#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibr h LEU 3 N 0.00 0.43 -1.57 -1.84 6.46 -2.03 -2.35 115.31 114.41 1ibr h LEU 3 Ca 0.00 -0.12 0.01 0.00 -0.12 0.00 0.00 57.88 57.65 1ibr h LEU 3 Cb 0.00 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 39.80 1ibr h LEU 3 CO 0.00 0.43 0.31 0.40 -0.62 0.00 0.00 178.44 178.95 1ibr h ILE 4 N 0.39 1.10 -0.12 4.05 2.04 -1.99 -1.46 117.51 121.51 1ibr h ILE 4 Ca 0.11 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1ibr h ILE 4 Cb 0.12 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1ibr h ILE 4 CO -0.01 0.11 0.06 0.74 0.00 0.00 0.00 178.15 179.04 1ibr h THR 5 N 0.59 1.13 -0.20 -0.27 2.02 -1.87 -0.62 112.91 113.70 1ibr h THR 5 Ca 0.17 -0.37 -0.14 0.00 0.77 0.00 0.00 66.41 66.85 1ibr h THR 5 Cb -0.02 1.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 1ibr h THR 5 CO -0.04 0.11 -0.45 0.16 0.37 0.00 0.00 175.52 175.67 1ibr h ILE 6 N 0.07 1.31 -0.24 3.11 -0.00 -1.14 -2.17 117.51 118.45 1ibr h ILE 6 Ca 0.04 -1.65 -0.03 0.00 -0.00 0.00 0.00 64.86 63.22 1ibr h ILE 6 Cb 0.13 1.66 -0.01 0.00 -0.00 0.00 0.00 36.82 38.59 1ibr h ILE 6 CO -0.00 0.51 0.01 -0.07 -0.00 0.00 0.00 178.15 178.59 1ibr h LEU 7 N 0.40 0.32 -1.36 0.16 3.38 -1.14 -0.97 115.31 116.10 1ibr h LEU 7 Ca 0.03 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1ibr h LEU 7 Cb 0.95 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1ibr h LEU 7 CO 0.08 0.38 -0.31 -0.08 0.09 0.00 0.00 178.44 178.61 1ibr h GLU 8 N 0.35 0.00 0.00 1.13 4.57 -0.47 -2.60 114.58 117.56 1ibr h GLU 8 Ca 0.08 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 1ibr h GLU 8 Cb 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 1ibr h GLU 8 CO 0.00 0.31 0.00 0.87 -1.18 0.00 0.00 179.01 179.01 1ibr h LYS 9 N 0.00 0.00 0.00 1.92 1.57 -0.84 -3.29 116.57 115.93 1ibr h LYS 9 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ibr h LYS 9 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1ibr h LYS 9 CO 0.04 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.17 1ibr n THR 10 N -2.60 1.17 0.55 -0.16 -2.24 -0.98 -1.26 114.28 108.76 1ibr n THR 10 Ca 0.03 0.29 0.06 0.00 -2.27 0.00 0.00 64.05 62.16 1ibr n THR 10 Cb 0.33 -1.21 0.04 0.00 -2.10 0.00 0.00 70.33 67.40 1ibr n THR 10 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1ibr n VAL 11 N -1.35 0.00 -2.32 2.28 3.14 -1.24 -4.99 118.33 113.84 1ibr n VAL 11 Ca 0.02 -0.48 -0.41 0.00 -2.96 0.00 0.00 64.34 60.52 1ibr n VAL 11 Cb 0.04 1.25 -0.03 0.00 -1.06 0.00 0.00 33.84 34.04 1ibr n VAL 11 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1ibr s SER 12 N -1.19 7.05 0.05 6.55 0.15 -0.39 -4.96 113.70 120.97 1ibr s SER 12 Ca 0.14 2.41 0.25 0.00 0.70 0.00 0.00 55.95 59.46 1ibr s SER 12 Cb 0.11 -2.63 1.03 0.00 -1.71 0.00 0.00 66.02 62.81 1ibr s SER 12 CO 0.19 -0.33 1.79 -0.81 1.20 0.00 0.00 173.24 175.29 1ibr n PRO 13 N 1.38 0.05 -2.52 5.44 -0.04 -1.26 -4.67 135.00 133.39 1ibr n PRO 13 Ca 0.01 0.11 -0.43 0.00 -0.04 0.00 0.00 63.50 63.15 1ibr n PRO 13 Cb 0.44 -1.57 -0.02 0.00 -0.04 0.00 0.00 33.50 32.30 1ibr n PRO 13 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1ibr s ASP 14 N -3.33 6.60 0.33 3.54 -1.08 -1.26 -4.89 116.67 116.59 1ibr s ASP 14 Ca 0.11 0.75 0.11 0.00 -0.52 0.00 0.00 52.55 53.00 1ibr s ASP 14 Cb 0.15 -2.55 0.95 0.00 -1.46 0.00 0.00 42.92 40.02 1ibr s ASP 14 CO 0.48 -1.22 1.72 0.08 0.52 0.00 0.00 175.17 176.74 1ibr h ARG 15 N 9.46 0.50 -0.89 4.34 0.11 -1.99 0.30 114.38 126.21 1ibr h ARG 15 Ca -0.24 -0.03 0.01 0.00 0.10 0.00 0.00 59.98 59.82 1ibr h ARG 15 Cb 1.08 -0.11 -0.04 0.00 1.11 0.00 0.00 29.97 32.00 1ibr h ARG 15 CO 1.09 0.33 0.59 -0.07 0.10 0.00 0.00 179.97 182.00 1ibr h LEU 16 N 0.51 1.02 -0.21 0.08 4.07 -1.97 0.99 115.31 119.81 1ibr h LEU 16 Ca 0.66 -0.03 -0.10 0.00 0.08 0.00 0.00 57.88 58.50 1ibr h LEU 16 Cb 1.35 -0.26 -0.00 0.00 1.08 0.00 0.00 40.66 42.83 1ibr h LEU 16 CO -0.49 0.74 -0.26 -0.33 -1.08 0.00 0.00 178.44 177.03 1ibr h GLU 17 N 1.21 0.54 -0.53 1.13 4.39 -0.81 -1.78 114.58 118.72 1ibr h GLU 17 Ca 0.32 -0.30 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 1ibr h GLU 17 Cb -0.13 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.51 1ibr h GLU 17 CO -0.07 0.90 0.14 -0.07 -1.16 0.00 0.00 179.01 178.74 1ibr h LEU 18 N 0.21 0.79 -0.61 1.33 3.38 -0.95 -0.24 115.31 119.22 1ibr h LEU 18 Ca 0.03 -0.23 -0.08 0.00 0.09 0.00 0.00 57.88 57.69 1ibr h LEU 18 Cb 0.82 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1ibr h LEU 18 CO 0.06 0.81 0.08 -0.33 0.09 0.00 0.00 178.44 179.15 1ibr h GLU 19 N 0.73 1.02 -0.60 1.13 5.08 -0.84 0.30 114.58 121.41 1ibr h GLU 19 Ca 0.17 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 1ibr h GLU 19 Cb 0.32 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1ibr h GLU 19 CO 0.00 0.97 0.25 0.00 -1.00 0.00 0.00 179.01 179.23 1ibr h ALA 20 N 1.01 0.78 -0.21 3.43 0.00 -1.08 0.18 119.26 123.36 1ibr h ALA 20 Ca 0.18 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ibr h ALA 20 Cb 0.46 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1ibr h ALA 20 CO 0.02 0.38 0.04 0.00 0.00 0.00 0.00 179.25 179.69 1ibr h ALA 21 N 1.09 0.28 -0.27 0.00 0.00 -0.62 -1.40 119.26 118.34 1ibr h ALA 21 Ca 0.20 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ibr h ALA 21 Cb 0.19 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ibr h ALA 21 CO -0.02 -0.05 0.16 0.37 0.00 0.00 0.00 179.25 179.71 1ibr h GLN 22 N 0.15 0.38 -0.76 0.00 4.15 -0.12 -0.40 115.11 118.51 1ibr h GLN 22 Ca 0.06 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.45 1ibr h GLN 22 Cb 0.31 -0.08 -0.04 0.00 0.21 0.00 0.00 27.48 27.88 1ibr h GLN 22 CO 0.00 0.31 0.48 -0.22 -1.93 0.00 0.00 178.83 177.48 1ibr h LYS 23 N 0.34 1.01 -0.40 1.69 3.64 -0.59 -0.13 116.57 122.13 1ibr h LYS 23 Ca 0.10 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1ibr h LYS 23 Cb 0.04 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 1ibr h LYS 23 CO -0.02 0.69 0.22 0.35 -2.27 0.00 0.00 179.45 178.42 1ibr h PHE 24 N 1.03 0.55 -0.38 1.91 3.04 -0.91 -1.76 116.94 120.42 1ibr h PHE 24 Ca 0.27 -0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.17 1ibr h PHE 24 Cb -0.08 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 38.23 1ibr h PHE 24 CO -0.02 0.43 0.09 -0.07 -2.02 0.00 0.00 178.31 176.72 1ibr h LEU 25 N 0.52 0.58 -0.82 0.59 -0.00 -0.58 -2.05 115.31 113.56 1ibr h LEU 25 Ca 0.14 -0.23 -0.01 0.00 -0.00 0.00 0.00 57.88 57.78 1ibr h LEU 25 Cb 0.06 -0.15 -0.04 0.00 -0.00 0.00 0.00 40.66 40.53 1ibr h LEU 25 CO -0.02 0.67 0.47 -0.33 -0.00 0.00 0.00 178.44 179.22 1ibr h GLU 26 N 0.47 1.12 -0.27 1.13 5.08 -0.95 -2.10 114.58 119.07 1ibr h GLU 26 Ca 0.12 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1ibr h GLU 26 Cb 0.31 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1ibr h GLU 26 CO 0.00 0.81 0.10 0.00 -1.00 0.00 0.00 179.01 178.92 1ibr h ARG 27 N 1.13 0.41 -0.84 2.33 3.08 -1.18 -1.87 114.38 117.44 1ibr h ARG 27 Ca 0.29 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.29 1ibr h ARG 27 Cb -0.01 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 29.93 1ibr h ARG 27 CO -0.05 0.45 0.55 0.00 -1.07 0.00 0.00 179.97 179.85 1ibr h ALA 28 N 0.94 1.45 -0.63 0.04 0.00 -1.19 0.47 119.26 120.35 1ibr h ALA 28 Ca 0.09 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1ibr h ALA 28 Cb 0.20 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1ibr h ALA 28 CO -0.01 0.48 0.13 0.00 0.00 0.00 0.00 179.25 179.86 1ibr h ALA 29 N 1.50 0.83 -0.10 0.00 0.00 -1.10 -1.51 119.26 118.88 1ibr h ALA 29 Ca 0.32 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1ibr h ALA 29 Cb -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1ibr h ALA 29 CO -0.09 0.55 -0.34 0.28 0.00 0.00 0.00 179.25 179.65 1ibr h VAL 30 N 0.93 1.39 -0.02 0.00 2.07 -0.51 -2.77 116.25 117.35 1ibr h VAL 30 Ca 0.19 -1.69 0.02 0.00 0.82 0.00 0.00 66.70 66.05 1ibr h VAL 30 Cb 0.38 2.21 -0.03 0.00 -1.52 0.00 0.00 31.29 32.33 1ibr h VAL 30 CO 0.01 0.50 -0.13 -0.08 0.02 0.00 0.00 177.57 177.88 1ibr h GLU 31 N -0.04 -0.20 -1.04 1.57 4.57 -0.01 -3.41 114.58 116.02 1ibr h GLU 31 Ca -0.02 0.01 -0.13 0.00 -1.18 0.00 0.00 59.36 58.05 1ibr h GLU 31 Cb 0.98 0.05 -0.18 0.00 -0.16 0.00 0.00 28.75 29.43 1ibr h GLU 31 CO 0.07 -0.13 -0.49 1.21 -1.18 0.00 0.00 179.01 178.49 1ibr s ASN 32 N -5.03 -1.39 0.22 1.04 3.84 -0.58 -5.04 114.94 108.00 1ibr s ASN 32 Ca -0.14 -1.40 -0.08 0.00 0.21 0.00 0.00 52.86 51.45 1ibr s ASN 32 Cb 0.09 1.87 0.34 0.00 -0.55 0.00 0.00 41.25 42.99 1ibr s ASN 32 CO 0.67 -0.10 1.72 0.25 -2.79 0.00 0.00 177.10 176.84 1ibr h LEU 33 N 5.80 0.12 -0.32 3.21 6.46 -1.62 -1.81 115.31 127.16 1ibr h LEU 33 Ca 0.06 0.11 0.03 0.00 -0.12 0.00 0.00 57.88 57.96 1ibr h LEU 33 Cb 1.13 0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 41.15 1ibr h LEU 33 CO 0.05 0.06 0.11 -0.65 -0.62 0.00 0.00 178.44 177.39 1ibr h PRO 34 N 0.34 0.24 -0.16 5.25 0.11 -1.93 -0.73 132.00 135.12 1ibr h PRO 34 Ca 0.34 -0.01 -0.14 0.00 0.11 0.00 0.00 66.00 66.30 1ibr h PRO 34 Cb 0.50 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 1ibr h PRO 34 CO -0.39 0.16 -0.49 1.15 -0.21 0.00 0.00 178.00 178.22 1ibr h THR 35 N 0.25 1.33 -0.05 -1.15 2.02 -1.90 -1.67 112.91 111.73 1ibr h THR 35 Ca 0.14 -1.71 -0.00 0.00 0.77 0.00 0.00 66.41 65.61 1ibr h THR 35 Cb 0.11 1.74 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1ibr h THR 35 CO -0.15 0.53 0.02 0.15 0.37 0.00 0.00 175.52 176.44 1ibr h PHE 36 N 0.35 0.08 -0.20 3.16 3.57 -1.06 -0.78 116.94 122.05 1ibr h PHE 36 Ca 0.02 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.42 1ibr h PHE 36 Cb 0.99 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 1ibr h PHE 36 CO 0.03 0.19 -0.29 -0.07 -2.23 0.00 0.00 178.31 175.95 1ibr h LEU 37 N -0.06 0.39 -0.18 0.59 3.38 -1.09 0.92 115.31 119.26 1ibr h LEU 37 Ca 0.02 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 1ibr h LEU 37 Cb 0.15 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ibr h LEU 37 CO -0.00 0.68 -0.15 0.58 0.09 0.00 0.00 178.44 179.64 1ibr h VAL 38 N 0.34 1.33 -0.38 1.22 2.07 -1.18 -1.45 116.25 118.20 1ibr h VAL 38 Ca 0.05 -1.28 -0.05 0.00 0.82 0.00 0.00 66.70 66.24 1ibr h VAL 38 Cb 0.69 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 1ibr h VAL 38 CO 0.05 0.38 0.03 -0.08 0.02 0.00 0.00 177.57 177.98 1ibr h GLU 39 N 0.09 0.65 -0.77 1.57 4.81 -0.98 -2.06 114.58 117.89 1ibr h GLU 39 Ca 0.03 -0.19 0.06 0.00 -0.13 0.00 0.00 59.36 59.13 1ibr h GLU 39 Cb 0.67 -0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.92 1ibr h GLU 39 CO 0.04 0.73 0.46 -0.07 -0.73 0.00 0.00 179.01 179.44 1ibr h LEU 40 N 0.48 0.71 -1.72 1.64 3.38 -0.81 0.04 115.31 119.03 1ibr h LEU 40 Ca 0.11 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1ibr h LEU 40 Cb 0.41 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1ibr h LEU 40 CO 0.01 0.46 -0.18 0.77 0.09 0.00 0.00 178.44 179.59 1ibr h SER 41 N 0.85 0.00 -0.05 -0.43 4.64 -0.97 -0.88 113.55 116.70 1ibr h SER 41 Ca 0.34 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.41 1ibr h SER 41 Cb 0.17 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.28 1ibr h SER 41 CO -0.17 0.18 -0.93 0.03 -0.87 0.00 0.00 176.83 175.06 1ibr h ARG 42 N 0.00 0.73 -0.74 4.77 3.08 -0.32 -0.83 114.38 121.07 1ibr h ARG 42 Ca -0.00 -0.70 -0.02 0.00 0.07 0.00 0.00 59.98 59.32 1ibr h ARG 42 Cb 0.38 0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1ibr h ARG 42 CO 0.02 1.29 0.37 0.28 -1.07 0.00 0.00 179.97 180.87 1ibr h VAL 43 N 0.45 1.23 -0.27 2.04 2.07 -0.69 -2.17 116.25 118.92 1ibr h VAL 43 Ca -0.10 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 66.80 1ibr h VAL 43 Cb 1.57 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1ibr h VAL 43 CO 0.19 0.27 0.17 0.25 0.02 0.00 0.00 177.57 178.46 1ibr h LEU 44 N 1.03 0.28 -1.61 2.57 6.46 -1.07 -2.92 115.31 120.05 1ibr h LEU 44 Ca 0.26 -0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.99 1ibr h LEU 44 Cb 0.09 -0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 39.95 1ibr h LEU 44 CO -0.04 0.20 -0.12 0.00 -0.62 0.00 0.00 178.44 177.87 1ibr h ALA 45 N 1.11 1.10 -1.68 1.25 0.00 -0.83 -3.43 119.26 116.78 1ibr h ALA 45 Ca 0.10 -0.11 -0.56 0.00 0.00 0.00 0.00 54.91 54.34 1ibr h ALA 45 Cb -0.02 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.68 1ibr h ALA 45 CO -0.04 0.15 0.91 1.21 0.00 0.00 0.00 179.25 181.49 1ibr s ASN 46 N -5.98 6.54 0.00 0.00 3.04 -0.84 -4.83 114.94 112.86 1ibr s ASN 46 Ca -0.01 0.26 0.12 0.00 0.04 0.00 0.00 52.86 53.27 1ibr s ASN 46 Cb 0.11 -2.54 0.64 0.00 -1.54 0.00 0.00 41.25 37.92 1ibr s ASN 46 CO 0.58 -1.34 1.21 -0.81 -3.04 0.00 0.00 177.10 173.70 1ibr n PRO 47 N 8.04 0.26 0.09 0.43 -0.04 -1.26 -1.52 135.00 141.00 1ibr n PRO 47 Ca 0.10 0.10 0.13 0.00 -0.04 0.00 0.00 63.50 63.78 1ibr n PRO 47 Cb 0.49 -1.50 0.30 0.00 -0.04 0.00 0.00 33.50 32.74 1ibr n PRO 47 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1ibr h GLY 48 N 1.87 0.00 -1.88 0.55 0.00 -1.93 -3.46 103.07 98.22 1ibr h GLY 48 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.87 1ibr h GLY 48 CO 0.00 0.00 0.36 -1.31 0.00 0.00 0.00 176.54 175.59 1ibr s ASN 49 N -4.52 6.72 0.82 0.19 0.01 -0.58 -5.03 114.94 112.55 1ibr s ASN 49 Ca 0.09 1.63 -0.10 0.00 -0.71 0.00 0.00 52.86 53.76 1ibr s ASN 49 Cb 0.12 -2.52 0.09 0.00 0.41 0.00 0.00 41.25 39.35 1ibr s ASN 49 CO 0.65 -0.52 1.11 -0.94 -1.51 0.00 0.00 177.10 175.89 1ibr s SER 50 N -2.69 3.98 0.20 -1.22 1.04 -1.26 -4.80 113.70 108.94 1ibr s SER 50 Ca 0.60 1.91 -0.11 0.00 0.48 0.00 0.00 55.95 58.84 1ibr s SER 50 Cb -0.10 -2.52 0.15 0.00 0.10 0.00 0.00 66.02 63.65 1ibr s SER 50 CO 0.24 -2.39 1.86 -0.61 0.98 0.00 0.00 173.24 173.32 1ibr h GLN 51 N -1.37 0.85 -0.13 4.02 4.15 -1.97 -1.52 115.11 119.14 1ibr h GLN 51 Ca -0.44 -0.05 0.04 0.00 0.77 0.00 0.00 58.65 58.97 1ibr h GLN 51 Cb 1.24 -0.19 -0.05 0.00 0.21 0.00 0.00 27.48 28.69 1ibr h GLN 51 CO 0.49 0.56 -0.17 0.28 -1.93 0.00 0.00 178.83 178.06 1ibr h VAL 52 N 0.88 0.56 -0.66 2.39 2.07 -1.97 0.61 116.25 120.13 1ibr h VAL 52 Ca 0.26 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.80 1ibr h VAL 52 Cb -0.05 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 30.25 1ibr h VAL 52 CO -0.08 0.00 0.42 0.00 0.02 0.00 0.00 177.57 177.94 1ibr h ALA 53 N 0.84 0.85 -0.19 1.67 0.00 -1.74 -0.01 119.26 120.68 1ibr h ALA 53 Ca 0.10 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1ibr h ALA 53 Cb 0.35 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ibr h ALA 53 CO -0.26 0.22 -0.09 0.00 0.00 0.00 0.00 179.25 179.12 1ibr h ARG 54 N 0.85 0.40 -0.36 0.00 3.08 -0.96 -1.92 114.38 115.48 1ibr h ARG 54 Ca 0.25 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 1ibr h ARG 54 Cb -0.04 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 1ibr h ARG 54 CO -0.08 0.70 0.07 0.28 -1.07 0.00 0.00 179.97 179.86 1ibr h VAL 55 N 0.10 1.23 -1.00 2.04 2.07 -0.74 -1.18 116.25 118.77 1ibr h VAL 55 Ca 0.04 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.77 1ibr h VAL 55 Cb 0.57 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 1ibr h VAL 55 CO 0.03 0.28 0.66 0.00 0.02 0.00 0.00 177.57 178.55 1ibr h ALA 56 N 0.91 1.29 -0.33 1.67 0.00 -1.01 0.36 119.26 122.15 1ibr h ALA 56 Ca 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1ibr h ALA 56 Cb 0.34 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1ibr h ALA 56 CO 0.01 0.62 0.06 0.00 0.00 0.00 0.00 179.25 179.93 1ibr h ALA 57 N 1.38 0.43 -0.79 0.00 0.00 -1.17 -1.37 119.26 117.74 1ibr h ALA 57 Ca 0.38 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1ibr h ALA 57 Cb -0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 1ibr h ALA 57 CO -0.10 0.12 0.46 0.78 0.00 0.00 0.00 179.25 180.52 1ibr h GLY 58 N 0.37 1.16 1.91 0.00 0.00 -0.52 -1.89 103.07 104.09 1ibr h GLY 58 Ca 0.10 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 1ibr h GLY 58 CO 0.01 0.48 -0.47 1.41 0.00 0.00 0.00 176.54 177.96 1ibr h LEU 59 N 1.09 0.11 -0.38 3.11 3.38 -0.81 -0.24 115.31 121.57 1ibr h LEU 59 Ca 0.28 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.17 1ibr h LEU 59 Cb -0.02 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1ibr h LEU 59 CO -0.05 0.57 0.10 1.56 0.09 0.00 0.00 178.44 180.70 1ibr h GLN 60 N 0.08 0.60 -0.07 1.13 1.08 -0.82 0.13 115.11 117.25 1ibr h GLN 60 Ca 0.00 -0.14 -0.01 0.00 -1.45 0.00 0.00 58.65 57.06 1ibr h GLN 60 Cb 0.87 -0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 28.21 1ibr h GLN 60 CO 0.07 0.63 0.01 0.82 -0.95 0.00 0.00 178.83 179.41 1ibr h ILE 61 N 0.46 1.19 -0.67 2.54 2.04 -1.14 -2.85 117.51 119.09 1ibr h ILE 61 Ca 0.12 -0.59 0.01 0.00 1.00 0.00 0.00 64.86 65.40 1ibr h ILE 61 Cb 0.30 1.