#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b1x s LEU 2 N 0.00 4.50 0.78 3.17 1.43 -1.26 -5.04 118.68 122.26 2b1x s LEU 2 Ca 0.00 2.14 -0.14 0.00 -1.03 0.00 0.00 54.13 55.10 2b1x s LEU 2 Cb 0.00 -3.73 0.05 0.00 0.03 0.00 0.00 46.19 42.54 2b1x s LEU 2 CO 0.00 -0.12 1.06 -1.54 0.23 0.00 0.00 176.35 175.98 2b1x n SER 3 N 1.04 0.63 -0.34 2.29 3.41 -1.26 -4.83 113.62 114.56 2b1x n SER 3 Ca -0.00 0.61 -0.04 0.00 -0.26 0.00 0.00 58.87 59.17 2b1x n SER 3 Cb 0.46 -1.45 0.09 0.00 -0.26 0.00 0.00 64.21 63.05 2b1x n SER 3 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2b1x h ASN 4 N -0.67 1.13 -0.21 4.04 2.35 -1.99 -1.36 115.58 118.86 2b1x h ASN 4 Ca -0.47 -0.10 0.04 0.00 -0.55 0.00 0.00 56.30 55.22 2b1x h ASN 4 Cb 1.31 -0.29 -0.03 0.00 0.05 0.00 0.00 38.32 39.36 2b1x h ASN 4 CO 0.46 0.90 -0.01 -0.33 -1.65 0.00 0.00 177.43 176.79 2b1x h GLU 5 N 1.26 0.05 -0.35 0.81 3.07 -1.99 -0.96 114.58 116.47 2b1x h GLU 5 Ca 0.32 -0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.09 2b1x h GLU 5 Cb 0.02 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 2b1x h GLU 5 CO -0.05 0.03 -0.11 1.25 -1.40 0.00 0.00 179.01 178.73 2b1x h LEU 6 N 0.05 0.70 -0.14 1.33 5.85 -1.86 -1.77 115.31 119.47 2b1x h LEU 6 Ca 0.10 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.48 2b1x h LEU 6 Cb 0.13 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.93 2b1x h LEU 6 CO -0.18 0.92 -0.09 -0.09 -0.34 0.00 0.00 178.44 178.66 2b1x h ARG 7 N 0.48 -0.09 -0.67 1.25 2.43 -1.03 -0.15 114.38 116.60 2b1x h ARG 7 Ca 0.08 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2b1x h ARG 7 Cb 0.63 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 2b1x h ARG 7 CO 0.04 -0.06 0.24 1.96 -1.51 0.00 0.00 179.97 180.63 2b1x h GLN 8 N -0.10 1.00 -0.56 0.20 4.20 -1.09 0.04 115.11 118.81 2b1x h GLN 8 Ca 0.09 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.59 2b1x h GLN 8 Cb 0.22 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2b1x h GLN 8 CO -0.20 0.84 0.27 1.15 -0.67 0.00 0.00 178.83 180.22 2b1x h THR 9 N 0.98 1.20 -0.43 -0.54 2.02 -0.59 0.30 112.91 115.84 2b1x h THR 9 Ca 0.22 -0.57 -0.11 0.00 0.77 0.00 0.00 66.41 66.73 2b1x h THR 9 Cb 0.24 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 2b1x h THR 9 CO -0.01 0.23 -0.15 -0.07 0.37 0.00 0.00 175.52 175.88 2b1x h LEU 10 N 0.76 0.89 -0.32 2.58 3.38 -0.37 -0.13 115.31 122.10 2b1x h LEU 10 Ca 0.19 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 2b1x h LEU 10 Cb 0.11 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2b1x h LEU 10 CO -0.03 1.07 0.18 1.56 0.09 0.00 0.00 178.44 181.31 2b1x h GLN 11 N 0.70 0.44 -0.67 1.13 4.20 -0.77 -0.33 115.11 119.82 2b1x h GLN 11 Ca 0.10 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.77 2b1x h GLN 11 Cb 0.71 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.36 2b1x h GLN 11 CO 0.05 0.36 0.44 -0.22 -0.67 0.00 0.00 178.83 178.79 2b1x h LYS 12 N 0.40 0.87 -0.95 1.46 3.64 -0.92 -2.69 116.57 118.37 2b1x h LYS 12 Ca 0.11 -0.05 0.05 0.00 -1.27 0.00 0.00 60.65 59.49 2b1x h LYS 12 Cb 0.04 -0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 31.61 2b1x h LYS 12 CO -0.02 0.58 0.61 0.78 -2.27 0.00 0.00 179.45 179.13 2b1x h GLY 13 N 0.90 1.42 1.96 5.01 0.00 -0.52 -0.57 103.07 111.26 2b1x h GLY 13 Ca 0.25 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 2b1x h GLY 13 CO -0.06 0.36 -0.35 -2.00 0.00 0.00 0.00 176.54 174.50 2b1x h LEU 14 N 1.16 0.04 0.02 3.11 5.85 -0.75 -1.77 115.31 122.97 2b1x h LEU 14 Ca 0.39 -0.01 -0.21 0.00 0.84 0.00 0.00 57.88 58.89 2b1x h LEU 14 Cb 0.08 -0.01 0.02 0.00 0.37 0.00 0.00 40.66 41.11 2b1x h LEU 14 CO -0.15 0.39 -0.85 -0.74 -0.34 0.00 0.00 178.44 176.76 2b1x h HIS 15 N 0.04 0.82 -0.07 1.25 2.76 -1.14 -3.37 115.15 115.44 2b1x h HIS 15 Ca 0.00 -0.46 -0.11 0.00 -2.20 0.00 0.00 60.37 57.60 2b1x h HIS 15 Cb 0.64 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.50 2b1x h HIS 15 CO 0.00 1.29 -0.47 -0.44 -1.30 0.00 0.00 177.93 177.02 2b1x h ASP 16 N 0.11 0.19 -0.34 3.26 3.32 -0.74 -3.00 116.42 119.21 2b1x h ASP 16 Ca -0.11 -0.09 0.01 0.00 0.02 0.00 0.00 57.03 56.86 2b1x h ASP 16 Cb 1.54 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 41.02 2b1x h ASP 16 CO 0.17 0.63 0.23 1.62 -1.72 0.00 0.00 179.24 180.17 2b1x h VAL 17 N 0.15 1.07 -0.12 -1.35 3.04 -1.14 0.15 116.25 118.05 2b1x h VAL 17 Ca 0.01 -0.15 0.00 0.00 -1.01 0.00 0.00 66.70 65.55 2b1x h VAL 17 Cb 0.88 0.59 0.00 0.00 -2.01 0.00 0.00 31.29 30.76 2b1x h VAL 17 CO 0.07 0.08 0.00 0.59 -1.01 0.00 0.00 177.57 177.30 2b1x n ASN 18 N -4.49 2.20 0.00 3.17 3.02 -1.21 -3.83 115.26 114.11 2b1x n ASN 18 Ca 0.02 -1.62 0.00 0.00 -0.03 0.00 0.00 54.58 52.95 2b1x n ASN 18 Cb 0.09 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 2b1x n ASN 18 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2b1x n SER 19 N 0.55 0.00 0.28 6.41 3.41 -0.99 -4.71 113.62 118.56 2b1x n SER 19 Ca 0.08 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.86 2b1x n SER 19 Cb 0.31 -0.23 0.74 0.00 -0.26 0.00 0.00 64.21 64.78 2b1x n SER 19 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2b1x h ASP 20 N 0.00 0.00 -5.87 4.04 3.32 -1.71 -3.47 116.42 112.72 2b1x h ASP 20 Ca 0.00 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.66 2b1x h ASP 20 Cb 0.00 0.00 0.12 0.00 0.22 0.00 0.00 39.33 39.67 2b1x h ASP 20 CO 0.00 0.00 -0.74 0.79 -1.72 0.00 0.00 179.24 177.57 2b1x n TRP 21 N -3.03 -2.42 -4.47 4.55 7.02 0.49 -4.75 117.44 114.83 2b1x n TRP 21 Ca 0.00 0.95 -0.22 0.00 -1.02 0.00 0.00 57.50 57.21 2b1x n TRP 21 Cb 0.27 -4.83 -0.11 0.00 -2.42 0.00 0.00 31.31 24.22 2b1x n TRP 21 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2b1x s THR 22 N -3.38 1.48 -0.00 -0.99 -4.23 -1.07 -1.38 115.64 106.07 2b1x s THR 22 Ca 0.30 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 2b1x s THR 22 Cb -0.14 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.02 2b1x s THR 22 CO 0.76 -0.12 -0.00 -0.69 -0.54 0.00 0.00 174.62 174.02 2b1x s VAL 23 N -3.10 0.04 0.23 2.29 1.01 -0.87 -2.74 120.40 117.26 2b1x s VAL 23 Ca 0.33 -0.01 -0.32 0.00 0.00 0.00 0.00 61.98 61.99 2b1x s VAL 23 Cb 0.07 -0.05 -0.13 0.00 0.00 0.00 0.00 36.38 36.27 2b1x s VAL 23 CO 0.14 0.02 1.55 -2.65 0.00 0.00 0.00 175.10 174.16 2b1x n PRO 24 N 3.14 2.34 0.26 2.72 -0.02 -1.26 0.99 135.00 143.17 2b1x n PRO 24 Ca -0.13 0.84 0.17 0.00 -2.02 0.00 0.00 63.50 62.36 2b1x n PRO 24 Cb 0.59 -2.59 0.79 0.00 -0.02 0.00 0.00 33.50 32.27 2b1x n PRO 24 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b1x h ALA 25 N 5.22 1.00 0.00 3.55 0.00 -1.14 -3.12 119.26 124.76 2b1x h ALA 25 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2b1x h ALA 25 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2b1x h ALA 25 CO 0.83 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.08 2b1x n ALA 26 N -2.00 1.39 0.82 0.00 0.00 -1.16 -2.87 120.51 116.69 2b1x n ALA 26 Ca -0.00 -0.02 0.14 0.00 0.00 0.00 0.00 53.44 53.55 2b1x n ALA 26 Cb 0.20 -1.15 0.51 0.00 0.00 0.00 0.00 19.45 19.01 2b1x n ALA 26 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2b1x n ILE 27 N -1.54 0.28 -0.05 0.00 -5.35 -1.18 -4.29 119.36 107.24 2b1x n ILE 27 Ca 0.02 -0.14 -0.11 0.00 -0.27 0.00 0.00 62.75 62.26 2b1x n ILE 27 Cb 0.10 -0.53 -0.09 0.00 -1.74 0.00 0.00 39.64 37.38 2b1x n ILE 27 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 2b1x h ILE 28 N 0.00 1.29 -2.66 7.28 2.04 -1.82 -3.44 117.51 120.20 2b1x h ILE 28 Ca 0.00 -1.85 -0.59 0.00 1.00 0.00 0.00 64.86 63.43 2b1x h ILE 28 Cb 0.61 2.38 -0.39 0.00 -0.74 0.00 0.00 36.82 38.68 2b1x h ILE 28 CO 0.00 0.42 -0.83 0.21 0.00 0.00 0.00 178.15 177.95 2b1x s ASN 29 N -5.96 3.02 -0.15 1.72 2.47 -1.26 -4.68 114.94 110.10 2b1x s ASN 29 Ca -0.14 -2.36 -0.08 0.00 0.42 0.00 0.00 52.86 50.70 2b1x s ASN 29 Cb -0.02 -0.55 0.06 0.00 -1.45 0.00 0.00 41.25 39.29 2b1x s ASN 29 CO 0.52 -0.29 0.35 -0.62 -3.72 0.00 0.00 177.10 173.35 2b1x s ASP 30 N 0.82 -0.40 0.29 -4.21 -1.08 -1.26 -4.44 116.67 106.39 2b1x s ASP 30 Ca 0.19 0.77 -0.02 0.00 -0.52 0.00 0.00 52.55 52.98 2b1x s ASP 30 Cb -0.21 0.68 0.44 0.00 -1.46 0.00 0.00 42.92 42.37 2b1x s ASP 30 CO -0.01 -0.19 1.94 -0.65 0.52 0.00 0.00 175.17 176.78 2b1x h PRO 31 N 7.24 1.10 -0.23 4.34 0.11 -1.96 -0.16 132.00 142.43 2b1x h PRO 31 Ca -0.36 -0.07 -0.20 0.00 0.11 0.00 0.00 66.00 65.48 2b1x h PRO 31 Cb 1.17 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2b1x h PRO 31 CO 0.31 0.73 -0.64 1.49 -0.21 0.00 0.00 178.00 179.67 2b1x h GLU 32 N 1.14 0.84 0.07 1.05 4.81 -1.99 -1.33 114.58 119.18 2b1x h GLU 32 Ca 0.35 -0.59 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 2b1x h GLU 32 Cb -0.01 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.46 2b1x h GLU 32 CO -0.10 1.22 -0.04 0.28 -0.73 0.00 0.00 179.01 179.64 2b1x h VAL 33 N 0.62 0.92 -0.66 0.32 2.07 -1.81 -0.67 116.25 117.04 2b1x h VAL 33 Ca -0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.58 2b1x h VAL 33 Cb 1.26 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 31.89 2b1x h VAL 33 CO 0.14 0.00 0.34 -0.74 0.02 0.00 0.00 177.57 177.33 2b1x h HIS 34 N -0.10 0.62 -0.35 1.57 -0.00 -0.87 0.33 115.15 116.35 2b1x h HIS 34 Ca -0.01 0.03 -0.08 0.00 -0.00 0.00 0.00 60.37 60.30 2b1x h HIS 34 Cb 0.08 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.30 2b1x h HIS 34 CO -0.07 0.26 -0.11 -0.44 -0.00 0.00 0.00 177.93 177.56 2b1x h ASP 35 N 0.61 0.70 -0.34 3.26 3.32 -0.80 -1.25 116.42 121.92 2b1x h ASP 35 Ca 0.31 -0.38 -0.04 0.00 0.02 0.00 0.00 57.03 56.94 2b1x h ASP 35 Cb 0.26 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 2b1x h ASP 35 CO -0.22 0.92 0.05 0.58 -1.72 0.00 0.00 179.24 178.84 2b1x h VAL 36 N 0.47 1.24 -0.86 -1.35 2.07 -0.96 -3.07 116.25 113.80 2b1x h VAL 36 Ca 0.08 -0.84 0.06 0.00 0.82 0.00 0.00 66.70 66.82 2b1x h VAL 36 Cb 0.63 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 2b1x h VAL 36 CO 0.04 0.28 0.56 -0.08 0.02 0.00 0.00 177.57 178.39 2b1x h GLU 37 N 0.39 0.95 -0.58 1.57 4.81 -0.80 0.14 114.58 121.07 2b1x h GLU 37 Ca 0.10 -0.06 0.08 0.00 -0.13 0.00 0.00 59.36 59.35 2b1x h GLU 37 Cb 0.36 -0.21 -0.06 0.00 0.63 0.00 0.00 28.75 29.47 2b1x h GLU 37 CO 0.01 0.63 0.24 -0.09 -0.73 0.00 0.00 179.01 179.07 2b1x h ARG 38 N 0.98 0.44 0.00 1.92 2.43 -1.13 0.22 114.38 119.23 2b1x h ARG 38 Ca 0.36 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.50 2b1x h ARG 38 Cb 0.18 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2b1x h ARG 38 CO -0.13 0.29 -0.02 1.49 -1.51 0.00 0.00 179.97 180.09 2b1x h GLU 39 N 0.45 0.01 0.00 0.20 4.81 -1.41 -1.76 114.58 116.87 2b1x h GLU 39 Ca 0.28 -0.01 -0.20 0.00 -0.13 0.00 0.00 59.36 59.30 2b1x h GLU 39 Cb 0.29 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 2b1x h GLU 39 CO -0.25 0.90 -0.93 0.00 -0.73 0.00 0.00 179.01 178.00 2b1x h ARG 40 N -0.87 0.00 0.00 1.92 3.08 -0.59 -2.11 114.38 115.81 2b1x h ARG 40 Ca -0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2b1x h ARG 40 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.95 2b1x h ARG 40 CO 0.00 0.93 -0.75 -0.89 -1.07 0.00 0.00 179.97 178.20 2b1x n ILE 41 N -3.43 1.41 0.30 2.04 -0.00 0.71 -4.40 119.36 115.99 2b1x n ILE 41 Ca -0.00 0.19 0.14 0.00 -0.00 0.00 0.00 62.75 63.07 2b1x n ILE 41 Cb 0.88 -2.34 0.38 0.00 -0.00 0.00 0.00 39.64 38.56 2b1x n ILE 41 CO 0.00 0.00 0.00 -0.26 -0.00 0.00 0.00 176.55 176.29 2b1x h PHE 42 N -0.97 0.00 -0.00 1.39 -1.00 -1.30 0.39 116.94 115.45 2b1x h PHE 42 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 2b1x h PHE 42 Cb 0.75 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.31 2b1x h PHE 42 CO -0.32 0.00 -0.09 0.41 -1.61 0.00 0.00 178.31 176.70 2b1x n GLY 43 N 0.71 -0.83 0.02 -1.45 0.00 -0.68 -4.50 105.19 98.47 2b1x n GLY 43 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2b1x n GLY 43 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2b1x n HIS 44 N -0.82 0.00 -1.32 1.61 8.25 -0.74 -3.39 115.22 118.81 2b1x n HIS 44 Ca 0.16 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.32 2b1x n HIS 44 Cb 0.27 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.49 2b1x n HIS 44 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2b1x s ALA 45 N -1.71 1.94 -0.09 -1.41 0.00 0.05 -4.58 121.76 115.96 2b1x s ALA 45 Ca 0.00 -0.02 -0.24 0.00 0.00 0.00 0.00 51.96 51.70 2b1x s ALA 45 Cb 0.00 -3.19 -0.03 0.00 0.00 0.00 0.00 23.12 19.90 2b1x s ALA 45 CO 0.00 -2.01 0.75 -1.58 0.00 0.00 0.00 175.76 172.92 2b1x s TRP 46 N -2.99 3.54 -0.07 0.00 0.52 -1.26 -4.42 118.94 114.26 2b1x s TRP 46 Ca 0.62 1.27 0.05 0.00 0.02 0.00 0.00 56.10 58.06 2b1x s TRP 46 Cb -0.17 -2.87 -0.01 0.00 -1.15 0.00 0.00 33.47 