Ca -0.00 -2.48 -0.32 0.00 -0.01 0.00 0.00 57.00 54.18 1iem n GLN 256 Cb 0.41 -1.54 0.03 0.00 1.02 0.00 0.00 30.24 30.16 1iem n GLN 256 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1iem s SER 257 N -1.07 5.53 -0.42 1.08 0.01 -1.04 -3.71 113.70 114.08 1iem s SER 257 Ca 0.46 1.84 -0.14 0.00 1.31 0.00 0.00 55.95 59.41 1iem s SER 257 Cb 0.24 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 63.98 1iem s SER 257 CO 0.32 -1.34 0.30 -0.13 0.41 0.00 0.00 173.24 172.80 1iem s ARG 258 N -4.23 2.91 -0.09 12.44 0.52 0.02 -4.16 118.95 126.37 1iem s ARG 258 Ca 0.64 -1.15 0.10 0.00 -0.52 0.00 0.00 55.73 54.79 1iem s ARG 258 Cb -0.17 -3.95 -0.24 0.00 0.52 0.00 0.00 34.95 31.11 1iem s ARG 258 CO 0.41 -0.83 0.49 0.66 0.02 0.00 0.00 175.30 176.05 1iem n TYR 259 N 5.12 0.86 -3.91 -0.53 4.01 -0.39 -2.77 117.16 119.55 1iem n TYR 259 Ca -0.11 0.28 -0.09 0.00 -0.16 0.00 0.00 57.90 57.81 1iem n TYR 259 Cb 0.46 -1.15 -0.07 0.00 -0.31 0.00 0.00 39.34 38.27 1iem n TYR 259 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1iem s TRP 260 N -2.57 0.28 -0.03 -0.72 0.52 -1.24 -2.02 118.94 113.16 1iem s TRP 260 Ca -0.09 -0.68 0.02 0.00 0.02 0.00 0.00 56.10 55.37 1iem s TRP 260 Cb 0.07 -0.07 0.01 0.00 -1.15 0.00 0.00 33.47 32.33 1iem s TRP 260 CO 0.81 -0.62 -0.07 -1.14 0.02 0.00 0.00 176.95 175.95 1iem s GLN 261 N -3.91 0.83 -0.04 4.98 0.74 -0.74 -0.93 119.66 120.58 1iem s GLN 261 Ca 0.11 -0.23 -0.02 0.00 0.05 0.00 0.00 55.36 55.28 1iem s GLN 261 Cb 0.04 -0.79 0.03 0.00 1.10 0.00 0.00 33.01 33.39 1iem s GLN 261 CO -0.06 0.06 0.07 -0.08 -0.55 0.00 0.00 175.29 174.73 1iem s THR 262 N 0.34 -0.12 0.00 -0.34 -1.32 -0.40 -0.86 115.64 112.95 1iem s THR 262 Ca -0.05 0.35 0.00 0.00 -1.21 0.00 0.00 61.69 60.78 1iem s THR 262 Cb -0.09 -0.16 0.00 0.00 -1.51 0.00 0.00 72.50 70.74 1iem s THR 262 CO 0.00 0.15 0.00 0.61 -2.21 0.00 0.00 174.62 173.17 1iem n GLY 263 N 4.95 2.59 1.56 6.08 0.00 -1.26 -1.46 105.19 117.65 1iem n GLY 263 Ca -0.11 -0.43 -0.05 0.00 0.00 0.00 0.00 46.02 45.43 1iem n GLY 263 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1iem n ASP 264 N 2.15 3.86 -4.63 1.61 5.75 -1.26 -4.95 116.55 119.09 1iem n ASP 264 Ca 0.00 -3.38 -0.31 0.00 -0.01 0.00 0.00 54.79 51.09 1iem n ASP 264 Cb 0.00 -0.68 -0.10 0.00 -1.03 0.00 0.00 41.12 39.31 1iem n ASP 264 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 1iem s MET 265 N -3.07 2.52 -0.06 0.11 1.75 -0.53 -4.59 119.30 115.43 1iem s MET 265 Ca 0.50 -0.78 0.06 0.00 -1.25 0.00 0.00 55.69 54.21 1iem s MET 265 Cb 0.42 -2.50 -0.01 0.00 2.84 0.00 0.00 34.83 35.57 1iem s MET 265 CO 0.08 0.58 -0.24 0.71 -0.65 0.00 0.00 175.02 175.50 1iem s TYR 266 N -1.12 2.47 -0.07 4.11 1.51 0.13 -1.27 117.35 123.11 1iem s TYR 266 Ca 0.20 -0.66 -0.19 0.00 -1.01 0.00 0.00 57.07 55.41 1iem s TYR 266 Cb -0.11 -1.61 -0.04 0.00 -0.11 0.00 0.00 41.96 40.09 1iem s TYR 266 CO 0.11 -0.17 0.54 -1.14 -1.11 0.00 0.00 175.55 173.78 1iem s GLN 267 N -0.21 4.33 0.00 -0.62 2.00 -0.10 -0.65 119.66 124.40 1iem s GLN 267 Ca -0.02 0.60 0.00 0.00 -2.00 0.00 0.00 55.36 53.94 1iem s GLN 267 Cb -0.13 -3.40 0.00 0.00 0.80 0.00 0.00 33.01 30.28 1iem s GLN 267 CO 0.03 0.23 0.00 0.41 -0.50 0.00 0.00 175.29 175.46 1iem n GLY 268 N 2.93 5.00 3.34 2.59 0.00 -0.45 -1.27 105.19 117.34 1iem n GLY 268 Ca -0.06 -1.92 -0.46 0.00 0.00 0.00 0.00 46.02 43.57 1iem n GLY 268 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iem s LEU 269 N 0.00 6.09 0.00 0.99 1.43 -0.33 -4.61 118.68 122.25 1iem s LEU 269 Ca 0.00 -2.02 0.00 0.00 -1.03 0.00 0.00 54.13 51.08 1iem s LEU 269 Cb 0.00 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.97 