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 1ibr h ILE 61 CO 0.00 0.17 0.44 0.50 0.00 0.00 0.00 178.15 179.25 1ibr h LYS 62 N -0.11 0.86 0.00 2.37 3.11 -0.93 -1.80 116.57 120.06 1ibr h LYS 62 Ca 0.02 -0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.81 1ibr h LYS 62 Cb 0.25 -0.19 0.00 0.00 -1.00 0.00 0.00 32.23 31.29 1ibr h LYS 62 CO 0.00 0.57 0.00 0.09 -2.81 0.00 0.00 179.45 177.30 1ibr n ASN 63 N -4.64 0.00 0.01 4.20 3.02 0.44 -1.66 115.26 116.63 1ibr n ASN 63 Ca 0.06 -0.63 0.11 0.00 -0.03 0.00 0.00 54.58 54.09 1ibr n ASN 63 Cb 0.04 -0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.15 1ibr n ASN 63 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1ibr n SER 64 N -1.03 0.60 -0.29 6.41 7.64 -0.68 -4.30 113.62 121.97 1ibr n SER 64 Ca 0.16 -0.36 0.06 0.00 1.01 0.00 0.00 58.87 59.74 1ibr n SER 64 Cb 0.08 1.02 0.00 0.00 -1.01 0.00 0.00 64.21 64.30 1ibr n SER 64 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1ibr n LEU 65 N -1.89 1.41 -4.04 -3.43 4.77 -0.67 -4.74 117.00 108.42 1ibr n LEU 65 Ca 0.02 -0.79 -0.11 0.00 -0.03 0.00 0.00 56.01 55.09 1ibr n LEU 65 Cb 0.43 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.47 1ibr n LEU 65 CO 0.42 0.28 0.14 -0.89 -1.33 0.00 0.00 177.39 176.00 1ibr s THR 66 N -1.47 0.00 -0.09 -5.08 2.01 -1.09 -4.44 115.64 105.47 1ibr s THR 66 Ca 0.10 -1.52 -0.30 0.00 0.31 0.00 0.00 61.69 60.29 1ibr s THR 66 Cb 0.10 -2.43 0.11 0.00 0.01 0.00 0.00 72.50 70.29 1ibr s THR 66 CO 0.28 0.00 0.93 -0.55 -0.69 0.00 0.00 174.62 174.59 1ibr s SER 67 N -3.11 -0.39 0.51 3.53 0.15 -1.26 -4.79 113.70 108.33 1ibr s SER 67 Ca 0.27 0.28 0.32 0.00 0.70 0.00 0.00 55.95 57.51 1ibr s SER 67 Cb 0.00 0.35 1.20 0.00 -1.71 0.00 0.00 66.02 65.87 1ibr s SER 67 CO 0.14 -0.47 1.92 0.11 1.20 0.00 0.00 173.24 176.13 1ibr h LYS 68 N 2.39 0.00 -5.50 5.44 1.57 -2.01 -3.41 116.57 115.05 1ibr h LYS 68 Ca -0.20 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 57.95 1ibr h LYS 68 Cb 1.19 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.37 1ibr h LYS 68 CO 0.32 0.00 0.15 0.34 -0.57 0.00 0.00 179.45 179.69 1ibr s ASP 69 N -5.63 6.45 0.57 0.86 -1.08 -1.26 -4.96 116.67 111.62 1ibr s ASP 69 Ca 0.02 0.24 0.27 0.00 -0.52 0.00 0.00 52.55 52.56 1ibr s ASP 69 Cb 0.09 -2.33 1.52 0.00 -1.46 0.00 0.00 42.92 40.74 1ibr s ASP 69 CO 0.55 -0.57 2.02 1.55 0.52 0.00 0.00 175.17 179.24 1ibr h PRO 70 N 8.38 0.00 0.14 4.34 0.13 -1.99 0.09 132.00 143.09 1ibr h PRO 70 Ca -0.26 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.66 1ibr h PRO 70 Cb 1.11 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.26 1ibr h PRO 70 CO 0.83 0.00 -0.94 -0.44 -0.23 0.00 0.00 178.00 177.22 1ibr h ASP 71 N 0.00 0.47 -0.65 1.44 3.32 -1.95 -2.44 116.42 116.62 1ibr h ASP 71 Ca 0.16 -0.93 -0.00 0.00 0.02 0.00 0.00 57.03 56.28 1ibr h ASP 71 Cb 0.81 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 1ibr h ASP 71 CO -0.00 1.44 0.39 0.40 -1.72 0.00 0.00 179.24 179.75 1ibr h ILE 72 N -0.34 1.19 -0.19 0.35 1.08 -1.81 -1.32 117.51 116.46 1ibr h ILE 72 Ca -0.18 -0.42 0.01 0.00 -0.39 0.00 0.00 64.86 63.89 1ibr h ILE 72 Cb 1.68 0.30 -0.02 0.00 -3.07 0.00 0.00 36.82 35.71 1ibr h ILE 72 CO 0.14 0.19 0.08 0.50 -0.69 0.00 0.00 178.15 178.37 1ibr h LYS 73 N 0.88 0.17 -0.97 2.37 3.64 -1.07 0.19 116.57 121.78 1ibr h LYS 73 Ca 0.23 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.67 1ibr h LYS 73 Cb -0.03 -0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 31.69 1ibr h LYS 73 CO -0.04 0.11 0.63 0.00 -2.27 0.00 0.00 179.45 177.88 1ibr h ALA 74 N 1.11 1.46 -0.38 5.00 0.00 -1.01 0.88 119.26 126.31 1ibr h ALA 74 Ca 0.08 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1ibr h ALA 74 Cb 0.03 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1ibr h ALA 74 CO -0.07 0.39 -0.26 1.96 0.00 0.00 0.00 179.25 181.27 1ibr h GLN 75 N 1.11 0.84 -0.61 0.00 4.20 -0.52 -1.63 115.11 118.50 1ibr h GLN 75 Ca 0.42 -0.40 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 1ibr h GLN 75 Cb 0.21 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 27.96 1ibr h GLN 75 CO -0.17 1.04 0.10 1.88 -0.67 0.00 0.00 178.83 181.01 1ibr h TYR 76 N 0.64 1.04 -0.36 2.96 -1.99 0.24 0.30 116.97 119.80 1ibr h TYR 76 Ca 0.07 -0.13 -0.10 0.00 2.00 0.00 0.00 58.73 60.57 1ibr h TYR 76 Cb 0.83 -0.29 -0.02 0.00 2.00 0.00 0.00 36.73 39.26 1ibr h TYR 76 CO 0.06 0.88 -0.20 1.96 -0.00 0.00 0.00 178.16 180.86 1ibr h GLN 77 N 0.93 0.70 -0.35 4.88 4.20 -0.78 -1.24 115.11 123.45 1ibr h GLN 77 Ca 0.19 -0.26 -0.12 0.00 0.06 0.00 0.00 58.65 58.52 1ibr h GLN 77 Cb 0.40 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1ibr h GLN 77 CO 0.01 0.85 -0.23 1.96 -0.67 0.00 0.00 178.83 180.75 1ibr h GLN 78 N 0.62 0.77 -0.94 1.46 4.20 -0.76 -1.60 115.11 118.87 1ibr h GLN 78 Ca 0.09 -0.37 0.04 0.00 0.06 0.00 0.00 58.65 58.47 1ibr h GLN 78 Cb 0.68 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.40 1ibr h GLN 78 CO 0.05 0.99 0.62 -0.09 -0.67 0.00 0.00 178.83 179.73 1ibr h ARG 79 N 0.56 1.15 -0.07 1.46 2.43 -0.11 -1.03 114.38 118.77 1ibr h ARG 79 Ca 0.07 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1ibr h ARG 79 Cb 0.79 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1ibr h ARG 79 CO 0.06 0.76 -0.04 2.35 -1.51 0.00 0.00 179.97 181.60 1ibr h TRP 80 N 1.18 0.16 -0.01 2.20 2.91 -1.05 -3.02 115.95 118.34 1ibr h TRP 80 Ca 0.37 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.35 1ibr h TRP 80 Cb 0.01 -0.04 -0.00 0.00 -0.51 0.00 0.00 29.16 28.63 1ibr h TRP 80 CO -0.00 0.53 0.00 -0.07 -1.03 0.00 0.00 178.44 177.87 1ibr h LEU 81 N -0.25 0.00 -0.01 0.65 3.38 -0.83 0.31 115.31 118.56 1ibr h LEU 81 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ibr h LEU 81 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1ibr h LEU 81 CO 0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.54 1ibr n ALA 82 N -2.38 2.27 -1.77 1.53 0.00 -0.43 -4.84 120.51 114.89 1ibr n ALA 82 Ca -0.03 -0.08 -0.36 0.00 0.00 0.00 0.00 53.44 52.97 1ibr n ALA 82 Cb 0.09 -1.45 -0.01 0.00 0.00 0.00 0.00 19.45 18.08 1ibr n ALA 82 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ibr s ILE 83 N -3.02 3.24 -0.24 0.00 -1.09 0.10 -4.89 121.20 115.30 1ibr s ILE 83 Ca 0.13 0.87 -0.40 0.00 -2.23 0.00 0.00 60.65 59.03 1ibr s ILE 83 Cb 0.17 -3.41 -0.15 0.00 -1.58 0.00 0.00 42.46 37.49 1ibr s ILE 83 CO 0.52 -0.07 1.73 -0.67 -1.23 0.00 0.00 174.94 175.22 1ibr n ASP 84 N -0.71 2.41 -0.20 3.58 -0.08 -1.26 -4.81 116.55 115.49 1ibr n ASP 84 Ca 0.08 1.07 0.25 0.00 -1.51 0.00 0.00 54.79 54.68 1ibr n ASP 84 Cb 0.49 -1.16 0.64 0.00 2.34 0.00 0.00 41.12 43.43 1ibr n ASP 84 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ibr h ALA 85 N 7.15 2.58 -0.17 -1.67 0.00 -1.90 -0.33 119.26 124.92 1ibr h ALA 85 Ca -0.47 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.25 1ibr h ALA 85 Cb 1.32 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1ibr h ALA 85 CO 0.95 -0.84 -0.65 -0.91 0.00 0.00 0.00 179.25 177.79 1ibr h ASN 86 N 0.16 0.73 -0.30 0.00 -0.26 -1.99 -1.12 115.58 112.79 1ibr h ASN 86 Ca 0.44 -0.43 -0.07 0.00 -0.56 0.00 0.00 56.30 55.68 1ibr h ASN 86 Cb 1.47 -0.21 -0.01 0.00 -1.06 0.00 0.00 38.32 38.51 1ibr h ASN 86 CO -0.08 1.19 -0.07 0.00 -1.06 0.00 0.00 177.43 177.42 1ibr h ALA 87 N 0.81 0.41 -0.89 -0.83 0.00 -1.47 -1.73 119.26 115.57 1ibr h ALA 87 Ca -0.02 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1ibr h ALA 87 Cb 1.24 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 1ibr h ALA 87 CO 0.13 0.23 0.59 0.00 0.00 0.00 0.00 179.25 180.20 1ibr h ARG 88 N 0.35 1.15 -0.23 0.00 3.08 -1.22 0.17 114.38 117.67 1ibr h ARG 88 Ca 0.08 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 1ibr h ARG 88 Cb 0.55 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1ibr h ARG 88 CO 0.03 0.76 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.59 1ibr h ARG 89 N 1.18 0.34 -0.01 0.04 2.43 -0.90 0.16 114.38 117.61 1ibr h ARG 89 Ca 0.33 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1ibr h ARG 89 Cb -0.11 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.38 1ibr h ARG 89 CO -0.08 0.37 -0.00 0.93 -1.51 0.00 0.00 179.97 179.68 1ibr h GLU 90 N 0.33 0.03 -0.36 0.20 5.08 0.17 -0.09 114.58 119.93 1ibr h GLU 90 Ca 0.08 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1ibr h GLU 90 Cb 0.24 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1ibr h GLU 90 CO 0.01 0.36 0.22 0.28 -1.00 0.00 0.00 179.01 178.87 1ibr h VAL 91 N -0.31 1.12 -0.85 3.13 2.07 -0.59 -1.82 116.25 118.99 1ibr h VAL 91 Ca 0.00 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1ibr h VAL 91 Cb 0.34 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 1ibr h VAL 91 CO 0.00 0.12 0.50 0.11 0.02 0.00 0.00 177.57 178.32 1ibr h LYS 92 N 0.47 1.17 0.50 1.57 1.57 -0.64 -0.74 116.57 120.47 1ibr h LYS 92 Ca 0.13 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1ibr h LYS 92 Cb 0.00 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.08 1ibr h LYS 92 CO -0.02 0.83 -0.24 -0.97 -0.57 0.00 0.00 179.45 178.48 1ibr h ASN 93 N 1.17 -0.57 -0.85 0.86 -1.24 -0.72 -1.49 115.58 112.74 1ibr h ASN 93 Ca 0.30 -0.04 0.10 0.00 0.71 0.00 0.00 56.30 57.37 1ibr h ASN 93 Cb -0.02 0.15 -0.06 0.00 0.73 0.00 0.00 38.32 39.12 1ibr h ASN 93 CO -0.05 -0.30 0.55 1.88 -1.29 0.00 0.00 177.43 178.22 1ibr h TYR 94 N -0.83 0.88 -0.07 0.67 0.05 -1.24 -0.53 116.97 115.90 1ibr h TYR 94 Ca -0.07 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.72 1ibr h TYR 94 Cb 0.58 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 38.04 1ibr h TYR 94 CO -0.01 0.40 0.00 0.28 -1.05 0.00 0.00 178.16 177.78 1ibr h VAL 95 N 0.81 1.24 -0.57 -2.88 2.07 -0.99 -2.66 116.25 113.27 1ibr h VAL 95 Ca 0.40 -0.75 -0.07 0.00 0.82 0.00 0.00 66.70 67.10 1ibr h VAL 95 Cb 0.44 1.61 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 1ibr h VAL 95 CO -0.16 0.21 0.09 -0.07 0.02 0.00 0.00 177.57 177.65 1ibr h LEU 96 N -0.15 0.88 -2.15 2.57 3.38 -0.82 -2.48 115.31 116.52 1ibr h LEU 96 Ca 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1ibr h LEU 96 Cb 0.32 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1ibr h LEU 96 CO 0.00 0.89 0.00 1.56 0.09 0.00 0.00 178.44 180.98 1ibr h GLN 97 N 0.87 0.00 0.00 1.13 4.20 -1.03 -2.22 115.11 118.06 1ibr h GLN 97 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1ibr h GLN 97 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1ibr h GLN 97 CO 0.01 0.00 -0.19 0.00 -0.67 0.00 0.00 178.83 177.98 1ibr h THR 98 N 0.00 0.00 -2.39 -0.54 1.03 -1.08 -3.44 112.91 106.50 1ibr h THR 98 Ca 0.00 -0.55 -0.54 0.00 -0.01 0.00 0.00 66.41 65.31 1ibr h THR 98 Cb 0.27 1.42 0.01 0.00 -1.07 0.00 0.00 68.15 68.78 1ibr h THR 98 CO 0.00 0.00 1.24 -0.76 -0.01 0.00 0.00 175.52 175.99 1ibr s LEU 99 N -4.64 4.24 0.00 0.00 1.43 -0.84 -0.84 118.68 118.02 1ibr s LEU 99 Ca 0.09 2.41 0.00 0.00 -1.03 0.00 0.00 54.13 55.60 1ibr s LEU 99 Cb 0.12 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.81 1ibr s LEU 99 CO 0.64 -1.18 0.00 0.61 0.23 0.00 0.00 176.35 176.66 1ibr n GLY 100 N 4.65 0.60 0.16 -3.19 0.00 -1.25 -4.72 105.19 101.44 1ibr n GLY 100 Ca 0.21 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 1ibr n GLY 100 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ibr n THR 101 N -1.96 0.52 -3.67 2.61 -2.24 -0.02 -4.58 114.28 104.94 1ibr n THR 101 Ca 0.00 -0.76 -0.37 0.00 -2.27 0.00 0.00 64.05 60.65 1ibr n THR 101 Cb 0.00 0.77 -0.11 0.00 -2.10 0.00 0.00 70.33 68.90 1ibr n THR 101 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1ibr s GLU 102 N -0.65 3.93 0.00 -0.78 2.02 -1.25 -4.70 118.70 117.26 1ibr s GLU 102 Ca 0.05 -0.34 0.30 0.00 0.02 0.00 0.00 54.97 55.01 1ibr s GLU 102 Cb 0.03 -3.53 1.56 0.00 0.10 0.00 0.00 34.13 32.29 1ibr s GLU 102 CO 0.04 -0.09 2.07 0.25 0.02 0.00 0.00 175.26 177.56 1ibr n THR 103 N 4.72 0.00 -3.87 3.63 -2.24 -1.26 -4.80 114.28 110.46 1ibr n THR 103 Ca -0.15 -0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.31 1ibr n THR 103 Cb 0.52 -0.49 -0.04 0.00 -2.10 0.00 0.00 70.33 68.22 1ibr n THR 103 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1ibr s TYR 104 N -2.50 3.53 0.00 4.78 1.13 -1.26 -5.09 117.35 117.94 1ibr s TYR 104 Ca 0.31 0.35 0.00 0.00 -1.41 0.00 0.00 57.07 56.32 1ibr s TYR 104 Cb 0.20 -1.83 0.00 0.00 -1.10 0.00 0.00 41.96 39.23 1ibr s TYR 104 CO 0.45 0.58 0.52 0.54 -2.51 0.00 0.00 175.55 175.14 1ibr n ARG 105 N 0.49 0.00 -1.96 -3.49 5.12 -1.26 -4.37 116.66 111.19 1ibr n ARG 105 Ca -0.07 0.07 -0.42 0.00 -1.93 0.00 0.00 57.85 55.50 1ibr n ARG 105 Cb 0.52 -1.02 -0.03 0.00 -1.16 0.00 0.00 32.46 30.77 1ibr n ARG 105 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1ibr s PRO 106 N -1.09 4.18 0.39 5.56 0.04 -1.26 -4.93 135.00 137.90 1ibr s PRO 106 Ca 0.00 2.26 -0.07 0.00 0.04 0.00 0.00 61.00 63.23 1ibr s PRO 106 Cb 0.00 -3.94 -0.05 0.00 0.04 0.00 0.00 34.50 30.55 1ibr s PRO 106 CO 0.00 -0.84 0.70 -1.54 0.04 0.00 0.00 177.00 175.37 1ibr s SER 107 N 3.30 6.42 0.05 6.66 1.04 -1.26 -5.01 113.70 124.91 1ibr s SER 107 Ca 0.75 0.93 0.20 0.00 0.48 0.00 0.00 55.95 58.31 1ibr s SER 107 Cb -0.35 -2.24 -0.15 0.00 0.10 0.00 0.00 66.02 63.37 1ibr s SER 107 CO 0.31 -0.38 0.73 -1.54 0.98 0.00 0.00 173.24 173.34 1ibr n SER 108 N -1.47 0.58 0.02 7.02 3.41 -1.26 -4.09 113.62 117.83 1ibr n SER 108 Ca 0.00 0.24 0.01 0.00 -0.26 0.00 0.00 58.87 58.86 1ibr n SER 108 Cb 0.54 0.74 0.32 0.00 -0.26 0.00 0.00 64.21 65.55 1ibr n SER 108 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ibr h ALA 109 N 1.67 1.42 -0.86 7.33 0.00 -1.93 -2.71 119.26 124.18 1ibr h ALA 109 Ca -0.12 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.67 1ibr h ALA 109 Cb 1.36 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 1ibr h ALA 109 CO 0.02 0.41 0.53 0.66 0.00 0.00 0.00 179.25 180.87 1ibr h SER 110 N 0.46 0.82 -0.23 0.00 4.64 -1.85 0.26 113.55 117.65 1ibr h SER 110 Ca 0.10 0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.35 1ibr h SER 110 Cb 0.31 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 1ibr h SER 110 CO 0.01 0.51 -0.16 1.56 -0.87 0.00 0.00 176.83 177.88 1ibr h GLN 111 N 0.95 0.65 -0.21 4.77 4.20 -1.69 -2.09 115.11 121.69 1ibr h GLN 111 Ca 0.38 -0.22 -0.03 0.00 0.06 0.00 0.00 58.65 58.84 1ibr h GLN 111 Cb 0.21 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 1ibr h GLN 111 CO -0.19 0.78 0.01 0.00 -0.67 0.00 0.00 178.83 178.76 1ibr h VAL 113 N 0.14 0.80 -0.25 0.00 2.07 -0.76 -0.99 116.25 117.26 1ibr h VAL 113 Ca 0.06 -0.18 -0.15 0.00 0.82 0.00 0.00 66.70 67.25 1ibr h VAL 113 Cb 0.38 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1ibr h VAL 113 CO 0.01 0.09 -0.45 0.00 0.02 0.00 0.00 177.57 177.24 1ibr h ALA 114 N 1.44 0.74 -0.35 1.67 0.00 -1.14 -0.55 119.26 121.07 1ibr h ALA 114 Ca 0.35 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1ibr h ALA 114 Cb 0.41 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1ibr h ALA 114 CO -0.30 0.67 0.13 0.78 0.00 0.00 0.00 179.25 180.53 1ibr h GLY 115 N 1.00 0.56 1.32 0.00 0.00 -0.08 -1.18 103.07 104.69 1ibr h GLY 115 Ca 0.03 -0.31 -0.16 0.00 0.00 0.00 0.00 47.33 46.89 1ibr h GLY 115 CO 0.09 0.29 -0.49 -2.22 0.00 0.00 0.00 176.54 174.21 1ibr h ILE 116 N 0.41 1.29 -0.70 2.60 2.04 -1.21 -3.21 117.51 118.73 1ibr h ILE 116 Ca 0.12 -1.70 -0.00 0.00 1.00 0.00 0.00 64.86 64.28 1ibr h ILE 116 Cb 0.19 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 1ibr h ILE 116 CO -0.01 0.54 0.43 0.00 0.00 0.00 0.00 178.15 179.11 1ibr h ALA 117 N 0.87 0.90 0.00 1.87 0.00 -0.85 -0.53 119.26 121.52 1ibr h ALA 117 Ca 0.03 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1ibr h ALA 117 Cb 1.06 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1ibr h ALA 117 CO 0.10 0.37 -0.11 0.00 0.00 0.00 0.00 179.25 179.60 1ibr h ALA 119 N 1.89 0.47 0.06 0.00 0.00 -1.44 -3.40 119.26 116.84 1ibr h ALA 119 Ca -0.00 -1.38 -0.31 0.00 0.00 0.00 0.00 54.91 53.22 1ibr h ALA 119 Cb 0.32 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1ibr h ALA 119 CO 0.01 1.34 -1.71 0.93 0.00 0.00 0.00 179.25 179.82 1ibr h GLU 120 N 0.06 0.13 -0.33 0.00 5.08 -0.99 -3.39 114.58 115.15 1ibr h GLU 120 Ca -0.39 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 57.73 1ibr h GLU 120 Cb 2.04 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 31.36 1ibr h GLU 120 CO 0.10 0.86 0.16 0.82 -1.00 0.00 0.00 179.01 179.95 1ibr h ILE 121 N 0.04 1.16 0.00 3.13 2.04 -1.32 0.37 117.51 122.92 1ibr h ILE 121 Ca -0.30 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1ibr h ILE 121 Cb 2.01 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1ibr h ILE 121 CO 0.10 0.17 0.00 -0.81 0.00 0.00 0.00 178.15 177.61 1ibr n PRO 122 N -4.75 0.04 -0.02 2.37 -0.04 -1.26 0.84 135.00 132.19 1ibr n PRO 122 Ca -0.01 0.31 0.01 0.00 -0.04 0.00 0.00 63.50 63.77 1ibr n PRO 122 Cb 0.11 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.08 1ibr n PRO 122 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1ibr n VAL 123 N -1.38 0.68 -3.44 0.52 0.31 -0.95 -5.02 118.33 109.05 1ibr n VAL 123 Ca 0.02 -0.84 -0.18 0.00 -0.01 0.00 0.00 64.34 63.33 1ibr n VAL 123 Cb 0.05 0.67 0.03 0.00 -0.91 0.00 0.00 33.84 33.68 1ibr n VAL 123 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1ibr n ASN 124 N -0.22 -6.24 0.00 4.52 5.15 0.25 -4.95 115.26 113.76 1ibr n ASN 124 Ca 0.01 -0.67 0.00 0.00 -0.60 0.00 0.00 54.58 53.33 1ibr n ASN 124 Cb 0.20 -3.97 0.00 0.00 -0.53 0.00 0.00 39.78 35.47 1ibr n ASN 124 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ibr n GLN 125 N -3.01 5.20 -2.97 1.20 6.02 0.11 -4.76 117.38 119.16 1ibr n GLN 125 Ca -0.10 -0.10 -0.24 0.00 -0.01 0.00 0.00 57.00 56.56 1ibr n GLN 125 Cb 0.59 -0.58 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 1ibr n GLN 125 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.06 177.92 1ibr n TRP 126 N -0.77 2.78 0.24 1.08 -0.00 -1.26 -4.91 117.44 114.60 1ibr n TRP 126 Ca 0.00 -3.84 0.15 0.00 -0.00 0.00 0.00 57.50 53.81 1ibr n TRP 126 Cb 0.00 -0.43 0.80 0.00 -0.00 0.00 0.00 31.31 31.67 1ibr n TRP 126 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1ibr h PRO 127 N 2.96 0.00 0.00 5.87 0.13 -1.94 -0.53 132.00 138.48 1ibr h PRO 127 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1ibr h PRO 127 Cb 0.69 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.82 1ibr h PRO 127 CO 0.72 0.00 -0.50 0.39 -0.23 0.00 0.00 178.00 178.38 1ibr n GLU 128 N -2.56 0.01 0.00 0.86 4.71 -1.26 -4.55 120.64 117.84 1ibr n GLU 128 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 1ibr n GLU 128 Cb 0.11 -1.51 0.00 0.00 -1.01 0.00 0.00 31.44 29.04 1ibr n GLU 128 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1ibr n LEU 129 N -1.52 0.00 -0.27 -4.62 7.94 -0.21 -2.12 117.00 116.20 1ibr n LEU 129 Ca 0.05 0.93 0.08 0.00 -1.11 0.00 0.00 56.01 55.96 1ibr n LEU 129 Cb 0.34 -0.43 0.22 0.00 0.53 0.00 0.00 43.42 44.08 1ibr n LEU 129 CO 0.35 -0.43 1.01 0.40 -1.11 0.00 0.00 177.39 177.61 1ibr h ILE 130 N 0.00 0.57 -0.77 1.96 1.08 -1.80 -1.13 117.51 117.42 1ibr h ILE 130 Ca 0.00 -0.14 -0.05 0.00 -0.39 0.00 0.00 64.86 64.28 1ibr h ILE 130 Cb 0.00 0.14 -0.03 0.00 -3.07 0.00 0.00 36.82 33.86 1ibr h ILE 130 CO 0.00 0.07 0.28 -0.65 -0.69 0.00 0.00 178.15 177.16 1ibr h PRO 131 N 0.40 1.17 -0.51 2.37 0.11 -1.80 -1.25 132.00 132.50 1ibr h PRO 131 Ca 0.46 -0.23 -0.06 0.00 0.11 0.00 0.00 66.00 66.28 1ibr h PRO 131 Cb 0.77 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.68 1ibr h PRO 131 CO -0.46 0.97 0.09 0.37 -0.21 0.00 0.00 178.00 178.76 1ibr h GLN 132 N 1.13 0.84 -0.55 1.05 5.75 -0.72 -1.79 115.11 120.83 1ibr h GLN 132 Ca 0.25 -0.22 -0.07 0.00 -0.15 0.00 0.00 58.65 58.46 1ibr h GLN 132 Cb 0.26 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 1ibr h GLN 132 CO -0.02 0.83 0.06 -0.07 -2.65 0.00 0.00 178.83 176.98 1ibr h LEU 133 N 0.72 0.91 -0.73 -2.39 3.38 -1.09 -0.75 115.31 115.36 1ibr h LEU 133 Ca 0.16 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1ibr h LEU 133 Cb 0.39 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1ibr h LEU 133 CO 0.01 0.95 0.39 0.58 0.09 0.00 0.00 178.44 180.47 1ibr h VAL 134 N 0.82 1.22 -0.07 1.22 2.07 -1.11 -2.32 116.25 118.08 1ibr h VAL 134 Ca 0.16 -0.57 -0.10 0.00 0.82 0.00 0.00 66.70 67.01 1ibr h VAL 134 Cb 0.45 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1ibr h VAL 134 CO 0.02 0.25 -0.41 0.00 0.02 0.00 0.00 177.57 177.45 1ibr h ALA 135 N 1.20 1.18 -0.31 1.67 0.00 -1.08 -2.04 119.26 119.87 1ibr h ALA 135 Ca 0.26 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1ibr h ALA 135 Cb 0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1ibr h ALA 135 CO -0.04 0.57 -0.02 -0.91 0.00 0.00 0.00 179.25 178.85 1ibr h ASN 136 N 0.13 0.45 0.18 0.00 -0.26 -0.60 -1.06 115.58 114.43 1ibr h ASN 136 Ca 0.01 -0.09 -0.28 0.00 -0.56 0.00 0.00 56.30 55.39 1ibr h ASN 136 Cb 0.79 -0.12 0.02 0.00 -1.06 0.00 0.00 38.32 37.95 1ibr h ASN 136 CO 0.06 0.54 -1.30 0.58 -1.06 0.00 0.00 177.43 176.25 1ibr h VAL 137 N 0.46 1.25 0.00 2.81 2.07 -1.16 -3.38 116.25 118.31 1ibr h VAL 137 Ca 0.10 -2.56 -0.15 0.00 0.82 0.00 0.00 66.70 64.91 1ibr h VAL 137 Cb 0.33 2.99 -0.02 0.00 -1.52 0.00 0.00 31.29 33.07 1ibr h VAL 137 CO 0.01 0.77 -0.78 0.71 0.02 0.00 0.00 177.57 178.30 1ibr h THR 138 N -0.12 1.07 -1.85 2.57 1.35 -1.37 -3.46 112.91 111.09 1ibr h THR 138 Ca -0.24 -2.55 -0.66 0.00 -0.55 0.00 0.00 66.41 62.40 1ibr h THR 138 Cb 1.91 2.50 0.03 0.00 -1.73 0.00 0.00 68.15 70.87 1ibr h THR 138 CO 0.18 0.61 0.83 -3.20 -0.25 0.00 0.00 175.52 173.69 1ibr n ASN 139 N -3.22 2.64 0.25 5.36 2.85 -0.41 -4.83 115.26 117.91 1ibr n ASN 139 Ca -0.00 1.06 0.08 0.00 -0.11 0.00 0.00 54.58 55.60 1ibr n ASN 139 Cb 0.82 -1.27 0.61 0.00 1.24 0.00 0.00 39.78 41.18 1ibr n ASN 139 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ibr h PRO 140 N 6.89 0.00 -0.06 1.20 0.11 -1.90 -2.41 132.00 135.82 1ibr h PRO 140 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ibr h PRO 140 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1ibr h PRO 140 CO 0.90 0.08 0.00 0.09 -0.21 0.00 0.00 178.00 178.86 1ibr n ASN 141 N -4.35 1.58 -4.76 -2.05 3.02 -1.26 -4.93 115.26 102.51 1ibr n ASN 141 Ca -0.03 -1.57 -0.41 0.00 -0.03 0.00 0.00 54.58 52.54 1ibr n ASN 141 Cb 0.16 -0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.28 1ibr n ASN 141 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1ibr s SER 142 N -1.87 6.60 0.87 6.41 0.01 -0.91 -5.00 113.70 119.82 1ibr s SER 142 Ca 0.36 2.80 -0.12 0.00 1.31 0.00 0.00 55.95 60.30 1ibr s SER 142 Cb 0.20 -2.65 0.11 0.00 0.21 0.00 0.00 66.02 63.90 1ibr s SER 142 CO 0.31 -0.69 1.12 0.42 0.41 0.00 0.00 173.24 174.81 1ibr s THR 143 N -0.79 2.45 0.19 1.44 -4.23 -1.26 -4.85 115.64 108.59 1ibr s THR 143 Ca 0.53 0.15 -0.09 0.00 -1.18 0.00 0.00 61.69 61.10 1ibr s THR 143 Cb -0.43 -2.86 0.11 0.00 1.34 0.00 0.00 72.50 70.66 1ibr s THR 143 CO 0.53 -0.19 1.72 -0.08 -0.54 0.00 0.00 174.62 176.06 1ibr h GLU 144 N -1.37 1.07 -0.51 3.99 4.81 -1.98 -1.51 114.58 119.08 1ibr h GLU 144 Ca -0.49 -0.23 -0.07 0.00 -0.13 0.00 0.00 59.36 58.44 1ibr h GLU 144 Cb 1.30 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.51 1ibr h GLU 144 CO 0.60 0.93 0.05 0.45 -0.73 0.00 0.00 179.01 180.31 1ibr h HIS 145 N 1.00 0.86 -0.29 0.92 3.86 -1.93 -0.66 115.15 118.91 1ibr h HIS 145 Ca 0.22 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.31 1ibr h HIS 145 Cb 0.31 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 1ibr h HIS 145 CO 0.02 0.77 0.15 1.98 0.86 0.00 0.00 177.93 181.71 1ibr h MET 146 N 0.78 0.41 -0.19 2.45 1.85 -1.71 -1.29 114.93 117.23 1ibr h MET 146 Ca 0.16 -0.06 -0.02 0.00 -0.61 0.00 0.00 59.70 59.17 1ibr h MET 146 Cb 0.40 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 32.34 1ibr h MET 146 CO 0.01 0.38 0.04 0.87 -0.40 0.00 0.00 176.91 177.81 1ibr h LYS 147 N 0.34 0.31 0.54 0.39 1.57 -0.96 -2.82 116.57 115.94 1ibr h LYS 147 Ca 0.10 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1ibr h LYS 147 Cb 0.10 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1ibr h LYS 147 CO -0.01 0.46 -0.34 0.93 -0.57 0.00 0.00 179.45 179.91 1ibr h GLU 148 N 0.11 -0.81 -0.67 3.15 5.08 -1.08 -1.43 114.58 118.92 1ibr h GLU 148 Ca 0.06 0.06 0.11 0.00 -1.00 0.00 0.00 59.36 58.58 1ibr h GLU 148 Cb 0.29 0.18 -0.12 0.00 0.50 0.00 0.00 28.75 29.61 1ibr h GLU 148 CO 0.00 -0.54 -0.37 0.77 -1.00 0.00 0.00 179.01 177.87 1ibr h SER 149 N -0.84 -1.31 0.72 1.42 0.02 -1.28 0.01 113.55 112.28 1ibr h SER 149 Ca -0.06 0.25 -0.16 0.00 -0.84 0.00 0.00 61.79 60.98 1ibr h SER 149 Cb 0.69 0.64 -0.02 0.00 0.14 0.00 0.00 62.40 63.85 1ibr h SER 149 CO 0.06 -0.31 -0.74 0.71 -1.14 0.00 0.00 176.83 175.41 1ibr h THR 150 N -0.14 1.52 -0.62 -2.27 1.35 -1.48 -2.27 112.91 109.01 1ibr h THR 150 Ca 0.24 -2.52 -0.04 0.00 -0.55 0.00 0.00 66.41 63.54 1ibr h THR 150 Cb 0.56 2.36 -0.03 0.00 -1.73 0.00 0.00 68.15 69.31 1ibr h THR 150 CO -0.75 0.72 0.21 -0.07 -0.25 0.00 0.00 175.52 175.39 1ibr h LEU 151 N 0.01 0.88 -0.17 3.87 3.38 -0.41 0.28 115.31 123.14 1ibr h LEU 151 Ca -0.01 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 57.79 1ibr h LEU 151 Cb 1.31 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.80 1ibr h LEU 151 CO 0.10 0.84 -0.01 -0.33 0.09 0.00 0.00 178.44 179.13 1ibr h GLU 152 N 0.87 0.04 -0.40 1.13 5.08 -0.90 -0.87 114.58 119.54 1ibr h GLU 152 Ca 0.20 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1ibr h GLU 152 Cb 0.26 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 1ibr h GLU 152 CO -0.01 0.03 0.22 0.00 -1.00 0.00 0.00 179.01 178.25 1ibr h ALA 153 N 1.15 0.50 -0.28 3.43 0.00 -0.86 -0.01 119.26 123.19 1ibr h ALA 153 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ibr h ALA 153 Cb 0.10 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ibr h ALA 153 CO -0.14 -0.13 0.17 0.82 0.00 0.00 0.00 179.25 179.97 1ibr h ILE 154 N 0.44 1.04 -0.66 0.00 2.04 -0.22 0.28 117.51 120.43 1ibr h ILE 154 Ca 0.16 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 1ibr h ILE 154 Cb 0.03 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1ibr h ILE 154 CO -0.09 0.06 0.37 1.23 0.00 0.00 0.00 178.15 179.72 1ibr h GLY 155 N 0.35 0.99 0.97 5.37 0.00 -0.78 -1.89 103.07 108.08 1ibr h GLY 155 Ca 0.11 -0.45 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1ibr h GLY 155 CO -0.04 0.43 0.23 -0.97 0.00 0.00 0.00 176.54 176.19 1ibr h TYR 156 N 0.91 0.68 0.02 5.60 0.05 -0.56 -0.64 116.97 123.03 1ibr h TYR 156 Ca 0.23 -0.03 0.02 0.00 0.05 0.00 0.00 58.73 59.01 1ibr h TYR 156 Cb 0.04 -0.21 -0.03 0.00 1.01 0.00 0.00 36.73 37.53 1ibr h TYR 156 CO -0.01 0.54 -0.18 0.82 -1.05 0.00 0.00 178.16 178.28 1ibr h ILE 157 N 0.62 0.57 -0.09 -2.88 2.04 -0.65 0.55 117.51 117.68 1ibr h ILE 157 Ca 0.16 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.00 1ibr h ILE 157 Cb 0.12 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 1ibr h ILE 157 CO -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 178.15 178.07 1ibr h GLN 159 N 0.13 0.13 0.00 0.00 4.15 -0.53 -3.40 115.11 115.59 1ibr h GLN 159 Ca 0.03 -0.14 -0.34 0.00 0.77 0.00 0.00 58.65 58.97 1ibr h GLN 159 Cb 0.19 0.04 -0.06 0.00 0.21 0.00 0.00 27.48 27.86 1ibr h GLN 159 CO 0.01 0.90 -2.14 -0.25 -1.93 0.00 0.00 178.83 175.42 1ibr n ASP 160 N -3.63 0.48 -4.87 -0.69 8.00 0.13 -4.99 116.55 110.98 1ibr n ASP 160 Ca -0.03 0.15 -0.31 0.00 0.71 0.00 0.00 54.79 55.32 1ibr n ASP 160 Cb 0.80 0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 42.36 1ibr n ASP 160 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1ibr s ILE 161 N -2.53 4.72 0.14 0.53 -5.25 -0.34 -4.99 121.20 113.49 1ibr s ILE 161 Ca -0.10 0.77 -0.31 0.00 -0.99 0.00 0.00 60.65 60.02 1ibr s ILE 161 Cb 0.07 -3.75 -0.10 0.00 2.95 0.00 0.00 42.46 41.63 1ibr s ILE 161 CO 0.81 -0.65 1.65 -0.62 -1.79 0.00 0.00 174.94 174.34 1ibr s ASP 162 N -3.31 6.53 0.15 4.36 2.15 -1.26 -4.86 116.67 120.44 1ibr s ASP 162 Ca 0.53 2.65 -0.30 0.00 0.43 0.00 0.00 52.55 55.86 1ibr s ASP 162 Cb -0.10 -2.58 -0.05 0.00 -0.30 0.00 0.00 42.92 39.88 1ibr s ASP 162 CO 0.35 -0.89 1.55 -0.65 -0.17 0.00 0.00 175.17 175.36 1ibr h PRO 163 N 7.39 -0.22 -0.79 4.34 0.11 -1.94 -1.84 132.00 139.05 1ibr h PRO 163 Ca -0.43 0.02 0.32 0.00 0.11 0.00 0.00 66.00 66.01 1ibr h PRO 163 Cb 1.20 0.05 -0.12 0.00 0.11 0.00 0.00 31.00 32.24 1ibr h PRO 163 CO 0.93 -0.15 0.45 0.39 -0.21 0.00 0.00 178.00 179.41 1ibr n GLU 164 N -5.35 -0.04 0.10 1.05 -0.58 -1.26 0.27 120.64 114.83 1ibr n GLU 164 Ca -0.00 0.99 0.13 0.00 -0.42 0.00 0.00 57.16 57.85 1ibr n GLU 164 Cb 0.32 -1.81 0.44 0.00 -0.57 0.00 0.00 31.44 29.82 1ibr n GLU 164 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1ibr n GLN 165 N -4.54 0.23 0.00 3.49 1.13 -0.69 -3.97 117.38 113.03 1ibr n GLN 165 Ca 0.28 0.25 0.00 0.00 -1.94 0.00 0.00 57.00 55.60 1ibr n GLN 165 Cb 0.99 -1.80 0.00 0.00 0.11 0.00 0.00 30.24 29.54 1ibr n GLN 165 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1ibr n LEU 166 N -2.21 1.34 -0.17 1.08 7.94 0.14 -4.76 117.00 120.36 1ibr n LEU 166 Ca 0.05 -1.34 0.12 0.00 -1.11 0.00 0.00 56.01 53.72 1ibr n LEU 166 Cb 0.37 0.00 0.44 0.00 0.53 0.00 0.00 43.42 44.77 1ibr n LEU 166 CO 0.27 0.34 1.21 1.56 -1.11 0.00 0.00 177.39 179.66 1ibr h GLN 167 N 0.00 0.53 0.00 1.96 1.08 -1.65 -2.07 115.11 114.96 1ibr h GLN 167 Ca 0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1ibr h GLN 167 Cb 0.26 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1ibr h GLN 167 CO 0.00 0.35 0.07 -0.40 -0.95 0.00 0.00 178.83 177.90 1ibr n ASP 168 N -4.49 0.00 -0.32 1.46 5.68 -1.26 -1.67 116.55 115.95 1ibr n ASP 168 Ca 0.13 0.29 0.01 0.00 -0.50 0.00 0.00 54.79 54.72 1ibr n ASP 168 Cb 0.42 -0.29 0.01 0.00 -1.14 0.00 0.00 41.12 40.12 1ibr n ASP 168 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1ibr n LYS 169 N -1.26 0.20 -0.17 0.11 5.02 -0.78 -4.88 118.16 116.39 1ibr n LYS 169 Ca 0.00 -1.02 -0.05 0.00 -2.02 0.00 0.00 58.31 55.22 1ibr n LYS 169 Cb 0.07 -0.60 0.04 0.00 -0.02 0.00 0.00 35.03 34.53 1ibr n LYS 169 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1ibr h SER 170 N 0.00 0.46 -0.87 4.39 4.64 -1.33 -1.23 113.55 119.62 1ibr h SER 170 Ca 0.00 0.01 0.07 0.00 -0.47 0.00 0.00 61.79 61.40 1ibr h SER 170 Cb 1.24 -0.08 -0.06 0.00 -0.31 0.00 0.00 62.40 63.19 1ibr h SER 170 CO 0.00 0.32 0.57 0.78 -0.87 0.00 0.00 176.83 177.63 1ibr h ASN 171 N 0.58 0.85 0.41 4.97 -0.26 -1.90 0.42 115.58 120.66 1ibr h ASN 171 Ca 0.22 0.01 -0.19 0.00 -0.56 0.00 0.00 56.30 55.77 1ibr h ASN 171 Cb 0.06 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.14 1ibr h ASN 171 CO -0.12 0.55 -0.80 -0.33 -1.06 0.00 0.00 177.43 175.67 1ibr h GLU 172 N 0.97 0.30 -0.08 0.81 5.08 -1.83 -2.02 114.58 117.81 1ibr h GLU 172 Ca 0.37 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 1ibr h GLU 172 Cb 0.22 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1ibr h GLU 172 CO -0.14 0.95 -0.11 