29.27 2b1x s TRP 46 CO 0.56 -0.01 -0.24 0.08 0.02 0.00 0.00 176.95 177.36 2b1x s VAL 47 N 1.17 2.09 0.21 4.03 1.01 0.58 -4.31 120.40 125.18 2b1x s VAL 47 Ca 0.38 -1.04 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2b1x s VAL 47 Cb -0.18 -1.77 -0.09 0.00 0.00 0.00 0.00 36.38 34.35 2b1x s VAL 47 CO 0.17 0.57 1.26 0.12 0.00 0.00 0.00 175.10 177.22 2b1x s PHE 48 N -0.00 3.31 -0.09 5.22 5.36 -1.26 -0.90 117.98 129.61 2b1x s PHE 48 Ca -0.08 1.33 -0.04 0.00 -0.96 0.00 0.00 56.93 57.17 2b1x s PHE 48 Cb -0.15 -3.54 -0.04 0.00 -0.34 0.00 0.00 43.02 38.95 2b1x s PHE 48 CO 0.05 -1.59 -0.11 1.28 -1.46 0.00 0.00 175.22 173.39 2b1x n LEU 49 N 2.33 0.68 -3.48 6.12 4.77 0.46 -4.90 117.00 122.98 2b1x n LEU 49 Ca 0.05 0.10 -0.11 0.00 -0.03 0.00 0.00 56.01 56.02 2b1x n LEU 49 Cb 0.43 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2b1x n LEU 49 CO 0.57 0.19 0.48 0.00 -1.33 0.00 0.00 177.39 177.30 2b1x s ALA 50 N -2.16 -1.62 -0.02 -1.18 0.00 -1.17 -4.86 121.76 110.75 2b1x s ALA 50 Ca -0.12 0.54 -0.09 0.00 0.00 0.00 0.00 51.96 52.28 2b1x s ALA 50 Cb 0.05 0.78 -0.05 0.00 0.00 0.00 0.00 23.12 23.89 2b1x s ALA 50 CO 0.16 -0.78 0.29 -1.58 0.00 0.00 0.00 175.76 173.85 2b1x s HIS 51 N -3.61 3.63 0.46 0.00 2.46 -1.26 -0.85 115.29 116.12 2b1x s HIS 51 Ca 0.03 0.71 0.17 0.00 0.47 0.00 0.00 55.06 56.44 2b1x s HIS 51 Cb -0.01 -2.09 1.14 0.00 -0.13 0.00 0.00 32.58 31.49 2b1x s HIS 51 CO -0.10 0.64 1.99 0.93 -2.47 0.00 0.00 174.74 175.73 2b1x h GLU 52 N 4.40 0.27 0.00 2.88 5.08 -1.07 -1.15 114.58 124.99 2b1x h GLU 52 Ca -0.52 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 2b1x h GLU 52 Cb 1.21 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2b1x h GLU 52 CO 0.63 0.18 0.00 -1.13 -1.00 0.00 0.00 179.01 177.69 2b1x n SER 53 N -4.45 0.00 0.16 1.42 3.41 -1.26 -2.12 113.62 110.78 2b1x n SER 53 Ca 0.09 0.46 0.05 0.00 -0.26 0.00 0.00 58.87 59.21 2b1x n SER 53 Cb 0.43 -0.48 0.11 0.00 -0.26 0.00 0.00 64.21 64.02 2b1x n SER 53 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2b1x h GLU 54 N 0.00 0.00 -2.17 4.33 5.08 -1.54 -3.38 114.58 116.91 2b1x h GLU 54 Ca 0.00 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.81 2b1x h GLU 54 Cb 0.20 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.04 2b1x h GLU 54 CO 0.00 0.40 -0.84 0.44 -1.00 0.00 0.00 179.01 178.01 2b1x n ILE 55 N -3.25 1.72 0.13 3.13 -5.35 -0.90 -4.82 119.36 110.02 2b1x n ILE 55 Ca 0.02 -5.12 -0.00 0.00 -0.27 0.00 0.00 62.75 57.37 2b1x n ILE 55 Cb 0.66 -1.17 0.12 0.00 -1.74 0.00 0.00 39.64 37.51 2b1x n ILE 55 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2b1x h PRO 56 N 3.20 0.00 -6.15 6.28 0.13 -1.74 -3.42 132.00 130.30 2b1x h PRO 56 Ca 0.12 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.67 2b1x h PRO 56 Cb 0.69 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.76 2b1x h PRO 56 CO 0.70 0.64 -0.56 -1.21 -0.23 0.00 0.00 178.00 177.34 2b1x s GLU 57 N -3.30 3.01 0.20 0.86 0.41 -1.26 -5.05 118.70 113.57 2b1x s GLU 57 Ca 0.00 -0.75 -0.32 0.00 -0.41 0.00 0.00 54.97 53.49 2b1x s GLU 57 Cb 0.11 -2.74 -0.12 0.00 -1.78 0.00 0.00 34.13 29.60 2b1x s GLU 57 CO 0.76 0.52 1.73 1.03 -0.49 0.00 0.00 175.26 178.80 2b1x s ARG 58 N -2.89 4.13 0.00 1.61 0.52 -1.26 -1.47 118.95 119.59 2b1x s ARG 58 Ca 0.31 2.60 0.00 0.00 -0.52 0.00 0.00 55.73 58.12 2b1x s ARG 58 Cb -0.11 -3.13 0.00 0.00 0.52 0.00 0.00 34.95 32.23 2b1x s ARG 58 CO 0.24 -0.76 0.00 0.41 0.02 0.00 0.00 175.30 175.21 2b1x n GLY 59 N 4.00 3.40 3.78 -3.53 0.00 0.12 -4.88 105.19 108.08 2b1x n GLY 59 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2b1x n GLY 59 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b1x s ASP 60 N -0.77 6.39 0.06 1.61 1.01 -0.54 -1.10 116.67 123.32 2b1x s ASP 60 Ca 0.00 3.01 -0.13 0.00 0.71 0.00 0.00 52.55 56.15 2b1x s ASP 60 Cb 0.00 -2.67 0.02 0.00 1.01 0.00 0.00 42.92 41.28 2b1x s ASP 60 CO 0.00 -0.84 0.29 -0.72 0.21 0.00 0.00 175.17 174.10 2b1x s TYR 61 N -1.10 -0.06 0.09 4.23 -0.85 -0.38 -1.48 117.35 117.80 2b1x s TYR 61 Ca 0.53 -0.14 0.04 0.00 -0.52 0.00 0.00 57.07 56.98 2b1x s TYR 61 Cb -0.46 0.08 -0.03 0.00 0.38 0.00 0.00 41.96 41.92 2b1x s TYR 61 CO 0.62 -0.52 -0.12 0.14 -1.52 0.00 0.00 175.55 174.15 2b1x s VAL 62 N -2.86 1.02 -0.25 -3.49 -7.23 -0.55 -1.87 120.40 105.17 2b1x s VAL 62 Ca -0.03 -1.54 -0.09 0.00 -1.81 0.00 0.00 61.98 58.52 2b1x s VAL 62 Cb 0.00 -1.27 -0.04 0.00 0.56 0.00 0.00 36.38 35.63 2b1x s VAL 62 CO -0.05 -0.45 0.11 -0.69 -0.31 0.00 0.00 175.10 173.71 2b1x s VAL 63 N -2.05 4.71 0.35 1.32 1.01 -0.30 -0.90 120.40 124.54 2b1x s VAL 63 Ca 0.03 -0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.02 2b1x s VAL 63 Cb -0.05 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 2b1x s VAL 63 CO 0.01 0.32 0.18 -0.13 0.00 0.00 0.00 175.10 175.48 2b1x s ARG 64 N 1.55 1.75 0.07 2.72 1.81 -0.27 -4.94 118.95 121.64 2b1x s ARG 64 Ca 0.06 -2.03 0.04 0.00 -1.72 0.00 0.00 55.73 52.08 2b1x s ARG 64 Cb -0.15 -0.16 -0.03 0.00 -0.45 0.00 0.00 34.95 34.16 2b1x s ARG 64 CO 0.06 -0.51 -0.11 0.71 -0.68 0.00 0.00 175.30 174.76 2b1x s TYR 65 N -3.43 1.02 -0.27 -0.53 1.51 -1.26 -0.36 117.35 114.03 2b1x s TYR 65 Ca 0.33 -0.51 0.03 0.00 -1.01 0.00 0.00 57.07 55.91 2b1x s TYR 65 Cb 0.03 -0.58 0.07 0.00 -0.11 0.00 0.00 41.96 41.37 2b1x s TYR 65 CO 0.19 0.00 -0.08 0.42 -1.11 0.00 0.00 175.55 174.97 2b1x s ILE 66 N -1.52 2.16 0.00 2.71 1.01 -0.40 -4.89 121.20 120.27 2b1x s ILE 66 Ca -0.03 -1.74 0.00 0.00 0.00 0.00 0.00 60.65 58.88 2b1x s ILE 66 Cb -0.09 -2.33 0.00 0.00 0.01 0.00 0.00 42.46 40.06 2b1x s ILE 66 CO 0.01 -0.12 0.00 -1.20 0.00 0.00 0.00 174.94 173.63 2b1x n SER 67 N 4.41 0.00 0.05 3.58 7.64 -1.26 -0.63 113.62 127.41 2b1x n SER 67 Ca -0.11 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.89 2b1x n SER 67 Cb 0.42 0.00 0.48 0.00 -1.01 0.00 0.00 64.21 64.10 2b1x n SER 67 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2b1x n GLU 68 N 14.00 0.09 -2.61 1.43 4.71 -1.26 -4.80 120.64 132.20 2b1x n GLU 68 Ca 0.00 0.18 -0.41 0.00 -0.01 0.00 0.00 57.16 56.91 2b1x n GLU 68 Cb 0.00 -1.63 -0.04 0.00 -1.01 0.00 0.00 31.44 28.76 2b1x n GLU 68 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2b1x s ASP 69 N -3.57 7.34 -0.16 1.62 1.01 0.20 -5.02 116.67 118.09 2b1x s ASP 69 Ca 0.10 1.89 -0.03 0.00 0.71 0.00 0.00 52.55 55.21 2b1x s ASP 69 Cb 0.14 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.45 2b1x s ASP 69 CO 0.46 -0.22 -0.04 -1.58 0.21 0.00 0.00 175.17 174.00 2b1x s GLN 70 N 0.27 3.62 -0.04 8.23 0.74 -1.26 -1.28 119.66 129.95 2b1x s GLN 70 Ca 0.51 -0.54 0.05 0.00 0.05 0.00 0.00 55.36 55.42 2b1x s GLN 70 Cb -0.26 -2.91 -0.01 0.00 1.10 0.00 0.00 33.01 30.94 2b1x s GLN 70 CO 0.31 0.20 -0.18 -0.06 -0.55 0.00 0.00 175.29 175.01 2b1x s PHE 71 N 0.47 1.73 -0.12 1.67 0.40 0.52 -0.74 117.98 121.91 2b1x s PHE 71 Ca -0.04 -0.45 -0.28 0.00 -0.60 0.00 0.00 56.93 55.57 2b1x s PHE 71 Cb -0.14 -1.15 -0.01 0.00 0.51 0.00 0.00 43.02 42.22 2b1x s PHE 71 CO 0.03 -0.13 0.93 0.42 0.70 0.00 0.00 175.22 177.17 2b1x s ILE 72 N -0.11 4.83 -0.26 0.64 1.01 0.14 -1.12 121.20 126.34 2b1x s ILE 72 Ca -0.01 1.87 -0.03 0.00 0.00 0.00 0.00 60.65 62.48 2b1x s ILE 72 Cb -0.10 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.15 2b1x s ILE 72 CO 0.01 0.03 -0.02 -0.69 0.00 0.00 0.00 174.94 174.27 2b1x s VAL 73 N 1.98 3.16 0.07 2.92 1.01 -0.08 -0.50 120.40 128.97 2b1x s VAL 73 Ca 0.44 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.47 2b1x s VAL 73 Cb -0.18 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 2b1x s VAL 73 CO 0.16 0.17 0.03 0.00 0.00 0.00 0.00 175.10 175.46 2b1x s ARG 75 N -3.94 3.83 0.80 0.00 3.52 -0.55 -0.76 118.95 121.86 2b1x s ARG 75 Ca 0.10 -0.40 -0.10 0.00 -0.13 0.00 0.00 55.73 55.20 2b1x s ARG 75 Cb 0.07 -3.66 0.18 0.00 -1.56 0.00 0.00 34.95 29.98 2b1x s ARG 75 CO -0.08 -0.24 1.10 -0.40 -0.81 0.00 0.00 175.30 174.87 2b1x n ASP 76 N 5.06 0.47 0.14 -2.12 5.68 0.22 0.16 116.55 126.15 2b1x n ASP 76 Ca -0.14 -1.63 0.12 0.00 -0.50 0.00 0.00 54.79 52.63 2b1x n ASP 76 Cb 0.51 -0.80 0.52 0.00 -1.14 0.00 0.00 41.12 40.21 2b1x n ASP 76 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2b1x n GLU 77 N -3.24 0.18 -0.02 0.11 -0.58 -1.26 -0.96 120.64 114.87 2b1x n GLU 77 Ca 0.15 0.49 0.13 0.00 -0.42 0.00 0.00 57.16 57.50 2b1x n GLU 77 Cb 0.52 -1.90 0.27 0.00 -0.57 0.00 0.00 31.44 29.76 2b1x n GLU 77 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2b1x n GLY 78 N -0.40 0.70 1.20 0.62 0.00 -1.26 -4.96 105.19 101.09 2b1x n GLY 78 Ca 0.01 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2b1x n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b1x n GLY 79 N 1.29 0.75 3.83 -0.02 0.00 -0.13 -5.06 105.19 105.85 2b1x n GLY 79 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2b1x n GLY 79 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2b1x s GLU 80 N -0.49 4.10 -0.08 1.61 2.12 -1.26 -4.73 118.70 119.97 2b1x s GLU 80 Ca 0.00 0.65 -0.25 0.00 0.36 0.00 0.00 54.97 55.73 2b1x s GLU 80 Cb 0.00 -2.94 -0.03 0.00 0.26 0.00 0.00 34.13 31.42 2b1x s GLU 80 CO 0.00 0.46 0.77 0.42 -0.54 0.00 0.00 175.26 176.38 2b1x s ILE 81 N -1.45 4.98 0.16 -3.70 -1.09 -1.26 -0.61 121.20 118.23 2b1x s ILE 81 Ca 0.39 1.57 0.10 0.00 -2.23 0.00 0.00 60.65 60.48 2b1x s ILE 81 Cb -0.16 -4.10 -0.04 0.00 -1.58 0.00 0.00 42.46 36.58 2b1x s ILE 81 CO 0.20 0.18 -0.23 -0.13 -1.23 0.00 0.00 174.94 173.73 2b1x s ARG 82 N 1.17 1.39 -0.17 2.79 1.81 0.06 -4.98 118.95 121.02 2b1x s ARG 82 Ca 0.40 -1.42 -0.01 0.00 -1.72 0.00 0.00 55.73 52.98 2b1x s ARG 82 Cb -0.18 -1.67 0.05 0.00 -0.45 0.00 0.00 34.95 32.69 2b1x s ARG 82 CO 0.18 0.37 -0.03 0.20 -0.68 0.00 0.00 175.30 175.34 2b1x s GLY 83 N -2.47 0.87 -0.11 -3.53 0.00 -1.25 -1.14 107.32 99.68 2b1x s GLY 83 Ca 0.17 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 44.15 2b1x s GLY 83 CO 0.08 1.08 -0.18 0.30 0.00 0.00 0.00 173.10 174.37 2b1x s HIS 84 N 1.71 2.68 0.16 1.90 0.09 0.35 -1.04 115.29 121.14 2b1x s HIS 84 Ca 0.00 -0.82 -0.33 0.00 -0.00 0.00 0.00 55.06 53.92 2b1x s HIS 84 Cb -0.16 -1.77 -0.12 0.00 -0.00 0.00 0.00 32.58 30.53 2b1x s HIS 84 CO -0.07 -0.30 1.72 -0.11 -0.00 0.00 0.00 174.74 175.97 2b1x n LEU 85 N 3.48 3.72 -3.34 0.89 7.94 0.51 0.29 117.00 130.48 2b1x n LEU 85 Ca -0.18 1.05 -0.39 0.00 -1.11 0.00 0.00 56.01 55.37 2b1x n LEU 85 Cb 0.53 -1.51 -0.02 0.00 0.53 0.00 0.00 43.42 42.94 2b1x n LEU 85 CO 0.29 0.03 3.08 -3.20 -1.11 0.00 0.00 177.39 176.49 2b1x n ASN 86 N 4.31 8.51 -3.45 1.96 5.15 0.09 -4.53 115.26 127.31 2b1x n ASN 86 Ca 0.17 -2.74 -0.12 0.00 -0.60 0.00 0.00 54.58 51.29 2b1x n ASN 86 Cb 0.33 -1.50 -0.10 0.00 -0.53 0.00 0.00 39.78 37.99 2b1x n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2b1x s ALA 87 N 1.14 -0.85 0.39 5.20 0.00 -1.26 -3.91 121.76 122.45 2b1x s ALA 87 Ca 0.65 0.82 -0.26 0.00 0.00 0.00 0.00 51.96 53.17 2b1x s ALA 87 Cb 0.18 -1.49 -0.11 0.00 0.00 0.00 0.00 23.12 21.70 2b1x s ALA 87 CO -0.07 -1.13 1.21 0.00 0.00 0.00 0.00 175.76 175.76 2b1x n ARG 89 N 0.27 0.09 0.00 0.00 5.12 -1.26 -0.79 116.66 120.10 2b1x n ARG 89 Ca 0.07 0.18 0.00 0.00 -1.93 0.00 0.00 57.85 56.16 2b1x n ARG 89 Cb 0.38 -1.63 0.00 0.00 -1.16 0.00 0.00 32.46 30.04 2b1x n ARG 89 CO 0.00 0.00 0.00 1.58 -1.93 0.00 0.00 177.63 177.28 2b1x n HIS 90 N -1.80 0.00 -0.78 -1.55 -0.00 -1.26 -4.73 115.22 105.10 2b1x n HIS 90 Ca 0.05 0.00 0.05 0.00 0.46 0.00 0.00 57.72 58.28 2b1x n HIS 90 Cb 0.31 -0.31 0.07 0.00 -0.12 0.00 0.00 29.99 29.94 2b1x n HIS 90 CO 0.00 0.00 0.00 -2.13 0.46 0.00 0.00 176.34 174.67 2b1x n ARG 91 N -1.60 1.68 -0.89 1.57 3.00 -1.26 -5.03 116.66 114.14 2b1x n ARG 91 Ca 0.00 -1.92 0.00 0.00 -0.00 0.00 0.00 57.85 55.93 2b1x n ARG 91 Cb 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 32.46 31.29 2b1x n ARG 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2b1x n GLY 92 N -0.88 0.54 3.76 5.14 0.00 0.03 -4.96 105.19 108.82 2b1x n GLY 92 Ca 0.08 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.56 2b1x n GLY 92 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2b1x s MET 93 N -0.41 3.39 0.17 1.61 1.75 -1.26 -4.14 119.30 120.41 2b1x s MET 93 Ca 0.00 1.85 -0.32 0.00 -1.25 0.00 0.00 55.69 55.97 2b1x s MET 93 Cb 0.00 -2.20 -0.11 0.00 2.84 0.00 0.00 34.83 35.36 2b1x s MET 93 CO 0.00 -0.88 1.78 1.04 -0.65 0.00 0.00 175.02 176.31 2b1x n GLN 94 N -0.98 2.78 0.00 4.11 6.02 -1.25 0.17 117.38 128.23 2b1x n GLN 94 Ca 0.10 1.01 0.13 0.00 -0.01 0.00 0.00 57.00 58.23 2b1x n GLN 94 Cb 0.48 -2.88 0.34 0.00 1.02 0.00 0.00 30.24 29.20 2b1x n GLN 94 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 2b1x n VAL 95 N 4.32 0.00 -3.58 5.09 0.24 -1.26 -4.64 118.33 118.50 2b1x n VAL 95 Ca 0.17 -0.20 -0.17 0.00 -2.04 0.00 0.00 64.34 62.10 2b1x n VAL 95 Cb 0.36 0.63 -0.14 0.00 -1.47 0.00 0.00 33.84 33.22 2b1x n VAL 95 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b1x n ARG 97 N 5.33 2.33 -2.72 0.00 1.74 -1.26 -4.96 116.66 117.11 2b1x n ARG 97 Ca -0.05 -2.13 -0.26 0.00 -0.77 0.00 0.00 57.85 54.64 2b1x n ARG 97 Cb 0.50 -1.43 0.01 0.00 -1.02 0.00 0.00 32.46 30.52 2b1x n ARG 97 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2b1x s ALA 98 N -1.27 3.48 -0.35 7.54 0.00 -1.26 -5.02 121.76 124.88 2b1x s ALA 98 Ca 0.33 -0.73 0.23 0.00 0.00 0.00 0.00 51.96 51.79 2b1x s ALA 98 Cb 0.19 -2.44 0.15 0.00 0.00 0.00 0.00 23.12 21.02 2b1x s ALA 98 CO 0.26 -0.46 1.23 0.93 0.00 0.00 0.00 175.76 177.73 2b1x h GLU 99 N 0.20 0.00 -1.90 0.00 5.08 -1.94 -3.43 114.58 112.60 2b1x h GLU 99 Ca -0.47 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.12 2b1x h GLU 99 Cb 1.23 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.36 2b1x h GLU 99 CO 0.60 0.00 0.65 0.00 -1.00 0.00 0.00 179.01 179.26 2b1x s MET 100 N -3.29 0.72 0.00 2.33 0.23 -1.26 -1.15 119.30 116.87 2b1x s MET 100 Ca 0.02 -0.36 0.00 0.00 -1.03 0.00 0.00 55.69 54.33 2b1x s MET 100 Cb 0.09 0.27 0.00 0.00 -1.53 0.00 0.00 34.83 33.66 2b1x s MET 100 CO 0.75 -0.32 0.00 0.41 -2.03 0.00 0.00 175.02 173.82 2b1x n GLY 101 N -0.37 -0.95 2.76 3.16 0.00 -0.78 -4.99 105.19 104.01 2b1x n GLY 101 Ca -0.06 -1.11 -0.16 0.00 0.00 0.00 0.00 46.02 44.70 2b1x n GLY 101 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2b1x s ASN 102 N -4.00 0.19 -0.02 1.61 3.84 -1.26 -1.25 114.94 114.05 2b1x s ASN 102 Ca 0.00 0.05 -0.22 0.00 0.21 0.00 0.00 52.86 52.90 2b1x s ASN 102 Cb 0.00 -0.08 0.04 0.00 -0.55 0.00 0.00 41.25 40.67 2b1x s ASN 102 CO 0.00 -0.14 0.48 0.28 -2.79 0.00 0.00 177.10 174.92 2b1x s THR 103 N 1.21 0.03 -0.22 -5.21 -1.32 -0.26 -4.95 115.64 104.92 2b1x s THR 103 Ca -0.07 -0.26 0.19 0.00 -1.21 0.00 0.00 61.69 60.33 2b1x s THR 103 Cb -0.13 -0.81 0.04 0.00 -1.51 0.00 0.00 72.50 70.10 2b1x s THR 103 CO -0.03 -0.15 1.19 0.77 -2.21 0.00 0.00 174.62 174.20 2b1x h SER 104 N 3.42 0.00 -5.05 8.08 4.64 -1.94 -3.40 113.55 119.30 2b1x h SER 104 Ca -0.29 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.90 2b1x h SER 104 Cb 1.16 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.07 2b1x h SER 104 CO 0.40 0.29 -0.53 -1.00 -0.87 0.00 0.00 176.83 175.11 2b1x s HIS 105 N -3.11 0.17 -0.22 4.77 3.76 -1.26 -1.87 115.29 117.52 2b1x s HIS 105 Ca 0.01 -0.42 0.00 0.00 -0.15 0.00 0.00 55.06 54.50 2b1x s HIS 105 Cb 0.08 -0.13 0.03 0.00 1.11 0.00 0.00 32.58 33.67 2b1x s HIS 105 CO 0.76 -0.33 -0.12 -0.06 -0.85 0.00 0.00 174.74 174.15 2b1x s PHE 106 N -2.21 3.00 -0.20 1.40 0.40 0.49 -4.92 117.98 115.94 2b1x s PHE 106 Ca -0.08 -1.70 -0.04 0.00 -0.60 0.00 0.00 56.93 54.50 2b1x s PHE 106 Cb -0.04 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 2b1x s PHE 106 CO -0.03 -0.77 -0.02 0.50 0.70 0.00 0.00 175.22 175.60 2b1x s ARG 107 N 1.28 3.54 -0.06 0.44 6.06 -1.26 -0.57 118.95 128.37 2b1x s ARG 107 Ca 0.00 -0.56 -0.30 0.00 -2.50 0.00 0.00 55.73 52.38 2b1x s ARG 107 Cb -0.16 -3.04 -0.03 0.00 0.06 0.00 0.00 34.95 31.78 2b1x s ARG 107 CO -0.07 -0.04 1.25 0.00 -2.50 0.00 0.00 175.30 173.93 2b1x h PRO 109 N 7.66 0.00 0.27 0.00 0.11 -1.90 -0.50 132.00 137.63 2b1x h PRO 109 Ca -0.34 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.76 2b1x h PRO 109 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2b1x h PRO 109 CO 0.90 0.12 -0.13 -0.92 -0.21 0.00 0.00 178.00 177.76 2b1x h TYR 110 N 0.00 -0.33 -0.02 0.65 -0.00 -1.93 -3.39 116.97 111.95 2b1x h TYR 110 Ca -0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.72 2b1x h TYR 110 Cb 0.36 0.11 0.00 0.00 -0.00 0.00 0.00 36.73 37.20 2b1x h TYR 110 CO 0.00 -0.21 0.00 0.72 -0.00 0.00 0.00 178.16 178.67 2b1x n HIS 111 N -3.42 0.02 -0.76 -3.82 8.25 -1.25 -5.03 115.22 109.20 2b1x n HIS 111 Ca -0.04 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 2b1x n HIS 111 Cb 0.14 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2b1x n HIS 111 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2b1x n GLY 112 N 0.13 0.56 3.74 -1.41 0.00 -0.20 -4.67 105.19 103.34 2b1x n GLY 112 Ca 0.02 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 2b1x n GLY 112 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2b1x n TRP 113 N -2.76 2.70 -4.96 1.61 7.02 -1.26 -4.50 117.44 115.29 2b1x n TRP 113 Ca 0.00 0.39 -0.30 0.00 -1.02 0.00 0.00 57.50 56.58 2b1x n TRP 113 Cb 0.00 -2.53 -0.17 0.00 -2.42 0.00 0.00 31.31 26.20 2b1x n TRP 113 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2b1x s THR 114 N -0.55 1.76 -0.08 -0.99 2.01 0.39 -1.35 115.64 116.83 2b1x s THR 114 Ca 0.60 -0.84 0.04 0.00 0.31 0.00 0.00 61.69 61.80 2b1x s THR 114 Cb -0.52 -1.54 -0.01 0.00 0.01 0.00 0.00 72.50 70.43 2b1x s THR 114 CO 0.56 0.49 -0.19 -0.31 -0.69 0.00 0.00 174.62 174.48 2b1x s TYR 115 N 0.50 2.61 0.77 4.92 1.51 0.26 -0.82 117.35 127.10 2b1x s TYR 115 Ca -0.16 -0.59 -0.14 0.00 -1.01 0.00 0.00 57.07 55.16 2b1x s TYR 115 Cb -0.17 -1.68 0.06 0.00 -0.11 0.00 0.00 41.96 40.06 2b1x s TYR 115 CO 0.06 -0.14 1.17 0.45 -1.11 0.00 0.00 175.55 175.99 2b1x n SER 116 N 2.99 1.08 0.00 2.29 2.88 0.28 -0.38 113.62 122.76 2b1x n SER 116 Ca -0.18 0.64 0.05 0.00 -1.33 0.00 0.00 58.87 58.05 2b1x n SER 116 Cb 0.52 -1.50 0.24 0.00 -0.75 0.00 0.00 64.21 62.73 2b1x n SER 116 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2b1x n ASN 117 N -2.78 0.00 0.27 -3.46 0.23 -0.78 -0.06 115.26 108.68 2b1x n ASN 117 Ca 0.14 0.46 0.12 0.00 -0.53 0.00 0.00 54.58 54.77 2b1x n ASN 117 Cb 0.50 -0.48 0.74 0.00 -2.08 0.00 0.00 39.78 38.46 2b1x n ASN 117 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2b1x h THR 118 N 0.00 0.67 0.00 5.53 2.02 -1.90 -3.43 112.91 115.80 2b1x h THR 118 Ca 0.00 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.79 2b1x h THR 118 Cb 0.18 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2b1x h THR 118 CO 0.00 0.09 0.00 0.61 0.37 0.00 0.00 175.52 176.59 2b1x n GLY 119 N -0.95 2.50 3.72 2.16 0.00 0.92 -5.02 105.19 108.53 2b1x n GLY 119 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2b1x n GLY 119 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b1x s SER 120 N -1.42 6.84 -0.21 1.61 0.01 -1.25 -1.19 113.70 118.10 2b1x s SER 120 Ca 0.00 2.34 -0.29 0.00 1.31 0.00 0.00 55.95 59.31 2b1x s SER 120 Cb 0.00 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.61 2b1x s SER 120 CO 0.00 -0.62 1.67 -0.22 0.41 0.00 0.00 173.24 174.48 2b1x s LEU 121 N 0.80 3.89 -0.00 2.44 2.96 -1.26 -0.56 118.68 126.95 2b1x s LEU 121 Ca 0.63 1.69 0.02 0.00 -0.22 0.00 0.00 54.13 56.25 2b1x s LEU 121 Cb -0.37 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 42.76 2b1x s LEU 121 CO 0.32 -1.30 0.07 1.33 -1.32 0.00 0.00 176.35 175.45 2b1x n VAL 122 N 6.46 0.00 -3.72 1.68 0.24 -0.00 -4.70 118.33 118.28 2b1x n VAL 122 Ca 0.20 -0.24 -0.14 0.00 -2.04 0.00 0.00 64.34 62.12 2b1x n VAL 122 Cb 0.45 0.71 -0.14 0.00 -1.47 0.00 0.00 33.84 33.39 2b1x n VAL 122 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2b1x s GLY 123 N -1.76 -0.07 -0.18 7.63 0.00 -0.86 -5.00 107.32 107.09 2b1x s GLY 123 Ca -0.00 0.81 0.01 0.00 0.00 0.00 0.00 44.72 45.54 2b1x s GLY 123 CO 0.09 1.34 -0.13 0.14 0.00 0.00 0.00 173.10 174.54 2b1x s VAL 124 N 1.56 1.64 0.30 1.40 1.01 -1.26 -0.46 120.40 124.60 2b1x s VAL 124 Ca -0.06 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 2b1x s VAL 124 Cb -0.11 -1.62 -0.11 0.00 0.00 0.00 0.00 36.38 34.53 2b1x s VAL 124 CO -0.07 0.32 1.58 -2.84 0.00 0.00 0.00 175.10 174.09 2b1x s PRO 125 N 1.43 4.13 -1.31 2.72 0.02 -1.26 -2.46 135.00 138.26 2b1x s PRO 125 Ca 0.02 2.56 -0.00 0.00 0.02 0.00 0.00 61.00 63.60 2b1x s PRO 125 Cb -0.14 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.35 2b1x s PRO 125 CO -0.10 -0.61 0.01 0.00 -0.33 0.00 0.00 177.00 175.97 2b1x n ALA 126 N 2.03 -0.46 -0.14 -1.55 0.00 -1.26 -4.88 120.51 114.25 2b1x n ALA 126 Ca 0.07 0.13 0.19 0.00 0.00 0.00 0.00 53.44 53.83 2b1x n ALA 126 Cb 0.38 -1.78 0.58 0.00 0.00 0.00 0.00 19.45 18.63 2b1x n ALA 126 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2b1x h GLY 127 N -0.02 0.47 0.00 0.00 0.00 -1.89 0.23 103.07 101.85 2b1x h GLY 127 Ca -0.37 -0.11 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 2b1x h GLY 127 CO 0.43 0.02 -0.55 0.07 0.00 0.00 0.00 176.54 176.52 2b1x h LYS 128 N 0.25 0.00 -0.67 4.80 5.09 -1.89 0.67 116.57 124.81 2b1x h LYS 128 Ca 0.37 0.00 -0.06 0.00 0.09 0.00 0.00 60.65 61.06 2b1x h LYS 128 Cb 1.08 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 33.38 2b1x h LYS 128 CO -0.09 0.21 0.20 -0.44 -2.09 0.00 0.00 179.45 177.24 2b1x h ASP 129 N -1.00 0.97 0.04 7.07 3.45 -1.89 -0.73 116.42 124.33 2b1x h ASP 129 Ca -0.06 -0.18 -0.38 0.00 0.43 0.00 0.00 57.03 56.84 2b1x h ASP 129 Cb 0.59 -0.25 -0.05 0.00 -0.56 0.00 0.00 39.33 39.05 2b1x h ASP 129 CO -0.04 0.91 -2.29 0.00 -1.57 0.00 0.00 179.24 176.26 2b1x n ALA 130 N -2.45 1.22 0.99 3.45 0.00 0.79 -4.62 120.51 119.89 2b1x n ALA 130 Ca 0.05 -0.92 0.10 0.00 0.00 0.00 0.00 53.44 52.67 2b1x n ALA 130 Cb 0.23 -0.28 -0.06 0.00 0.00 0.00 0.00 19.45 19.34 2b1x n ALA 130 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2b1x n TYR 131 N -3.45 0.00 -2.78 0.00 4.02 -1.03 -4.97 117.16 108.95 2b1x n TYR 131 Ca -0.42 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.28 2b1x n TYR 131 Cb 0.99 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 40.31 2b1x n TYR 131 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b1x n GLY 132 N 1.45 -0.50 2.34 2.72 0.00 -0.28 -1.15 105.19 109.77 2b1x n GLY 132 Ca 0.07 0.05 -0.16 0.00 0.00 0.00 0.00 46.02 45.98 2b1x n GLY 132 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2b1x n ASN 133 N -2.15 -4.58 -0.10 1.61 5.03 0.20 -4.86 115.26 110.40 2b1x n ASN 133 Ca -0.13 0.26 0.11 0.00 0.87 0.00 0.00 54.58 55.68 2b1x n ASN 133 Cb 0.62 -4.00 0.05 0.00 -1.02 0.00 0.00 39.78 35.43 2b1x n ASN 133 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2b1x n GLN 134 N -2.48 0.28 -2.65 3.52 1.13 -0.30 -4.88 117.38 112.00 2b1x n GLN 134 Ca -0.18 -0.21 -0.43 0.00 -1.94 0.00 0.00 57.00 54.24 2b1x n GLN 134 Cb 0.59 -1.50 -0.02 0.00 0.11 0.00 0.00 30.24 29.43 2b1x n GLN 134 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2b1x s LEU 135 N -2.87 4.03 -0.70 1.08 2.96 -1.26 -4.98 118.68 116.94 2b1x s LEU 135 Ca 0.12 1.25 -0.26 0.00 -0.22 0.00 0.00 54.13 55.02 2b1x s LEU 135 Cb 0.17 -3.54 0.04 0.00 0.50 0.00 0.00 46.19 43.36 2b1x s LEU 135 CO 0.74 -0.76 1.17 -0.75 -1.32 0.00 0.00 176.35 175.43 2b1x s LYS 136 N 3.39 3.19 0.26 1.98 2.20 -1.26 -4.91 119.74 124.59 2b1x s LYS 136 Ca 0.45 -0.39 -0.01 0.00 -0.36 0.00 0.00 55.97 55.65 2b1x s LYS 136 Cb -0.14 -4.18 0.48 0.00 -1.51 0.00 0.00 37.83 32.48 2b1x s LYS 136 CO 0.10 -2.01 1.82 0.87 -0.36 0.00 0.00 175.35 175.77 2b1x h LYS 137 N 9.85 0.87 0.00 4.03 1.57 -1.94 -1.55 116.57 129.40 2b1x h LYS 137 Ca -0.28 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2b1x h LYS 137 Cb 1.06 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2b1x h LYS 137 CO 1.24 0.58 0.00 0.66 -0.57 0.00 0.00 179.45 181.36 2b1x h SER 138 N 0.90 0.00 1.12 0.86 4.64 -1.91 0.40 113.55 119.57 2b1x h SER 138 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 2b1x h SER 138 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2b1x h SER 138 CO -0.26 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.17 2b1x n ASP 139 N -2.36 0.34 -2.27 4.97 10.43 -0.58 -4.17 116.55 122.91 2b1x n ASP 139 Ca 0.01 0.54 -0.17 0.00 2.57 0.00 0.00 54.79 57.74 2b1x n ASP 139 Cb 0.19 -0.63 0.03 0.00 1.84 0.00 0.00 41.12 42.55 2b1x n ASP 139 CO 0.00 0.00 0.00 0.79 -1.07 0.00 0.00 177.20 176.92 2b1x n TRP 140 N -1.82 2.32 -1.25 1.24 7.02 0.13 -5.06 117.44 120.02 2b1x n TRP 140 Ca 0.06 -2.21 -0.31 0.00 -1.02 0.00 0.00 57.50 54.02 2b1x n TRP 140 Cb 0.35 -0.31 0.10 0.00 -2.42 0.00 0.00 31.31 29.04 2b1x n TRP 140 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2b1x s ASN 141 N -3.66 4.26 0.38 -0.99 0.01 -1.22 -4.54 114.94 109.19 2b1x s ASN 141 Ca 0.44 1.73 -0.27 0.00 -0.71 0.00 0.00 52.86 54.04 2b1x s ASN 141 Cb 0.38 -2.43 -0.11 0.00 0.41 0.00 0.00 41.25 39.51 2b1x s ASN 141 CO 0.01 -2.18 1.44 0.18 -1.51 0.00 0.00 177.10 175.04 2b1x n LEU 142 N -3.61 4.59 -4.68 0.60 4.77 -0.33 -4.89 117.00 113.45 2b1x n LEU 142 Ca 0.08 1.20 -0.42 0.00 -0.03 0.00 0.00 56.01 56.85 2b1x n LEU 142 Cb 0.54 -1.59 -0.03 0.00 -2.33 0.00 0.00 43.42 40.01 2b1x n LEU 142 CO 0.54 -0.03 1.19 -0.13 -1.33 0.00 0.00 177.39 177.63 2b1x s ARG 