1iem s LEU 269 CO 0.00 -0.85 0.00 0.61 0.23 0.00 0.00 176.35 176.34 1iem n GLY 270 N 4.86 2.05 3.74 -3.19 0.00 -1.26 -4.18 105.19 107.20 1iem n GLY 270 Ca -0.00 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 1iem n GLY 270 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1iem s TRP 271 N 0.00 2.21 0.04 1.61 0.52 -1.26 -4.70 118.94 117.36 1iem s TRP 271 Ca 0.00 1.60 0.06 0.00 0.02 0.00 0.00 56.10 57.78 1iem s TRP 271 Cb 0.00 -3.36 -0.02 0.00 -1.15 0.00 0.00 33.47 28.94 1iem s TRP 271 CO 0.00 -2.31 -0.18 -1.21 0.02 0.00 0.00 176.95 173.27 1iem s GLU 272 N -4.03 1.21 0.09 4.98 2.02 -0.99 -1.34 118.70 120.65 1iem s GLU 272 Ca 0.71 -0.84 0.03 0.00 0.02 0.00 0.00 54.97 54.89 1iem s GLU 272 Cb -0.26 -1.28 -0.04 0.00 0.10 0.00 0.00 34.13 32.66 1iem s GLU 272 CO 0.45 0.33 -0.08 -1.64 0.02 0.00 0.00 175.26 174.33 1iem s MET 273 N -1.09 0.80 0.03 1.61 -1.94 0.17 -1.59 119.30 117.30 1iem s MET 273 Ca 0.05 -1.19 -0.01 0.00 -1.71 0.00 0.00 55.69 52.83 1iem s MET 273 Cb -0.08 -0.35 -0.03 0.00 2.01 0.00 0.00 34.83 36.38 1iem s MET 273 CO 0.01 0.03 -0.01 -0.51 -0.01 0.00 0.00 175.02 174.54 1iem s LEU 274 N -2.61 2.25 0.22 -0.03 1.02 -0.92 0.17 118.68 118.78 1iem s LEU 274 Ca 0.06 -0.67 -0.30 0.00 0.02 0.00 0.00 54.13 53.24 1iem s LEU 274 Cb -0.00 0.22 -0.09 0.00 0.02 0.00 0.00 46.19 46.34 1iem s LEU 274 CO -0.02 -0.44 1.15 -1.81 0.02 0.00 0.00 176.35 175.26 1iem s ASP 275 N -2.06 7.16 -0.06 2.29 1.11 -1.26 -0.65 116.67 123.20 1iem s ASP 275 Ca -0.06 2.24 -0.11 0.00 0.18 0.00 0.00 52.55 54.79 1iem s ASP 275 Cb -0.02 -2.61 -0.05 0.00 1.07 0.00 0.00 42.92 41.30 1iem s ASP 275 CO -0.05 -0.28 0.28 0.86 1.18 0.00 0.00 175.17 177.17 1iem s TRP 276 N -0.49 3.66 0.58 4.23 -0.11 0.60 -3.47 118.94 123.94 1iem s TRP 276 Ca 0.49 0.77 -0.18 0.00 1.22 0.00 0.00 56.10 58.41 1iem s TRP 276 Cb -0.32 -2.14 -0.04 0.00 -1.50 0.00 0.00 33.47 29.47 1iem s TRP 276 CO 0.38 0.67 1.10 -1.25 -4.62 0.00 0.00 176.95 173.24 1iem s PRO 277 N -0.99 3.21 0.32 5.86 0.04 -1.26 -4.76 135.00 137.42 1iem s PRO 277 Ca 0.19 1.45 0.10 0.00 0.04 0.00 0.00 61.00 62.79 1iem s PRO 277 Cb -0.14 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 1iem s PRO 277 CO 0.09 -0.93 -0.03 0.14 0.04 0.00 0.00 177.00 176.30 1iem s VAL 278 N -2.08 2.74 -0.40 -0.36 -7.23 -1.23 -5.09 120.40 106.76 1iem s VAL 278 Ca 0.69 -2.05 -0.20 0.00 -1.81 0.00 0.00 61.98 58.61 1iem s VAL 278 Cb -0.21 -2.71 0.01 0.00 0.56 0.00 0.00 36.38 34.03 1iem s VAL 278 CO 0.32 -0.27 0.63 0.21 -0.31 0.00 0.00 175.10 175.68 1iem s ASN 279 N -3.67 6.36 0.38 4.85 3.04 -1.26 -4.95 114.94 119.69 1iem s ASN 279 Ca 0.33 -0.12 0.15 0.00 0.04 0.00 0.00 52.86 53.27 1iem s ASN 279 Cb -0.02 -2.32 1.02 0.00 -1.54 0.00 0.00 41.25 38.39 1iem s ASN 279 CO 0.19 -0.67 1.78 1.55 -3.04 0.00 0.00 177.10 176.90 1iem h PRO 280 N 8.67 0.47 0.00 0.43 0.13 -2.00 0.28 132.00 139.97 1iem h PRO 280 Ca -0.26 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 1iem h PRO 280 Cb 1.10 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 1iem h PRO 280 CO 0.86 0.31 -0.04 -0.44 -0.23 0.00 0.00 178.00 178.46 1iem h ASP 281 N 0.48 0.00 -0.13 1.44 5.19 -1.98 0.15 116.42 121.57 1iem h ASP 281 Ca 0.58 0.00 -0.23 0.00 -0.62 0.00 0.00 57.03 56.76 1iem h ASP 281 Cb 1.33 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.85 1iem h ASP 281 CO -0.31 0.04 -0.82 -1.28 -3.12 0.00 0.00 179.24 173.74 1iem h SER 282 N 0.00 0.95 0.67 6.45 0.87 -0.85 -1.63 113.55 120.01 1iem h SER 282 Ca -0.00 -0.64 -0.27 0.00 -1.23 0.00 0.00 61.79 59.65 1iem h SER 282 Cb 0.07 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.72 1iem h SER 282 CO 