0.82 -1.00 0.00 0.00 179.01 179.53 1ibr h ILE 173 N 0.19 1.39 -0.95 3.13 2.04 -0.04 -2.88 117.51 120.39 1ibr h ILE 173 Ca -0.04 -1.33 0.06 0.00 1.00 0.00 0.00 64.86 64.55 1ibr h ILE 173 Cb 1.39 2.08 -0.07 0.00 -0.74 0.00 0.00 36.82 39.49 1ibr h ILE 173 CO 0.13 0.37 0.61 -0.07 0.00 0.00 0.00 178.15 179.19 1ibr h LEU 174 N -0.23 0.96 -0.78 1.44 3.38 -0.22 -1.90 115.31 117.96 1ibr h LEU 174 Ca 0.01 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1ibr h LEU 174 Cb 0.66 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1ibr h LEU 174 CO 0.03 0.61 0.51 0.74 0.09 0.00 0.00 178.44 180.42 1ibr h THR 175 N 1.10 1.21 -0.49 0.22 2.02 -1.32 -0.74 112.91 114.91 1ibr h THR 175 Ca 0.41 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 67.13 1ibr h THR 175 Cb 0.17 0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 1ibr h THR 175 CO -0.17 0.20 0.02 0.00 0.37 0.00 0.00 175.52 175.94 1ibr h ALA 176 N 1.28 0.66 -0.61 6.16 0.00 -1.18 -1.57 119.26 124.01 1ibr h ALA 176 Ca 0.29 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ibr h ALA 176 Cb -0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1ibr h ALA 176 CO -0.06 0.45 0.34 0.82 0.00 0.00 0.00 179.25 180.80 1ibr h ILE 177 N 0.72 1.19 -0.54 0.00 2.04 -0.94 -1.50 117.51 118.48 1ibr h ILE 177 Ca 0.14 -0.47 -0.12 0.00 1.00 0.00 0.00 64.86 65.41 1ibr h ILE 177 Cb 0.49 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 1ibr h ILE 177 CO 0.02 0.21 -0.13 0.40 0.00 0.00 0.00 178.15 178.65 1ibr h ILE 178 N 0.82 1.27 -0.61 -0.67 2.04 -1.07 -1.46 117.51 117.83 1ibr h ILE 178 Ca 0.21 -1.29 0.06 0.00 1.00 0.00 0.00 64.86 64.85 1ibr h ILE 178 Cb 0.03 0.99 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1ibr h ILE 178 CO -0.04 0.46 0.31 -0.61 0.00 0.00 0.00 178.15 178.27 1ibr h GLN 179 N 0.91 0.55 0.00 2.37 5.75 -0.91 0.52 115.11 124.30 1ibr h GLN 179 Ca 0.14 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.57 1ibr h GLN 179 Cb 0.70 -0.12 -0.00 0.00 1.07 0.00 0.00 27.48 29.13 1ibr h GLN 179 CO 0.05 0.36 -0.14 0.78 -2.65 0.00 0.00 178.83 177.24 1ibr h GLY 180 N 0.56 0.00 0.86 2.39 0.00 -1.01 -3.21 103.07 102.67 1ibr h GLY 180 Ca 0.28 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.29 1ibr h GLY 180 CO -0.21 0.00 -1.80 -0.33 0.00 0.00 0.00 176.54 174.20 1ibr h MET 181 N 0.00 0.11 -6.55 4.80 2.86 0.01 -3.25 114.93 112.92 1ibr h MET 181 Ca -0.00 -0.18 -0.59 0.00 -2.06 0.00 0.00 59.70 56.87 1ibr h MET 181 Cb 0.59 0.07 0.16 0.00 0.06 0.00 0.00 31.60 32.48 1ibr h MET 181 CO 0.02 0.79 -0.20 2.89 1.06 0.00 0.00 176.91 181.47 1ibr n ARG 182 N -3.22 0.76 -0.27 1.72 1.85 0.17 -4.85 116.66 112.81 1ibr n ARG 182 Ca -0.22 0.28 -0.02 0.00 -1.00 0.00 0.00 57.85 56.90 1ibr n ARG 182 Cb 1.05 -1.80 0.05 0.00 -1.05 0.00 0.00 32.46 30.71 1ibr n ARG 182 CO 0.00 0.00 0.00 -0.22 -0.01 0.00 0.00 177.63 177.40 1ibr h LYS 183 N 0.67 -0.07 -0.15 2.89 3.64 -1.91 -0.83 116.57 120.81 1ibr h LYS 183 Ca -0.45 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 58.98 1ibr h LYS 183 Cb 1.38 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.21 1ibr h LYS 183 CO 0.51 -0.04 0.22 1.05 -2.27 0.00 0.00 179.45 178.91 1ibr h GLU 184 N -0.07 0.00 -6.38 1.90 4.11 -1.94 -3.41 114.58 108.79 1ibr h GLU 184 Ca 0.31 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 59.21 1ibr h GLU 184 Cb 0.57 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.84 1ibr h GLU 184 CO -0.80 0.00 1.20 -2.00 0.07 0.00 0.00 179.01 177.49 1ibr s GLU 185 N -4.50 4.14 0.17 1.06 2.56 -0.32 -4.90 118.70 116.92 1ibr s GLU 185 Ca -0.04 2.58 -0.10 0.00 0.00 0.00 0.00 54.97 57.41 1ibr s GLU 185 Cb 0.14 -4.05 0.06 0.00 2.00 0.00 0.00 34.13 32.27 1ibr s GLU 185 CO 0.49 -0.93 1.63 -1.00 -0.56 0.00 0.00 175.26 174.90 1ibr h PRO 186 N 10.18 1.02 -6.09 4.30 0.13 -1.88 -3.45 132.00 136.21 1ibr h PRO 186 Ca -0.48 -0.32 -0.56 0.00 -0.87 0.00 0.00 66.00 63.77 1ibr h PRO 186 Cb 1.23 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 1ibr h PRO 186 CO 0.94 1.00 0.25 0.45 -0.23 0.00 0.00 178.00 180.41 1ibr s SER 187 N -6.50 7.06 0.33 1.44 0.15 -1.26 -4.94 113.70 109.98 1ibr s SER 187 Ca -0.12 1.29 0.14 0.00 0.70 0.00 0.00 55.95 57.96 1ibr s SER 187 Cb 0.13 -2.46 0.55 0.00 -1.71 0.00 0.00 66.02 62.53 1ibr s SER 187 CO 0.85 -0.24 1.69 0.78 1.20 0.00 0.00 173.24 177.52 1ibr h ASN 188 N 6.95 0.00 -0.29 5.45 2.35 -1.99 -1.50 115.58 126.55 1ibr h ASN 188 Ca -0.37 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.27 1ibr h ASN 188 Cb 1.18 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.54 1ibr h ASN 188 CO 0.78 0.49 -0.18 0.78 -1.65 0.00 0.00 177.43 177.64 1ibr h ASN 189 N 0.00 0.75 -0.13 5.81 2.35 -1.99 0.33 115.58 122.71 1ibr h ASN 189 Ca -0.00 -0.25 -0.07 0.00 -0.55 0.00 0.00 56.30 55.42 1ibr h ASN 189 Cb 0.95 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 39.11 1ibr h ASN 189 CO 0.06 0.93 -0.19 0.58 -1.65 0.00 0.00 177.43 177.16 1ibr h VAL 190 N 0.66 1.37 -0.90 2.81 2.07 -1.81 -0.74 116.25 119.70 1ibr h VAL 190 Ca 0.10 -1.43 0.04 0.00 0.82 0.00 0.00 66.70 66.23 1ibr h VAL 190 Cb 0.67 2.00 -0.05 0.00 -1.52 0.00 0.00 31.29 32.39 1ibr h VAL 190 CO 0.05 0.42 0.59 0.11 0.02 0.00 0.00 177.57 178.76 1ibr h LYS 191 N -0.05 1.10 0.02 1.57 1.57 -1.16 0.59 116.57 120.20 1ibr h LYS 191 Ca 0.01 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1ibr h LYS 191 Cb 0.76 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1ibr h LYS 191 CO 0.04 0.73 -0.01 1.25 -0.57 0.00 0.00 179.45 180.89 1ibr h LEU 192 N 1.13 -0.02 -0.78 2.94 6.46 -0.80 -0.09 115.31 124.15 1ibr h LEU 192 Ca 0.36 -0.31 0.07 0.00 -0.12 0.00 0.00 57.88 57.88 1ibr h LEU 192 Cb 0.02 0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 39.89 1ibr h LEU 192 CO -0.11 0.30 0.46 0.00 -0.62 0.00 0.00 178.44 178.47 1ibr h ALA 193 N 0.64 1.09 -0.35 1.25 0.00 -0.70 0.66 119.26 121.85 1ibr h ALA 193 Ca -0.00 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1ibr h ALA 193 Cb 0.33 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1ibr h ALA 193 CO 0.00 0.14 -0.09 0.00 0.00 0.00 0.00 179.25 179.30 1ibr h ALA 194 N 1.41 0.48 -0.24 0.00 0.00 -0.76 0.61 119.26 120.75 1ibr h ALA 194 Ca 0.36 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1ibr h ALA 194 Cb 0.25 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1ibr h ALA 194 CO -0.20 0.34 -0.11 1.15 0.00 0.00 0.00 179.25 180.43 1ibr h THR 195 N 0.47 1.21 -0.15 0.00 2.02 -0.56 0.27 112.91 116.17 1ibr h THR 195 Ca 0.09 -0.90 -0.22 0.00 0.77 0.00 0.00 66.41 66.15 1ibr h THR 195 Cb 0.60 1.15 0.01 0.00 -1.74 0.00 0.00 68.15 68.17 1ibr h THR 195 CO 0.04 0.29 -0.78 0.78 0.37 0.00 0.00 175.52 176.22 1ibr h ASN 196 N 0.37 0.91 -0.80 4.18 -0.26 -0.69 -2.41 115.58 116.88 1ibr h ASN 196 Ca 0.07 -0.60 -0.02 0.00 -0.56 0.00 0.00 56.30 55.20 1ibr h ASN 196 Cb 0.43 -0.27 -0.04 0.00 -1.06 0.00 0.00 38.32 37.38 1ibr h ASN 196 CO 0.02 1.39 0.44 0.00 -1.06 0.00 0.00 177.43 178.23 1ibr h ALA 197 N 0.59 1.02 -0.38 -0.83 0.00 -0.25 -0.75 119.26 118.67 1ibr h ALA 197 Ca -0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1ibr h ALA 197 Cb 1.40 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1ibr h ALA 197 CO 0.16 0.54 0.17 1.25 0.00 0.00 0.00 179.25 181.37 1ibr h LEU 198 N 1.11 0.50 -0.76 0.00 5.85 -0.90 -0.96 115.31 120.15 1ibr h LEU 198 Ca 0.28 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.88 1ibr h LEU 198 Cb 0.03 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 1ibr h LEU 198 CO -0.04 0.50 0.50 0.25 -0.34 0.00 0.00 178.44 179.30 1ibr h LEU 199 N 0.47 0.84 -1.40 2.25 5.85 -1.00 0.86 115.31 123.19 1ibr h LEU 199 Ca 0.13 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1ibr h LEU 199 Cb 0.14 -0.20 -0.00 0.00 0.37 0.00 0.00 40.66 40.97 1ibr h LEU 199 CO -0.01 0.60 -0.07 0.78 -0.34 0.00 0.00 178.44 179.39 1ibr h ASN 200 N 1.00 0.00 -0.02 1.25 2.35 -0.92 -3.09 115.58 116.14 1ibr h ASN 200 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 1ibr h ASN 200 Cb -0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1ibr h ASN 200 CO -0.08 0.07 -0.15 -1.20 -1.65 0.00 0.00 177.43 174.42 1ibr n SER 201 N -3.21 2.55 -0.20 5.81 7.64 -0.36 -3.60 113.62 122.25 1ibr n SER 201 Ca 0.00 -1.78 0.00 0.00 1.01 0.00 0.00 58.87 58.11 1ibr n SER 201 Cb 0.34 0.16 0.11 0.00 -1.01 0.00 0.00 64.21 63.81 1ibr n SER 201 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1ibr h LEU 202 N 3.69 0.14 -1.13 -3.43 3.38 -0.81 -1.20 115.31 115.95 1ibr h LEU 202 Ca 0.00 0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.98 1ibr h LEU 202 Cb 0.86 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1ibr h LEU 202 CO 0.00 0.08 -0.33 -0.33 0.09 0.00 0.00 178.44 177.95 1ibr h GLU 203 N 0.35 0.18 0.00 1.13 5.08 -1.84 -2.55 114.58 116.93 1ibr h GLU 203 Ca 0.31 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.52 1ibr h GLU 203 Cb 0.42 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1ibr h GLU 203 CO -0.34 0.50 -0.39 0.35 -1.00 0.00 0.00 179.01 178.12 1ibr h PHE 204 N 0.16 0.00 -0.25 4.33 3.57 -1.49 -3.11 116.94 120.15 1ibr h PHE 204 Ca 0.02 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1ibr h PHE 204 Cb 0.67 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.41 1ibr h PHE 204 CO 0.01 0.39 0.00 0.25 -2.23 0.00 0.00 178.31 176.73 1ibr n THR 205 N -3.73 1.10 -0.28 4.41 -2.24 -0.70 -4.44 114.28 108.40 1ibr n THR 205 Ca -0.01 -0.58 0.06 0.00 -2.27 0.00 0.00 64.05 61.26 1ibr n THR 205 Cb 0.47 -0.34 0.21 0.00 -2.10 0.00 0.00 70.33 68.57 1ibr n THR 205 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1ibr h LYS 206 N 1.71 0.55 -0.75 -0.78 3.64 -1.62 -0.91 116.57 118.41 1ibr h LYS 206 Ca 0.00 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1ibr h LYS 206 Cb 1.06 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.72 1ibr h LYS 206 CO 0.19 0.37 0.39 0.00 -2.27 0.00 0.00 179.45 178.13 1ibr h ALA 207 N 1.55 0.96 -0.33 5.00 0.00 -1.89 -2.30 119.26 122.26 1ibr h ALA 207 Ca 0.45 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 55.14 1ibr h ALA 207 Cb 0.64 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1ibr h ALA 207 CO -0.37 0.49 -0.18 -0.91 0.00 0.00 0.00 179.25 178.28 1ibr h ASN 208 N 1.04 0.60 0.36 0.00 4.21 -1.59 -2.16 115.58 118.04 1ibr h ASN 208 Ca 0.26 -0.19 -0.00 0.00 1.21 0.00 0.00 56.30 57.58 1ibr h ASN 208 Cb 0.06 -0.16 -0.00 0.00 -1.12 0.00 0.00 38.32 37.10 1ibr h ASN 208 CO -0.04 0.79 -0.01 -0.26 -1.29 0.00 0.00 177.43 176.62 1ibr h PHE 209 N 0.54 0.00 0.00 1.19 0.04 -0.63 -0.11 116.94 117.97 1ibr h PHE 209 Ca 0.09 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.86 1ibr h PHE 209 Cb 0.62 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.77 1ibr h PHE 209 CO 0.02 0.01 0.00 -0.44 -0.60 0.00 0.00 178.31 177.30 1ibr h ASP 210 N 0.00 0.00 -3.09 2.17 3.32 -1.21 -3.42 116.42 114.20 1ibr h ASP 210 Ca -0.00 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.39 1ibr h ASP 210 Cb 0.19 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 39.58 1ibr h ASP 210 CO 0.00 0.00 0.30 -0.54 -1.72 0.00 0.00 179.24 177.28 1ibr s LYS 211 N -3.16 3.17 0.22 3.56 3.01 -0.05 -4.95 119.74 121.54 1ibr s LYS 211 Ca 0.09 -0.75 -0.17 0.00 -1.01 0.00 0.00 55.97 54.12 1ibr s LYS 211 Cb 0.09 -4.13 0.22 0.00 -1.01 0.00 0.00 37.83 33.00 1ibr s LYS 211 CO 0.63 -1.45 1.57 1.49 0.51 0.00 0.00 175.35 178.11 1ibr h GLU 212 N 9.21 -0.06 -0.56 1.68 4.81 -1.82 0.26 114.58 128.10 1ibr h GLU 212 Ca -0.28 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.06 1ibr h GLU 212 Cb 1.08 0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.40 1ibr h GLU 212 CO 1.06 -0.04 0.14 0.66 -0.73 0.00 0.00 179.01 180.10 1ibr h SER 213 N -0.06 0.06 0.15 1.04 4.64 -1.92 0.34 113.55 117.79 1ibr h SER 213 Ca 0.31 0.10 -0.17 0.00 -0.47 0.00 0.00 61.79 61.56 1ibr h SER 213 Cb 0.59 0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.79 1ibr h SER 213 CO -0.85 0.05 -0.62 -0.33 -0.87 0.00 0.00 176.83 174.20 1ibr h GLU 214 N 0.29 0.47 -0.75 4.77 5.08 -1.41 -2.85 114.58 120.17 1ibr h GLU 214 Ca 0.29 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1ibr h GLU 214 Cb 0.40 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.66 1ibr h GLU 214 CO -0.35 0.94 0.46 -0.09 -1.00 0.00 0.00 179.01 178.97 1ibr h ARG 215 N 0.34 1.01 -0.83 2.33 2.43 0.45 -1.69 114.38 118.42 1ibr h ARG 215 Ca -0.01 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1ibr h ARG 215 Cb 1.17 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.47 1ibr h ARG 215 CO 0.11 0.71 0.51 1.25 -1.51 0.00 0.00 179.97 181.04 1ibr h HIS 216 N 1.02 1.09 -0.52 2.20 2.76 -0.86 -2.40 115.15 118.43 1ibr h HIS 216 Ca 0.27 0.00 -0.09 0.00 -2.20 0.00 0.00 60.37 58.35 1ibr h HIS 216 Cb -0.04 -0.36 -0.02 0.00 1.55 0.00 0.00 27.41 28.54 1ibr h HIS 216 CO -0.01 0.72 -0.04 0.35 -1.30 0.00 0.00 177.93 177.65 1ibr h PHE 217 N 1.14 1.00 -0.24 5.26 3.57 -1.17 -0.89 116.94 125.61 1ibr h PHE 217 Ca 0.30 -0.17 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 1ibr h PHE 217 Cb -0.06 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.41 1ibr h PHE 217 CO -0.00 0.92 -0.01 0.82 -2.23 0.00 0.00 178.31 177.80 1ibr h ILE 218 N 0.84 1.26 -0.19 1.41 2.04 -1.05 -1.90 117.51 119.93 1ibr h ILE 218 Ca 0.15 -0.93 -0.04 0.00 1.00 0.00 0.00 64.86 65.04 1ibr h ILE 218 Cb 0.55 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.02 1ibr h ILE 218 CO 0.03 0.29 -0.06 0.24 0.00 0.00 0.00 178.15 178.66 1ibr h MET 219 N 0.20 0.28 0.26 2.37 2.86 -1.39 -1.99 114.93 117.52 1ibr h MET 219 Ca 0.07 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1ibr h MET 219 Cb 0.43 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 1ibr h MET 219 CO 0.01 0.36 -0.34 0.37 1.06 0.00 0.00 176.91 178.37 1ibr h GLN 220 N 0.27 -0.60 -0.20 1.72 -0.00 -0.69 -1.65 115.11 113.96 1ibr h GLN 220 Ca 0.06 0.04 -0.07 0.00 -0.00 0.00 0.00 58.65 58.68 1ibr h GLN 220 Cb 0.28 0.14 -0.01 0.00 0.00 0.00 0.00 27.48 27.88 1ibr h GLN 220 CO 0.01 -0.40 -0.18 -0.24 0.00 0.00 0.00 178.83 178.02 1ibr h VAL 221 N -0.62 1.22 0.12 2.39 3.04 -1.20 -2.64 116.25 118.57 1ibr h VAL 221 Ca -0.03 -1.02 -0.01 0.00 -1.01 0.00 0.00 66.70 64.63 1ibr h VAL 221 Cb 0.56 1.28 0.00 0.00 -2.01 0.00 0.00 31.29 31.12 1ibr h VAL 221 CO -0.08 0.32 -0.06 0.58 -1.01 0.00 0.00 177.57 177.32 1ibr h VAL 222 N 0.32 1.05 -0.87 1.51 2.07 -1.26 -0.65 116.25 118.42 1ibr h VAL 222 Ca 0.06 -0.71 0.07 0.00 0.82 0.00 0.00 66.70 66.93 1ibr h VAL 222 Cb 0.51 1.49 -0.06 0.00 -1.52 0.00 0.00 31.29 31.71 1ibr h VAL 222 CO 0.03 0.17 0.54 0.00 0.02 0.00 0.00 177.57 178.33 1ibr h GLU 224 N 0.97 0.85 0.00 0.00 4.81 -1.42 -2.28 114.58 117.51 1ibr h GLU 224 Ca 0.38 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1ibr h GLU 224 Cb 0.19 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.44 1ibr h GLU 224 CO -0.18 0.77 -0.11 0.00 -0.73 0.00 0.00 179.01 178.77 1ibr h ALA 225 N 1.03 1.71 0.00 2.92 0.00 -0.00 0.20 119.26 125.13 1ibr h ALA 225 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ibr h ALA 225 Cb 0.