143 N -2.12 4.25 0.50 3.23 0.52 -1.26 -4.86 118.95 119.20 2b1x s ARG 143 Ca 0.55 2.00 -0.21 0.00 -0.52 0.00 0.00 55.73 57.55 2b1x s ARG 143 Cb -0.49 -3.70 -0.07 0.00 0.52 0.00 0.00 34.95 31.21 2b1x s ARG 143 CO 0.62 -0.67 1.12 -2.14 0.02 0.00 0.00 175.30 174.25 2b1x s PRO 144 N 2.97 3.60 -0.09 3.54 0.02 -1.26 -0.37 135.00 143.41 2b1x s PRO 144 Ca 0.65 1.61 -0.37 0.00 0.02 0.00 0.00 61.00 62.91 2b1x s PRO 144 Cb -0.31 -2.17 -0.14 0.00 0.02 0.00 0.00 34.50 31.90 2b1x s PRO 144 CO 0.26 -0.64 1.70 -0.12 -0.33 0.00 0.00 177.00 177.86 2b1x n MET 145 N -0.92 1.62 -0.34 5.54 0.00 -0.21 -4.78 117.12 118.04 2b1x n MET 145 Ca 0.10 0.59 0.05 0.00 -0.00 0.00 0.00 57.70 58.44 2b1x n MET 145 Cb 0.50 -2.33 0.21 0.00 0.00 0.00 0.00 33.22 31.60 2b1x n MET 145 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 2b1x h PRO 146 N 7.22 0.90 -3.95 2.12 0.11 -1.86 -3.38 132.00 133.15 2b1x h PRO 146 Ca -0.47 -0.05 -0.46 0.00 0.11 0.00 0.00 66.00 65.13 2b1x h PRO 146 Cb 1.30 -0.20 -0.37 0.00 0.11 0.00 0.00 31.00 31.84 2b1x h PRO 146 CO 0.91 0.60 -0.78 -0.80 -0.21 0.00 0.00 178.00 177.72 2b1x s ASN 147 N -5.67 1.61 -0.03 -2.05 0.01 -0.69 -4.70 114.94 103.44 2b1x s ASN 147 Ca -0.12 -0.16 0.02 0.00 -0.71 0.00 0.00 52.86 51.89 2b1x s ASN 147 Cb 0.21 -0.57 0.00 0.00 0.41 0.00 0.00 41.25 41.31 2b1x s ASN 147 CO 0.80 -0.13 -0.09 -0.22 -1.51 0.00 0.00 177.10 175.94 2b1x s LEU 148 N 1.61 1.77 0.24 0.60 2.96 -1.26 -0.72 118.68 123.87 2b1x s LEU 148 Ca 0.01 -0.20 -0.21 0.00 -0.22 0.00 0.00 54.13 53.51 2b1x s LEU 148 Cb -0.13 -0.58 0.03 0.00 0.50 0.00 0.00 46.19 46.01 2b1x s LEU 148 CO -0.04 0.06 0.66 0.00 -1.32 0.00 0.00 176.35 175.71 2b1x s ALA 149 N 0.23 -1.25 -0.01 5.97 0.00 -0.70 -5.04 121.76 120.96 2b1x s ALA 149 Ca -0.04 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 51.87 2b1x s ALA 149 Cb -0.09 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.88 2b1x s ALA 149 CO 0.01 -0.93 -0.18 0.45 0.00 0.00 0.00 175.76 175.11 2b1x s SER 150 N -2.87 2.07 -0.16 0.00 0.15 -1.26 -0.78 113.70 110.85 2b1x s SER 150 Ca 0.09 -0.33 -0.00 0.00 0.70 0.00 0.00 55.95 56.40 2b1x s SER 150 Cb -0.04 -0.23 0.04 0.00 -1.71 0.00 0.00 66.02 64.08 2b1x s SER 150 CO 0.01 0.21 -0.08 -0.47 1.20 0.00 0.00 173.24 174.11 2b1x s TYR 151 N -0.45 1.87 -1.44 3.44 6.14 -0.37 -4.90 117.35 121.65 2b1x s TYR 151 Ca 0.07 -1.16 -0.01 0.00 0.64 0.00 0.00 57.07 56.60 2b1x s TYR 151 Cb -0.07 -1.40 0.00 0.00 0.42 0.00 0.00 41.96 40.91 2b1x s TYR 151 CO -0.00 -0.64 0.31 1.63 0.64 0.00 0.00 175.55 177.48 2b1x n LYS 152 N 4.83 -2.47 0.00 4.97 4.76 -1.26 -1.57 118.16 127.42 2b1x n LYS 152 Ca -0.13 0.30 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 2b1x n LYS 152 Cb 0.48 -4.19 0.00 0.00 -1.84 0.00 0.00 35.03 29.48 2b1x n LYS 152 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2b1x n GLY 153 N -2.16 2.73 3.57 0.72 0.00 -1.26 -4.94 105.19 103.85 2b1x n GLY 153 Ca -0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 2b1x n GLY 153 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b1x s LEU 154 N 0.00 4.16 -0.28 0.99 1.02 -0.61 -0.34 118.68 123.61 2b1x s LEU 154 Ca 0.00 0.22 -0.22 0.00 0.02 0.00 0.00 54.13 54.15 2b1x s LEU 154 Cb 0.00 -3.01 -0.01 0.00 0.02 0.00 0.00 46.19 43.19 2b1x s LEU 154 CO 0.00 -0.79 0.73 -0.63 0.02 0.00 0.00 176.35 175.67 2b1x s ILE 155 N 3.18 4.87 0.18 -0.59 1.01 -0.03 -1.24 121.20 128.58 2b1x s ILE 155 Ca 0.31 1.18 0.09 0.00 0.00 0.00 0.00 60.65 62.23 2b1x s ILE 155 Cb -0.13 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 2b1x s ILE 155 CO 0.19 -0.13 -0.09 -0.36 0.00 0.00 0.00 174.94 174.54 2b1x s PHE 156 N 2.77 2.65 0.08 3.97 0.40 0.04 -0.40 117.98 127.48 2b1x s PHE 156 Ca 0.30 -0.22 0.04 0.00 -0.60 0.00 0.00 56.93 56.45 2b1x s PHE 156 Cb -0.15 -1.30 -0.03 0.00 0.51 0.00 0.00 43.02 42.05 2b1x s PHE 156 CO 0.10 0.51 -0.10 0.20 0.70 0.00 0.00 175.22 176.63 2b1x s GLY 157 N -2.80 0.78 0.01 4.36 0.00 -0.08 -1.73 107.32 107.86 2b1x s GLY 157 Ca 0.25 -1.08 0.03 0.00 0.00 0.00 0.00 44.72 43.92 2b1x s GLY 157 CO 0.15 -1.14 -0.11 -0.45 0.00 0.00 0.00 173.10 171.55 2b1x s SER 158 N -2.18 1.28 0.00 1.64 0.15 0.10 -0.31 113.70 114.39 2b1x s SER 158 Ca 0.01 -0.29 0.28 0.00 0.70 0.00 0.00 55.95 56.65 2b1x s SER 158 Cb -0.05 -0.11 1.31 0.00 -1.71 0.00 0.00 66.02 65.46 2b1x s SER 158 CO 0.00 0.07 1.92 0.18 1.20 0.00 0.00 173.24 176.62 2b1x n LEU 159 N 2.47 0.00 -4.46 3.45 4.32 -1.26 -1.70 117.00 119.82 2b1x n LEU 159 Ca -0.15 0.37 -0.41 0.00 -0.02 0.00 0.00 56.01 55.79 2b1x n LEU 159 Cb 0.56 -0.37 -0.11 0.00 -1.62 0.00 0.00 43.42 41.89 2b1x n LEU 159 CO 0.24 -0.03 -0.13 -0.62 -1.22 0.00 0.00 177.39 175.63 2b1x s ASP 160 N -2.73 5.93 0.61 -1.43 2.15 -1.22 -4.76 116.67 115.21 2b1x s ASP 160 Ca 0.21 -0.70 0.38 0.00 0.43 0.00 0.00 52.55 52.87 2b1x s ASP 160 Cb 0.18 -2.10 1.93 0.00 -0.30 0.00 0.00 42.92 42.63 2b1x s ASP 160 CO 0.45 -0.32 2.21 1.55 -0.17 0.00 0.00 175.17 178.89 2b1x h PRO 161 N 8.50 0.00 -0.48 4.34 0.13 -1.85 -2.74 132.00 139.89 2b1x h PRO 161 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2b1x h PRO 161 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2b1x h PRO 161 CO 0.67 0.02 0.00 0.72 -0.23 0.00 0.00 178.00 179.18 2b1x n HIS 162 N -3.24 1.22 -1.58 1.56 8.25 -1.26 -4.92 115.22 115.26 2b1x n HIS 162 Ca -0.02 -0.68 -0.36 0.00 -0.26 0.00 0.00 57.72 56.40 2b1x n HIS 162 Cb 0.17 -0.25 0.08 0.00 1.12 0.00 0.00 29.99 31.10 2b1x n HIS 162 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2b1x n ALA 163 N 0.52 0.66 -1.49 -1.41 0.00 -1.04 -4.98 120.51 112.77 2b1x n ALA 163 Ca 0.22 -0.07 -0.35 0.00 0.00 0.00 0.00 53.44 53.24 2b1x n ALA 163 Cb 0.84 -2.26 0.08 0.00 0.00 0.00 0.00 19.45 18.12 2b1x n ALA 163 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2b1x s ASP 164 N -1.50 4.32 0.66 0.00 1.01 -1.26 -4.95 116.67 114.95 2b1x s ASP 164 Ca 0.79 2.47 -0.18 0.00 0.71 0.00 0.00 52.55 56.35 2b1x s ASP 164 Cb -0.37 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 40.95 2b1x s ASP 164 CO 0.44 -2.19 1.28 -1.54 0.21 0.00 0.00 175.17 173.37 2b1x n SER 165 N -2.41 1.99 -0.28 0.27 3.41 -1.26 -4.72 113.62 110.61 2b1x n SER 165 Ca 0.14 0.82 0.04 0.00 -0.26 0.00 0.00 58.87 59.61 2b1x n SER 165 Cb 0.49 -1.55 0.12 0.00 -0.26 0.00 0.00 64.21 63.01 2b1x n SER 165 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2b1x h LEU 166 N 0.45 -0.70 -0.88 1.04 6.46 -1.98 -0.26 115.31 119.44 2b1x h LEU 166 Ca -0.51 0.24 -0.02 0.00 -0.12 0.00 0.00 57.88 57.47 2b1x h LEU 166 Cb 1.34 0.49 -0.04 0.00 -0.73 0.00 0.00 40.66 41.71 2b1x h LEU 166 CO 0.53 -0.26 0.46 -0.33 -0.62 0.00 0.00 178.44 178.22 2b1x h GLU 167 N 0.01 1.24 -0.66 1.25 5.08 -1.94 0.84 114.58 120.41 2b1x h GLU 167 Ca 0.40 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.53 2b1x h GLU 167 Cb 0.64 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 2b1x h GLU 167 CO -0.82 0.92 0.12 -0.44 -1.00 0.00 0.00 179.01 177.79 2b1x h ASP 168 N 1.24 1.04 -0.70 1.42 3.32 -1.69 -0.18 116.42 120.87 2b1x h ASP 168 Ca 0.31 -0.26 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 2b1x h ASP 168 Cb 0.06 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 2b1x h ASP 168 CO -0.05 1.03 0.30 0.22 -1.72 0.00 0.00 179.24 179.02 2b1x h TYR 169 N 1.01 1.05 -0.17 4.55 3.20 -0.06 -2.63 116.97 123.91 2b1x h TYR 169 Ca 0.20 -0.07 -0.21 0.00 3.14 0.00 0.00 58.73 61.79 2b1x h TYR 169 Cb 0.42 -0.32 0.01 0.00 1.54 0.00 0.00 36.73 38.39 2b1x h TYR 169 CO 0.03 0.80 -0.71 -0.07 -1.64 0.00 0.00 178.16 176.57 2b1x h LEU 170 N 0.99 0.93 0.00 2.82 3.38 -0.86 -3.45 115.31 119.13 2b1x h LEU 170 Ca 0.24 -0.61 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2b1x h LEU 170 Cb 0.18 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.66 2b1x h LEU 170 CO -0.02 1.39 0.00 0.61 0.09 0.00 0.00 178.44 180.50 2b1x n GLY 171 N 0.65 3.30 0.30 0.83 0.00 -0.08 -1.66 105.19 108.53 2b1x n GLY 171 Ca -0.07 -0.05 0.19 0.00 0.00 0.00 0.00 46.02 46.09 2b1x n GLY 171 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2b1x h ASP 172 N 0.00 0.00 -0.15 1.61 3.32 -1.89 -2.13 116.42 117.19 2b1x h ASP 172 Ca 0.00 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.09 2b1x h ASP 172 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2b1x h ASP 172 CO 0.00 0.00 0.13 0.25 -1.72 0.00 0.00 179.24 177.90 2b1x h LEU 173 N 0.00 0.00 -1.08 1.55 6.46 -1.70 -2.82 115.31 117.73 2b1x h LEU 173 Ca 0.00 0.00 0.17 0.00 -0.12 0.00 0.00 57.88 57.93 2b1x h LEU 173 Cb 0.30 0.00 -0.09 0.00 -0.73 0.00 0.00 40.66 40.14 2b1x h LEU 173 CO 0.00 0.00 0.62 0.11 -0.62 0.00 0.00 178.44 178.55 2b1x h LYS 174 N 0.00 0.77 -1.00 1.25 1.57 -1.53 -0.61 116.57 117.02 2b1x h LYS 174 Ca 0.07 -0.05 0.17 0.00 -1.87 0.00 0.00 60.65 58.98 2b1x h LYS 174 Cb 0.32 -0.17 -0.10 0.00 0.08 0.00 0.00 32.23 32.35 2b1x h LYS 174 CO -0.00 0.51 0.62 0.35 -0.57 0.00 0.00 179.45 180.36 2b1x h PHE 175 N 0.80 1.08 0.14 -1.35 3.04 -1.73 -1.50 116.94 117.42 2b1x h PHE 175 Ca 0.53 0.03 -0.35 0.00 3.98 0.00 0.00 57.97 62.17 2b1x h PHE 175 Cb 0.78 -0.33 -0.01 0.00 2.56 0.00 0.00 35.95 38.96 2b1x h PHE 175 CO -0.00 0.29 -1.84 1.88 -2.02 0.00 0.00 178.31 176.61 2b1x h TYR 176 N 0.82 0.55 -1.00 0.41 -1.99 -1.35 -3.32 116.97 111.09 2b1x h TYR 176 Ca 0.56 -0.40 0.10 0.00 2.00 0.00 0.00 58.73 60.98 2b1x h TYR 176 Cb 0.80 -0.02 -0.08 0.00 2.00 0.00 0.00 36.73 39.43 2b1x h TYR 176 CO -0.00 1.67 0.63 -0.07 -0.00 0.00 0.00 178.16 180.39 2b1x h LEU 177 N 0.08 0.97 -0.89 3.88 3.38 -1.02 -1.87 115.31 119.84 2b1x h LEU 177 Ca -0.37 0.03 0.13 0.00 0.09 0.00 0.00 57.88 57.77 2b1x h LEU 177 Cb 2.06 -0.17 -0.09 0.00 0.09 0.00 0.00 40.66 42.56 2b1x h LEU 177 CO 0.13 0.56 0.50 0.44 0.09 0.00 0.00 178.44 180.16 2b1x h ASP 178 N 1.06 0.66 -0.07 -0.43 3.32 -1.38 0.34 116.42 119.93 2b1x h ASP 178 Ca 0.47 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.59 2b1x h ASP 178 Cb 0.35 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 2b1x h ASP 178 CO -0.23 0.32 0.04 0.40 -1.72 0.00 0.00 179.24 178.05 2b1x h ILE 179 N 0.75 1.02 0.03 0.35 2.04 -1.44 0.53 117.51 120.79 2b1x h ILE 179 Ca 0.47 -0.05 -0.36 0.00 1.00 0.00 0.00 64.86 65.91 2b1x h ILE 179 Cb 0.58 0.92 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 2b1x h ILE 179 CO -0.32 0.02 -2.17 0.52 0.00 0.00 0.00 178.15 176.20 2b1x n VAL 180 N -4.52 1.57 -0.03 1.67 0.31 -0.58 -4.68 118.33 112.07 2b1x n VAL 180 Ca -0.02 -0.70 0.02 0.00 -0.01 0.00 0.00 64.34 63.63 2b1x n VAL 180 Cb 0.09 -1.22 -0.15 0.00 -0.91 0.00 0.00 33.84 31.65 2b1x n VAL 180 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2b1x n LEU 181 N -3.16 0.11 -0.80 7.52 4.77 0.11 -4.63 117.00 120.91 2b1x n LEU 181 Ca -0.33 0.05 0.02 0.00 -0.03 0.00 0.00 56.01 55.71 2b1x n LEU 181 Cb 1.06 0.18 0.21 0.00 -2.33 0.00 0.00 43.42 42.54 2b1x n LEU 181 CO 0.38 0.19 0.48 -0.67 -1.33 0.00 0.00 177.39 176.44 2b1x n ASP 182 N -2.51 1.97 0.13 -1.43 2.03 0.16 -4.53 116.55 112.37 2b1x n ASP 182 Ca -0.15 -3.87 -0.01 0.00 0.52 0.00 0.00 54.79 51.28 2b1x n ASP 182 Cb 0.81 -0.57 0.15 0.00 -0.72 0.00 0.00 41.12 40.79 2b1x n ASP 182 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2b1x h ARG 183 N 1.00 0.00 -6.43 -0.67 3.08 -1.82 -3.43 114.38 106.10 2b1x h ARG 183 Ca 0.08 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.51 2b1x h ARG 183 Cb 1.23 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.10 2b1x h ARG 183 CO 0.14 0.64 -0.81 -1.54 -1.07 0.00 0.00 179.97 177.33 2b1x s SER 184 N -6.79 3.29 0.10 7.04 1.04 -1.26 -1.78 113.70 115.35 2b1x s SER 184 Ca -0.01 -0.88 -0.17 0.00 0.48 0.00 0.00 55.95 55.37 2b1x s SER 184 Cb 0.12 -0.24 -0.05 0.00 0.10 0.00 0.00 66.02 65.95 2b1x s SER 184 CO 0.76 0.08 1.56 0.44 0.98 0.00 0.00 173.24 177.06 2b1x h ASP 185 N 3.13 0.53 1.69 7.02 3.32 -1.92 -3.08 116.42 127.11 2b1x h ASP 185 Ca -0.45 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 56.31 2b1x h ASP 185 Cb 1.21 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.62 2b1x h ASP 185 CO 0.50 0.69 0.00 0.00 -1.72 0.00 0.00 179.24 178.71 2b1x h ALA 186 N 0.86 1.00 0.00 3.45 0.00 -2.00 -3.50 119.26 119.07 2b1x h ALA 186 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2b1x h ALA 186 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2b1x h ALA 186 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 2b1x n GLY 187 N 1.01 -3.20 3.83 0.00 0.00 -1.17 -4.81 105.19 100.85 2b1x n GLY 187 Ca 0.04 -1.79 -0.33 0.00 0.00 0.00 0.00 46.02 43.94 2b1x n GLY 187 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b1x s LEU 188 N 0.00 4.00 -0.05 0.99 1.02 -1.26 -0.55 118.68 122.82 2b1x s LEU 188 Ca 0.00 1.53 0.04 0.00 0.02 0.00 0.00 