0.00 1.44 -1.36 0.16 -0.53 0.00 0.00 176.83 176.55 1iem h ILE 283 N 0.52 1.31 0.56 2.23 3.07 -1.37 -2.55 117.51 121.27 1iem h ILE 283 Ca -0.07 -3.02 -0.03 0.00 1.55 0.00 0.00 64.86 63.30 1iem h ILE 283 Cb 1.46 2.72 0.01 0.00 -0.27 0.00 0.00 36.82 40.73 1iem h ILE 283 CO 0.17 0.80 -0.27 0.40 -1.05 0.00 0.00 178.15 178.20 1iem h ILE 284 N 0.03 0.16 -0.37 0.16 2.04 -0.79 -1.73 117.51 117.01 1iem h ILE 284 Ca -0.16 -0.44 -0.07 0.00 1.00 0.00 0.00 64.86 65.19 1iem h ILE 284 Cb 1.92 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 1iem h ILE 284 CO 0.13 0.03 -0.06 0.78 0.00 0.00 0.00 178.15 179.03 1iem h ASN 285 N -1.13 0.59 0.65 1.72 2.35 -1.46 -2.52 115.58 115.78 1iem h ASN 285 Ca -0.08 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.52 1iem h ASN 285 Cb 0.62 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.83 1iem h ASN 285 CO 0.13 0.71 -0.06 1.23 -1.65 0.00 0.00 177.43 177.78 1iem h GLY 286 N 0.93 0.00 2.00 2.83 0.00 -1.48 -2.17 103.07 105.19 1iem h GLY 286 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 1iem h GLY 286 CO 0.02 0.00 0.00 1.48 0.00 0.00 0.00 176.54 178.04 1iem h SER 287 N 0.00 0.00 -3.64 0.19 4.64 -0.85 -3.26 113.55 110.64 1iem h SER 287 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1iem h SER 287 Cb 0.40 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.57 1iem h SER 287 CO 0.01 0.00 0.76 -0.62 -0.87 0.00 0.00 176.83 176.10 1iem s ASP 288 N -4.78 6.56 0.60 4.97 -1.08 -0.82 -4.60 116.67 117.52 1iem s ASP 288 Ca 0.10 2.82 0.30 0.00 -0.52 0.00 0.00 52.55 55.25 1iem s ASP 288 Cb 0.11 -2.64 1.73 0.00 -1.46 0.00 0.00 42.92 40.65 1iem s ASP 288 CO 0.60 -0.74 2.11 0.78 0.52 0.00 0.00 175.17 178.44 1iem h ASN 289 N 4.09 0.00 -1.03 -0.34 2.35 -1.88 0.99 115.58 119.76 1iem h ASN 289 Ca -0.48 0.00 0.27 0.00 -0.55 0.00 0.00 56.30 55.54 1iem h ASN 289 Cb 1.23 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 39.47 1iem h ASN 289 CO 0.72 0.00 0.62 0.11 -1.65 0.00 0.00 177.43 177.23 1iem h LYS 290 N 0.00 0.46 0.00 0.81 1.57 -1.91 -2.29 116.57 115.21 1iem h LYS 290 Ca 0.07 -0.03 -0.29 0.00 -1.87 0.00 0.00 60.65 58.53 1iem h LYS 290 Cb 0.45 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.61 1iem h LYS 290 CO -0.00 0.30 -2.07 -0.89 -0.57 0.00 0.00 179.45 176.23 1iem n ILE 291 N -4.84 1.07 -0.00 1.86 5.41 0.14 -4.25 119.36 118.75 1iem n ILE 291 Ca 0.28 -0.36 0.11 0.00 1.00 0.00 0.00 62.75 63.77 1iem n ILE 291 Cb 0.85 -1.35 0.53 0.00 -0.71 0.00 0.00 39.64 38.96 1iem n ILE 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1iem h ALA 292 N -0.22 2.01 -0.02 -1.39 0.00 -0.95 -2.31 119.26 116.37 1iem h ALA 292 Ca -0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1iem h ALA 292 Cb 1.58 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1iem h ALA 292 CO -0.14 -0.10 -0.17 1.28 0.00 0.00 0.00 179.25 180.12 1iem n LEU 293 N -4.47 2.31 -4.79 0.00 4.77 -0.87 -4.56 117.00 109.39 1iem n LEU 293 Ca 0.06 -0.90 -0.35 0.00 -0.03 0.00 0.00 56.01 54.79 1iem n LEU 293 Cb 0.29 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 1iem n LEU 293 CO 0.35 0.41 0.75 0.00 -1.33 0.00 0.00 177.39 177.56 1iem s ALA 294 N -1.88 2.93 0.08 -1.18 0.00 -0.87 -4.63 121.76 116.21 1iem s ALA 294 Ca 0.20 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 52.57 1iem s ALA 294 Cb 0.16 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.94 1iem s ALA 294 CO 0.35 -0.38 1.03 0.00 0.00 0.00 0.00 175.76 176.75 1iem s ALA 295 N -1.79 3.26 0.01 0.00 0.00 -1.26 -4.69 121.76 117.29 1iem s ALA 295 Ca 0.64 0.65 -0.02 0.00 0.00 0.00 0.00 51.96 53.23 1iem s ALA 295 Cb -0.21 