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1ibr h ALA 225 CO -0.01 0.14 0.00 0.25 0.00 0.00 0.00 179.25 179.63 1ibr n THR 226 N -4.25 0.94 0.76 0.00 -2.24 -0.53 -1.74 114.28 107.22 1ibr n THR 226 Ca -0.03 0.24 0.09 0.00 -2.27 0.00 0.00 64.05 62.08 1ibr n THR 226 Cb 0.19 -1.00 0.06 0.00 -2.10 0.00 0.00 70.33 67.48 1ibr n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ibr n GLN 227 N -1.45 1.56 -1.79 -0.78 1.13 0.05 -4.81 117.38 111.29 1ibr n GLN 227 Ca 0.04 -1.43 -0.41 0.00 -1.94 0.00 0.00 57.00 53.26 1ibr n GLN 227 Cb 0.15 -1.34 -0.01 0.00 0.11 0.00 0.00 30.24 29.15 1ibr n GLN 227 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ibr h PRO 229 N 3.78 0.81 -6.26 0.00 0.11 -1.94 -3.42 132.00 125.08 1ibr h PRO 229 Ca -0.49 -0.05 -0.55 0.00 0.11 0.00 0.00 66.00 65.02 1ibr h PRO 229 Cb 1.23 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1ibr h PRO 229 CO 0.71 0.53 1.09 0.34 -0.21 0.00 0.00 178.00 180.46 1ibr s ASP 230 N -6.10 6.65 0.24 -2.05 2.15 -1.26 -4.91 116.67 111.38 1ibr s ASP 230 Ca -0.10 2.20 -0.05 0.00 0.43 0.00 0.00 52.55 55.03 1ibr s ASP 230 Cb 0.20 -2.53 0.40 0.00 -0.30 0.00 0.00 42.92 40.69 1ibr s ASP 230 CO 0.78 -0.95 1.79 0.74 -0.17 0.00 0.00 175.17 177.36 1ibr h THR 231 N 5.62 0.85 -0.74 1.71 2.02 -2.00 -1.94 112.91 118.42 1ibr h THR 231 Ca -0.39 -0.23 -0.05 0.00 0.77 0.00 0.00 66.41 66.51 1ibr h THR 231 Cb 1.18 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1ibr h THR 231 CO 0.96 0.12 0.27 0.03 0.37 0.00 0.00 175.52 177.28 1ibr h ARG 232 N 0.68 1.11 -0.52 6.66 3.08 -1.95 -1.28 114.38 122.16 1ibr h ARG 232 Ca 0.39 -0.20 -0.11 0.00 0.07 0.00 0.00 59.98 60.13 1ibr h ARG 232 Cb 0.43 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1ibr h ARG 232 CO -0.28 0.91 -0.09 0.28 -1.07 0.00 0.00 179.97 179.72 1ibr h VAL 233 N 1.08 1.27 0.07 2.04 2.07 -1.77 -2.15 116.25 118.86 1ibr h VAL 233 Ca 0.24 -1.24 0.01 0.00 0.82 0.00 0.00 66.70 66.54 1ibr h VAL 233 Cb 0.23 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1ibr h VAL 233 CO -0.02 0.43 -0.11 0.03 0.02 0.00 0.00 177.57 177.93 1ibr h ARG 234 N 0.85 -0.22 -0.38 1.57 3.08 -0.98 -0.50 114.38 117.80 1ibr h ARG 234 Ca 0.14 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.25 1ibr h ARG 234 Cb 0.65 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.71 1ibr h ARG 234 CO 0.04 -0.15 0.11 0.28 -1.07 0.00 0.00 179.97 179.19 1ibr h VAL 235 N -0.23 0.85 -0.60 2.04 2.07 -1.19 0.13 116.25 119.33 1ibr h VAL 235 Ca 0.02 -0.09 -0.04 0.00 0.82 0.00 0.00 66.70 67.41 1ibr h VAL 235 Cb 0.24 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1ibr h VAL 235 CO -0.06 0.05 0.22 0.00 0.02 0.00 0.00 177.57 177.80 1ibr h ALA 236 N 1.26 1.27 -0.34 1.67 0.00 -1.19 0.35 119.26 122.27 1ibr h ALA 236 Ca 0.18 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 1ibr h ALA 236 Cb 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ibr h ALA 236 CO -0.20 0.54 -0.17 0.00 0.00 0.00 0.00 179.25 179.42 1ibr h ALA 237 N 1.38 0.48 -0.49 0.00 0.00 -0.42 -1.66 119.26 118.55 1ibr h ALA 237 Ca 0.20 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1ibr h ALA 237 Cb 0.19 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1ibr h ALA 237 CO -0.02 0.40 0.08 -0.07 0.00 0.00 0.00 179.25 179.65 1ibr h LEU 238 N 0.50 0.71 -1.26 0.00 3.38 -0.30 -1.88 115.31 116.46 1ibr h LEU 238 Ca 0.08 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1ibr h LEU 238 Cb 0.70 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1ibr h LEU 238 CO 0.05 0.73 -0.06 1.56 0.09 0.00 0.00 178.44 180.81 1ibr h GLN 239 N 0.72 0.44 -0.45 1.13 4.20 -0.60 -1.59 115.11 118.97 1ibr h GLN 239 Ca 0.16 -0.10 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 1ibr h GLN 239 Cb 0.33 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1ibr h GLN 239 CO 0.00 0.51 0.18 -0.91 -0.67 0.00 0.00 178.83 177.95 1ibr h ASN 240 N 0.42 0.62 -0.88 1.46 2.35 -0.52 -1.38 115.58 117.65 1ibr h ASN 240 Ca 0.09 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1ibr h ASN 240 Cb 0.37 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.53 1ibr h ASN 240 CO 0.02 0.62 0.56 -0.07 -1.65 0.00 0.00 177.43 176.91 1ibr h LEU 241 N 0.59 1.03 0.08 1.61 3.38 -0.82 0.28 115.31 121.47 1ibr h LEU 241 Ca 0.15 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 1ibr h LEU 241 Cb 0.19 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1ibr h LEU 241 CO -0.01 0.77 -0.05 0.58 0.09 0.00 0.00 178.44 179.82 1ibr h VAL 242 N 1.20 0.90 -0.75 1.22 2.07 -1.02 -0.69 116.25 119.19 1ibr h VAL 242 Ca 0.32 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.80 1ibr h VAL 242 Cb -0.10 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1ibr h VAL 242 CO -0.06 0.00 0.32 0.50 0.02 0.00 0.00 177.57 178.35 1ibr h LYS 243 N -0.12 1.09 -0.60 1.57 1.63 -0.80 -2.38 116.57 116.96 1ibr h LYS 243 Ca -0.01 -0.17 -0.05 0.00 -0.85 0.00 0.00 60.65 59.57 1ibr h LYS 243 Cb 0.10 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 31.51 1ibr h LYS 243 CO 0.01 0.87 0.18 0.82 -3.45 0.00 0.00 179.45 177.88 1ibr h ILE 244 N 1.08 1.24 -0.11 2.00 2.04 -0.20 0.13 117.51 123.69 1ibr h ILE 244 Ca 0.25 -0.83 -0.03 0.00 1.00 0.00 0.00 64.86 65.26 1ibr h ILE 244 Cb 0.16 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1ibr h ILE 244 CO -0.03 0.31 -0.05 -0.03 0.00 0.00 0.00 178.15 178.36 1ibr h MET 245 N 0.85 0.16 0.17 2.37 4.05 -0.81 0.59 114.93 122.31 1ibr h MET 245 Ca 0.19 -0.02 -0.30 0.00 -0.28 0.00 0.00 59.70 59.28 1ibr h MET 245 Cb 0.29 -0.03 0.03 0.00 -0.80 0.00 0.00 31.60 31.09 1ibr h MET 245 CO -0.01 0.22 -1.32 0.77 0.23 0.00 0.00 176.91 176.81 1ibr h SER 246 N 0.16 0.73 0.43 1.39 0.02 -0.89 -3.01 113.55 112.37 1ibr h SER 246 Ca 0.04 -0.73 -0.31 0.00 -0.84 0.00 0.00 61.79 59.94 1ibr h SER 246 Cb 0.20 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1ibr h SER 246 CO 0.01 1.56 -1.63 -0.07 -1.14 0.00 0.00 176.83 175.56 1ibr h LEU 247 N 0.17 0.27 -4.21 5.07 3.38 -0.65 -3.40 115.31 115.94 1ibr h LEU 247 Ca -0.19 -0.45 -0.50 0.00 0.09 0.00 0.00 57.88 56.83 1ibr h LEU 247 Cb 2.01 -0.09 -0.42 0.00 0.09 0.00 0.00 40.66 42.25 1ibr h LEU 247 CO 0.24 1.39 -0.87 -1.22 0.09 0.00 0.00 178.44 178.07 1ibr n TYR 248 N -3.35 2.54 -0.30 1.13 4.01 0.20 -4.91 117.16 116.49 1ibr n TYR 248 Ca -0.18 -2.38 0.09 0.00 -0.16 0.00 0.00 57.90 55.26 1ibr n TYR 248 Cb 1.04 -0.28 0.20 0.00 -0.31 0.00 0.00 39.34 39.99 1ibr n TYR 248 CO 0.00 0.00 0.00 -0.92 -0.46 0.00 0.00 176.86 175.48 1ibr h TYR 249 N 2.35 -0.11 0.00 -0.72 5.03 -1.61 -1.91 116.97 120.01 1ibr h TYR 249 Ca 0.25 0.07 0.00 0.00 2.58 0.00 0.00 58.73 61.63 1ibr h TYR 249 Cb 1.38 0.18 0.00 0.00 1.55 0.00 0.00 36.73 39.84 1ibr h TYR 249 CO 0.77 -0.33 0.00 0.00 -1.32 0.00 0.00 178.16 177.28 1ibr n GLN 250 N -5.43 0.10 0.00 1.82 10.64 -1.26 -2.45 117.38 120.79 1ibr n GLN 250 Ca 0.17 0.43 0.12 0.00 -1.83 0.00 0.00 57.00 55.90 1ibr n GLN 250 Cb 0.58 -1.73 0.21 0.00 -0.86 0.00 0.00 30.24 28.44 1ibr n GLN 250 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1ibr n TYR 251 N -1.92 0.00 0.38 2.61 4.01 -0.72 -4.46 117.16 117.07 1ibr n TYR 251 Ca 0.01 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.89 1ibr n TYR 251 Cb 0.13 -0.01 0.46 0.00 -0.31 0.00 0.00 39.34 39.62 1ibr n TYR 251 CO 0.00 0.00 0.00 0.52 -0.46 0.00 0.00 176.86 176.92 1ibr h MET 252 N 3.43 0.00 -0.40 -0.72 2.86 -1.58 -3.35 114.93 115.16 1ibr h MET 252 Ca 0.00 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.71 1ibr h MET 252 Cb 0.79 0.00 -0.09 0.00 0.06 0.00 0.00 31.60 32.36 1ibr h MET 252 CO 0.00 0.00 -0.45 0.93 1.06 0.00 0.00 176.91 178.45 1ibr h GLU 253 N 0.00 -0.33 0.00 1.72 3.07 -1.81 0.30 114.58 117.53 1ibr h GLU 253 Ca 0.00 0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1ibr h GLU 253 Cb 0.62 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1ibr h GLU 253 CO 0.00 -0.22 0.00 1.79 -1.40 0.00 0.00 179.01 179.18 1ibr h THR 254 N -0.34 0.00 0.00 1.13 1.35 -1.94 -2.91 112.91 110.20 1ibr h THR 254 Ca 0.13 -0.05 -0.11 0.00 -0.55 0.00 0.00 66.41 65.83 1ibr h THR 254 Cb 0.59 0.71 -0.02 0.00 -1.73 0.00 0.00 68.15 67.70 1ibr h THR 254 CO -0.57 0.00 -1.72 -1.22 -0.25 0.00 0.00 175.52 171.76 1ibr n TYR 255 N -2.52 0.00 -2.62 4.73 4.01 -0.24 -4.67 117.16 115.85 1ibr n TYR 255 Ca -0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.30 1ibr n TYR 255 Cb 0.07 -0.45 -0.02 0.00 -0.31 0.00 0.00 39.34 38.63 1ibr n TYR 255 CO 0.00 0.00 0.00 1.41 -0.46 0.00 0.00 176.86 177.81 1ibr s MET 256 N -2.61 4.38 0.00 -0.72 1.75 0.91 -0.92 119.30 122.08 1ibr s MET 256 Ca -0.05 1.46 0.00 0.00 -1.25 0.00 0.00 55.69 55.85 1ibr s MET 256 Cb 0.06 -3.57 0.00 0.00 2.84 0.00 0.00 34.83 34.16 1ibr s MET 256 CO 0.53 -0.40 0.00 0.41 -0.65 0.00 0.00 175.02 174.90 1ibr n GLY 257 N 3.21 2.32 0.00 2.11 0.00 -1.26 -4.72 105.19 106.85 1ibr n GLY 257 Ca 0.10 -0.69 0.12 0.00 0.00 0.00 0.00 46.02 45.55 1ibr n GLY 257 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ibr n PRO 258 N 0.00 0.58 0.15 1.61 -0.04 -1.24 -4.67 135.00 131.40 1ibr n PRO 258 Ca 0.00 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1ibr n PRO 258 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1ibr n PRO 258 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ibr n ALA 259 N -1.13 0.00 -0.19 0.55 0.00 -0.74 -5.01 120.51 113.99 1ibr n ALA 259 Ca 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.57 1ibr n ALA 259 Cb 0.14 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.66 1ibr n ALA 259 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ibr h LEU 260 N 0.00 0.36 0.08 0.00 3.38 -1.31 -2.74 115.31 115.08 1ibr h LEU 260 Ca 0.00 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1ibr h LEU 260 Cb 0.00 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 1ibr h LEU 260 CO 0.00 0.24 -0.42 0.15 0.09 0.00 0.00 178.44 178.50 1ibr h PHE 261 N 0.51 -1.19 -0.45 1.13 3.57 -1.83 -0.82 116.94 117.85 1ibr h PHE 261 Ca 0.26 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.73 1ibr h PHE 261 Cb 0.21 0.51 -0.02 0.00 2.79 0.00 0.00 35.95 39.44 1ibr h PHE 261 CO -0.11 -0.51 0.01 0.00 -2.23 0.00 0.00 178.31 175.46 1ibr h ALA 262 N -0.14 1.17 0.08 2.41 0.00 -1.83 -1.03 119.26 119.91 1ibr h ALA 262 Ca 0.03 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ibr h ALA 262 Cb 0.67 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1ibr h ALA 262 CO -0.27 0.54 -0.04 0.82 0.00 0.00 0.00 179.25 180.30 1ibr h ILE 263 N 0.69 1.06 -0.43 0.00 2.04 -1.20 -0.52 117.51 119.16 1ibr h ILE 263 Ca 0.14 -0.50 -0.09 0.00 1.00 0.00 0.00 64.86 65.41 1ibr h ILE 263 Cb 0.41 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 1ibr h ILE 263 CO 0.02 0.12 -0.09 0.71 0.00 0.00 0.00 178.15 178.91 1ibr h THR 264 N -0.33 1.25 -0.54 -0.27 1.35 -1.11 -1.17 112.91 112.08 1ibr h THR 264 Ca -0.01 -1.12 -0.04 0.00 -0.55 0.00 0.00 66.41 64.69 1ibr h THR 264 Cb 0.29 1.02 -0.02 0.00 -1.73 0.00 0.00 68.15 67.70 1ibr h THR 264 CO 0.02 0.39 0.19 0.40 -0.25 0.00 0.00 175.52 176.27 1ibr h ILE 265 N 0.70 1.23 -0.51 6.82 1.08 -1.12 -1.12 117.51 124.58 1ibr h ILE 265 Ca 0.12 -0.74 -0.02 0.00 -0.39 0.00 0.00 64.86 63.83 1ibr h ILE 265 Cb 0.55 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.97 1ibr h ILE 265 CO 0.03 0.28 0.24 -0.08 -0.69 0.00 0.00 178.15 177.93 1ibr h GLU 266 N 0.75 0.74 -0.56 2.37 4.81 -0.79 -2.90 114.58 119.01 1ibr h GLU 266 Ca 0.18 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 59.30 1ibr h GLU 266 Cb 0.24 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1ibr h GLU 266 CO -0.01 0.63 0.37 0.00 -0.73 0.00 0.00 179.01 179.26 1ibr h ALA 267 N 1.08 0.71 -0.86 2.92 0.00 -0.94 -2.24 119.26 119.92 1ibr h ALA 267 Ca 0.17 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 55.17 1ibr h ALA 267 Cb 0.14 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1ibr h ALA 267 CO -0.02 0.14 0.56 0.52 0.00 0.00 0.00 179.25 180.44 1ibr h MET 268 N 0.75 0.69 -0.00 0.00 2.86 -1.01 -1.00 114.93 117.21 1ibr h MET 268 Ca 0.21 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1ibr h MET 268 Cb -0.08 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.43 1ibr h MET 268 CO -0.05 0.46 -0.13 1.63 1.06 0.00 0.00 176.91 179.88 1ibr n LYS 269 N -4.54 0.27 -1.68 1.72 5.02 -0.88 -4.73 118.16 113.34 1ibr n LYS 269 Ca 0.16 -0.07 -0.37 0.00 -2.02 0.00 0.00 58.31 56.01 1ibr n LYS 269 Cb 0.42 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.99 1ibr n LYS 269 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1ibr n SER 270 N -1.30 1.53 -0.28 4.39 2.88 -0.38 -4.88 113.62 115.57 1ibr n SER 270 Ca 0.10 0.82 0.13 0.00 -1.33 0.00 0.00 58.87 58.60 1ibr n SER 270 Cb 0.31 -1.49 0.42 0.00 -0.75 0.00 0.00 64.21 62.70 1ibr n SER 270 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1ibr n ASP 271 N -1.38 1.07 -4.49 -3.46 8.00 -1.26 -4.60 116.55 110.43 1ibr n ASP 271 Ca 0.15 -0.97 -0.43 0.00 0.71 0.00 0.00 54.79 54.24 1ibr n ASP 271 Cb 0.48 0.10 -0.05 0.00 -0.02 0.00 0.00 41.12 41.62 1ibr n ASP 271 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ibr s ILE 272 N -2.41 4.62 0.21 0.53 1.01 -1.26 -4.95 121.20 118.94 1ibr s ILE 272 Ca 0.27 -0.07 -0.18 0.00 0.00 0.00 0.00 60.65 60.67 1ibr s ILE 272 Cb 0.20 -4.42 0.19 0.00 0.01 0.00 0.00 42.46 38.43 1ibr s ILE 272 CO 0.48 -0.97 1.58 0.44 0.00 0.00 0.00 174.94 176.48 1ibr h ASP 273 N 9.16 -1.10 -0.07 3.58 5.19 -1.98 0.08 116.42 131.28 1ibr h ASP 273 Ca -0.27 0.24 0.02 0.00 -0.62 0.00 0.00 57.03 56.41 1ibr h ASP 273 Cb 1.08 0.58 -0.00 0.00 0.18 0.00 0.00 39.33 41.17 1ibr h ASP 273 CO 1.03 -0.29 0.06 1.05 -3.12 0.00 0.00 179.24 177.97 1ibr h GLU 274 N -0.09 0.00 0.03 3.56 9.09 -1.97 0.35 114.58 125.54 1ibr h GLU 274 Ca 0.29 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.58 1ibr h GLU 274 Cb 0.56 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.67 1ibr h GLU 274 CO -0.76 0.00 -0.46 0.28 0.05 0.00 0.00 179.01 178.11 1ibr h VAL 275 N 0.00 1.52 -0.80 -1.06 2.07 -1.36 -3.16 116.25 113.46 1ibr h VAL 275 Ca 0.03 -2.14 -0.02 0.00 0.82 0.00 0.00 66.70 65.39 1ibr h VAL 275 Cb 0.16 2.85 -0.04 0.00 -1.52 0.00 0.00 31.29 32.74 1ibr h VAL 275 CO -0.00 0.60 0.43 0.00 0.02 0.00 0.00 177.57 178.63 1ibr h ALA 276 N 0.22 1.26 -0.57 1.67 0.00 -0.67 -1.94 119.26 119.24 1ibr h ALA 276 Ca -0.07 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.79 1ibr h ALA 276 Cb 1.24 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 1ibr h ALA 276 CO 0.09 0.60 0.25 -0.07 0.00 0.00 0.00 179.25 180.11 1ibr h LEU 277 N 1.12 0.30 -0.44 0.00 3.38 -1.01 0.48 115.31 119.13 1ibr h LEU 277 Ca 0.28 0.05 -0.18 0.00 0.09 0.00 0.00 57.88 58.13 1ibr h LEU 277 Cb 0.03 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ibr h LEU 277 CO -0.05 0.20 -0.67 1.56 0.09 0.00 0.00 178.44 179.57 1ibr h GLN 278 N 0.46 0.45 -0.75 1.13 1.08 -1.43 0.30 115.11 116.35 1ibr h GLN 278 Ca 0.27 -0.34 -0.02 0.00 -1.45 0.00 0.00 58.65 57.11 1ibr h GLN 278 Cb 0.26 0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.72 1ibr h GLN 278 CO -0.24 0.96 0.39 0.78 -0.95 0.00 0.00 178.83 179.78 1ibr h GLY 279 N 1.20 1.12 0.90 3.46 0.00 -0.86 0.12 103.07 109.01 1ibr h GLY 279 Ca -0.02 -0.52 -0.12 0.00 0.00 0.00 0.00 47.33 46.67 1ibr h GLY 279 CO 0.12 0.49 -0.35 -2.22 0.00 0.00 0.00 176.54 174.58 1ibr h ILE 280 N 1.05 1.34 -0.41 2.60 2.04 -0.72 -3.14 117.51 120.27 1ibr h ILE 280 Ca 0.26 -1.58 -0.01 0.00 1.00 0.00 0.00 64.86 64.53 1ibr h ILE 280 Cb 0.06 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 1ibr h ILE 280 CO -0.04 0.49 0.19 -0.08 0.00 0.00 0.00 178.15 178.71 1ibr h GLU 281 N 0.24 0.57 -0.45 2.37 4.57 -0.37 -1.00 114.58 120.50 1ibr h GLU 281 Ca 0.01 -0.06 0.08 0.00 -1.18 0.00 0.00 59.36 58.21 1ibr h GLU 281 Cb 0.95 -0.11 -0.07 0.00 -0.16 0.00 0.00 28.75 29.35 1ibr h GLU 281 CO 0.08 0.45 0.01 0.35 -1.18 0.00 0.00 179.01 178.72 1ibr h PHE 282 N 0.57 -0.01 0.03 0.92 3.57 -0.72 0.41 116.94 121.71 1ibr h PHE 282 Ca 0.14 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.46 1ibr h PHE 282 Cb 0.07 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1ibr h PHE 282 CO 0.00 -0.08 -0.97 -1.49 -2.23 0.00 0.00 178.31 173.54 1ibr h TRP 283 N 0.12 0.34 -0.48 0.41 4.06 -1.49 -1.44 115.95 117.47 1ibr h TRP 283 Ca 0.22 -0.20 -0.07 0.00 2.06 0.00 0.00 58.89 60.90 1ibr h TRP 283 Cb 0.32 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.43 1ibr h TRP 283 CO -0.28 1.06 0.03 0.77 -3.56 0.00 0.00 178.44 176.46 1ibr h SER 284 N 0.10 0.74 -0.22 -3.49 0.02 -0.70 -1.82 113.55 108.17 1ibr h SER 284 Ca -0.06 -0.16 -0.13 0.00 -0.84 0.00 0.00 61.79 60.60 1ibr h SER 284 Cb 1.64 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.97 1ibr h SER 284 CO 0.15 0.79 -0.30 -1.13 -1.14 0.00 0.00 176.83 175.19 1ibr h ASN 285 N 0.73 0.75 -0.51 3.07 -0.00 -0.06 -2.01 115.58 117.54 1ibr h ASN 285 Ca 0.15 -0.30 -0.03 0.00 -0.00 0.00 0.00 56.30 56.12 1ibr h ASN 285 Cb 0.40 -0.21 -0.03 0.00 -0.00 0.00 0.00 38.32 38.49 1ibr h ASN 285 CO 0.01 1.00 0.22 0.58 -0.00 0.00 0.00 177.43 179.24 1ibr h VAL 286 N 0.62 1.20 -0.50 2.57 2.07 -0.80 -1.07 116.25 120.35 1ibr h VAL 286 Ca 0.07 -0.64 -0.07 0.00 0.82 0.00 0.00 66.70 66.88 1ibr h VAL 286 Cb 0.82 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1ibr h VAL 286 CO 0.07 0.25 0.05 0.00 0.02 0.00 0.00 177.57 177.96 1ibr h ASP 288 N 0.72 1.08 -0.23 0.00 3.32 -0.80 0.15 116.42 120.66 1ibr h ASP 288 Ca 0.15 -0.17 -0.18 0.00 0.02 0.00 0.00 57.03 56.84 1ibr h ASP 288 Cb 0.44 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1ibr h ASP 288 CO 0.02 0.96 -0.58 -0.33 -1.72 0.00 0.00 179.24 177.58 1ibr h GLU 289 N 1.13 0.79 0.00 3.56 4.39 -1.04 -2.97 114.58 120.44 1ibr h GLU 289 Ca 0.26 -0.55 -0.08 0.00 0.34 0.00 0.00 59.36 59.33 1ibr h GLU 289 Cb 0.21 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1ibr h GLU 289 CO -0.02 1.17 -0.37 0.93 -1.16 0.00 0.00 179.01 179.56 1ibr h GLU 290 N 0.53 0.00 0.00 2.33 5.08 -0.92 -1.90 114.58 119.70 1ibr h GLU 290 Ca -0.01 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 1ibr h GLU 290 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 1ibr h GLU 290 CO 0.13 0.37 -0.39 0.52 -1.00 0.00 0.00 179.01 178.64 1ibr h MET 291 N 0.00 0.00 0.01 2.33 2.86 -0.94 -2.25 114.93 116.94 1ibr h MET 291 Ca -0.00 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 1ibr h MET 291 Cb 0.90 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.57 1ibr h MET 291 CO 0.05 0.39 -0.16 -0.44 1.06 0.00 0.00 176.91 177.81 1ibr h ASP 292 N 0.00 0.12 0.00 1.22 5.19 -1.32 -2.36 116.42 119.27 1ibr h ASP 292 Ca -0.00 -0.86 0.00 0.00 -0.62 0.00 0.00 57.03 55.54 1ibr h ASP 292 Cb 0.93 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.41 1ibr h ASP 292 CO 0.05 0.97 0.13 -0.07 -3.12 0.00 0.00 179.24 177.19 1ibr h LEU 293 N -0.72 0.00 0.06 1.55 3.38 -1.25 0.47 115.31 118.81 1ibr h LEU 293 Ca -0.02 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.62 1ibr h LEU 293 Cb 1.