54.13 55.72 2b1x s LEU 188 Cb 0.00 -4.34 -0.00 0.00 0.02 0.00 0.00 46.19 41.86 2b1x s LEU 188 CO 0.00 -0.29 -0.18 0.00 0.02 0.00 0.00 176.35 175.90 2b1x s GLN 189 N -3.07 1.96 0.16 1.70 -2.07 0.16 -4.73 119.66 113.77 2b1x s GLN 189 Ca 0.59 -0.63 -0.30 0.00 -1.82 0.00 0.00 55.36 53.20 2b1x s GLN 189 Cb -0.10 -1.65 -0.08 0.00 -1.09 0.00 0.00 33.01 30.09 2b1x s GLN 189 CO 0.15 0.21 1.30 0.08 -1.32 0.00 0.00 175.29 175.71 2b1x s VAL 190 N 0.16 3.39 -0.31 3.63 1.01 -1.26 -1.78 120.40 125.23 2b1x s VAL 190 Ca -0.07 1.09 -0.16 0.00 0.00 0.00 0.00 61.98 62.84 2b1x s VAL 190 Cb -0.13 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 2b1x s VAL 190 CO 0.03 0.14 0.41 -0.69 0.00 0.00 0.00 175.10 174.99 2b1x s VAL 191 N 0.42 5.13 0.00 2.92 1.01 -0.45 -4.86 120.40 124.57 2b1x s VAL 191 Ca 0.58 0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.92 2b1x s VAL 191 Cb -0.35 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.22 2b1x s VAL 191 CO 0.35 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.05 2b1x n GLY 192 N 4.79 1.54 3.28 4.51 0.00 -1.26 -4.71 105.19 113.34 2b1x n GLY 192 Ca -0.08 0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.89 2b1x n GLY 192 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b1x s ALA 193 N -1.01 0.16 0.40 4.61 0.00 -1.26 -5.04 121.76 119.62 2b1x s ALA 193 Ca 0.00 -0.98 -0.25 0.00 0.00 0.00 0.00 51.96 50.73 2b1x s ALA 193 Cb 0.00 0.80 -0.08 0.00 0.00 0.00 0.00 23.12 23.84 2b1x s ALA 193 CO 0.00 -0.59 1.12 -1.25 0.00 0.00 0.00 175.76 175.04 2b1x s PRO 194 N -3.97 4.07 0.19 0.00 0.04 -1.26 -4.78 135.00 129.29 2b1x s PRO 194 Ca 0.17 1.70 -0.30 0.00 0.04 0.00 0.00 61.00 62.60 2b1x s PRO 194 Cb 0.04 -2.60 -0.09 0.00 0.04 0.00 0.00 34.50 31.90 2b1x s PRO 194 CO -0.01 -0.27 1.34 -0.65 0.04 0.00 0.00 177.00 177.45 2b1x s GLN 195 N -2.40 4.36 -0.11 4.56 -0.21 -0.70 -4.83 119.66 120.33 2b1x s GLN 195 Ca 0.58 2.08 0.01 0.00 0.02 0.00 0.00 55.36 58.05 2b1x s GLN 195 Cb -0.27 -3.20 0.02 0.00 1.00 0.00 0.00 33.01 30.56 2b1x s GLN 195 CO 0.34 -0.31 -0.12 1.03 -2.12 0.00 0.00 175.29 174.11 2b1x s ARG 196 N 0.11 1.89 0.17 2.91 0.52 -1.26 -0.85 118.95 122.44 2b1x s ARG 196 Ca 0.58 -0.42 -0.13 0.00 -0.52 0.00 0.00 55.73 55.24 2b1x s ARG 196 Cb -0.37 -1.74 0.01 0.00 0.52 0.00 0.00 34.95 33.37 2b1x s ARG 196 CO 0.37 -0.16 0.39 1.67 0.02 0.00 0.00 175.30 177.59 2b1x s TRP 197 N 1.30 0.13 -0.19 -0.53 -2.14 -0.98 -4.99 118.94 111.54 2b1x s TRP 197 Ca -0.01 -0.49 -0.08 0.00 2.66 0.00 0.00 56.10 58.18 2b1x s TRP 197 Cb -0.14 0.15 -0.04 0.00 -3.10 0.00 0.00 33.47 30.35 2b1x s TRP 197 CO -0.05 -0.80 0.07 0.08 -2.66 0.00 0.00 176.95 173.59 2b1x s VAL 198 N -3.91 4.78 -0.10 -0.66 1.01 -1.26 -0.74 120.40 119.51 2b1x s VAL 198 Ca 0.12 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.10 2b1x s VAL 198 Cb 0.01 -3.16 -0.00 0.00 0.00 0.00 0.00 36.38 33.23 2b1x s VAL 198 CO -0.02 0.45 -0.22 -0.63 0.00 0.00 0.00 175.10 174.67 2b1x s ILE 199 N 0.47 2.23 -1.34 2.22 1.01 -0.14 -4.99 121.20 120.66 2b1x s ILE 199 Ca 0.03 -0.97 -0.11 0.00 0.00 0.00 0.00 60.65 59.60 2b1x s ILE 199 Cb -0.13 -1.86 -0.06 0.00 0.01 0.00 0.00 42.46 40.43 2b1x s ILE 199 CO 0.01 0.56 2.49 -0.90 0.00 0.00 0.00 174.94 177.09 2b1x n ASP 200 N 3.44 6.09 -4.10 3.58 5.75 -1.26 -0.69 116.55 129.36 2b1x n ASP 200 Ca -0.19 -2.59 -0.08 0.00 -0.01 0.00 0.00 54.79 51.93 2b1x n ASP 200 Cb 0.53 -1.43 -0.10 0.00 -1.03 0.00 0.00 41.12 39.08 2b1x n ASP 200 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b1x s ALA 201 N 2.99 0.56 0.26 2.12 0.00 -0.99 -4.37 121.76 122.33 2b1x s ALA 201 Ca 0.56 -1.22 -0.30 0.00 0.00 0.00 0.00 51.96 51.01 2b1x s ALA 201 Cb 0.15 0.25 -0.09 0.00 0.00 0.00 0.00 23.12 23.43 2b1x s ALA 201 CO -0.04 -0.35 1.13 1.21 0.00 0.00 0.00 175.76 177.71 2b1x s ASN 202 N -2.91 7.20 0.43 0.00 3.84 -1.26 -2.51 114.94 119.74 2b1x s ASN 202 Ca 0.07 2.28 0.18 0.00 0.21 0.00 0.00 52.86 55.60 2b1x s ASN 202 Cb 0.07 -2.62 1.09 0.00 -0.55 0.00 0.00 41.25 39.24 2b1x s ASN 202 CO -0.09 -0.22 1.88 4.11 -2.79 0.00 0.00 177.10 179.99 2b1x h TRP 203 N 4.14 0.49 0.00 0.43 5.08 -1.86 -2.69 115.95 121.55 2b1x h TRP 203 Ca -0.46 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 59.51 2b1x h TRP 203 Cb 1.21 -0.15 -0.00 0.00 -3.00 0.00 0.00 29.16 27.22 2b1x h TRP 203 CO 0.59 0.15 -0.05 0.87 -1.28 0.00 0.00 178.44 178.72 2b1x h LYS 204 N 0.39 0.00 -0.21 0.12 1.57 -1.92 -2.18 116.57 114.34 2b1x h LYS 204 Ca 0.43 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 59.08 2b1x h LYS 204 Cb 1.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 2b1x h LYS 204 CO -0.15 0.05 -0.44 -0.07 -0.57 0.00 0.00 179.45 178.27 2b1x h LEU 205 N 0.00 0.55 -0.23 2.94 3.38 -1.88 0.20 115.31 120.27 2b1x h LEU 205 Ca -0.00 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.67 2b1x h LEU 205 Cb 0.13 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 2b1x h LEU 205 CO 0.01 0.92 -0.02 1.23 0.09 0.00 0.00 178.44 180.67 2b1x h GLY 206 N 1.09 0.46 0.99 0.83 0.00 -1.58 -2.55 103.07 102.31 2b1x h GLY 206 Ca 0.03 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2b1x h GLY 206 CO 0.08 0.32 0.31 0.00 0.00 0.00 0.00 176.54 177.26 2b1x h ALA 207 N 0.79 0.72 -0.76 3.60 0.00 -1.22 -2.30 119.26 120.09 2b1x h ALA 207 Ca 0.06 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2b1x h ALA 207 Cb 0.44 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 2b1x h ALA 207 CO 0.02 0.23 0.48 0.22 0.00 0.00 0.00 179.25 180.20 2b1x h ASP 208 N 0.76 0.79 -0.07 0.00 1.82 -0.68 -0.40 116.42 118.63 2b1x h ASP 208 Ca 0.20 -0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.83 2b1x h ASP 208 Cb 0.03 -0.17 -0.00 0.00 0.68 0.00 0.00 39.33 39.87 2b1x h ASP 208 CO -0.03 0.55 0.02 -1.13 -1.61 0.00 0.00 179.24 177.03 2b1x h ASN 209 N 0.94 0.11 1.25 2.28 -0.73 -1.17 -3.24 115.58 115.02 2b1x h ASN 209 Ca 0.30 -0.23 -0.13 0.00 1.87 0.00 0.00 56.30 58.11 2b1x h ASN 209 Cb 0.02 -0.03 -0.02 0.00 0.27 0.00 0.00 38.32 38.56 2b1x h ASN 209 CO -0.11 0.31 -0.63 -0.26 -0.37 0.00 0.00 177.43 176.36 2b1x h PHE 210 N -0.10 0.00 -0.05 0.67 -1.00 -1.31 -1.01 116.94 114.14 2b1x h PHE 210 Ca 0.02 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.77 2b1x h PHE 210 Cb 0.24 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.80 2b1x h PHE 210 CO 0.00 0.63 -0.11 -0.24 -1.61 0.00 0.00 178.31 176.99 2b1x h VAL 211 N 0.00 1.11 0.00 -0.55 3.04 -1.09 -2.47 116.25 116.29 2b1x h VAL 211 Ca -0.01 -0.50 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 2b1x h VAL 211 Cb 1.43 1.20 0.00 0.00 -2.01 0.00 0.00 31.29 31.91 2b1x h VAL 211 CO 0.08 0.15 0.00 0.61 -1.01 0.00 0.00 177.57 177.40 2b1x n GLY 212 N -1.12 1.00 3.27 3.17 0.00 -1.24 -3.28 105.19 106.99 2b1x n GLY 212 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 2b1x n GLY 212 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b1x s ASP 213 N 0.00 6.06 -0.11 1.61 -1.08 -0.38 -4.68 116.67 118.08 2b1x s ASP 213 Ca 0.00 -2.00 0.14 0.00 -0.52 0.00 0.00 52.55 50.17 2b1x s ASP 213 Cb 0.00 -2.13 -0.24 0.00 -1.46 0.00 0.00 42.92 39.10 2b1x s ASP 213 CO 0.00 -0.74 0.43 0.00 0.52 0.00 0.00 175.17 175.37 2b1x n ALA 214 N 4.89 1.48 -0.33 3.66 0.00 -1.26 -4.55 120.51 124.40 2b1x n ALA 214 Ca -0.07 -0.97 0.25 0.00 0.00 0.00 0.00 53.44 52.65 2b1x n ALA 214 Cb 0.41 -0.59 0.48 0.00 0.00 0.00 0.00 19.45 19.75 2b1x n ALA 214 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2b1x h TYR 215 N 0.00 0.67 0.00 0.00 3.20 -1.86 -1.07 116.97 117.91 2b1x h TYR 215 Ca -0.39 0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.51 2b1x h TYR 215 Cb 2.10 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 40.24 2b1x h TYR 215 CO 0.00 -0.37 -0.07 1.12 -1.64 0.00 0.00 178.16 177.20 2b1x h HIS 216 N 0.10 0.00 -0.61 -3.82 2.07 -1.99 -3.23 115.15 107.68 2b1x h HIS 216 Ca 0.75 0.00 0.12 0.00 -2.85 0.00 0.00 60.37 58.40 2b1x h HIS 216 Cb 1.83 0.00 -0.11 0.00 2.57 0.00 0.00 27.41 31.70 2b1x h HIS 216 CO -0.11 0.07 -0.11 1.15 -3.07 0.00 0.00 177.93 175.86 2b1x h THR 217 N 0.00 0.42 -0.99 6.12 2.02 -1.50 0.66 112.91 119.64 2b1x h THR 217 Ca -0.00 -0.01 0.01 0.00 0.77 0.00 0.00 66.41 67.18 2b1x h THR 217 Cb 0.28 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 2b1x h THR 217 CO 0.01 0.01 0.66 0.24 0.37 0.00 0.00 175.52 176.80 2b1x h MET 218 N 0.03 1.30 0.00 6.66 2.86 -1.78 -1.18 114.93 122.81 2b1x h MET 218 Ca 0.30 -0.08 -0.22 0.00 -2.06 0.00 0.00 59.70 57.64 2b1x h MET 218 Cb 0.47 -0.29 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 2b1x h MET 218 CO -0.59 0.86 -1.52 -0.12 1.06 0.00 0.00 176.91 176.59 2b1x n MET 219 N -4.39 0.55 -0.34 1.72 0.00 -1.07 -3.48 117.12 110.11 2b1x n MET 219 Ca 0.12 0.39 0.03 0.00 0.00 0.00 0.00 57.70 58.23 2b1x n MET 219 Cb 0.02 -1.59 0.17 0.00 0.00 0.00 0.00 33.22 31.83 2b1x n MET 219 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 2b1x h THR 220 N -1.00 1.02 -0.49 1.12 2.02 -0.96 -2.60 112.91 112.02 2b1x h THR 220 Ca -0.34 -0.35 -0.18 0.00 0.77 0.00 0.00 66.41 66.31 2b1x h THR 220 Cb 1.21 -0.10 -0.11 0.00 -1.74 0.00 0.00 68.15 67.41 2b1x h THR 220 CO -0.21 0.19 0.11 1.41 0.37 0.00 0.00 175.52 177.39 2b1x n HIS 221 N -4.59 1.59 -0.33 3.16 8.25 -0.45 -4.64 115.22 118.21 2b1x n HIS 221 Ca 0.15 -1.34 0.07 0.00 -0.26 0.00 0.00 57.72 56.33 2b1x n HIS 221 Cb 0.22 -0.54 0.23 0.00 1.12 0.00 0.00 29.99 31.02 2b1x n HIS 221 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2b1x h ARG 222 N 1.58 0.81 -0.92 -0.41 9.65 -1.49 -0.20 114.38 123.39 2b1x h ARG 222 Ca 0.22 -0.05 0.10 0.00 -1.10 0.00 0.00 59.98 59.15 2b1x h ARG 222 Cb 1.90 -0.18 -0.08 0.00 -1.39 0.00 0.00 29.97 30.22 2b1x h ARG 222 CO 0.51 0.53 0.57 0.66 2.80 0.00 0.00 179.97 185.04 2b1x h SER 223 N 0.83 0.84 0.53 -3.80 4.64 -1.83 -0.69 113.55 114.07 2b1x h SER 223 Ca 0.48 0.04 -0.20 0.00 -0.47 0.00 0.00 61.79 61.64 2b1x h SER 223 Cb 0.55 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 2b1x h SER 223 CO -0.30 0.48 -0.87 0.24 -0.87 0.00 0.00 176.83 175.52 2b1x h MET 224 N 0.95 0.23 -0.43 4.77 2.86 -1.46 -2.11 114.93 119.73 2b1x h MET 224 Ca 0.44 -0.24 0.04 0.00 -2.06 0.00 0.00 59.70 57.88 2b1x h MET 224 Cb 0.36 0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.05 2b1x h MET 224 CO -0.24 0.96 0.20 0.28 1.06 0.00 0.00 176.91 179.18 2b1x h VAL 225 N 0.13 0.95 0.00 -2.22 2.07 -0.77 0.50 116.25 116.91 2b1x h VAL 225 Ca -0.05 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 2b1x h VAL 225 Cb 1.49 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 2b1x h VAL 225 CO 0.13 0.07 -0.30 -0.33 0.02 0.00 0.00 177.57 177.17 2b1x h GLU 226 N 0.41 0.00 -0.00 1.57 5.08 -0.92 -2.64 114.58 118.08 2b1x h GLU 226 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2b1x h GLU 226 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2b1x h GLU 226 CO -0.15 0.30 -0.16 1.28 -1.00 0.00 0.00 179.01 179.29 2b1x n LEU 227 N -4.17 0.38 0.00 1.33 4.77 -0.81 -4.92 117.00 113.57 2b1x n LEU 227 Ca -0.02 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2b1x n LEU 227 Cb 0.35 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2b1x n LEU 227 CO 0.38 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 2b1x n GLY 228 N 1.37 0.76 0.10 -0.72 0.00 -0.82 -4.73 105.19 101.14 2b1x n GLY 228 Ca 0.11 -0.03 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 2b1x n GLY 228 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2b1x n LEU 229 N 0.00 0.90 -4.93 0.99 4.32 0.10 -4.92 117.00 113.46 2b1x n LEU 229 Ca 0.00 0.15 -0.26 0.00 -0.02 0.00 0.00 56.01 55.89 2b1x n LEU 229 Cb 0.00 0.07 -0.02 0.00 -1.62 0.00 0.00 43.42 41.85 2b1x n LEU 229 CO 0.00 0.54 0.08 0.00 -1.22 0.00 0.00 177.39 176.80 2b1x s ALA 230 N -2.54 3.77 0.12 -1.18 0.00 -0.83 -4.68 121.76 116.43 2b1x s ALA 230 Ca -0.12 -0.86 -0.33 0.00 0.00 0.00 0.00 51.96 50.65 2b1x s ALA 230 Cb 0.07 -2.04 -0.12 0.00 0.00 0.00 0.00 23.12 21.03 2b1x s ALA 230 CO 0.80 0.26 1.74 -2.30 0.00 0.00 0.00 175.76 176.25 2b1x n PRO 231 N -1.10 2.50 0.20 0.00 -0.02 -1.26 -4.48 135.00 130.84 2b1x n PRO 231 Ca -0.05 0.91 0.09 0.00 -2.02 0.00 0.00 63.50 62.43 2b1x n PRO 231 Cb 0.55 -2.74 0.23 0.00 -0.02 0.00 0.00 33.50 31.52 2b1x n PRO 231 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2b1x h PRO 232 N 7.47 0.00 -6.26 0.52 0.13 -1.95 -3.45 132.00 128.47 2b1x h PRO 232 Ca -0.46 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.11 2b1x h PRO 232 Cb 1.24 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.33 2b1x h PRO 232 CO 0.93 0.21 1.00 0.34 -0.23 0.00 0.00 178.00 180.25 2b1x s ASP 233 N -6.24 6.69 0.41 1.44 -1.08 -1.26 -4.89 116.67 111.74 2b1x s ASP 233 Ca 0.04 1.57 0.27 