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.56 1iem s ALA 295 CO 0.25 -0.19 0.02 1.03 0.00 0.00 0.00 175.76 176.88 1iem s ARG 296 N 0.41 0.36 0.44 0.00 1.81 -0.77 -4.96 118.95 116.25 1iem s ARG 296 Ca 0.51 -0.54 -0.24 0.00 -1.72 0.00 0.00 55.73 53.74 1iem s ARG 296 Cb -0.25 0.14 -0.08 0.00 -0.45 0.00 0.00 34.95 34.31 1iem s ARG 296 CO 0.30 -0.07 1.17 -2.14 -0.68 0.00 0.00 175.30 173.89 1iem s PRO 297 N -1.43 3.84 0.04 3.54 0.02 -1.26 0.29 135.00 140.04 1iem s PRO 297 Ca -0.15 1.81 0.05 0.00 0.02 0.00 0.00 61.00 62.73 1iem s PRO 297 Cb -0.09 -2.50 -0.02 0.00 0.02 0.00 0.00 34.50 31.91 1iem s PRO 297 CO -0.00 -0.49 -0.15 0.14 -0.33 0.00 0.00 177.00 176.16 1iem s VAL 298 N -1.49 1.21 -0.26 3.83 -7.23 -1.06 -4.63 120.40 110.77 1iem s VAL 298 Ca 0.62 -1.00 -0.09 0.00 -1.81 0.00 0.00 61.98 59.69 1iem s VAL 298 Cb -0.30 -1.08 -0.04 0.00 0.56 0.00 0.00 36.38 35.52 1iem s VAL 298 CO 0.37 0.07 0.14 -0.54 -0.31 0.00 0.00 175.10 174.82 1iem s LYS 299 N -1.08 3.85 0.51 4.82 1.02 -0.04 -4.82 119.74 124.00 1iem s LYS 299 Ca 0.03 -0.38 -0.23 0.00 0.02 0.00 0.00 55.97 55.42 1iem s LYS 299 Cb -0.08 -3.50 -0.06 0.00 -0.52 0.00 0.00 37.83 33.67 1iem s LYS 299 CO 0.01 -0.14 1.32 0.00 -0.92 0.00 0.00 175.35 175.62 1iem s ALA 300 N 1.57 2.91 -0.46 5.17 0.00 -1.26 -1.80 121.76 127.89 1iem s ALA 300 Ca 0.07 1.25 -0.07 0.00 0.00 0.00 0.00 51.96 53.21 1iem s ALA 300 Cb -0.15 -3.52 0.12 0.00 0.00 0.00 0.00 23.12 19.56 1iem s ALA 300 CO 0.07 -1.17 0.30 0.42 0.00 0.00 0.00 175.76 175.39 1iem s ILE 301 N -1.35 3.87 -0.38 0.00 1.01 -0.86 -4.88 121.20 118.62 1iem s ILE 301 Ca 0.68 -1.94 -0.09 0.00 0.00 0.00 0.00 60.65 59.30 1iem s ILE 301 Cb -0.38 -3.58 0.05 0.00 0.01 0.00 0.00 42.46 38.56 1iem s ILE 301 CO 0.46 -0.75 0.20 -0.89 0.00 0.00 0.00 174.94 173.95 1iem s THR 302 N 1.21 4.20 0.80 2.92 2.01 -1.26 -1.73 115.64 123.79 1iem s THR 302 Ca 0.07 -1.16 -0.07 0.00 0.31 0.00 0.00 61.69 60.85 1iem s THR 302 Cb -0.25 -3.45 0.14 0.00 0.01 0.00 0.00 72.50 68.95 1iem s THR 302 CO -0.02 -0.33 1.10 -2.16 -0.69 0.00 0.00 174.62 172.52 1iem s PRO 303 N 1.46 1.43 0.28 4.92 0.04 -1.26 -5.09 135.00 136.77 1iem s PRO 303 Ca 0.01 -0.74 -0.30 0.00 0.04 0.00 0.00 61.00 60.02 1iem s PRO 303 Cb -0.21 -2.15 -0.10 0.00 0.04 0.00 0.00 34.50 32.08 1iem s PRO 303 CO 0.04 -1.73 1.47 -2.14 0.04 0.00 0.00 177.00 174.68 1iem s PRO 304 N -5.40 4.22 0.02 0.56 0.02 -0.71 -4.98 135.00 128.74 1iem s PRO 304 Ca 0.68 2.39 -0.30 0.00 0.02 0.00 0.00 61.00 63.79 1iem s PRO 304 Cb -0.06 -3.07 -0.05 0.00 0.02 0.00 0.00 34.50 31.35 1iem s PRO 304 CO 0.47 -0.47 1.16 0.99 -0.33 0.00 0.00 177.00 178.83 1iem s THR 305 N -0.20 4.23 0.73 0.99 2.01 -1.11 -4.81 115.64 117.47 1iem s THR 305 Ca 0.59 1.59 -0.14 0.00 0.31 0.00 0.00 61.69 64.03 1iem s THR 305 Cb -0.44 -4.02 0.04 0.00 0.01 0.00 0.00 72.50 68.09 1iem s THR 305 CO 0.47 0.09 1.16 -2.84 -0.69 0.00 0.00 174.62 172.81 1iem s PRO 306 N 1.35 2.26 -0.45 4.92 0.02 -1.26 -0.80 135.00 141.05 1iem s PRO 306 Ca 0.57 1.59 -0.42 0.00 0.02 0.00 0.00 61.00 62.76 1iem s PRO 306 Cb -0.27 -1.87 -0.18 0.00 0.02 0.00 0.00 34.50 32.21 1iem s PRO 306 CO 0.27 -1.70 1.47 0.00 -0.33 0.00 0.00 177.00 176.70 1iem n ALA 307 N -2.80 -1.10 -2.55 -1.55 0.00 -1.24 -4.76 120.51 106.51 1iem n ALA 307 Ca 0.12 0.42 -0.42 0.00 0.00 0.00 0.00 53.44 53.56 1iem n ALA 307 Cb 0.51 -1.73 -0.06 0.00 0.00 0.00 0.00 19.45 18.17 1iem n ALA 307 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1iem s VAL 308 N 2.90 4.82 0.34 0.00 1.01 -1.26 -4.96 120.40 123.24 1iem s VAL 308 Ca 0.95 0.48 0.08 0.00 0.00 0.00 0.00 61.98 63.49 1iem s VAL 308 Cb -1.34 -4.16 0.32 0.00 0.00 0.00 0.00 