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1ibr h LEU 293 CO 0.03 0.00 -1.84 0.00 0.09 0.00 0.00 178.44 176.72 1ibr h ALA 294 N 1.71 0.59 0.00 1.53 0.00 -1.35 -2.08 119.26 119.66 1ibr h ALA 294 Ca 0.00 -1.42 -0.11 0.00 0.00 0.00 0.00 54.91 53.39 1ibr h ALA 294 Cb 0.26 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1ibr h ALA 294 CO 0.00 1.44 -0.50 0.82 0.00 0.00 0.00 179.25 181.01 1ibr h ILE 295 N 0.04 0.99 0.29 0.00 1.08 -0.19 -0.73 117.51 118.99 1ibr h ILE 295 Ca -0.35 -2.02 -0.01 0.00 -0.39 0.00 0.00 64.86 62.09 1ibr h ILE 295 Cb 2.02 2.22 0.00 0.00 -3.07 0.00 0.00 36.82 38.00 1ibr h ILE 295 CO 0.09 0.49 -0.14 -0.08 -0.69 0.00 0.00 178.15 177.82 1ibr h GLU 296 N 0.00 -0.37 -0.74 2.37 4.81 -0.31 -3.23 114.58 117.11 1ibr h GLU 296 Ca -0.01 0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.42 1ibr h GLU 296 Cb 1.18 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.61 1ibr h GLU 296 CO 0.07 -0.12 0.50 0.00 -0.73 0.00 0.00 179.01 178.73 1ibr h ALA 297 N -0.84 2.31 -0.03 2.92 0.00 -1.37 -3.21 119.26 119.03 1ibr h ALA 297 Ca -0.04 -0.01 -0.59 0.00 0.00 0.00 0.00 54.91 54.28 1ibr h ALA 297 Cb 0.43 -0.01 0.08 0.00 0.00 0.00 0.00 17.79 18.28 1ibr h ALA 297 CO 0.07 -0.52 1.80 0.45 0.00 0.00 0.00 179.25 181.04 1ibr n SER 298 N -4.43 1.94 -2.49 0.00 2.88 -0.28 -4.29 113.62 106.95 1ibr n SER 298 Ca 0.14 -2.61 -0.12 0.00 -1.33 0.00 0.00 58.87 54.96 1ibr n SER 298 Cb 0.62 -0.95 0.03 0.00 -0.75 0.00 0.00 64.21 63.17 1ibr n SER 298 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1ibr n GLU 299 N 7.49 2.52 0.00 -1.46 2.13 -1.22 -4.75 120.64 125.36 1ibr n GLU 299 Ca 0.48 -3.81 0.00 0.00 0.66 0.00 0.00 57.16 54.49 1ibr n GLU 299 Cb 0.42 -1.88 0.00 0.00 0.27 0.00 0.00 31.44 30.25 1ibr n GLU 299 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ibr n ALA 300 N -0.58 2.25 -0.09 4.31 0.00 -1.26 0.48 120.51 125.62 1ibr n ALA 300 Ca 0.24 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.44 1ibr n ALA 300 Cb 0.85 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.19 1ibr n ALA 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ibr n ALA 301 N 0.24 1.02 0.00 0.00 0.00 -1.26 -5.10 120.51 115.42 1ibr n ALA 301 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1ibr n ALA 301 Cb 0.27 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.39 1ibr n ALA 301 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1ibr n GLU 302 N -3.97 0.00 0.00 0.00 1.02 0.18 -5.09 120.64 112.78 1ibr n GLU 302 Ca -0.40 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.74 1ibr n GLU 302 Cb 0.87 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.29 1ibr n GLU 302 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1ibr n GLN 303 N -1.56 0.00 0.00 3.49 0.00 -1.26 -5.13 117.38 112.92 1ibr n GLN 303 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1ibr n GLN 303 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1ibr n GLN 303 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ibr n GLY 304 N 0.00 -0.19 4.01 1.69 0.00 -1.26 -4.90 105.19 104.54 1ibr n GLY 304 Ca 0.00 -1.43 -0.20 0.00 0.00 0.00 0.00 46.02 44.39 1ibr n GLY 304 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ibr s ARG 305 N 0.00 2.43 0.11 1.61 1.70 -1.26 -4.99 118.95 118.55 1ibr s ARG 305 Ca 0.00 -1.26 -0.36 0.00 -0.47 0.00 0.00 55.73 53.65 1ibr s ARG 305 Cb 0.00 -2.60 -0.16 0.00 -0.57 0.00 0.00 34.95 31.61 1ibr s ARG 305 CO 0.00 -0.73 1.35 -2.30 -1.08 0.00 0.00 175.30 172.55 1ibr n PRO 306 N -2.22 1.30 0.00 3.89 -0.02 -1.26 -4.80 135.00 131.89 1ibr n PRO 306 Ca 0.11 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1ibr n PRO 306 Cb 0.60 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1ibr n PRO 306 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ibr n PRO 307 N 2.53 0.00 -0.77 0.52 -0.02 -1.26 -3.67 135.00 132.33 1ibr n PRO 307 Ca 0.18 0.03 -0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1ibr n PRO 307 Cb 0.21 -0.06 -0.01 0.00 -0.02 0.00 0.00 33.50 33.62 1ibr n PRO 307 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1ibr n GLU 308 N -0.47 0.00 -2.06 -0.52 1.02 -1.26 -5.11 120.64 112.24 1ibr n GLU 308 Ca 0.00 -0.91 -0.41 0.00 -0.02 0.00 0.00 57.16 55.82 1ibr n GLU 308 Cb 0.00 -0.10 -0.02 0.00 -0.02 0.00 0.00 31.44 31.29 1ibr n GLU 308 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1ibr s HIS 309 N 0.00 3.07 -0.24 -0.32 5.65 -1.24 -4.93 115.29 117.28 1ibr s HIS 309 Ca 0.07 1.11 0.17 0.00 0.25 0.00 0.00 55.06 56.65 1ibr s HIS 309 Cb 0.08 -3.76 0.40 0.00 -1.18 0.00 0.00 32.58 28.12 1ibr s HIS 309 CO -0.03 -2.42 1.28 2.41 -0.65 0.00 0.00 174.74 175.33 1ibr n THR 310 N 2.22 0.48 -1.49 0.89 -1.04 -1.26 -4.87 114.28 109.20 1ibr n THR 310 Ca 0.06 -1.61 -0.61 0.00 -2.04 0.00 0.00 64.05 59.85 1ibr n THR 310 Cb 0.41 1.06 -0.10 0.00 -1.82 0.00 0.00 70.33 69.88 1ibr n THR 310 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1ibr n SER 311 N -0.81 1.32 -1.27 8.00 2.88 -1.26 -4.71 113.62 117.78 1ibr n SER 311 Ca -0.07 0.85 0.08 0.00 -1.33 0.00 0.00 58.87 58.40 1ibr n SER 311 Cb 0.86 -0.98 0.29 0.00 -0.75 0.00 0.00 64.21 63.62 1ibr n SER 311 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1ibr n LYS 312 N 6.28 2.95 -3.93 -1.46 4.76 -1.26 -4.97 118.16 120.53 1ibr n LYS 312 Ca 0.42 -2.28 -0.38 0.00 -2.87 0.00 0.00 58.31 53.20 1ibr n LYS 312 Cb 0.02 -1.67 0.02 0.00 -1.84 0.00 0.00 35.03 31.55 1ibr n LYS 312 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1ibr n PHE 313 N 1.03 -1.68 -0.02 2.13 3.01 -1.26 -4.87 117.46 115.80 1ibr n PHE 313 Ca 0.21 0.37 -0.12 0.00 1.01 0.00 0.00 57.45 58.92 1ibr n PHE 313 Cb 0.67 -2.86 0.01 0.00 -0.01 0.00 0.00 39.48 37.29 1ibr n PHE 313 CO 0.00 0.00 0.00 1.88 1.01 0.00 0.00 176.76 179.65 1ibr h TYR 314 N -1.76 0.84 -0.17 1.38 0.05 -1.94 -2.77 116.97 112.60 1ibr h TYR 314 Ca -0.67 -0.31 0.01 0.00 0.05 0.00 0.00 58.73 57.80 1ibr h TYR 314 Cb 1.39 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.97 1ibr h TYR 314 CO 0.32 1.08 0.10 0.00 -1.05 0.00 0.00 178.16 178.61 1ibr h ALA 315 N 0.85 0.20 -0.80 3.88 0.00 -1.90 0.25 119.26 121.74 1ibr h ALA 315 Ca 0.00 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1ibr h ALA 315 Cb 1.16 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.84 1ibr h ALA 315 CO 0.12 -0.33 0.48 -0.22 0.00 0.00 0.00 179.25 179.30 1ibr h LYS 316 N 0.20 0.86 0.00 0.00 3.64 -1.93 0.12 116.57 119.46 1ibr h LYS 316 Ca 0.06 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.32 1ibr h LYS 316 Cb -0.01 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 1ibr h LYS 316 CO -0.03 0.57 -0.35 0.78 -2.27 0.00 0.00 179.45 178.15 1ibr h GLY 317 N 0.89 0.00 0.33 5.01 0.00 -1.10 -3.18 103.07 105.02 1ibr h GLY 317 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1ibr h GLY 317 CO -0.17 0.00 -1.03 0.00 0.00 0.00 0.00 176.54 175.33 1ibr n ALA 318 N -2.27 3.96 -0.34 3.60 0.00 0.02 -4.57 120.51 120.91 1ibr n ALA 318 Ca 0.00 -0.49 0.01 0.00 0.00 0.00 0.00 53.44 52.96 1ibr n ALA 318 Cb 0.51 -0.88 0.07 0.00 0.00 0.00 0.00 19.45 19.15 1ibr n ALA 318 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ibr h LEU 319 N 0.00 -1.15 -2.33 0.00 5.85 -0.76 0.31 115.31 117.23 1ibr h LEU 319 Ca 0.00 0.29 0.03 0.00 0.84 0.00 0.00 57.88 59.04 1ibr h LEU 319 Cb 0.62 0.65 -0.00 0.00 0.37 0.00 0.00 40.66 42.30 1ibr h LEU 319 CO 0.00 -0.30 0.15 0.06 -0.34 0.00 0.00 178.44 178.01 1ibr h GLN 320 N -0.02 0.00 0.02 1.25 3.07 -1.80 -2.19 115.11 115.43 1ibr h GLN 320 Ca 0.38 0.00 -0.36 0.00 0.09 0.00 0.00 58.65 58.76 1ibr h GLN 320 Cb 0.63 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 28.13 1ibr h GLN 320 CO -0.93 0.00 -2.23 0.66 0.09 0.00 0.00 178.83 176.42 1ibr n TYR 321 N -3.70 0.35 -0.01 0.06 4.02 0.88 -4.55 117.16 114.20 1ibr n TYR 321 Ca -0.00 0.10 -0.13 0.00 -0.01 0.00 0.00 57.90 57.87 1ibr n TYR 321 Cb 0.25 -1.06 -0.09 0.00 -0.02 0.00 0.00 39.34 38.43 1ibr n TYR 321 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1ibr h LEU 322 N 0.01 0.07 0.01 7.72 3.38 -0.53 -3.33 115.31 122.64 1ibr h LEU 322 Ca -0.49 -0.39 0.02 0.00 0.09 0.00 0.00 57.88 57.11 1ibr h LEU 322 Cb 2.09 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 42.77 1ibr h LEU 322 CO 0.02 0.45 -0.51 0.58 0.09 0.00 0.00 178.44 179.07 1ibr h VAL 323 N -0.31 0.00 -0.77 1.22 2.07 -1.65 0.19 116.25 117.00 1ibr h VAL 323 Ca 0.01 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.75 1ibr h VAL 323 Cb 0.42 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 1ibr h VAL 323 CO 0.00 0.00 0.58 1.55 0.02 0.00 0.00 177.57 179.73 1ibr h PRO 324 N -0.65 0.00 -0.03 1.57 0.13 -1.80 0.12 132.00 131.35 1ibr h PRO 324 Ca 0.01 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.00 1ibr h PRO 324 Cb 0.69 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.83 1ibr h PRO 324 CO -0.33 0.00 -0.51 0.82 -0.23 0.00 0.00 178.00 177.75 1ibr h ILE 325 N 0.00 1.43 -0.04 -3.56 2.04 -1.27 -2.79 117.51 113.31 1ibr h ILE 325 Ca 0.37 -1.97 -0.00 0.00 1.00 0.00 0.00 64.86 64.25 1ibr h ILE 325 Cb 1.53 2.50 -0.00 0.00 -0.74 0.00 0.00 36.82 40.11 1ibr h ILE 325 CO -0.00 0.57 0.01 -0.07 0.00 0.00 0.00 178.15 178.66 1ibr h LEU 326 N -0.11 0.06 -1.35 1.44 3.38 0.16 -1.68 115.31 117.21 1ibr h LEU 326 Ca -0.06 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 1ibr h LEU 326 Cb 1.21 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1ibr h LEU 326 CO 0.10 0.26 0.10 0.71 0.09 0.00 0.00 178.44 179.71 1ibr h THR 327 N -0.14 1.17 -0.38 0.22 1.35 -0.99 -1.11 112.91 113.02 1ibr h THR 327 Ca 0.01 -0.57 -0.11 0.00 -0.55 0.00 0.00 66.41 65.19 1ibr h THR 327 Cb 0.22 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.40 1ibr h THR 327 CO -0.00 0.21 -0.21 -0.61 -0.25 0.00 0.00 175.52 174.66 1ibr h GLN 328 N 0.53 0.74 0.00 4.72 5.75 -1.38 -2.70 115.11 122.77 1ibr h GLN 328 Ca 0.13 -0.29 -0.04 0.00 -0.15 0.00 0.00 58.65 58.30 1ibr h GLN 328 Cb 0.18 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1ibr h GLN 328 CO -0.01 0.89 -0.17 1.15 -2.65 0.00 0.00 178.83 178.04 1ibr h THR 329 N 0.65 0.81 0.00 2.39 2.02 -0.24 -1.22 112.91 117.32 1ibr h THR 329 Ca 0.09 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1ibr h THR 329 Cb 0.70 1.39 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 1ibr h THR 329 CO 0.05 0.17 0.00 0.18 0.37 0.00 0.00 175.52 176.29 1ibr n LEU 330 N -3.89 0.00 0.08 2.58 4.77 -0.88 -1.57 117.00 118.10 1ibr n LEU 330 Ca -0.02 0.43 0.07 0.00 -0.03 0.00 0.00 56.01 56.45 1ibr n LEU 330 Cb 0.26 -0.43 -0.02 0.00 -2.33 0.00 0.00 43.42 40.91 1ibr n LEU 330 CO 0.33 -0.29 -0.04 0.74 -1.33 0.00 0.00 177.39 176.80 1ibr h THR 331 N 0.00 0.22 -0.91 -5.08 2.02 -1.32 -3.38 112.91 104.46 1ibr h THR 331 Ca 0.00 -1.42 -0.54 0.00 0.77 0.00 0.00 66.41 65.22 1ibr h THR 331 Cb 0.13 1.76 -0.08 0.00 -1.74 0.00 0.00 68.15 68.23 1ibr h THR 331 CO 0.00 0.13 1.51 -0.54 0.37 0.00 0.00 175.52 176.98 1ibr s LYS 332 N -3.17 3.40 -0.02 6.66 1.02 -0.61 -4.77 119.74 122.25 1ibr s LYS 332 Ca -0.01 -1.21 0.00 0.00 0.02 0.00 0.00 55.97 54.77 1ibr s LYS 332 Cb 0.09 -5.34 0.03 0.00 -0.52 0.00 0.00 37.83 32.08 1ibr s LYS 332 CO 0.79 -2.61 0.02 -0.65 -0.92 0.00 0.00 175.35 171.98 1ibr s GLN 333 N 5.29 0.03 0.73 1.68 -0.21 -1.26 -4.46 119.66 121.45 1ibr s GLN 333 Ca 0.55 0.14 -0.01 0.00 0.02 0.00 0.00 55.36 56.06 1ibr s GLN 333 Cb -0.00 -0.27 0.13 0.00 1.00 0.00 0.00 33.01 33.87 1ibr s GLN 333 CO -0.01 -0.14 1.00 -0.51 -2.12 0.00 0.00 175.29 173.51 1ibr s ASP 334 N 0.94 4.31 0.25 5.90 1.01 -1.26 -4.99 116.67 122.82 1ibr s ASP 334 Ca -0.08 -0.37 0.26 0.00 0.71 0.00 0.00 52.55 53.07 1ibr s ASP 334 Cb -0.12 0.00 0.76 0.00 1.01 0.00 0.00 42.92 44.58 1ibr s ASP 334 CO -0.02 -1.89 1.75 -0.33 0.21 0.00 0.00 175.17 174.88 1ibr h GLU 335 N -0.56 0.00 -0.02 8.23 4.39 -2.03 -3.21 114.58 121.38 1ibr h GLU 335 Ca -0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1ibr h GLU 335 Cb 1.