0.00 -0.52 0.00 0.00 52.55 53.92 2b1x s ASP 233 Cb 0.07 -2.54 1.48 0.00 -1.46 0.00 0.00 42.92 40.47 2b1x s ASP 233 CO 0.68 -1.00 1.83 -0.65 0.52 0.00 0.00 175.17 176.54 2b1x h PRO 234 N 9.29 0.00 -0.67 4.34 0.11 -2.03 -0.73 132.00 142.31 2b1x h PRO 234 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2b1x h PRO 234 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2b1x h PRO 234 CO 1.00 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.83 2b1x n GLN 235 N -2.46 2.70 -0.27 1.05 6.02 -1.26 -4.71 117.38 118.46 2b1x n GLN 235 Ca -0.02 -2.58 0.21 0.00 -0.01 0.00 0.00 57.00 54.60 2b1x n GLN 235 Cb 0.05 -1.55 0.54 0.00 1.02 0.00 0.00 30.24 30.30 2b1x n GLN 235 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2b1x h PHE 236 N 4.21 0.51 -0.00 1.08 -5.15 -1.51 -0.87 116.94 115.21 2b1x h PHE 236 Ca 0.00 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 2b1x h PHE 236 Cb 0.98 -0.15 0.00 0.00 0.22 0.00 0.00 35.95 36.99 2b1x h PHE 236 CO 0.44 0.10 -0.10 0.00 -2.00 0.00 0.00 178.31 176.76 2b1x n ALA 237 N -2.53 2.66 0.26 12.09 0.00 -1.26 -2.81 120.51 128.92 2b1x n ALA 237 Ca 0.21 -0.20 0.13 0.00 0.00 0.00 0.00 53.44 53.59 2b1x n ALA 237 Cb 0.79 -1.39 0.72 0.00 0.00 0.00 0.00 19.45 19.57 2b1x n ALA 237 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2b1x h LEU 238 N 0.18 0.00 -5.41 0.00 3.38 -1.52 0.74 115.31 112.68 2b1x h LEU 238 Ca 0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 2b1x h LEU 238 Cb 0.40 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 40.95 2b1x h LEU 238 CO 0.00 0.12 1.32 -1.22 0.09 0.00 0.00 178.44 178.75 2b1x n TYR 239 N -3.55 2.46 -3.74 1.13 4.02 -1.12 -4.55 117.16 111.81 2b1x n TYR 239 Ca -0.01 -2.45 -0.09 0.00 -0.01 0.00 0.00 57.90 55.34 2b1x n TYR 239 Cb 0.26 -1.44 0.01 0.00 -0.02 0.00 0.00 39.34 38.14 2b1x n TYR 239 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b1x n GLY 240 N 0.65 1.44 3.05 2.72 0.00 -1.21 -0.69 105.19 111.16 2b1x n GLY 240 Ca 0.54 -1.31 -0.20 0.00 0.00 0.00 0.00 46.02 45.05 2b1x n GLY 240 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2b1x s GLU 241 N -2.23 0.90 -0.26 1.61 2.56 0.11 -2.05 118.70 119.33 2b1x s GLU 241 Ca 0.16 -0.38 -0.02 0.00 0.00 0.00 0.00 54.97 54.73 2b1x s GLU 241 Cb -0.03 -0.86 0.03 0.00 2.00 0.00 0.00 34.13 35.26 2b1x s GLU 241 CO 0.12 0.22 -0.04 -1.58 -0.56 0.00 0.00 175.26 173.42 2b1x s HIS 242 N -0.20 3.10 -0.04 5.30 5.65 -0.61 -1.08 115.29 127.41 2b1x s HIS 242 Ca 0.03 -1.54 0.03 0.00 0.25 0.00 0.00 55.06 53.83 2b1x s HIS 242 Cb -0.05 -2.09 0.00 0.00 -1.18 0.00 0.00 32.58 29.27 2b1x s HIS 242 CO -0.00 -0.72 -0.13 0.42 -0.65 0.00 0.00 174.74 173.65 2b1x s ILE 243 N 1.33 1.12 0.20 0.89 1.01 -0.02 -0.81 121.20 124.92 2b1x s ILE 243 Ca -0.00 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.13 2b1x s ILE 243 Cb -0.17 -0.99 -0.05 0.00 0.01 0.00 0.00 42.46 41.26 2b1x s ILE 243 CO -0.03 0.34 0.05 -1.38 0.00 0.00 0.00 174.94 173.91 2b1x s HIS 244 N 0.27 1.30 0.32 3.97 -3.43 -0.22 -0.92 115.29 116.57 2b1x s HIS 244 Ca -0.07 -1.11 0.04 0.00 -0.80 0.00 0.00 55.06 53.12 2b1x s HIS 244 Cb -0.12 -0.74 -0.04 0.00 -1.43 0.00 0.00 32.58 30.25 2b1x s HIS 244 CO 0.02 -0.30 0.16 0.99 -2.00 0.00 0.00 174.74 173.62 2b1x s THR 245 N -3.74 0.35 1.17 -5.38 2.01 -0.43 0.19 115.64 109.81 2b1x s THR 245 Ca 0.30 -2.00 -0.18 0.00 0.31 0.00 0.00 61.69 60.12 2b1x s THR 245 Cb 0.07 -2.50 0.27 0.00 0.01 0.00 0.00 72.50 70.35 2b1x s THR 245 CO 0.08 0.00 1.10 -0.83 -0.69 0.00 0.00 174.62 174.27 2b1x s GLY 246 N -3.40 1.57 -1.51 4.40 0.00 -1.26 -4.05 107.32 103.06 2b1x s GLY 246 Ca 0.35 -0.81 -0.02 0.00 0.00 0.00 0.00 44.72 44.24 2b1x s GLY 246 CO 0.18 0.03 0.17 1.42 0.00 0.00 0.00 173.10 174.89 2b1x n HIS 247 N -4.69 -1.38 -0.91 1.90 8.25 -1.26 -3.19 115.22 113.94 2b1x n HIS 247 Ca 0.11 0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 2b1x n HIS 247 Cb 0.59 -3.68 0.00 0.00 1.12 0.00 0.00 29.99 28.02 2b1x n HIS 247 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2b1x n GLY 248 N -1.08 0.75 3.81 -1.41 0.00 -1.26 -4.50 105.19 101.50 2b1x n GLY 248 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.49 2b1x n GLY 248 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2b1x s HIS 249 N -3.22 3.60 0.21 1.61 4.02 -1.19 -4.01 115.29 116.31 2b1x s HIS 249 Ca 0.00 1.52 -0.23 0.00 1.02 0.00 0.00 55.06 57.37 2b1x s HIS 249 Cb 0.00 -2.73 0.05 0.00 -1.02 0.00 0.00 32.58 28.88 2b1x s HIS 249 CO 0.00 0.23 0.77 0.20 1.02 0.00 0.00 174.74 176.96 2b1x s GLY 250 N -1.75 -0.25 0.21 -2.22 0.00 -1.14 -1.32 107.32 100.86 2b1x s GLY 250 Ca 0.48 0.04 -0.19 0.00 0.00 0.00 0.00 44.72 45.05 2b1x s GLY 250 CO 0.21 0.01 0.58 0.48 0.00 0.00 0.00 173.10 174.38 2b1x s LEU 251 N -2.86 -0.09 0.07 0.66 2.34 -0.10 -1.29 118.68 117.41 2b1x s LEU 251 Ca 0.09 -0.46 0.06 0.00 0.06 0.00 0.00 54.13 53.87 2b1x s LEU 251 Cb -0.04 2.34 -0.03 0.00 -0.56 0.00 0.00 46.19 47.90 2b1x s LEU 251 CO 0.01 -1.12 -0.15 -0.83 -1.06 0.00 0.00 176.35 173.20 2b1x s GLY 252 N -2.87 0.91 -0.10 -3.48 0.00 0.80 -0.84 107.32 101.73 2b1x s GLY 252 Ca 0.09 -1.00 0.01 0.00 0.00 0.00 0.00 44.72 43.82 2b1x s GLY 252 CO -0.01 -1.01 -0.11 -0.42 0.00 0.00 0.00 173.10 171.54 2b1x s ILE 253 N -1.16 1.22 -0.05 0.90 1.01 -0.24 -1.85 121.20 121.03 2b1x s ILE 253 Ca 0.00 -0.46 0.06 0.00 0.00 0.00 0.00 60.65 60.24 2b1x s ILE 253 Cb -0.10 -1.16 -0.01 0.00 0.01 0.00 0.00 42.46 41.21 2b1x s ILE 253 CO 0.02 0.39 -0.23 -0.63 0.00 0.00 0.00 174.94 174.50 2b1x s ILE 254 N 1.21 1.86 0.51 2.92 1.01 0.26 0.04 121.20 129.00 2b1x s ILE 254 Ca -0.04 -0.96 0.01 0.00 0.00 0.00 0.00 60.65 59.67 2b1x s ILE 254 Cb -0.14 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.74 2b1x s ILE 254 CO -0.03 0.52 0.02 -0.83 0.00 0.00 0.00 174.94 174.61 2b1x s GLY 255 N -0.10 3.02 0.66 6.18 0.00 0.14 -0.39 107.32 116.82 2b1x s GLY 255 Ca -0.04 -0.36 -0.12 0.00 0.00 0.00 0.00 44.72 44.19 2b1x s GLY 255 CO 0.03 -2.19 1.06 2.56 0.00 0.00 0.00 173.10 174.56 2b1x s PRO 256 N -3.90 3.07 0.85 2.90 0.04 -1.26 -4.75 135.00 131.95 2b1x s PRO 256 Ca 0.06 1.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.03 2b1x s PRO 256 Cb 0.01 -2.00 0.10 0.00 0.04 0.00 0.00 34.50 32.65 2b1x s PRO 256 CO 0.03 -1.00 1.10 -1.25 0.04 0.00 0.00 177.00 175.92 2b1x s PRO 257 N -4.73 1.65 0.34 0.56 0.04 -1.26 -4.93 135.00 126.67 2b1x s PRO 257 Ca 0.60 1.14 0.12 0.00 0.04 0.00 0.00 61.00 62.90 2b1x s PRO 257 Cb -0.15 -1.83 0.94 0.00 0.04 0.00 0.00 34.50 33.50 2b1x s PRO 257 CO 0.49 -2.06 1.75 -1.35 0.04 0.00 0.00 177.00 175.87 2b1x h PRO 258 N -1.43 0.53 -1.20 0.56 0.11 -2.02 -2.03 132.00 126.52 2b1x h PRO 258 Ca -0.46 -0.03 -0.29 0.00 0.11 0.00 0.00 66.00 65.34 2b1x h PRO 258 Cb 1.25 -0.12 -0.15 0.00 0.11 0.00 0.00 31.00 32.10 2b1x h PRO 258 CO 0.50 0.35 0.37 0.41 -0.21 0.00 0.00 178.00 179.42 2b1x n GLY 259 N -1.37 3.59 2.75 -0.55 0.00 -1.26 -4.66 105.19 103.69 2b1x n GLY 259 Ca 0.26 -0.77 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 2b1x n GLY 259 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2b1x s MET 260 N -1.72 0.29 -0.11 1.61 0.00 -0.77 -5.13 119.30 113.47 2b1x s MET 260 Ca 0.30 -0.06 -0.27 0.00 0.00 0.00 0.00 55.69 55.66 2b1x s MET 260 Cb 0.24 -0.79 -0.02 0.00 0.00 0.00 0.00 34.83 34.26 2b1x s MET 260 CO 0.03 -0.93 0.91 -1.25 0.00 0.00 0.00 175.02 173.78 2b1x s PRO 261 N 2.35 4.40 0.07 4.11 0.05 -1.26 -4.61 135.00 140.10 2b1x s PRO 261 Ca 0.09 1.21 0.07 0.00 0.05 0.00 0.00 61.00 62.43 2b1x s PRO 261 Cb -0.14 -3.53 -0.03 0.00 0.05 0.00 0.00 34.50 30.84 2b1x s PRO 261 CO -0.28 -0.25 -0.20 -0.51 0.05 0.00 0.00 177.00 175.81 2b1x s LEU 262 N 1.82 2.23 0.17 -3.56 1.43 -1.26 -5.11 118.68 114.41 2b1x s LEU 262 Ca 0.44 -0.59 -0.32 0.00 -1.03 0.00 0.00 54.13 52.63 2b1x s LEU 262 Cb -0.18 -0.89 -0.16 0.00 0.03 0.00 0.00 46.19 44.98 2b1x s LEU 262 CO 0.17 0.10 0.98 -2.65 0.23 0.00 0.00 176.35 175.18 2b1x n PRO 263 N 1.49 0.75 -1.49 1.29 -0.02 -1.26 -4.92 135.00 130.84 2b1x n PRO 263 Ca -0.18 0.27 -0.34 0.00 -2.02 0.00 0.00 63.50 61.22 2b1x n PRO 263 Cb 0.54 -1.63 0.08 0.00 -0.02 0.00 0.00 33.50 32.46 2b1x n PRO 263 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2b1x s GLU 264 N -0.61 2.27 -1.38 -0.52 2.02 -1.26 -3.27 118.70 115.95 2b1x s GLU 264 Ca 0.72 1.67 -0.09 0.00 0.02 0.00 0.00 54.97 57.29 2b1x s GLU 264 Cb -0.91 -1.86 0.02 0.00 0.10 0.00 0.00 34.13 31.48 2b1x s GLU 264 CO 0.55 -1.72 1.13 1.19 0.02 0.00 0.00 175.26 176.43 2b1x n PHE 265 N -2.68 -2.73 -1.59 1.61 3.01 0.16 -1.61 117.46 113.64 2b1x n PHE 265 Ca 0.13 0.99 -0.20 0.00 1.01 0.00 0.00 57.45 59.38 2b1x n PHE 265 Cb 0.51 -4.85 -0.08 0.00 -0.01 0.00 0.00 39.48 35.04 2b1x n PHE 265 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 2b1x n MET 266 N -4.89 -1.38 -2.17 -1.08 2.81 -1.23 -1.03 117.12 108.14 2b1x n MET 266 Ca -0.01 1.20 -0.18 0.00 -1.81 0.00 0.00 57.70 56.89 2b1x n MET 266 Cb 0.56 -5.54 -0.02 0.00 -0.71 0.00 0.00 33.22 27.51 2b1x n MET 266 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2b1x n GLY 267 N -0.54 0.08 3.68 3.03 0.00 -0.64 -4.30 105.19 106.50 2b1x n GLY 267 Ca -0.20 -0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 2b1x n GLY 267 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2b1x n LEU 268 N -2.52 4.72 -4.69 0.99 4.77 -0.20 -4.94 117.00 115.14 2b1x n LEU 268 Ca -0.21 0.70 -0.35 0.00 -0.03 0.00 0.00 56.01 56.11 2b1x n LEU 268 Cb 0.65 -1.49 0.10 0.00 -2.33 0.00 0.00 43.42 40.35 2b1x n LEU 268 CO 0.26 -1.55 0.76 -2.65 -1.33 0.00 0.00 177.39 172.88 2b1x n PRO 269 N -2.35 0.59 -0.31 3.23 -0.02 -1.26 -4.71 135.00 130.16 2b1x n PRO 269 Ca 0.14 0.27 0.03 0.00 -2.02 0.00 0.00 63.50 61.92 2b1x n PRO 269 Cb 0.49 -2.42 0.22 0.00 -0.02 0.00 0.00 33.50 31.77 2b1x n PRO 269 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2b1x h GLU 270 N -0.24 1.05 -0.19 -0.52 3.07 -1.99 -1.33 114.58 114.43 2b1x h GLU 270 Ca -0.48 -0.06 -0.10 0.00 -0.50 0.00 0.00 59.36 58.21 2b1x h GLU 270 Cb 1.32 -0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.98 2b1x h GLU 270 CO 0.49 0.70 -0.33 -2.95 -1.40 0.00 0.00 179.01 175.51 2b1x h ASN 271 N 1.09 0.41 -0.23 1.42 -1.07 -1.95 -1.42 115.58 113.83 2b1x h ASN 271 Ca 0.39 -0.15 -0.18 0.00 0.07 0.00 0.00 56.30 56.42 2b1x h ASN 271 Cb 0.13 -0.11 -0.00 0.00 -2.07 0.00 0.00 38.32 36.27 2b1x h ASN 271 CO -0.14 0.72 -0.55 0.40 0.07 0.00 0.00 177.43 177.93 2b1x h ILE 272 N 0.34 1.28 -0.56 6.14 1.08 -1.64 -2.53 117.51 121.63 2b1x h ILE 272 Ca 0.04 -1.75 -0.03 0.00 -0.39 0.00 0.00 64.86 62.73 2b1x h ILE 272 Cb 0.75 1.66 -0.02 0.00 -3.07 0.00 0.00 36.82 36.13 2b1x h ILE 272 CO 0.06 0.57 0.22 0.58 -0.69 0.00 0.00 178.15 178.89 2b1x h VAL 273 N 0.63 1.22 -0.41 1.67 2.07 -1.11 0.35 116.25 120.67 2b1x h VAL 273 Ca 0.01 -0.70 0.09 0.00 0.82 0.00 0.00 66.70 66.92 2b1x h VAL 273 Cb 1.15 0.63 -0.09 0.00 -1.52 0.00 0.00 31.29 31.47 2b1x h VAL 273 CO 0.12 0.27 -0.19 -0.33 0.02 0.00 0.00 177.57 177.46 2b1x h GLU 274 N 0.77 -0.11 -0.27 1.57 5.08 -1.22 -2.06 114.58 118.34 2b1x h GLU 274 Ca 0.19 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.47 2b1x h GLU 274 Cb 0.20 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2b1x h GLU 274 CO -0.01 -0.07 -0.15 0.93 -1.00 0.00 0.00 179.01 178.70 2b1x h GLU 275 N -0.11 0.58 -0.48 2.33 5.08 -1.00 -3.17 114.58 117.81 2b1x h GLU 275 Ca 0.20 -0.26 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 2b1x h GLU 275 Cb 0.42 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2b1x h GLU 275 CO -0.49 0.83 0.05 1.37 -1.00 0.00 0.00 179.01 179.78 2b1x h LEU 276 N 0.32 0.73 -2.78 1.33 8.10 -0.11 0.27 115.31 123.16 2b1x h LEU 276 Ca 0.06 -0.15 -0.00 0.00 0.11 0.00 0.00 57.88 57.90 2b1x h LEU 276 Cb 0.67 -0.19 -0.00 0.00 -0.44 0.00 0.00 40.66 40.70 2b1x h LEU 276 CO 0.04 0.77 -0.00 -0.33 -4.11 0.00 0.00 178.44 174.81 2b1x h GLU 277 N 0.73 0.00 0.00 0.17 5.08 -1.35 -1.35 114.58 117.86 2b1x h GLU 277 Ca 0.15 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.27 2b1x h GLU 277 Cb 0.38 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 2b1x h GLU 277 CO 0.01 0.00 -2.10 -2.13 -1.00 0.00 0.00 179.01 173.79 2b1x n ARG 278 N -3.29 1.02 0.03 2.33 0.63 -0.25 -4.59 116.66 112.54 2b1x n ARG 278 Ca -0.03 -0.05 -0.14 0.00 -0.92 0.00 0.00 57.85 56.72 2b1x n ARG 278 Cb 0.09 -1.44 -0.14 0.00 0.45 0.00 0.00 32.46 31.41 2b1x n ARG 278 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2b1x h ARG 279 N 0.00 0.15 -6.19 -0.14 3.08 -0.26 -3.47 114.38 107.54 2b1x h ARG 279 Ca -0.35 -0.25 -0.49 0.00 0.07 0.00 0.00 59.98 58.96 2b1x h ARG 279 Cb 1.76 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.89 2b1x h ARG 279 CO 0.02 