36.38 31.19 1iem s VAL 308 CO 0.72 -0.46 1.84 0.03 0.00 0.00 0.00 175.10 177.22 1iem h ARG 309 N 8.65 0.71 -3.14 2.72 3.08 -1.98 -2.92 114.38 121.50 1iem h ARG 309 Ca -0.26 -0.04 -0.70 0.00 0.07 0.00 0.00 59.98 59.05 1iem h ARG 309 Cb 1.10 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.96 1iem h ARG 309 CO 0.88 0.47 3.26 0.00 -1.07 0.00 0.00 179.97 183.51 1iem n ALA 310 N -2.40 6.86 -2.53 0.04 0.00 -1.26 -1.08 120.51 120.14 1iem n ALA 310 Ca 0.20 -3.78 -0.17 0.00 0.00 0.00 0.00 53.44 49.69 1iem n ALA 310 Cb 0.51 -3.24 -0.11 0.00 0.00 0.00 0.00 19.45 16.61 1iem n ALA 310 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1iem s SER 311 N 1.85 1.75 -0.47 0.00 0.01 -1.10 -0.29 113.70 115.43 1iem s SER 311 Ca 0.60 -0.77 -0.15 0.00 1.31 0.00 0.00 55.95 56.93 1iem s SER 311 Cb 0.17 -0.04 0.08 0.00 0.21 0.00 0.00 66.02 66.43 1iem s SER 311 CO -0.07 -0.17 0.39 0.86 0.41 0.00 0.00 173.24 174.66 1iem s TRP 312 N -2.08 3.25 -0.19 2.43 -0.11 0.18 -3.99 118.94 118.43 1iem s TRP 312 Ca 0.06 -0.99 -0.10 0.00 1.22 0.00 0.00 56.10 56.29 1iem s TRP 312 Cb -0.05 -3.18 -0.05 0.00 -1.50 0.00 0.00 33.47 28.69 1iem s TRP 312 CO 0.02 -0.81 0.13 0.08 -4.62 0.00 0.00 176.95 171.75 1iem s VAL 313 N 1.62 5.40 0.38 5.86 1.01 -0.02 -2.16 120.40 132.48 1iem s VAL 313 Ca 0.04 0.18 -0.14 0.00 0.00 0.00 0.00 61.98 62.06 1iem s VAL 313 Cb -0.24 -3.45 0.05 0.00 0.00 0.00 0.00 36.38 32.73 1iem s VAL 313 CO 0.06 0.46 0.75 -1.38 0.00 0.00 0.00 175.10 174.99 1iem s HIS 314 N 0.18 0.23 -0.29 5.22 -3.43 -0.62 -0.08 115.29 116.50 1iem s HIS 314 Ca 0.09 -0.84 -0.19 0.00 -0.80 0.00 0.00 55.06 53.32 1iem s HIS 314 Cb -0.11 0.72 0.13 0.00 -1.43 0.00 0.00 32.58 31.88 1iem s HIS 314 CO -0.01 -1.50 0.95 0.21 -2.00 0.00 0.00 174.74 172.39 1iem s LYS 315 N -2.48 0.47 0.41 -0.38 2.47 -0.26 -2.36 119.74 117.61 1iem s LYS 315 Ca 0.17 0.72 -0.01 0.00 -1.56 0.00 0.00 55.97 55.30 1iem s LYS 315 Cb -0.05 0.15 -0.02 0.00 -1.46 0.00 0.00 37.83 36.45 1iem s LYS 315 CO 0.12 -0.08 0.63 0.95 0.16 0.00 0.00 175.35 177.13 1iem s THR 316 N 1.00 4.69 -0.09 3.43 -4.23 -1.26 -1.90 115.64 117.27 1iem s THR 316 Ca -0.05 -0.36 -0.17 0.00 -1.18 0.00 0.00 61.69 59.93 1iem s THR 316 Cb -0.04 -3.73 0.04 0.00 1.34 0.00 0.00 72.50 70.11 1iem s THR 316 CO -0.12 -0.53 0.42 -0.83 -0.54 0.00 0.00 174.62 173.01 1iem s GLY 317 N -4.11 -0.29 -0.02 3.99 0.00 -0.33 -3.69 107.32 102.87 1iem s GLY 317 Ca 0.44 0.87 -0.29 0.00 0.00 0.00 0.00 44.72 45.74 1iem s GLY 317 CO 0.38 0.66 0.71 0.00 0.00 0.00 0.00 173.10 174.85 1iem s ALA 318 N -0.61 -1.76 0.08 3.20 0.00 -1.26 -0.07 121.76 121.34 1iem s ALA 318 Ca -0.07 1.19 0.01 0.00 0.00 0.00 0.00 51.96 53.09 1iem s ALA 318 Cb -0.04 0.09 -0.00 0.00 0.00 0.00 0.00 23.12 23.18 1iem s ALA 318 CO 0.03 -0.44 0.04 0.25 0.00 0.00 0.00 175.76 175.64 1iem n THR 319 N 0.63 0.00 0.06 0.00 -2.24 -0.45 -4.02 114.28 108.26 1iem n THR 319 Ca -0.17 -0.50 0.02 0.00 -2.27 0.00 0.00 64.05 61.13 1iem n THR 319 Cb 0.59 0.21 0.38 0.00 -2.10 0.00 0.00 70.33 69.40 1iem n THR 319 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1iem h GLY 320 N 0.37 0.41 -0.54 3.38 0.00 -1.96 -3.25 103.07 101.48 1iem h GLY 320 Ca -0.06 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1iem h GLY 320 CO 0.09 0.21 -0.03 0.61 0.00 0.00 0.00 176.54 177.42 1iem n GLY 321 N -1.04 -0.62 3.23 4.60 0.00 -1.26 -4.49 105.19 105.61 1iem n GLY 321 Ca 0.01 -0.21 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 1iem n GLY 321 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iem s PHE 322 N -0.71 1.42 -0.04 1.61 0.40 -1.23 -0.30 117.98 119.13 1iem s PHE 322 Ca 0.08 -0.51 -0.02 