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 1ibr h GLU 335 CO 0.40 0.00 -0.09 0.27 -1.16 0.00 0.00 179.01 178.43 1ibr n ASN 336 N -2.40 2.19 -4.77 1.42 2.04 -1.26 -4.98 115.26 107.49 1ibr n ASN 336 Ca 0.05 -1.59 -0.38 0.00 -0.44 0.00 0.00 54.58 52.22 1ibr n ASN 336 Cb 0.43 0.13 -0.03 0.00 -2.53 0.00 0.00 39.78 37.78 1ibr n ASN 336 CO 0.00 0.00 0.00 -1.81 -0.44 0.00 0.00 177.26 175.01 1ibr s ASP 337 N -1.54 6.65 0.01 0.53 1.01 -1.22 -5.04 116.67 117.08 1ibr s ASP 337 Ca 0.18 2.23 0.01 0.00 0.71 0.00 0.00 52.55 55.68 1ibr s ASP 337 Cb 0.14 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.43 1ibr s ASP 337 CO 0.26 -0.58 0.04 -1.81 0.21 0.00 0.00 175.17 173.29 1ibr s ASP 338 N -1.27 5.34 0.26 0.27 1.01 -1.26 -4.90 116.67 116.12 1ibr s ASP 338 Ca 0.56 0.03 0.06 0.00 0.71 0.00 0.00 52.55 53.91 1ibr s ASP 338 Cb -0.28 -1.44 0.76 0.00 1.01 0.00 0.00 42.92 42.97 1ibr s ASP 338 CO 0.35 0.26 1.27 -0.90 0.21 0.00 0.00 175.17 176.35 1ibr n ASP 339 N 1.15 0.02 -1.43 0.27 5.75 -1.26 -1.02 116.55 120.02 1ibr n ASP 339 Ca -0.13 1.36 0.08 0.00 -0.01 0.00 0.00 54.79 56.09 1ibr n ASP 339 Cb 0.52 -0.55 0.33 0.00 -1.03 0.00 0.00 41.12 40.40 1ibr n ASP 339 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 1ibr n ASP 340 N -5.05 4.76 -4.76 -1.12 5.68 -1.26 -4.97 116.55 109.83 1ibr n ASP 340 Ca 0.22 -2.78 -0.38 0.00 -0.50 0.00 0.00 54.79 51.36 1ibr n ASP 340 Cb 0.75 -0.59 0.01 0.00 -1.14 0.00 0.00 41.12 40.14 1ibr n ASP 340 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1ibr s ASP 341 N -1.18 5.92 -0.79 -1.12 1.01 -0.19 -4.90 116.67 115.42 1ibr s ASP 341 Ca 0.48 2.46 -0.20 0.00 0.71 0.00 0.00 52.55 56.00 1ibr s ASP 341 Cb 0.35 -2.61 0.11 0.00 1.01 0.00 0.00 42.92 41.78 1ibr s ASP 341 CO 0.16 -1.10 0.99 0.86 0.21 0.00 0.00 175.17 176.29 1ibr s TRP 342 N -1.46 3.00 0.35 4.23 -0.11 -1.26 -4.70 118.94 118.99 1ibr s TRP 342 Ca 0.65 -1.10 0.04 0.00 1.22 0.00 0.00 56.10 56.91 1ibr s TRP 342 Cb -0.33 -4.22 -0.04 0.00 -1.50 0.00 0.00 33.47 27.39 1ibr s TRP 342 CO 0.39 -1.48 0.13 0.54 -4.62 0.00 0.00 176.95 171.91 1ibr s ASN 343 N 3.57 2.19 0.26 5.86 2.20 -1.26 -5.01 114.94 122.75 1ibr s ASN 343 Ca 0.25 -1.57 -0.02 0.00 -0.94 0.00 0.00 52.86 50.58 1ibr s ASN 343 Cb -0.12 0.35 0.57 0.00 -2.00 0.00 0.00 41.25 40.05 1ibr s ASN 343 CO -0.01 -0.85 1.67 -0.65 -2.94 0.00 0.00 177.10 174.32 1ibr h PRO 344 N 2.03 0.25 -0.38 3.55 0.11 -1.92 0.63 132.00 136.26 1ibr h PRO 344 Ca -0.36 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.80 1ibr h PRO 344 Cb 1.26 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 32.26 1ibr h PRO 344 CO 0.57 0.16 0.05 0.00 -0.21 0.00 0.00 178.00 178.58 1ibr h LYS 346 N 0.17 0.82 -0.42 0.00 1.63 -1.33 -2.77 116.57 114.67 1ibr h LYS 346 Ca 0.18 -0.31 -0.10 0.00 -0.85 0.00 0.00 60.65 59.57 1ibr h LYS 346 Cb 0.23 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.79 1ibr h LYS 346 CO -0.26 0.94 -0.15 0.00 -3.45 0.00 0.00 179.45 176.53 1ibr h ALA 347 N 1.07 0.95 -0.82 5.00 0.00 -0.24 -2.56 119.26 122.67 1ibr h ALA 347 Ca 0.11 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1ibr h ALA 347 Cb 0.69 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1ibr h ALA 347 CO 0.05 0.61 0.43 0.00 0.00 0.00 0.00 179.25 180.35 1ibr h ALA 348 N 1.13 1.05 -0.41 0.00 0.00 -0.48 0.38 119.26 120.92 1ibr h ALA 348 Ca 0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ibr h ALA 348 Cb 0.64 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1ibr h ALA 348 CO 0.04 0.58 0.25 0.78 0.00 0.00 0.00 179.25 180.90 1ibr h GLY 349 N 1.14 0.60 1.28 0.00 0.00 -1.23 0.19 103.07 105.05 1ibr h GLY 349 Ca 0.29 -0.25 -0.04 0.00 0.00 0.00 0.00 47.33 47.32 1ibr h GLY 349 CO -0.04 0.24 0.20 -2.08 0.00 0.00 0.00 176.54 174.86 1ibr h VAL 350 N 0.55 1.23 -0.29 4.60 2.07 -1.04 -1.67 116.25 121.69 1ibr h VAL 350 Ca 0.15 -0.76 -0.12 0.00 0.82 0.00 0.00 66.70 66.78 1ibr h VAL 350 Cb -0.00 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1ibr h VAL 350 CO -0.03 0.30 -0.29 0.00 0.02 0.00 0.00 177.57 177.57 1ibr h LEU 352 N 0.45 -0.09 -1.42 0.00 3.38 -0.37 -0.59 115.31 116.67 1ibr h LEU 352 Ca 0.05 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1ibr h LEU 352 Cb 0.86 0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 1ibr h LEU 352 CO 0.07 -0.02 0.16 0.24 0.09 0.00 0.00 178.44 178.99 1ibr h MET 353 N 0.06 0.55 -0.06 1.13 2.86 -1.27 0.22 114.93 118.42 1ibr h MET 353 Ca 0.10 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.55 1ibr h MET 353 Cb 0.13 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1ibr h MET 353 CO -0.17 0.46 -0.50 -0.07 1.06 0.00 0.00 176.91 177.69 1ibr h LEU 354 N 0.55 0.16 -0.38 1.22 3.38 -0.79 -2.17 115.31 117.27 1ibr h LEU 354 Ca 0.14 -0.08 -0.19 0.00 0.09 0.00 0.00 57.88 57.84 1ibr h LEU 354 Cb 0.11 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1ibr h LEU 354 CO -0.01 0.64 -0.78 -0.07 0.09 0.00 0.00 178.44 178.30 1ibr h LEU 355 N 0.12 0.37 -0.44 1.67 3.38 -0.06 -0.72 115.31 119.63 1ibr h LEU 355 Ca 0.00 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.75 1ibr h LEU 355 Cb 0.93 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 1ibr h LEU 355 CO 0.07 1.01 0.21 0.00 0.09 0.00 0.00 178.44 179.83 1ibr h ALA 356 N 0.97 0.55 0.00 1.53 0.00 -0.01 0.59 119.26 122.89 1ibr h ALA 356 Ca -0.04 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1ibr h ALA 356 Cb 1.37 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1ibr h ALA 356 CO 0.13 -0.15 -0.76 1.79 0.00 0.00 0.00 179.25 180.26 1ibr h THR 357 N 0.43 0.40 0.14 0.00 1.35 -1.35 -2.40 112.91 111.48 1ibr h THR 357 Ca 0.19 -1.64 -0.29 0.00 -0.55 0.00 0.00 66.41 64.12 1ibr h THR 357 Cb 0.11 2.03 0.02 0.00 -1.73 0.00 0.00 68.15 68.58 1ibr h THR 357 CO -0.15 0.23 -1.27 0.00 -0.25 0.00 0.00 175.52 174.09 1ibr n GLU 360 N -0.28 0.00 0.00 0.00 1.02 -0.90 -2.38 120.64 118.11 1ibr n GLU 360 Ca 0.27 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.45 1ibr n GLU 360 Cb 0.70 -0.09 0.00 0.00 -0.02 0.00 0.00 31.44 32.02 1ibr n GLU 360 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1ibr n ASP 361 N -1.20 0.04 0.21 1.62 5.75 -1.26 -1.13 116.55 120.59 1ibr n ASP 361 Ca 0.01 0.01 0.08 0.00 -0.01 0.00 0.00 54.79 54.87 1ibr n ASP 361 Cb 0.05 -0.01 0.41 0.00 -1.03 0.00 0.00 41.12 40.54 1ibr n ASP 361 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 1ibr h ASP 362 N 0.00 0.00 0.05 -1.12 5.19 -1.87 -1.92 116.42 116.75 1ibr h ASP 362 Ca 0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1ibr h ASP 362 Cb 0.76 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.27 1ibr h ASP 362 CO 0.00 0.00 -0.02 0.40 -3.12 0.00 0.00 179.24 176.50 1ibr h ILE 363 N 0.00 1.28 -0.89 0.35 5.03 -1.86 -3.27 117.51 118.15 1ibr h ILE 363 Ca 0.00 -1.20 0.15 0.00 -0.12 0.00 0.00 64.86 63.69 1ibr h ILE 363 Cb 0.77 2.06 -0.16 0.00 -3.03 0.00 0.00 36.82 36.47 1ibr h ILE 363 CO 0.00 0.30 -0.34 0.58 -0.68 0.00 0.00 178.15 178.01 1ibr h VAL 364 N -0.61 0.06 -0.63 1.67 2.07 -1.67 0.34 116.25 117.47 1ibr h VAL 364 Ca -0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1ibr h VAL 364 Cb 0.54 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1ibr h VAL 364 CO 0.01 0.00 0.42 -0.65 0.02 0.00 0.00 177.57 177.37 1ibr h PRO 365 N -0.03 0.82 0.00 1.57 0.11 -1.72 -1.07 132.00 131.67 1ibr h PRO 365 Ca 0.35 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.27 1ibr h PRO 365 Cb 0.61 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 1ibr h PRO 365 CO -0.92 0.54 -0.68 0.45 -0.21 0.00 0.00 178.00 177.19 1ibr h HIS 366 N 0.84 0.00 0.05 0.65 3.86 -0.49 -3.37 115.15 116.68 1ibr h HIS 366 Ca 0.23 0.00 -0.36 0.00 -1.16 0.00 0.00 60.37 59.09 1ibr h HIS 366 Cb -0.08 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.35 1ibr h HIS 366 CO -0.00 0.68 -2.11 0.28 0.86 0.00 0.00 177.93 177.63 1ibr n VAL 367 N -3.35 1.61 -0.31 2.45 0.31 0.08 -4.52 118.33 114.60 1ibr n VAL 367 Ca 0.01 -0.70 0.12 0.00 -0.01 0.00 0.00 64.34 63.76 1ibr n VAL 367 Cb 0.77 -1.29 0.30 0.00 -0.91 0.00 0.00 33.84 32.71 1ibr n VAL 367 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1ibr h LEU 368 N 0.03 0.44 -0.42 7.52 5.85 -1.37 -2.10 115.31 125.27 1ibr h LEU 368 Ca -0.45 0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.47 1ibr h LEU 368 Cb 2.03 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 43.09 1ibr h LEU 368 CO 0.03 0.08 0.09 -0.65 -0.34 0.00 0.00 178.44 177.66 1ibr h PRO 369 N 0.49 0.22 -0.68 5.25 0.11 -1.79 -0.11 132.00 135.49 1ibr h PRO 369 Ca 0.55 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.58 1ibr h PRO 369 Cb 0.97 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 32.00 1ibr h PRO 369 CO -0.47 0.15 0.18 0.35 -0.21 0.00 0.00 178.00 177.99 1ibr h PHE 370 N 0.23 1.13 -0.25 0.65 3.04 -1.67 -0.98 116.94 119.10 1ibr h PHE 370 Ca 0.20 -0.13 0.00 0.00 3.98 0.00 0.00 57.97 62.02 1ibr h PHE 370 Cb 0.24 -0.32 -0.01 0.00 2.56 0.00 0.00 35.95 38.41 1ibr h PHE 370 CO -0.19 0.92 0.16 0.82 -2.02 0.00 0.00 178.31 178.00 1ibr h ILE 371 N 1.02 1.07 -0.17 1.41 2.04 -0.90 -1.86 117.51 120.12 1ibr h ILE 371 Ca 0.22 -0.16 -0.11 0.00 1.00 0.00 0.00 64.86 65.81 1ibr h ILE 371 Cb 0.35 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1ibr h ILE 371 CO -0.00 0.07 -0.36 0.11 0.00 0.00 0.00 178.15 177.97 1ibr h LYS 372 N 0.32 0.37 0.00 2.37 1.57 -0.86 -0.31 116.57 120.03 1ibr h LYS 372 Ca 0.09 -0.17 -0.13 0.00 -1.87 0.00 0.00 60.65 58.57 1ibr h LYS 372 Cb -0.02 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1ibr h LYS 372 CO -0.02 0.69 -0.61 1.49 -0.57 0.00 0.00 179.45 180.43 1ibr h GLU 373 N 0.32 0.00 -0.00 3.15 4.81 -0.96 -3.36 114.58 118.54 1ibr h GLU 373 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1ibr h GLU 373 Cb 0.79 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.17 1ibr h GLU 373 CO 0.06 0.61 0.00 0.72 -0.73 0.00 0.00 179.01 179.67 1ibr n HIS 374 N -3.55 0.00 0.00 0.92 8.25 -0.72 -4.61 115.22 115.52 1ibr n HIS 374 Ca -0.00 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1ibr n HIS 374 Cb 0.67 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.78 1ibr n HIS 374 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 1ibr n ILE 375 N 0.11 1.89 -0.67 1.59 0.13 -0.13 -1.48 119.36 120.80 1ibr n ILE 375 Ca 0.01 0.50 0.00 0.00 -1.10 0.00 0.00 62.75 62.16 1ibr n ILE 375 Cb 0.06 -1.50 0.00 0.00 -0.84 0.00 0.00 39.64 37.36 1ibr n ILE 375 CO 0.00 0.00 0.00 2.29 2.80 0.00 0.00 176.55 181.64 1ibr n LYS 376 N -1.47 0.94 -1.69 9.51 2.85 -1.26 -4.95 118.16 122.09 1ibr n LYS 376 Ca 0.00 -0.81 -0.44 0.00 -1.05 0.00 0.00 58.31 56.02 1ibr n LYS 376 Cb 0.03 -0.66 -0.02 0.00 -0.65 0.00 0.00 35.03 33.72 1ibr n LYS 376 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 1ibr n ASN 377 N -0.16 2.93 0.22 -5.58 2.85 -0.55 -4.87 115.26 110.10 1ibr n ASN 377 Ca 0.00 1.15 0.15 0.00 -0.11 0.00 0.00 54.58 55.77 1ibr n ASN 377 Cb 0.41 -1.46 0.79 0.00 1.24 0.00 0.00 39.78 40.76 1ibr n ASN 377 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1ibr h PRO 378 N 4.02 0.00 -5.92 1.20 0.11 -1.98 -3.40 132.00 126.03 1ibr h PRO 378 Ca -0.45 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.06 1ibr h PRO 378 Cb 1.27 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.29 1ibr h PRO 378 CO 0.74 0.00 0.56 0.34 -0.21 0.00 0.00 178.00 179.43 1ibr s ASP 379 N -6.22 6.83 0.47 -2.05 -1.08 -1.26 -4.94 116.67 108.42 1ibr s ASP 379 Ca -0.05 0.96 0.12 0.00 -0.52 0.00 0.00 52.55 53.06 1ibr s ASP 379 Cb 0.16 -2.46 1.07 0.00 -1.46 0.00 0.00 42.92 40.23 1ibr s ASP 379 CO 0.60 -0.64 2.10 4.11 0.52 0.00 0.00 175.17 181.86 1ibr h TRP 380 N 7.87 0.24 -0.26 -5.34 5.08 -1.99 -1.37 115.95 120.17 1ibr h TRP 380 Ca -0.22 0.00 0.03 0.00 1.08 0.00 0.00 58.89 59.78 1ibr h TRP 380 Cb 1.08 -0.08 -0.03 0.00 -3.00 0.00 0.00 29.16 27.13 1ibr h TRP 380 CO 0.77 0.16 0.06 0.00 -1.28 0.00 0.00 178.44 178.16 1ibr h ARG 381 N 0.25 0.16 -0.25 0.12 3.08 -1.92 0.91 114.38 116.74 1ibr h ARG 381 Ca 0.07 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.95 1ibr h ARG 381 Cb -0.01 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1ibr h ARG 381 CO -0.01 0.11 -0.48 1.88 -1.07 0.00 0.00 179.97 180.40 1ibr h TYR 382 N 0.17 0.80 -0.15 3.04 -1.99 -1.75 -0.15 116.97 116.95 1ibr h TYR 382 Ca 0.12 -0.26 -0.01 0.00 2.00 0.00 0.00 58.73 60.58 1ibr h TYR 382 Cb 0.11 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 38.68 1ibr h TYR 382 CO -0.15 1.00 0.06 -0.09 -0.00 0.00 0.00 178.16 178.98 1ibr h ARG 383 N 0.52 0.22 -0.55 4.88 2.43 -0.69 0.07 114.38 121.26 1ibr h ARG 383 Ca 0.03 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1ibr h ARG 383 Cb 1.02 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.51 1ibr h ARG 383 CO 0.10 0.31 0.29 0.22 -1.51 0.00 0.00 179.97 179.38 1ibr h ASP 384 N 0.09 0.69 -0.99 -3.80 1.82 0.92 -2.00 116.42 113.15 1ibr h ASP 384 Ca 0.05 -0.10 0.04 0.00 -0.39 0.00 0.00 57.03 56.63 1ibr h ASP 384 Cb 0.17 -0.18 -0.06 0.00 0.68 0.00 0.00 39.33 39.94 1ibr h ASP 384 CO -0.00 0.59 0.65 0.00 -1.61 0.00 0.00 179.24 178.87 1ibr h ALA 385 N 1.13 1.32 -0.16 -0.78 0.00 -0.77 -0.54 119.26 119.46 1ibr h ALA 385 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1ibr h ALA 385 Cb 0.06 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1ibr h ALA 385 CO -0.03 0.54 0.10 0.00 0.00 0.00 0.00 179.25 179.86 1ibr h ALA 386 N 1.41 0.20 -0.28 0.00 0.00 -0.29 -0.75 119.26 119.55 1ibr h ALA 386 Ca 0.40 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 1ibr h ALA 386 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ibr h ALA 386 CO -0.13 -0.30 0.06 0.28 0.00 0.00 0.00 179.25 179.16 1ibr h VAL 387 N 0.19 1.22 -0.34 0.00 2.07 -0.92 -2.55 116.25 115.92 1ibr h VAL 387 Ca 0.06 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.84 1ibr h VAL 387 Cb 0.00 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1ibr h VAL 387 CO -0.01 0.25 0.20 -0.03 0.02 0.00 0.00 177.57 177.99 1ibr h MET 388 N 0.29 0.39 -0.64 1.57 -1.53 -1.03 -2.51 114.93 111.47 1ibr h MET 388 Ca 0.09 -0.02 0.04 0.00 -3.44 0.00 0.00 59.70 56.37 1ibr h MET 388 Cb 0.31 -0.09 -0.05 0.00 -0.55 0.00 0.00 31.60 31.23 1ibr h MET 388 CO 0.00 0.26 0.37 0.00 0.14 0.00 0.00 176.91 177.68 1ibr h ALA 389 N 1.15 0.84 -0.98 0.39 0.00 -1.09 -1.49 119.26 118.09 1ibr h ALA 389 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1ibr h ALA 389 Cb 0.01 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.57 1ibr h ALA 389 CO -0.07 0.08 0.62 0.35 0.00 0.00 0.00 179.25 180.23 1ibr h PHE 390 N 0.70 1.14 0.00 0.00 3.57 -1.05 -1.19 116.94 120.11 1ibr h PHE 390 Ca 0.27 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.79 1ibr h PHE 390 Cb 0.11 -0.37 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 1ibr h PHE 390 CO -0.07 0.54 -0.07 0.78 -2.23 0.00 0.00 178.31 177.26 1ibr h GLY 391 N 1.07 0.00 1.76 2.40 0.00 -0.91 -3.10 103.07 104.29 1ibr h GLY 391 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 1ibr h GLY 391 CO -0.21 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.33 1ibr n ILE 393 N -1.38 1.03 1.37 0.00 -5.35 -1.17 -4.15 119.36 109.72 1ibr n ILE 393 Ca 0.10 -1.02 0.14 0.00 -0.27 0.00 0.00 62.75 61.70 1ibr n ILE 393 Cb 0.25 0.48 0.52 0.00 -1.74 0.00 0.00 39.64 39.16 1ibr n ILE 393 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1ibr n LEU 394 N 0.28 0.78 -4.05 7.28 4.77 -1.21 -4.30 117.00 120.55 1ibr n LEU 394 Ca 0.09 -0.15 -0.34 0.00 -0.03 0.00 0.00 56.01 55.58 1ibr n LEU 394 Cb 0.40 -0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 41.24 1ibr n LEU 394 CO 0.06 0.14 -0.08 -1.61 -1.33 0.00 0.00 177.39 174.57 1ibr s GLU 395 N -2.42 2.23 0.00 3.23 2.02 -1.26 -4.74 118.70 117.76 1ibr s GLU 395 Ca 0.29 -2.40 0.00 0.00 0.02 0.00 0.00 54.97 52.88 1ibr s GLU 395 Cb 0.20 -3.55 0.00 0.00 0.10 0.00 0.00 34.13 30.88 1ibr s GLU 395 CO 0.47 -1.12 0.00 0.41 0.02 0.00 0.00 175.26 175.04 1ibr n GLY 396 N 3.61 2.06 3.68 -1.39 0.00 -1.26 -3.08 105.19 108.80 1ibr n GLY 396 Ca 0.05 -0.30 -0.45 0.00 0.00 0.00 0.00 46.02 45.32 1ibr n GLY 396 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ibr n PRO 397 N 0.00 2.35 -1.67 1.61 -0.02 -0.28 -4.82 135.00 132.16 1ibr n PRO 397 Ca 0.00 0.85 -0.46 0.00 -2.02 0.00 0.00 63.50 61.87 1ibr n PRO 397 Cb 0.00 -2.67 -0.04 0.00 -0.02 0.00 0.00 33.50 30.77 1ibr n PRO 397 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1ibr n GLU 398 N 4.51 2.16 -0.68 -0.52 0.28 -1.26 -4.58 120.64 120.56 1ibr n GLU 398 Ca 0.18 0.78 0.51 0.00 -0.16 0.00 0.00 57.16 58.47 1ibr n GLU 398 Cb 0.31 -2.54 0.79 0.00 1.43 0.00 0.00 31.44 31.43 1ibr n GLU 398 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 1ibr n PRO 399 N 3.25 -0.00 -0.01 3.44 -0.04 -1.26 0.01 135.00 140.39 1ibr n PRO 399 Ca 0.16 1.06 -0.09 0.00 -0.04 0.00 0.00 63.50 64.58 1ibr n PRO 399 Cb 0.29 -2.42 -0.04 0.00 -0.04 0.00 0.00 33.50 31.30 1ibr n PRO 399 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ibr h SER 400 N 0.00 -0.23 1.40 3.54 4.64 -1.90 -0.64 113.55 120.36 1ibr h SER 400 Ca 0.91 0.05 -0.09 0.00 -0.47 0.00 0.00 61.79 62.20 1ibr h SER 400 Cb 3.62 0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 65.82 1ibr h SER 400 CO -0.03 -0.09 -0.42 -0.61 -0.87 0.00 0.00 176.83 174.81 1ibr h GLN 401 N -0.06 0.00 -0.83 4.77 4.15 -0.75 -3.27 115.11 119.13 1ibr h GLN 401 Ca 0.08 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.50 1ibr h GLN 401 Cb 0.