0.00 -0.60 0.00 0.00 56.93 55.88 1iem s PHE 322 Cb 0.06 -0.76 0.03 0.00 0.51 0.00 0.00 43.02 42.86 1iem s PHE 322 CO 0.11 0.14 0.05 0.20 0.70 0.00 0.00 175.22 176.42 1iem s GLY 323 N -2.23 0.24 0.28 4.36 0.00 -0.54 -1.34 107.32 108.10 1iem s GLY 323 Ca 0.06 0.15 0.06 0.00 0.00 0.00 0.00 44.72 44.99 1iem s GLY 323 CO 0.03 1.33 -0.04 -1.35 0.00 0.00 0.00 173.10 173.07 1iem s SER 324 N 2.10 2.55 -0.25 1.64 1.04 0.89 -1.75 113.70 119.93 1iem s SER 324 Ca 0.04 -1.21 -0.20 0.00 0.48 0.00 0.00 55.95 55.06 1iem s SER 324 Cb -0.12 -0.13 0.07 0.00 0.10 0.00 0.00 66.02 65.94 1iem s SER 324 CO -0.03 -0.40 0.65 -0.47 0.98 0.00 0.00 173.24 173.97 1iem s TYR 325 N -3.12 -0.80 -0.04 5.02 5.04 -0.53 -1.19 117.35 121.73 1iem s TYR 325 Ca 0.30 1.83 0.01 0.00 -2.44 0.00 0.00 57.07 56.77 1iem s TYR 325 Cb 0.05 0.34 0.02 0.00 0.35 0.00 0.00 41.96 42.72 1iem s TYR 325 CO 0.12 -0.39 -0.06 0.08 -1.34 0.00 0.00 175.55 173.95 1iem s VAL 326 N 0.73 0.61 -0.14 3.14 1.01 -0.80 -1.02 120.40 123.93 1iem s VAL 326 Ca -0.03 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 61.63 1iem s VAL 326 Cb -0.05 -0.60 0.04 0.00 0.00 0.00 0.00 36.38 35.78 1iem s VAL 326 CO -0.05 0.23 0.36 0.00 0.00 0.00 0.00 175.10 175.64 1iem s ALA 327 N 0.64 -0.89 0.06 5.51 0.00 -0.88 -1.11 121.76 125.09 1iem s ALA 327 Ca -0.09 1.11 -0.14 0.00 0.00 0.00 0.00 51.96 52.84 1iem s ALA 327 Cb -0.12 -0.66 0.02 0.00 0.00 0.00 0.00 23.12 22.36 1iem s ALA 327 CO 0.01 -0.19 0.32 -0.59 0.00 0.00 0.00 175.76 175.30 1iem s PHE 328 N 0.50 -0.11 -0.34 0.00 -0.12 0.89 -0.98 117.98 117.83 1iem s PHE 328 Ca -0.03 -0.06 0.04 0.00 -0.05 0.00 0.00 56.93 56.83 1iem s PHE 328 Cb -0.04 0.11 0.10 0.00 -0.63 0.00 0.00 43.02 42.56 1iem s PHE 328 CO -0.03 -0.54 0.05 0.42 -0.05 0.00 0.00 175.22 175.08 1iem s ILE 329 N -2.81 2.25 0.19 -4.49 1.01 0.20 -0.84 121.20 116.70 1iem s ILE 329 Ca -0.03 -2.33 -0.17 0.00 0.00 0.00 0.00 60.65 58.11 1iem s ILE 329 Cb 0.00 -2.67 0.16 0.00 0.01 0.00 0.00 42.46 39.96 1iem s ILE 329 CO -0.05 -0.60 1.62 -0.65 0.00 0.00 0.00 174.94 175.26 1iem h PRO 330 N 7.61 -0.09 -0.46 2.79 0.11 -1.69 -1.41 132.00 138.87 1iem h PRO 330 Ca -0.04 0.01 0.12 0.00 0.11 0.00 0.00 66.00 66.20 1iem h PRO 330 Cb 1.02 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1iem h PRO 330 CO 0.52 -0.06 0.33 1.49 -0.21 0.00 0.00 178.00 180.07 1iem h GLU 331 N -0.09 0.06 -0.02 1.05 4.81 -1.42 -1.08 114.58 117.89 1iem h GLU 331 Ca 0.25 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 1iem h GLU 331 Cb 0.47 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1iem h GLU 331 CO -0.59 0.04 -0.24 1.63 -0.73 0.00 0.00 179.01 179.11 1iem n LYS 332 N -4.42 1.57 -3.84 1.92 4.76 -0.60 -4.95 118.16 112.60 1iem n LYS 332 Ca 0.08 -1.23 -0.26 0.00 -2.87 0.00 0.00 58.31 54.03 1iem n LYS 332 Cb 0.50 -1.47 0.02 0.00 -1.84 0.00 0.00 35.03 32.23 1iem n LYS 332 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1iem n GLU 333 N 0.36 -4.92 -4.53 1.97 1.02 -0.41 -4.57 120.64 109.56 1iem n GLU 333 Ca 0.12 0.58 -0.22 0.00 -0.02 0.00 0.00 57.16 57.61 1iem n GLU 333 Cb 0.48 -5.23 -0.16 0.00 -0.02 0.00 0.00 31.44 26.52 1iem n GLU 333 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1iem s LEU 334 N -6.99 1.79 0.28 -4.62 2.96 -1.12 -1.75 118.68 109.23 1iem s LEU 334 Ca 0.31 -0.25 -0.19 0.00 -0.22 0.00 0.00 54.13 53.78 1iem s LEU 334 Cb -0.16 -0.70 0.02 0.00 0.50 0.00 0.00 46.19 45.85 1iem s LEU 334 CO 0.83 0.08 0.68 -0.83 -1.32 0.00 0.00 176.35 175.80 1iem s GLY 335 N 0.22 0.05 -0.08 7.98 0.00 -0.50 0.60 107.32 115.58 1iem s GLY 335 Ca -0.05 -0.43 -0.20 0.00 0.00 0.00 0.00 44.72 44.04 1iem s GLY 335 CO 0.01 -0.20 0.48 -1.50 0.00 0.00 0.00 173.10 171.89 1iem s ILE 336 N -3.85 0.02 -0.08 0.90 2.07 -0.15 -0.82 121.20 119.30 1iem s ILE 336 Ca 0.13 -0.18 0.02 0.00 -1.41 0.00 0.00 60.65 59.21 1iem s ILE 336 Cb -0.05 -0.75 0.02 0.00 0.13 0.00 0.00 42.46 41.81 1iem s ILE 336 CO 0.08 -0.10 -0.11 -0.69 -1.91 0.00 0.00 174.94 172.20 1iem s VAL 337 N -0.74 1.11 -0.23 4.00 1.01 0.05 -2.08 120.40 123.52 1iem s VAL 337 Ca -0.08 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.47 1iem s VAL 337 Cb -0.03 -1.04 0.05 0.00 0.00 0.00 0.00 36.38 35.36 1iem s VAL 337 CO 0.05 0.36 -0.09 -0.04 0.00 0.00 0.00 175.10 175.38 1iem s MET 338 N 0.87 1.93 -0.15 2.72 -1.94 -0.18 -1.29 119.30 121.26 1iem s MET 338 Ca -0.11 -1.02 0.00 0.00 -1.71 0.00 0.00 55.69 52.86 1iem s MET 338 Cb -0.15 -2.60 -0.00 0.00 2.01 0.00 0.00 34.83 34.09 1iem s MET 338 CO 0.01 -0.52 -0.15 -0.51 -0.01 0.00 0.00 175.02 173.84 1iem s LEU 339 N 1.32 2.50 0.01 -0.03 1.43 0.01 -1.46 118.68 122.48 1iem s LEU 339 Ca -0.05 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.60 1iem s LEU 339 Cb -0.18 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 1iem s LEU 339 CO -0.07 0.09 -0.04 0.00 0.23 0.00 0.00 176.35 176.57 1iem s ALA 340 N 0.78 0.25 -0.71 4.21 0.00 -0.72 -0.70 121.76 124.88 1iem s ALA 340 Ca -0.06 -0.40 -0.03 0.00 0.00 0.00 0.00 51.96 51.47 1iem s ALA 340 Cb -0.15 0.04 0.20 0.00 0.00 0.00 0.00 23.12 23.20 1iem s ALA 340 CO 0.00 -0.03 2.39 0.27 0.00 0.00 0.00 175.76 178.39 1iem n ASN 341 N 2.23 7.07 -3.64 0.00 6.94 -1.12 -1.46 115.26 125.27 1iem n ASN 341 Ca -0.18 -3.48 -0.08 0.00 -0.02 0.00 0.00 54.58 50.81 1iem n ASN 341 Cb 0.57 -1.17 -0.07 0.00 -2.36 0.00 0.00 39.78 36.75 1iem n ASN 341 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1iem s LYS 342 N -2.78 0.66 -1.11 -3.83 2.20 0.59 -1.60 119.74 113.87 1iem s LYS 342 Ca 0.55 0.98 -0.18 0.00 -0.36 0.00 0.00 55.97 56.96 1iem s LYS 342 Cb 0.38 0.21 0.11 0.00 -1.51 0.00 0.00 37.83 37.02 1iem s LYS 342 CO -0.29 -0.11 1.42 1.21 -0.36 0.00 0.00 175.35 177.22 1iem s ASN 343 N 1.07 6.78 0.40 1.43 3.84 -1.25 -2.19 114.94 125.02 1iem s ASN 343 Ca -0.05 -2.28 0.01 0.00 0.21 0.00 0.00 52.86 50.74 1iem s ASN 343 Cb -0.05 -2.48 -0.02 0.00 -0.55 0.00 0.00 41.25 38.16 1iem s ASN 343 CO -0.12 -1.09 0.61 -0.72 -2.79 0.00 0.00 177.10 172.99 1iem s TYR 344 N 3.19 3.33 0.13 0.43 1.13 -1.26 -4.95 117.35 119.34 1iem s TYR 344 Ca 0.43 0.25 -0.35 0.00 -1.41 0.00 0.00 57.07 55.99 1iem s TYR 344 Cb -0.01 -2.12 -0.16 0.00 -1.10 0.00 0.00 41.96 38.57 1iem s TYR 344 CO -0.03 -0.14 1.38 -2.30 -2.51 0.00 0.00 175.55 171.95 1iem n PRO 345 N -1.93 1.48 -0.20 -3.49 -0.02 -1.26 -4.91 135.00 124.66 1iem n PRO 345 Ca -0.01 0.53 0.01 0.00 -2.02 0.00 0.00 63.50 62.01 1iem n PRO 345 Cb 0.57 -2.19 0.10 0.00 -0.02 0.00 0.00 33.50 31.96 1iem n PRO 345 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 1iem h ASN 346 N 4.74 -0.18 -0.68 2.55 2.35 -1.96 -2.32 115.58 120.09 1iem h ASN 346 Ca -0.46 0.14 0.14 0.00 -0.55 0.00 0.00 56.30 55.57 1iem h ASN 346 Cb 1.31 0.23 -0.10 0.00 0.05 0.00 0.00 38.32 39.81 1iem h ASN 346 CO 0.80 -0.07 0.15 -0.65 -1.65 0.00 0.00 177.43 176.00 1iem h PRO 347 N 0.16 0.25 -0.27 0.81 0.11 -1.81 0.19 132.00 131.44 1iem h PRO 347 Ca 0.32 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.38 1iem h PRO 347 Cb 0.51 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 1iem h PRO 347 CO -0.48 0.17 0.01 0.00 -0.21 0.00 0.00 178.00 177.49 1iem h ALA 348 N 1.56 1.53 0.37 -0.75 0.00 -1.78 -0.67 119.26 119.53 1iem h ALA 348 Ca 0.37 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1iem h ALA 348 Cb 