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.86 1ibr h GLN 401 CO -0.17 0.42 0.00 1.28 -1.93 0.00 0.00 178.83 178.43 1ibr n LEU 402 N -3.26 0.83 -0.58 -2.39 4.77 -0.30 -3.93 117.00 112.14 1ibr n LEU 402 Ca 0.02 -0.41 0.04 0.00 -0.03 0.00 0.00 56.01 55.62 1ibr n LEU 402 Cb 0.66 -0.41 0.12 0.00 -2.33 0.00 0.00 43.42 41.46 1ibr n LEU 402 CO 0.39 0.21 0.57 0.29 -1.33 0.00 0.00 177.39 177.51 1ibr n LYS 403 N -0.04 1.75 -1.00 3.23 4.76 -0.91 -4.16 118.16 121.79 1ibr n LYS 403 Ca 0.00 -0.96 -0.21 0.00 -2.87 0.00 0.00 58.31 54.26 1ibr n LYS 403 Cb 0.21 -1.32 0.05 0.00 -1.84 0.00 0.00 35.03 32.13 1ibr n LYS 403 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1ibr n PRO 404 N 0.25 2.03 -0.03 1.97 -0.04 -1.25 -3.18 135.00 134.75 1ibr n PRO 404 Ca 0.09 -2.03 -0.04 0.00 -0.04 0.00 0.00 63.50 61.48 1ibr n PRO 404 Cb 0.29 -1.79 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 1ibr n PRO 404 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1ibr n LEU 405 N -0.02 2.86 0.00 1.53 -0.00 -1.26 -3.95 117.00 116.16 1ibr n LEU 405 Ca 0.39 -0.03 0.00 0.00 -0.00 0.00 0.00 56.01 56.37 1ibr n LEU 405 Cb 0.63 -0.21 0.00 0.00 -0.00 0.00 0.00 43.42 43.84 1ibr n LEU 405 CO 0.49 0.58 0.36 1.33 -0.00 0.00 0.00 177.39 180.14 1ibr n VAL 406 N -2.71 0.00 0.00 1.47 0.24 -1.19 0.14 118.33 116.28 1ibr n VAL 406 Ca -0.11 1.20 0.00 0.00 -2.04 0.00 0.00 64.34 63.39 1ibr n VAL 406 Cb 0.61 -2.17 0.00 0.00 -1.47 0.00 0.00 33.84 30.81 1ibr n VAL 406 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1ibr n ILE 407 N -1.26 0.00 0.18 1.34 5.41 -1.26 -3.85 119.36 119.93 1ibr n ILE 407 Ca 0.00 0.28 -0.13 0.00 1.00 0.00 0.00 62.75 63.89 1ibr n ILE 407 Cb 0.00 -0.85 -0.08 0.00 -0.71 0.00 0.00 39.64 38.00 1ibr n ILE 407 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1ibr h GLN 408 N 0.00 -0.45 0.00 0.38 1.08 -1.83 -3.41 115.11 110.89 1ibr h GLN 408 Ca 0.00 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1ibr h GLN 408 Cb 0.00 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1ibr h GLN 408 CO 0.00 -0.14 0.00 0.00 -0.95 0.00 0.00 178.83 177.74 1ibr n ALA 409 N -2.49 -0.09 -0.06 3.87 0.00 -1.18 -3.88 120.51 116.68 1ibr n ALA 409 Ca -0.10 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.33 1ibr n ALA 409 Cb 0.27 0.17 -0.02 0.00 0.00 0.00 0.00 19.45 19.88 1ibr n ALA 409 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1ibr n MET 410 N -1.37 -0.07 -0.18 0.00 2.81 0.38 -0.38 117.12 118.31 1ibr n MET 410 Ca 0.00 0.28 -0.01 0.00 -1.81 0.00 0.00 57.70 56.17 1ibr n MET 410 Cb 0.00 -0.42 0.08 0.00 -0.71 0.00 0.00 33.22 32.17 1ibr n MET 410 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 1ibr h PRO 411 N 0.00 0.13 -0.37 0.03 0.13 -1.78 0.62 132.00 130.76 1ibr h PRO 411 Ca 0.02 -0.01 -0.13 0.00 -0.87 0.00 0.00 66.00 65.01 1ibr h PRO 411 Cb 0.06 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.16 1ibr h PRO 411 CO -0.14 0.09 -0.29 1.15 -0.23 0.00 0.00 178.00 178.57 1ibr h THR 412 N 0.14 1.28 -0.13 1.56 2.02 -0.84 -2.50 112.91 114.44 1ibr h THR 412 Ca 0.28 -1.46 0.03 0.00 0.77 0.00 0.00 66.41 66.03 1ibr h THR 412 Cb 0.44 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 1ibr h THR 412 CO -0.45 0.48 0.09 -0.07 0.37 0.00 0.00 175.52 175.94 1ibr h LEU 413 N 0.65 0.05 -0.05 2.58 3.38 -0.23 0.23 115.31 121.93 1ibr h LEU 413 Ca 0.07 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.84 1ibr h LEU 413 Cb 0.87 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.62 1ibr h LEU 413 CO 0.08 0.04 -0.73 0.40 0.09 0.00 0.00 178.44 178.32 1ibr h ILE 414 N 0.06 1.35 -0.21 1.22 2.04 -0.71 -3.24 117.51 118.02 1ibr h ILE 414 Ca 0.06 -2.04 -0.01 0.00 1.00 0.00 0.00 64.86 63.87 1ibr h ILE 414 Cb 0.16 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.56 1ibr h ILE 414 CO -0.01 0.62 0.10 -0.33 0.00 0.00 0.00 178.15 178.53 1ibr h GLU 415 N 0.20 0.30 0.00 2.37 5.08 -0.89 -2.46 114.58 119.18 1ibr h GLU 415 Ca -0.08 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1ibr h GLU 415 Cb 1.39 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1ibr h GLU 415 CO 0.15 0.33 0.17 1.28 -1.00 0.00 0.00 179.01 179.93 1ibr n LEU 416 N -4.85 0.45 0.00 1.33 4.77 -0.01 -0.05 117.00 118.64 1ibr n LEU 416 Ca -0.04 0.66 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 1ibr n LEU 416 Cb 0.10 -0.66 0.59 0.00 -2.33 0.00 0.00 43.42 41.12 1ibr n LEU 416 CO 0.35 -0.81 0.93 0.23 -1.33 0.00 0.00 177.39 176.75 1ibr n MET 417 N -2.17 0.09 -0.25 3.23 2.81 -0.93 -2.39 117.12 117.52 1ibr n MET 417 Ca -0.01 0.04 0.09 0.00 -1.81 0.00 0.00 57.70 56.01 1ibr n MET 417 Cb 0.20 -1.50 0.19 0.00 -0.71 0.00 0.00 33.22 31.39 1ibr n MET 417 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1ibr n LYS 418 N -1.45 2.23 -1.92 0.03 5.02 0.93 -4.82 118.16 118.17 1ibr n LYS 418 Ca 0.08 -2.61 -0.38 0.00 -2.02 0.00 0.00 58.31 53.38 1ibr n LYS 418 Cb 0.29 -1.62 0.02 0.00 -0.02 0.00 0.00 35.03 33.70 1ibr n LYS 418 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ibr s ASP 419 N -2.23 5.61 0.48 4.39 2.15 -1.01 -4.91 116.67 121.17 1ibr s ASP 419 Ca 0.34 2.65 0.16 0.00 0.43 0.00 0.00 52.55 56.13 1ibr s ASP 419 Cb 0.28 -2.63 1.17 0.00 -0.30 0.00 0.00 42.92 41.45 1ibr s ASP 419 CO 0.06 -1.33 2.06 -0.65 -0.17 0.00 0.00 175.17 175.15 1ibr h PRO 420 N 1.75 0.18 -6.15 4.34 0.11 -1.96 -3.41 132.00 126.87 1ibr h PRO 420 Ca -0.50 -0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.04 1ibr h PRO 420 Cb 1.28 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 1ibr h PRO 420 CO 0.59 0.12 0.24 0.45 -0.21 0.00 0.00 178.00 179.18 1ibr s SER 421 N -6.64 7.12 0.23 -2.05 0.15 -1.26 -4.96 113.70 106.29 1ibr s SER 421 Ca -0.06 1.35 -0.00 0.00 0.70 0.00 0.00 55.95 57.94 1ibr s SER 421 Cb 0.18 -2.47 0.23 0.00 -1.71 0.00 0.00 66.02 62.25 1ibr s SER 421 CO 0.71 -0.21 1.59 -0.37 1.20 0.00 0.00 173.24 176.16 1ibr h VAL 422 N 4.85 1.31 0.21 4.45 -1.51 -2.00 -2.10 116.25 121.46 1ibr h VAL 422 Ca -0.39 -1.64 -0.00 0.00 -1.23 0.00 0.00 66.70 63.44 1ibr h VAL 422 Cb 1.19 1.65 -0.01 0.00 -2.13 0.00 0.00 31.29 32.00 1ibr h VAL 422 CO 0.77 0.51 -0.15 0.58 -1.23 0.00 0.00 177.57 178.05 1ibr h VAL 423 N 0.39 0.68 -0.61 7.19 2.07 -1.95 -0.73 116.25 123.29 1ibr h VAL 423 Ca 0.03 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.62 1ibr h VAL 423 Cb 0.94 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.34 1ibr h VAL 423 CO 0.08 0.00 0.29 0.58 0.02 0.00 0.00 177.57 178.55 1ibr h VAL 424 N -0.36 0.89 0.24 2.57 2.07 -1.86 -1.81 116.25 117.97 1ibr h VAL 424 Ca -0.02 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1ibr h VAL 424 Cb 0.31 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1ibr h VAL 424 CO 0.01 0.10 -0.24 0.03 0.02 0.00 0.00 177.57 177.49 1ibr h ARG 425 N 0.54 -0.49 -0.79 1.57 3.08 -0.96 -0.20 114.38 117.13 1ibr h ARG 425 Ca 0.29 0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.43 1ibr h ARG 425 Cb 0.26 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.36 1ibr h ARG 425 CO -0.22 -0.32 0.48 -0.44 -1.07 0.00 0.00 179.97 178.39 1ibr h ASP 426 N -0.51 0.75 -0.03 7.04 5.19 -0.88 -0.36 116.42 127.63 1ibr h ASP 426 Ca -0.00 0.02 -0.12 0.00 -0.62 0.00 0.00 57.03 56.31 1ibr h ASP 426 Cb 0.47 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.83 1ibr h ASP 426 CO -0.05 0.48 -0.34 0.74 -3.12 0.00 0.00 179.24 176.95 1ibr h THR 427 N 0.88 1.29 0.13 0.35 2.02 -1.15 -1.32 112.91 115.11 1ibr h THR 427 Ca 0.35 -1.44 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 1ibr h THR 427 Cb 0.16 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1ibr h THR 427 CO -0.17 0.45 -0.06 0.00 0.37 0.00 0.00 175.52 176.11 1ibr h ALA 428 N 1.20 -0.18 -0.50 6.16 0.00 0.05 -0.69 119.26 125.31 1ibr h ALA 428 Ca 0.05 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 54.97 1ibr h ALA 428 Cb 0.80 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 1ibr h ALA 428 CO 0.06 -0.56 0.09 0.00 0.00 0.00 0.00 179.25 178.85 1ibr h ALA 429 N 0.60 0.55 -0.24 0.00 0.00 -0.95 0.15 119.26 119.38 1ibr h ALA 429 Ca -0.02 0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1ibr h ALA 429 Cb 0.21 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1ibr h ALA 429 CO 0.03 -0.32 -0.10 2.35 0.00 0.00 0.00 179.25 181.21 1ibr h TRP 430 N 0.22 -0.24 0.21 0.00 7.01 -0.88 0.19 115.95 122.47 1ibr h TRP 430 Ca 0.25 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.27 1ibr h TRP 430 Cb 0.34 0.14 0.00 0.00 -2.10 0.00 0.00 29.16 27.55 1ibr h TRP 430 CO -0.24 -0.16 -0.10 1.15 -2.79 0.00 0.00 178.44 176.31 1ibr h THR 431 N -0.06 0.82 -0.69 2.65 2.02 -0.19 -1.95 112.91 115.50 1ibr h THR 431 Ca 0.12 -0.09 0.09 0.00 0.77 0.00 0.00 66.41 67.30 1ibr h THR 431 Cb 0.25 0.87 -0.07 0.00 -1.74 0.00 0.00 68.15 67.46 1ibr h THR 431 CO -0.28 0.02 0.34 0.58 0.37 0.00 0.00 175.52 176.55 1ibr h VAL 432 N -0.32 0.85 -0.84 3.16 2.07 -0.40 -1.10 116.25 119.68 1ibr h VAL 432 Ca -0.03 -0.20 0.04 0.00 0.82 0.00 0.00 66.70 67.33 1ibr h VAL 432 Cb 0.25 0.22 -0.05 0.00 -1.52 0.00 0.00 31.29 30.18 1ibr h VAL 432 CO 0.05 0.11 0.54 1.23 0.02 0.00 0.00 177.57 179.51 1ibr h GLY 433 N 0.59 1.23 1.77 2.17 0.00 -0.38 -1.32 103.07 107.13 1ibr h GLY 433 Ca 0.34 -0.41 -0.07 0.00 0.00 0.00 0.00 47.33 47.19 1ibr h GLY 433 CO -0.26 0.34 -0.22 3.21 0.00 0.00 0.00 176.54 179.60 1ibr h ARG 434 N 1.04 0.28 -0.63 4.80 3.08 -0.46 -2.49 114.38 119.99 1ibr h ARG 434 Ca 0.34 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.26 1ibr h ARG 434 Cb 0.04 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 1ibr h ARG 434 CO -0.13 0.49 0.21 0.82 -1.07 0.00 0.00 179.97 180.30 1ibr h ILE 435 N 0.25 1.23 -0.16 2.04 2.04 -0.12 -2.27 117.51 120.53 1ibr h ILE 435 Ca 0.04 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 1ibr h ILE 435 Cb 0.54 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1ibr h ILE 435 CO 0.04 0.30 0.08 0.00 0.00 0.00 0.00 178.15 178.57 1ibr h GLU 437 N 0.21 0.74 0.00 0.00 4.39 -1.40 -3.28 114.58 115.23 1ibr h GLU 437 Ca 0.06 -0.47 -0.17 0.00 0.34 0.00 0.00 59.36 59.12 1ibr h GLU 437 Cb 0.01 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 1ibr h GLU 437 CO -0.01 1.09 -0.96 1.25 -1.16 0.00 0.00 179.01 179.22 1ibr h LEU 438 N 0.56 0.00 -0.66 1.33 5.85 -1.14 -3.39 115.31 117.86 1ibr h LEU 438 Ca 0.01 0.00 0.12 0.00 0.84 0.00 0.00 57.88 58.86 1ibr h LEU 438 Cb 1.13 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 42.03 1ibr h LEU 438 CO 0.11 0.72 -0.27 0.25 -0.34 0.00 0.00 178.44 178.91 1ibr h LEU 439 N 0.00 -0.97 -2.01 2.25 7.12 -0.96 0.54 115.31 121.28 1ibr h LEU 439 Ca -0.07 0.23 0.16 0.00 0.13 0.00 0.00 57.88 58.33 1ibr h LEU 439 Cb 1.61 0.53 -0.02 0.00 -0.53 0.00 0.00 40.66 42.25 1ibr h LEU 439 CO 0.08 -0.28 0.40 -0.65 -0.13 0.00 0.00 178.44 177.87 1ibr h PRO 440 N -0.09 0.00 -0.98 5.25 0.11 -1.77 0.50 132.00 135.02 1ibr h PRO 440 Ca 0.29 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.42 1ibr h PRO 440 Cb 0.54 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.60 1ibr h PRO 440 CO -0.72 0.00 0.64 0.93 -0.21 0.00 0.00 178.00 178.64 1ibr h GLU 441 N 0.00 1.24 -1.82 1.05 4.39 -1.15 -0.78 114.58 117.51 1ibr h GLU 441 Ca 0.26 -0.07 -0.73 0.00 0.34 0.00 0.00 59.36 59.16 1ibr h GLU 441 Cb 1.06 -0.28 -0.30 0.00 -0.10 0.00 0.00 28.75 29.13 1ibr h GLU 441 CO -0.00 0.82 0.69 0.00 -1.16 0.00 0.00 179.01 179.36 1ibr n ALA 442 N -2.38 6.22 -0.05 3.43 0.00 0.17 -4.82 120.51 123.08 1ibr n ALA 442 Ca 0.12 -4.11 0.23 0.00 0.00 0.00 0.00 53.44 49.68 1ibr n ALA 442 Cb 0.05 -1.69 0.53 0.00 0.00 0.00 0.00 19.45 18.35 1ibr n ALA 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ibr h ALA 443 N 2.84 2.55 0.00 0.00 0.00 -0.50 -3.44 119.26 120.71 1ibr h ALA 443 Ca 0.52 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.29 1ibr h ALA 443 Cb 0.26 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1ibr h ALA 443 CO 1.33 -1.28 0.69 0.44 0.00 0.00 0.00 179.25 180.44 1ibr n ILE 444 N -3.33 0.00 0.00 0.00 -5.35 -1.26 -4.24 119.36 105.18 1ibr n ILE 444 Ca 0.15 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.45 1ibr n ILE 444 Cb 1.14 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 39.04 1ibr n ILE 444 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1ibr n ASN 445 N 1.95 0.00 -4.67 7.28 2.85 -1.26 -4.88 115.26 116.53 1ibr n ASN 445 Ca 0.22 0.00 -0.34 0.00 -0.11 0.00 0.00 54.58 54.35 1ibr n ASN 445 Cb 0.07 0.00 0.12 0.00 1.24 0.00 0.00 39.78 41.21 1ibr n ASN 445 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1ibr n ASP 446 N 0.00 0.91 -2.08 1.20 2.03 -1.26 -0.72 116.55 116.63 1ibr n ASP 446 Ca 0.00 0.60 -0.08 0.00 0.52 0.00 0.00 54.79 55.83 1ibr n ASP 446 Cb 0.00 -1.49 -0.01 0.00 -0.72 0.00 0.00 41.12 38.90 1ibr n ASP 446 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1ibr n VAL 447 N -3.14 -0.26 0.00 5.18 3.14 -1.26 -4.44 118.33 117.55 1ibr n VAL 447 Ca 0.13 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.51 1ibr n VAL 447 Cb 0.50 -1.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.29 1ibr n VAL 447 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1ibr n TYR 448 N -2.58 0.00 0.07 1.45 4.01 -0.98 -4.56 117.16 114.56 1ibr n TYR 448 Ca -0.09 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.49 1ibr n TYR 448 Cb 0.47 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.43 1ibr n TYR 448 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1ibr h LEU 449 N 0.00 0.62 0.35 7.72 6.46 -1.14 -2.83 115.31 126.50 1ibr h LEU 449 Ca 0.00 -0.53 -0.02 0.00 -0.12 0.00 0.00 57.88 57.22 1ibr h LEU 449 Cb 0.00 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 39.74 1ibr h LEU 449 CO 0.00 1.34 -0.17 0.00 -0.62 0.00 0.00 178.44 178.99 1ibr h ALA 450 N 0.61 -0.68 -0.94 1.25 0.00 -1.86 -2.42 119.26 115.22 1ibr h ALA 450 Ca -0.11 -0.10 0.19 0.00 0.00 0.00 0.00 54.91 54.89 1ibr h ALA 450 Cb 1.70 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 19.59 1ibr h ALA 450 CO 0.19 -0.64 0.61 -1.00 0.00 0.00 0.00 179.25 178.40 1ibr h PRO 451 N -0.76 0.55 0.41 0.00 0.13 -1.81 -0.07 132.00 130.44 1ibr h PRO 451 Ca -0.05 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 1ibr h PRO 451 Cb 0.37 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.36 1ibr h PRO 451 CO 0.08 0.36 -0.29 1.25 -0.23 0.00 0.00 178.00 179.18 1ibr h LEU 452 N 0.56 -0.73 -0.90 1.56 5.85 -1.54 0.18 115.31 120.29 1ibr h LEU 452 Ca 0.51 0.05 0.16 0.00 0.84 0.00 0.00 57.88 59.44 1ibr h LEU 452 Cb 1.04 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 42.20 1ibr h LEU 452 CO -0.25 -0.44 0.49 -0.07 -0.34 0.00 0.00 178.44 177.84 1ibr h LEU 453 N -0.68 0.62 0.84 2.25 3.38 -0.66 0.58 115.31 121.64 1ibr h LEU 453 Ca -0.04 0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1ibr h LEU 453 Cb 0.58 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.32 1ibr h LEU 453 CO 0.02 0.24 -0.43 1.56 0.09 0.00 0.00 178.44 179.92 1ibr h GLN 454 N 0.67 -1.12 0.31 1.13 4.20 -0.31 0.10 115.11 120.08 1ibr h GLN 454 Ca 0.50 0.08 0.00 0.00 0.06 0.00 0.00 58.65 59.29 1ibr h GLN 454 Cb 0.73 0.26 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 1ibr h GLN 454 CO -0.37 -0.75 -0.34 0.00 -0.67 0.00 0.00 178.83 176.70 1ibr h LEU 456 N -0.68 -1.29 -0.74 0.00 3.38 0.16 -0.61 115.31 115.51 1ibr h LEU 456 Ca -0.01 0.25 0.27 0.00 0.09 0.00 0.00 57.88 58.48 1ibr h LEU 456 Cb 0.63 0.63 -0.14 0.00 0.09 0.00 0.00 40.66 41.88 1ibr h LEU 456 CO -0.08 -0.31 0.26 -0.38 0.09 0.00 0.00 178.44 178.02 1ibr n ILE 457 N -5.43 -0.31 -2.54 1.22 5.41 0.34 -1.83 119.36 116.22 1ibr n ILE 457 Ca 0.04 1.56 -0.42 0.00 1.00 0.00 0.00 62.75 64.94 1ibr n ILE 457 Cb 0.36 -2.43 -0.01 0.00 -0.71 0.00 0.00 39.64 36.85 1ibr n ILE 457 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 1ibr s GLU 458 N -5.33 3.81 0.00 0.38 2.02 -0.24 -5.12 118.70 114.22 1ibr s GLU 458 Ca -0.08 -1.77 0.00 0.00 0.02 0.00 0.00 54.97 53.14 1ibr s GLU 458 Cb 0.24 -5.48 0.00 0.00 0.10 0.00 0.00 34.13 28.99 1ibr s GLU 458 CO 0.58 -2.37 0.00 0.41 0.02 0.00 0.00 175.26 173.90