0.61 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1iem h ALA 348 CO -0.47 0.35 -0.18 0.00 0.00 0.00 0.00 179.25 178.94 1iem h ARG 349 N 0.39 -0.48 -0.77 0.00 3.08 -0.48 -2.45 114.38 113.66 1iem h ARG 349 Ca 0.09 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 1iem h ARG 349 Cb 0.24 0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 1iem h ARG 349 CO 0.00 -0.20 0.44 0.28 -1.07 0.00 0.00 179.97 179.43 1iem h VAL 350 N -0.73 1.22 -0.68 2.04 2.07 -1.14 -1.20 116.25 117.84 1iem h VAL 350 Ca -0.05 -0.52 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 1iem h VAL 350 Cb 0.51 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 1iem h VAL 350 CO 0.08 0.24 0.36 -0.78 0.02 0.00 0.00 177.57 177.49 1iem h ASP 351 N 1.07 0.86 -0.36 0.57 -0.00 -1.11 0.24 116.42 117.69 1iem h ASP 351 Ca 0.28 -0.11 -0.07 0.00 -0.00 0.00 0.00 57.03 57.13 1iem h ASP 351 Cb -0.01 -0.22 -0.01 0.00 -0.00 0.00 0.00 39.33 39.09 1iem h ASP 351 CO -0.05 0.72 -0.06 0.00 -0.00 0.00 0.00 179.24 179.85 1iem h ALA 352 N 1.17 0.50 -0.79 -0.78 0.00 -0.93 -1.58 119.26 116.84 1iem h ALA 352 Ca 0.24 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1iem h ALA 352 Cb 0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1iem h ALA 352 CO -0.04 0.33 0.30 0.00 0.00 0.00 0.00 179.25 179.84 1iem h ALA 353 N 0.83 1.04 0.23 0.00 0.00 -0.94 -2.22 119.26 118.20 1iem h ALA 353 Ca 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1iem h ALA 353 Cb 0.56 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1iem h ALA 353 CO 0.03 0.67 -0.11 2.35 0.00 0.00 0.00 179.25 182.19 1iem h TRP 354 N 1.16 -0.29 -0.40 0.00 2.91 -0.37 0.58 115.95 119.54 1iem h TRP 354 Ca 0.26 -0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.35 1iem h TRP 354 Cb 0.24 0.10 -0.06 0.00 -0.51 0.00 0.00 29.16 28.92 1iem h TRP 354 CO 0.02 -0.09 0.03 1.96 -1.03 0.00 0.00 178.44 179.33 1iem h GLN 355 N -0.44 0.14 0.61 2.65 1.08 -1.21 0.20 115.11 118.14 1iem h GLN 355 Ca -0.03 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 1iem h GLN 355 Cb 0.33 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 1iem h GLN 355 CO 0.05 0.09 -0.33 0.82 -0.95 0.00 0.00 178.83 178.52 1iem h ILE 356 N 0.15 0.33 -0.42 2.54 2.04 -1.29 -1.91 117.51 118.95 1iem h ILE 356 Ca 0.20 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.01 1iem h ILE 356 Cb 0.27 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 1iem h ILE 356 CO -0.30 0.00 0.05 -0.07 0.00 0.00 0.00 178.15 177.83 1iem h LEU 357 N -0.87 0.68 -0.99 1.44 3.38 -0.67 -2.90 115.31 115.37 1iem h LEU 357 Ca -0.08 -0.27 0.10 0.00 0.09 0.00 0.00 57.88 57.72 1iem h LEU 357 Cb 0.69 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 41.18 1iem h LEU 357 CO 0.11 0.78 0.63 -1.13 0.09 0.00 0.00 178.44 178.92 1iem h ASN 358 N 0.55 0.96 0.32 -0.43 -0.00 -0.61 1.00 115.58 117.37 1iem h ASN 358 Ca 0.13 0.03 0.00 0.00 -0.00 0.00 0.00 56.30 56.46 1iem h ASN 358 Cb 0.40 -0.17 0.00 0.00 -0.00 0.00 0.00 38.32 38.55 1iem h ASN 358 CO 0.01 0.56 0.00 0.00 -0.00 0.00 0.00 177.43 178.00 1iem h ALA 359 N 1.50 1.00 -0.53 1.57 0.00 -1.14 -2.59 119.26 119.07 1iem h ALA 359 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1iem h ALA 359 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1iem h ALA 359 CO -0.23 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.30 1iem n LEU 360 N -2.52 4.17 0.00 0.00 4.77 0.34 -5.10 117.00 118.66 1iem n LEU 360 Ca -0.01 -2.41 0.00 0.00 -0.03 0.00 0.00 56.01 53.56 1iem n LEU 360 Cb 0.13 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 1iem n LEU 360 CO 0.17 0.79 0.00 0.00 -1.33 0.00 0.00 177.39 177.01