0.93 -0.41 -0.51 -1.07 0.00 0.00 179.97 178.94 2b1x s LEU 280 N -6.70 4.29 0.60 3.04 1.43 -0.53 -5.06 118.68 115.74 2b1x s LEU 280 Ca -0.08 0.16 -0.16 0.00 -1.03 0.00 0.00 54.13 53.01 2b1x s LEU 280 Cb 0.08 -2.94 -0.03 0.00 0.03 0.00 0.00 46.19 43.32 2b1x s LEU 280 CO 0.83 -0.06 1.08 0.42 0.23 0.00 0.00 176.35 178.85 2b1x s THR 281 N -1.95 3.55 0.38 5.49 -4.23 -1.26 -4.79 115.64 112.83 2b1x s THR 281 Ca 0.35 0.78 0.16 0.00 -1.18 0.00 0.00 61.69 61.80 2b1x s THR 281 Cb -0.10 -3.29 0.37 0.00 1.34 0.00 0.00 72.50 70.82 2b1x s THR 281 CO 0.30 -0.39 1.79 -0.65 -0.54 0.00 0.00 174.62 175.13 2b1x h PRO 282 N 0.52 0.45 -0.49 3.99 0.11 -1.97 0.97 132.00 135.59 2b1x h PRO 282 Ca -0.47 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2b1x h PRO 282 Cb 1.23 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2b1x h PRO 282 CO 0.56 0.30 0.12 0.93 -0.21 0.00 0.00 178.00 179.71 2b1x h GLU 283 N 0.47 0.78 -0.38 1.05 3.07 -1.96 -1.35 114.58 116.26 2b1x h GLU 283 Ca 0.57 -0.19 -0.04 0.00 -0.50 0.00 0.00 59.36 59.20 2b1x h GLU 283 Cb 1.32 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 29.11 2b1x h GLU 283 CO -0.29 0.76 0.08 1.96 -1.40 0.00 0.00 179.01 180.12 2b1x h GLN 284 N 0.67 0.62 -0.35 2.33 4.20 -1.39 -2.42 115.11 118.77 2b1x h GLN 284 Ca 0.15 -0.16 0.04 0.00 0.06 0.00 0.00 58.65 58.74 2b1x h GLN 284 Cb 0.33 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 2b1x h GLN 284 CO 0.00 0.66 0.14 0.28 -0.67 0.00 0.00 178.83 179.25 2b1x h VAL 285 N 0.47 0.92 -0.08 -0.54 2.07 -0.73 -0.92 116.25 117.45 2b1x h VAL 285 Ca 0.12 -0.10 -0.11 0.00 0.82 0.00 0.00 66.70 67.42 2b1x h VAL 285 Cb 0.33 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2b1x h VAL 285 CO 0.00 0.05 -0.46 -0.33 0.02 0.00 0.00 177.57 176.86 2b1x h GLU 286 N 0.30 0.20 -0.61 1.57 4.39 -1.20 -0.12 114.58 119.11 2b1x h GLU 286 Ca 0.16 -0.11 -0.08 0.00 0.34 0.00 0.00 59.36 59.67 2b1x h GLU 286 Cb 0.11 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 2b1x h GLU 286 CO -0.15 0.63 0.06 0.82 -1.16 0.00 0.00 179.01 179.22 2b1x h ILE 287 N 0.17 1.26 0.00 3.13 2.04 -1.09 -3.21 117.51 119.80 2b1x h ILE 287 Ca 0.01 -1.06 -0.14 0.00 1.00 0.00 0.00 64.86 64.67 2b1x h ILE 287 Cb 0.88 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2b1x h ILE 287 CO 0.07 0.39 -0.67 0.15 0.00 0.00 0.00 178.15 178.09 2b1x h PHE 288 N 0.95 0.00 -0.63 1.37 3.57 -0.86 -3.38 116.94 117.95 2b1x h PHE 288 Ca 0.18 0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.81 2b1x h PHE 288 Cb 0.48 0.00 -0.11 0.00 2.79 0.00 0.00 35.95 39.11 2b1x h PHE 288 CO 0.04 0.67 -0.03 -0.09 -2.23 0.00 0.00 178.31 176.67 2b1x h ARG 289 N 0.00 0.09 -0.64 1.11 2.43 -1.02 -1.21 114.38 115.13 2b1x h ARG 289 Ca -0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2b1x h ARG 289 Cb 1.21 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2b1x h ARG 289 CO 0.09 0.06 0.00 -0.35 -1.51 0.00 0.00 179.97 178.25 2b1x n PRO 290 N -5.32 3.82 -2.28 0.20 -0.04 -1.26 -0.66 135.00 129.46 2b1x n PRO 290 Ca 0.09 -2.57 -0.41 0.00 -0.04 0.00 0.00 63.50 60.58 2b1x n PRO 290 Cb 0.36 -1.98 -0.03 0.00 -0.04 0.00 0.00 33.50 31.81 2b1x n PRO 290 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2b1x s THR 291 N -2.14 3.10 -0.06 0.52 2.01 -0.46 -4.02 115.64 114.60 2b1x s THR 291 Ca 0.45 1.08 0.02 0.00 0.31 0.00 0.00 61.69 63.55 2b1x s THR 291 Cb 0.32 -3.69 -0.05 0.00 0.01 0.00 0.00 72.50 69.09 2b1x s THR 291 CO 0.18 0.25 -0.03 0.00 -0.69 0.00 0.00 174.62 174.32 2b1x n ALA 292 N 1.16 1.87 -3.21 7.40 0.00 0.47 -3.90 120.51 124.29 2b1x n ALA 292 Ca 0.00 -0.29 -0.16 0.00 0.00 0.00 0.00 53.44 52.99 2b1x n ALA 292 Cb 0.43 0.29 -0.15 0.00 0.00 0.00 0.00 19.45 20.02 2b1x n ALA 292 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2b1x s PHE 293 N -2.12 0.35 -0.06 0.00 0.40 -0.67 -1.89 117.98 113.98 2b1x s PHE 293 Ca -0.07 -0.05 0.03 0.00 -0.60 0.00 0.00 56.93 56.24 2b1x s PHE 293 Cb 0.02 -0.32 0.01 0.00 0.51 0.00 0.00 43.02 43.24 2b1x s PHE 293 CO 0.16 -0.07 -0.14 0.42 0.70 0.00 0.00 175.22 176.30 2b1x s ILE 294 N 0.41 1.25 -0.00 0.64 1.01 0.08 -0.58 121.20 124.01 2b1x s ILE 294 Ca -0.04 -0.57 0.01 0.00 0.00 0.00 0.00 60.65 60.04 2b1x s ILE 294 Cb -0.07 -1.12 -0.00 0.00 0.01 0.00 0.00 42.46 41.28 2b1x s ILE 294 CO -0.01 0.38 -0.03 -1.38 0.00 0.00 0.00 174.94 173.90 2b1x s HIS 295 N 0.43 0.29 0.16 3.97 -3.43 -0.77 -0.56 115.29 115.38 2b1x s HIS 295 Ca -0.11 -0.05 -0.25 0.00 -0.80 0.00 0.00 55.06 53.85 2b1x s HIS 295 Cb -0.14 -0.19 0.06 0.00 -1.43 0.00 0.00 32.58 30.88 2b1x s HIS 295 CO 0.03 -0.01 0.95 0.20 -2.00 0.00 0.00 174.74 173.92 2b1x s GLY 296 N -0.07 -0.23 -0.05 -1.38 0.00 -0.79 -0.14 107.32 104.66 2b1x s GLY 296 Ca 0.01 0.12 0.02 0.00 0.00 0.00 0.00 44.72 44.87 2b1x s GLY 296 CO -0.00 0.00 -0.08 -1.59 0.00 0.00 0.00 173.10 171.43 2b1x s THR 297 N -3.31 0.79 -0.47 0.90 2.01 -0.41 -0.91 115.64 114.24 2b1x s THR 297 Ca 0.12 -0.30 -0.23 0.00 0.31 0.00 0.00 61.69 61.59 2b1x s THR 297 Cb -0.02 -0.75 0.03 0.00 0.01 0.00 0.00 72.50 71.78 2b1x s THR 297 CO 0.02 0.27 0.81 -0.69 -0.69 0.00 0.00 174.62 174.34 2b1x s VAL 298 N 0.66 4.61 0.31 3.82 1.01 0.15 -2.88 120.40 128.07 2b1x s VAL 298 Ca -0.11 0.37 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 2b1x s VAL 298 Cb -0.14 -4.36 -0.13 0.00 0.00 0.00 0.00 36.38 31.75 2b1x s VAL 298 CO 0.02 -0.79 1.24 0.33 0.00 0.00 0.00 175.10 175.90 2b1x n PHE 299 N 6.82 2.00 0.02 5.22 7.35 -1.26 -2.75 117.46 134.86 2b1x n PHE 299 Ca 0.02 0.57 -0.20 0.00 -0.76 0.00 0.00 57.45 57.07 2b1x n PHE 299 Cb 0.48 -2.38 -0.14 0.00 0.35 0.00 0.00 39.48 37.79 2b1x n PHE 299 CO 0.00 0.00 0.00 -1.00 -0.76 0.00 0.00 176.76 175.00 2b1x h PRO 300 N 2.75 0.25 0.00 -7.13 0.13 -1.92 -3.44 132.00 122.64 2b1x h PRO 300 Ca -0.44 -0.42 -0.07 0.00 -0.87 0.00 0.00 66.00 64.20 2b1x h PRO 300 Cb 1.30 0.16 -0.14 0.00 0.13 0.00 0.00 31.00 32.44 2b1x h PRO 300 CO 0.65 1.20 -0.63 0.27 -0.23 0.00 0.00 178.00 179.26 2b1x n ASN 301 N -4.08 0.90 -4.45 1.44 6.94 -1.14 -4.88 115.26 109.99 2b1x n ASN 301 Ca -0.19 -2.40 -0.36 0.00 -0.02 0.00 0.00 54.58 51.61 2b1x n ASN 301 Cb 0.83 -0.31 -0.12 0.00 -2.36 0.00 0.00 39.78 37.82 2b1x n ASN 301 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2b1x s LEU 302 N -0.81 3.40 0.20 -4.53 2.96 -1.11 -1.52 118.68 117.27 2b1x s LEU 302 Ca 0.22 -0.19 0.11 0.00 -0.22 0.00 0.00 54.13 54.04 2b1x s LEU 302 Cb 0.23 -1.89 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 2b1x s LEU 302 CO -0.07 0.00 -0.18 -0.44 -1.32 0.00 0.00 176.35 174.34 2b1x s SER 303 N 1.37 3.74 -0.05 3.68 0.01 0.07 0.31 113.70 122.83 2b1x s SER 303 Ca 0.05 -0.79 0.05 0.00 1.31 0.00 0.00 55.95 56.57 2b1x s SER 303 Cb -0.15 -0.42 -0.01 0.00 0.21 0.00 0.00 66.02 65.66 2b1x s SER 303 CO 0.03 0.10 -0.20 -0.63 0.41 0.00 0.00 173.24 172.95 2b1x s ILE 304 N -1.79 1.65 -0.11 1.44 1.01 -0.09 -0.79 121.20 122.52 2b1x s ILE 304 Ca 0.23 -0.84 -0.00 0.00 0.00 0.00 0.00 60.65 60.04 2b1x s ILE 304 Cb -0.08 -1.41 0.02 0.00 0.01 0.00 0.00 42.46 41.01 2b1x s ILE 304 CO 0.12 0.47 -0.09 -0.83 0.00 0.00 0.00 174.94 174.61 2b1x s GLY 305 N -0.04 0.86 -0.35 6.18 0.00 0.35 -1.89 107.32 112.44 2b1x s GLY 305 Ca -0.04 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.13 2b1x s GLY 305 CO 0.03 0.71 0.08 0.21 0.00 0.00 0.00 173.10 174.13 2b1x s ASN 306 N 1.59 4.54 0.13 1.64 3.04 0.27 -0.56 114.94 125.59 2b1x s ASN 306 Ca 0.03 -2.12 0.08 0.00 0.04 0.00 0.00 52.86 50.89 2b1x s ASN 306 Cb -0.13 -1.44 -0.04 0.00 -1.54 0.00 0.00 41.25 38.10 2b1x s ASN 306 CO -0.08 -0.37 -0.19 -0.36 -3.04 0.00 0.00 177.10 173.06 2b1x s PHE 307 N 0.95 1.72 -0.29 0.43 2.99 -0.43 -0.74 117.98 122.61 2b1x s PHE 307 Ca 0.11 -0.45 -0.06 0.00 0.00 0.00 0.00 56.93 56.53 2b1x s PHE 307 Cb -0.19 -0.91 0.01 0.00 0.00 0.00 0.00 43.02 41.93 2b1x s PHE 307 CO -0.11 0.23 0.07 -1.17 -0.00 0.00 0.00 175.22 174.24 2b1x s LEU 308 N -2.23 3.82 -0.09 -0.37 0.20 -0.79 -0.66 118.68 118.55 2b1x s LEU 308 Ca 0.09 -0.76 -0.21 0.00 0.69 0.00 0.00 54.13 53.95 2b1x s LEU 308 Cb -0.08 -1.86 0.05 0.00 -0.43 0.00 0.00 46.19 43.87 2b1x s LEU 308 CO 0.05 -0.20 0.50 -0.32 -0.29 0.00 0.00 176.35 176.10 2b1x s MET 309 N 1.47 0.77 0.56 1.98 1.75 -0.64 -4.85 119.30 120.35 2b1x s MET 309 Ca 0.02 0.29 -0.20 0.00 -1.25 0.00 0.00 55.69 54.55 2b1x s MET 309 Cb -0.17 0.36 -0.05 0.00 2.84 0.00 0.00 34.83 37.81 2b1x s MET 309 CO 0.02 -0.19 1.19 0.20 -0.65 0.00 0.00 175.02 175.59 2b1x s GLY 310 N -0.69 2.73 0.00 2.11 0.00 -1.26 -1.36 107.32 108.84 2b1x s GLY 310 Ca -0.08 0.98 0.29 0.00 0.00 0.00 0.00 44.72 45.91 2b1x s GLY 310 CO 0.05 1.38 1.85 0.58 0.00 0.00 0.00 173.10 176.96 2b1x n LYS 311 N -1.35 1.10 -3.92 2.90 2.85 -1.26 -4.73 118.16 113.75 2b1x n LYS 311 Ca 0.12 -0.47 0.02 0.00 -1.05 0.00 0.00 58.31 56.93 2b1x n LYS 311 Cb 0.49 -1.49 0.01 0.00 -0.65 0.00 0.00 35.03 33.39 2b1x n LYS 311 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 2b1x s ASP 312 N -2.23 -0.00 0.00 -5.58 3.84 -1.26 -4.78 116.67 106.66 2b1x s ASP 312 Ca 0.35 -0.21 0.22 0.00 -0.00 0.00 0.00 52.55 52.91 2b1x s ASP 312 Cb 0.21 0.16 1.15 0.00 -1.38 0.00 0.00 42.92 43.06 2b1x s ASP 312 CO 0.41 -0.31 1.71 0.00 -0.00 0.00 0.00 175.17 176.98 2b1x n HIS 313 N -0.83 0.00 0.25 2.11 1.44 -1.26 -3.04 115.22 113.90 2b1x n HIS 313 Ca 0.01 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.77 2b1x n HIS 313 Cb 0.59 -0.23 0.06 0.00 0.12 0.00 0.00 29.99 30.54 2b1x n HIS 313 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2b1x n LEU 314 N -1.23 2.06 -4.43 2.39 4.77 -1.26 -4.93 117.00 114.37 2b1x n LEU 314 Ca 0.12 -1.27 -0.30 0.00 -0.03 0.00 0.00 56.01 54.53 2b1x n LEU 314 Cb 0.16 -0.05 -0.13 0.00 -2.33 0.00 0.00 43.42 41.06 2b1x n LEU 314 CO 0.16 0.44 -0.52 -0.44 -1.33 0.00 0.00 177.39 175.71 2b1x s SER 315 N -0.85 3.63 0.45 -1.43 0.01 -1.17 -5.10 113.70 109.24 2b1x s SER 315 Ca 0.13 -0.53 -0.24 0.00 1.31 0.00 0.00 55.95 56.62 2b1x s SER 315 Cb 0.09 -0.48 -0.08 0.00 0.21 0.00 0.00 66.02 65.76 2b1x s SER 315 CO 0.12 0.23 1.29 0.00 0.41 0.00 0.00 173.24 175.29 2b1x s ALA 316 N -0.97 3.09 0.53 1.44 0.00 -1.26 -4.58 121.76 120.01 2b1x s ALA 316 Ca 0.15 1.19 -0.20 0.00 0.00 0.00 0.00 51.96 53.10 2b1x s ALA 316 Cb -0.10 -3.48 -0.07 0.00 0.00 0.00 0.00 23.12 19.47 2b1x s ALA 316 CO 0.06 -0.92 1.11 -1.25 0.00 0.00 0.00 175.76 174.76 2b1x s PRO 317 N -2.50 3.47 0.07 0.00 0.04 -1.26 -4.59 135.00 130.23 2b1x s PRO 317 Ca 0.62 1.56 0.04 0.00 0.04 0.00 0.00 61.00 63.27 2b1x s PRO 317 Cb -0.36 -2.04 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 2b1x s PRO 317 CO 0.45 -0.74 -0.12 -0.08 0.04 0.00 0.00 177.00 176.55 2b1x s THR 318 N -1.81 0.98 0.32 1.26 -1.32 -0.47 -4.77 115.64 109.84 2b1x s THR 318 Ca 0.71 -1.35 -0.28 0.00 -1.21 0.00 0.00 61.69 59.56 2b1x s THR 318 Cb -0.22 -1.06 -0.09 0.00 -1.51 0.00 0.00 72.50 69.61 2b1x s THR 318 CO 0.26 -0.33 1.15 0.00 -2.21 0.00 0.00 174.62 173.48 2b1x s ALA 319 N -1.57 3.34 0.03 11.08 0.00 -1.26 -1.61 121.76 131.77 2b1x s ALA 319 Ca -0.01 0.96 -0.03 0.00 0.00 0.00 0.00 51.96 52.88 2b1x s ALA 319 Cb -0.08 -3.36 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 2b1x s ALA 319 CO 0.02 -0.33 0.04 -0.59 0.00 0.00 0.00 175.76 174.89 2b1x s PHE 320 N -1.25 0.27 -0.11 0.00 -0.12 0.16 -4.60 117.98 112.32 2b1x s PHE 320 Ca 0.49 -0.60 0.02 0.00 -0.05 0.00 0.00 56.93 56.79 2b1x s PHE 320 Cb -0.32 -0.20 -0.01 0.00 -0.63 0.00 0.00 43.02 41.86 2b1x s PHE 320 CO 0.42 -0.31 -0.18 -1.17 -0.05 0.00 0.00 175.22 173.92 2b1x s LEU 321 N -2.05 2.43 -0.02 -1.99 2.96 -1.25 -1.31 118.68 117.45 2b1x s LEU 321 Ca -0.06 -0.43 0.04 0.00 -0.22 0.00 0.00 54.13 53.45 2b1x s LEU 321 Cb -0.02 -1.52 -0.01 0.00 0.50 0.00 0.00 46.19 45.14 2b1x s LEU 321 CO -0.04 0.17 -0.13 0.28 -1.32 0.00 0.00 176.35 175.31 2b1x s THR 322 N 0.31 1.05 -0.00 3.68 -1.32 0.27 -1.69 115.64 117.93 2b1x s THR 322 Ca -0.14 -0.55 0.03 0.00 -1.21 0.00 0.00 61.69 59.83 2b1x s THR 322 Cb -0.17 -0.89 -0.03 0.00 -1.51 0.00 0.00 72.50 69.90 2b1x s THR 322 CO 0.07 0.30 -0.08 -0.76 -2.21 0.00 0.00 174.62 171.94 2b1x s LEU 323 N -0.18 3.11 -0.03 9.08 1.43 -0.98 -0.50 118.68 130.62 2b1x s LEU 323 Ca 0.03 -0.16 -0.06 0.00 -1.03 0.00 0.00 54.13 52.91 2b1x s LEU 323 Cb -0.07 -1.77 0.01 0.00 0.03 0.00 0.00 46.19 44.39 2b1x s LEU 323 CO -0.00 0.29 0.14 0.00 0.23 0.00 0.00 176.35 177.01 2b1x s ARG 324 N -1.32 0.33 -0.12 1.70 3.03 0.03 -0.49 118.95 122.12 2b1x s ARG 324 Ca 0.16 -0.10 -0.13 0.00 2.03 0.00 0.00 55.73 57.69 2b1x s ARG 324 Cb -0.11 0.14 -0.05 0.00 -1.03 0.00 0.00 34.95 33.91 2b1x s ARG 324 CO 0.06 -0.07 0.28 -0.51 -1.13 0.00 0.00 175.30 173.94 2b1x s LEU 325 N -0.66 4.32 -0.87 -1.89 1.43 -0.36 -0.75 118.68 119.90 2b1x s LEU 325 Ca -0.08 0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 53.48 2b1x s LEU 325 Cb -0.04 -2.35 0.22 0.00 0.03 0.00 0.00 46.19 44.04 2b1x s LEU 325 CO 0.01 0.21 0.82 0.26 0.23 0.00 0.00 176.35 177.88 2b1x s TRP 326 N -0.17 3.81 -0.18 0.29 0.52 -0.57 -1.78 118.94 120.86 2b1x s TRP 326 Ca 0.18 -2.07 -0.29 0.00 0.02 0.00 0.00 56.10 53.94 2b1x s TRP 326 Cb -0.14 -3.83 -0.00 0.00 -1.15 0.00 0.00 33.47 28.35 2b1x s TRP 326 CO 0.06 -1.00 1.07 -1.58 0.02 0.00 0.00 176.95 175.52 2b1x s HIS 327 N 0.05 3.31 -0.09 -1.98 2.46 0.27 -4.85 115.29 114.46 2b1x s HIS 327 Ca 0.20 1.42 -0.30 0.00 0.47 0.00 0.00 55.06 56.86 2b1x s HIS 327 Cb -0.10 -3.29 -0.03 0.00 -0.13 0.00 0.00 32.58 29.03 2b1x s HIS 327 CO -0.09 -0.63 1.36 -1.25 -2.47 0.00 0.00 174.74 171.66 2b1x s PRO 328 N 2.89 4.25 -0.10 2.88 0.04 -1.26 -0.92 135.00 142.79 2b1x s PRO 328 Ca 0.47 1.84 0.07 0.00 0.04 0.00 0.00 61.00 63.43 2b1x s PRO 328 Cb -0.17 -3.73 -0.11 0.00 0.04 0.00 0.00 34.50 30.52 2b1x s PRO 328 CO 0.11 -0.66 0.02 1.28 0.04 0.00 0.00 177.00 177.78 2b1x n LEU 329 N 6.20 0.37 0.00 -3.56 4.77 -0.72 -4.73 117.00 119.33 2b1x n LEU 329 Ca 0.14 -0.01 0.01 0.00 -0.03 0.00 0.00 56.01 56.12 2b1x n LEU 329 Cb 0.44 0.15 0.01 0.00 -2.33 0.00 0.00 43.42 41.70 2b1x n LEU 329 CO 0.58 0.29 0.82 0.61 -1.33 0.00 0.00 177.39 178.35 2b1x n GLY 330 N 2.48 0.39 0.33 -0.72 0.00 -0.95 -4.92 105.19 101.80 2b1x n GLY 330 Ca -0.16 -1.02 0.14 0.00 0.00 0.00 0.00 46.02 44.97 2b1x n GLY 330 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b1x h PRO 331 N 0.00 0.09 0.00 1.61 0.13 -1.93 -2.98 132.00 128.92 2b1x h PRO 331 Ca -0.17 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.93 2b1x h PRO 331 Cb 0.92 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.00 2b1x h PRO 331 CO 0.25 0.06 -0.32 -0.40 -0.23 0.00 0.00 178.00 177.36 2b1x n ASP 332 N -4.46 1.73 -3.73 1.44 5.68 -1.26 -3.99 116.55 111.95 2b1x n ASP 332 Ca 0.05 -3.13 -0.12 0.00 -0.50 0.00 0.00 54.79 51.09 2b1x n ASP 332 Cb 0.35 -0.42 -0.10 0.00 -1.14 0.00 0.00 41.12 39.80 2b1x n ASP 332 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2b1x s LYS 333 N -2.38 0.44 0.11 0.11 2.20 -1.06 -2.36 119.74 116.79 2b1x s LYS 333 Ca 0.30 0.61 -0.02 0.00 -0.36 0.00 0.00 55.97 56.50 2b1x s LYS 333 Cb 0.28 0.15 -0.04 0.00 -1.51 0.00 0.00 37.83 36.72 2b1x s LYS 333 CO -0.02 -0.08 0.06 0.00 -0.36 0.00 0.00 175.35 174.94 2b1x s MET 334 N 0.53 0.85 -0.20 4.03 0.23 0.13 -1.75 119.30 123.12 2b1x s MET 334 Ca -0.03 -1.33 -0.02 0.00 -1.03 0.00 0.00 55.69 53.28 2b1x s MET 334 Cb -0.04 0.25 0.00 0.00 -1.53 0.00 0.00 34.83 33.51 2b1x s MET 334 CO -0.03 -0.23 -0.11 -2.00 -2.03 0.00 0.00 175.02 170.61 2b1x s GLU 335 N -4.00 3.20 0.13 3.16 2.12 -0.09 -0.96 118.70 122.26 2b1x s GLU 335 Ca 0.18 -0.72 -0.28 0.00 0.36 0.00 0.00 54.97 54.51 2b1x s GLU 335 Cb 0.07 -2.81 -0.07 0.00 0.26 0.00 0.00 34.13 31.59 2b1x s GLU 335 CO -0.02 -0.19 0.89 0.08 -0.54 0.00 0.00 175.26 175.47 2b1x s VAL 336 N 1.37 4.45 -0.29 3.70 1.01 0.08 -0.56 120.40 130.16 2b1x s VAL 336 Ca 0.05 1.92 0.02 0.00 0.00 0.00 0.00 61.98 63.98 2b1x s VAL 336 Cb -0.14 -4.25 0.07 0.00 0.00 0.00 0.00 36.38 32.06 2b1x s VAL 336 CO -0.07 0.39 -0.05 -0.04 0.00 0.00 0.00 175.10 175.32 2b1x s MET 337 N -0.40 2.10 -0.27 2.72 1.00 -0.73 -2.32 119.30 121.40 2b1x s MET 337 Ca 0.42 -1.46 -0.06 0.00 0.00 0.00 0.00 55.69 54.59 2b1x s MET 337 Cb -0.23 -3.02 0.00 0.00 0.00 0.00 0.00 34.83 31.59 2b1x s MET 337 CO 0.28 -0.67 0.04 0.45 0.00 0.00 0.00 175.02 175.13 2b1x s SER 338 N 1.10 4.90 -0.12 3.03 0.15 -0.03 -1.22 113.70 121.52 2b1x s SER 338 Ca -0.04 -0.63 -0.05 0.00 0.70 0.00 0.00 55.95 55.93 2b1x s SER 338 Cb -0.20 -1.84 -0.04 0.00 -1.71 0.00 0.00 66.02 62.24 2b1x s SER 338 CO -0.05 -0.14 0.08 -0.36 1.20 0.00 0.00 173.24 173.97 2b1x s PHE 339 N 1.49 3.41 -0.16 3.44 0.40 0.36 -1.72 117.98 125.20 2b1x s PHE 339 Ca 0.03 0.36 -0.06 0.00 -0.60 0.00 0.00 56.93 56.66 2b1x s PHE 339 Cb -0.16 -1.91 -0.04 0.00 0.51 0.00 0.00 43.02 41.42 2b1x s PHE 339 CO 0.01 0.58 0.05 0.12 0.70 0.00 0.00 175.22 176.67 2b1x s PHE 340 N -0.80 3.24 0.10 0.36 5.36 -1.26 -2.31 117.98 122.66 2b1x s PHE 340 Ca 0.13 0.09 0.07 0.00 -0.96 0.00 0.00 56.93 56.26 2b1x s PHE 340 Cb -0.12 -2.01 -0.03 0.00 -0.34 0.00 0.00 43.02 40.52 2b1x s PHE 340 CO 0.03 0.23 -0.18 -0.51 -1.46 0.00 0.00 175.22 173.33 2b1x s LEU 341 N 0.06 2.30 0.01 6.12 1.02 -0.68 -1.35 118.68 126.16 2b1x s LEU 341 Ca 0.05 -0.68 -0.19 0.00 0.02 0.00 0.00 54.13 53.33 2b1x s LEU 341 Cb -0.12 -0.73 0.04 0.00 0.02 0.00 0.00 46.19 45.40 2b1x s LEU 341 CO 0.01 -0.01 0.42 0.54 0.02 0.00 0.00 176.35 177.34 2b1x s VAL 342 N -1.31 0.05 0.20 -1.59 0.11 -0.73 -3.94 120.40 113.18 2b1x s VAL 342 Ca 0.04 -0.38 -0.31 0.00 -2.93 0.00 0.00 61.98 58.39 2b1x s VAL 342 Cb -0.09 -0.85 -0.11 0.00 -1.53 0.00 0.00 36.38 33.80 2b1x s VAL 342 CO 0.04 -0.21 1.61 -1.61 -3.33 0.00 0.00 175.10 171.60 2b1x s GLU 343 N -1.87 4.18 0.37 1.54 8.01 -1.26 -0.67 118.70 129.00 2b1x s GLU 343 Ca -0.09 2.46 0.11 0.00 0.01 0.00 0.00 54.97 57.46 2b1x s GLU 343 Cb -0.02 -3.11 0.90 0.00 -4.31 0.00 0.00 34.13 27.59 2b1x s GLU 343 CO 0.02 -0.64 1.86 0.87 0.01 0.00 0.00 175.26 177.38 2b1x h LYS 344 N 6.45 0.58 -0.26 1.61 1.57 -1.12 -2.18 116.57 123.22 2b1x h LYS 344 Ca -0.43 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2b1x h LYS 344 Cb 1.21 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2b1x h LYS 344 CO 0.91 0.39 0.00 -0.25 -0.57 0.00 0.00 179.45 179.92 2b1x n ASP 345 N -4.56 2.34 -4.75 0.86 8.00 -1.26 -4.91 116.55 112.26 2b1x n ASP 345 Ca 0.18 -1.84 -0.38 0.00 0.71 0.00 0.00 54.79 53.46 2b1x n ASP 345 Cb 0.54 -0.17 0.03 0.00 -0.02 0.00 0.00 41.12 41.51 2b1x n ASP 345 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b1x s ALA 346 N -1.66 2.88 0.65 2.24 0.00 -0.82 -4.93 121.76 120.11 2b1x s ALA 346 Ca 0.34 1.32 -0.17 0.00 0.00 0.00 0.00 51.96 53.45 2b1x s ALA 346 Cb 0.19 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 2b1x s ALA 346 CO 0.27 -1.30 1.21 -2.14 0.00 0.00 0.00 175.76 173.81 2b1x s PRO 347 N -2.84 2.66 0.39 0.00 0.02 -1.26 -4.82 135.00 129.15 2b1x s PRO 347 Ca 0.70 1.79 0.05 0.00 0.02 0.00 0.00 61.00 63.57 2b1x s PRO 347 Cb -0.40 -1.89 0.77 0.00 0.02 0.00 0.00 34.50 33.00 2b1x s PRO 347 CO 0.48 -1.45 2.03 -0.44 -0.33 0.00 0.00 177.00 177.29 2b1x h ASP 348 N 0.41 0.55 -0.75 2.53 3.45 -1.97 -1.30 116.42 119.35 2b1x h ASP 348 Ca -0.49 -0.02 0.03 0.00 0.43 0.00 0.00 57.03 56.98 2b1x h ASP 348 Cb 1.30 -0.14 -0.05 0.00 -0.56 0.00 0.00 39.33 39.88 2b1x h ASP 348 CO 0.53 0.42 0.47 4.11 -1.57 0.00 0.00 179.24 183.20 2b1x h TRP 349 N 0.64 0.88 -0.42 4.55 5.08 -2.00 -2.27 115.95 122.41 2b1x h TRP 349 Ca 0.17 0.02 -0.14 0.00 1.08 0.00 0.00 58.89 60.03 2b1x h TRP 349 Cb -0.03 -0.29 -0.01 0.00 -3.00 0.00 0.00 29.16 25.82 2b1x h TRP 349 CO 0.00 0.50 -0.28 0.35 -1.28 0.00 0.00 178.44 177.73 2b1x h PHE 350 N 0.92 1.05 -0.36 0.12 3.04 -1.61 -1.89 116.94 118.20 2b1x h PHE 350 Ca 0.30 -0.27 0.03 0.00 3.98 0.00 0.00 57.97 62.01 2b1x h PHE 350 Cb 0.02 -0.24 -0.04 0.00 2.56 0.00 0.00 35.95 38.26 2b1x h PHE 350 CO -0.04 1.07 0.15 0.87 -2.02 0.00 0.00 178.31 178.34 2b1x h LYS 351 N 0.77 0.31 -0.20 1.11 1.57 -1.14 0.16 116.57 119.15 2b1x h LYS 351 Ca 0.09 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2b1x h LYS 351 Cb 0.84 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2b1x h LYS 351 CO 0.07 0.21 0.08 0.22 -0.57 0.00 0.00 179.45 179.46 2b1x h ASP 352 N 0.32 0.27 -0.78 0.86 3.58 -1.37 -1.37 116.42 117.94 2b1x h ASP 352 Ca 0.16 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2b1x h ASP 352 Cb 0.10 -0.07 -0.04 0.00 1.72 0.00 0.00 39.33 41.05 2b1x h ASP 352 CO -0.14 0.35 0.50 -0.33 -2.88 0.00 0.00 179.24 176.75 2b1x h GLU 353 N 0.17 1.04 -0.35 0.28 4.39 -1.13 -1.49 114.58 117.49 2b1x h GLU 353 Ca 0.07 -0.07 -0.15 0.00 0.34 0.00 0.00 59.36 59.55 2b1x h GLU 353 Cb 0.17 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 2b1x h GLU 353 CO -0.01 0.70 -0.37 1.03 -1.16 0.00 0.00 179.01 179.20 2b1x h SER 354 N 1.06 0.88 -0.27 1.42 0.87 -0.59 -1.65 113.55 115.28 2b1x h SER 354 Ca 0.28 -0.39 0.02 0.00 -1.23 0.00 0.00 61.79 60.47 2b1x h SER 354 Cb -0.10 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 61.59 2b1x h SER 354 CO -0.06 1.15 0.11 0.22 -0.53 0.00 0.00 176.83 177.72 2b1x h TYR 355 N 0.69 0.20 -0.49 2.24 3.20 -1.09 -1.29 116.97 120.43 2b1x h TYR 355 Ca 0.06 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.85 2b1x h TYR 355 Cb 0.94 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 2b1x h TYR 355 CO 0.05 0.10 -0.09 0.87 -1.64 0.00 0.00 178.16 177.46 2b1x h LYS 356 N 0.24 0.88 -0.37 1.82 1.79 -1.16 -0.12 116.57 119.65 2b1x h LYS 356 Ca 0.11 -0.29 -0.00 0.00 -2.18 0.00 0.00 60.65 58.29 2b1x h LYS 356 Cb 0.06 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 2b1x h LYS 356 CO -0.10 0.93 0.22 0.77 -1.08 0.00 0.00 179.45 180.19 2b1x h SER 357 N 0.80 0.46 -0.42 0.86 0.02 -1.11 -2.40 113.55 111.76 2b1x h SER 357 Ca 0.13 -0.07 0.02 0.00 -0.84 0.00 0.00 61.79 61.04 2b1x h SER 357 Cb 0.60 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.99 2b1x h SER 357 CO 0.04 0.39 0.24 0.22 -1.14 0.00 0.00 176.83 176.58 2b1x h TYR 358 N 0.49 0.45 -0.23 3.45 3.20 -1.15 -3.26 116.97 119.92 2b1x h TYR 358 Ca 0.13 0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.87 2b1x h TYR 358 Cb 0.03 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2b1x h TYR 358 CO -0.03 0.26 -0.45 1.25 -1.64 0.00 0.00 178.16 177.54 2b1x h LEU 359 N 0.49 0.62 0.00 2.82 5.85 -0.59 0.10 115.31 124.60 2b1x h LEU 359 Ca 0.17 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.59 2b1x h LEU 359 Cb 0.02 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 40.88 2b1x h LEU 359 CO -0.09 0.99 -0.33 0.54 -0.34 0.00 0.00 178.44 179.21 2b1x n ARG 360 N -4.01 0.02 -0.08 1.25 3.00 -0.94 -3.82 116.66 112.08 2b1x n ARG 360 Ca -0.02 0.01 -0.18 0.00 -0.01 0.00 0.00 57.85 57.65 2b1x n ARG 360 Cb 0.55 -1.52 -0.06 0.00 0.00 0.00 0.00 32.46 31.43 2b1x n ARG 360 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2b1x n THR 361 N -1.55 0.93 -4.67 0.55 -2.24 -1.11 -0.85 114.28 105.34 2b1x n THR 361 Ca 0.06 -0.25 -0.33 0.00 -2.27 0.00 0.00 64.05 61.27 2b1x n THR 361 Cb 0.34 -1.68 -0.06 0.00 -2.10 0.00 0.00 70.33 66.84 2b1x n THR 361 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2b1x n PHE 362 N -3.70 0.99 -1.82 4.78 3.01 0.33 -0.61 117.46 120.44 2b1x n PHE 362 Ca -0.33 -2.55 0.00 0.00 1.01 0.00 0.00 57.45 55.58 2b1x n PHE 362 Cb 0.74 -0.36 -0.00 0.00 -0.01 0.00 0.00 39.48 39.85 2b1x n PHE 362 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2b1x n GLY 363 N -1.30 -2.19 0.23 1.37 0.00 -1.26 -3.40 105.19 98.64 2b1x n GLY 363 Ca -0.19 -1.49 0.04 0.00 0.00 0.00 0.00 46.02 44.38 2b1x n GLY 363 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2b1x h ILE 364 N -0.01 1.14 -0.15 -0.61 2.10 -1.96 -2.56 117.51 115.47 2b1x h ILE 364 Ca 0.00 -0.64 0.00 0.00 1.08 0.00 0.00 64.86 65.30 2b1x h ILE 364 Cb 0.01 1.25 0.00 0.00 -1.09 0.00 0.00 36.82 36.98 2b1x h ILE 364 CO 0.00 0.19 0.00 -1.54 -1.08 0.00 0.00 178.15 175.72 2b1x n SER 365 N -4.32 2.36 -4.77 2.19 3.41 -1.26 -4.76 113.62 106.46 2b1x n SER 365 Ca -0.02 -1.68 -0.41 0.00 -0.26 0.00 0.00 58.87 56.51 2b1x n SER 365 Cb 0.24 -0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 64.09 2b1x n SER 365 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2b1x s GLY 366 N -0.99 2.96 0.53 5.00 0.00 -0.96 -4.87 107.32 108.98 2b1x s GLY 366 Ca 0.18 1.43 0.30 0.00 0.00 0.00 0.00 44.72 46.62 2b1x s GLY 366 CO 0.16 2.08 2.07 -1.33 0.00 0.00 0.00 173.10 176.08 2b1x h GLY 367 N 3.01 0.00 0.00 0.20 0.00 -0.84 -1.53 103.07 103.90 2b1x h GLY 367 Ca -0.50 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2b1x h GLY 367 CO 0.64 0.00 -0.15 0.74 0.00 0.00 0.00 176.54 177.77 2b1x h PHE 368 N 0.00 0.00 -0.04 5.60 -1.00 -1.10 -3.41 116.94 117.00 2b1x h PHE 368 Ca -0.00 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 2b1x h PHE 368 Cb 0.36 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.91 2b1x h PHE 368 CO 0.00 0.06 -0.15 1.49 -1.61 0.00 0.00 178.31 178.10 2b1x h GLU 369 N -1.00 0.06 -0.45 1.51 4.81 -1.31 -1.82 114.58 116.38 2b1x h GLU 369 Ca -0.01 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2b1x h GLU 369 Cb 0.19 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2b1x h GLU 369 CO -0.00 0.22 0.26 -0.56 -0.73 0.00 0.00 179.01 178.19 2b1x h GLN 370 N 0.06 0.60 0.01 1.92 3.07 -1.49 -0.36 115.11 118.93 2b1x h GLN 370 Ca 0.01 -0.05 -0.24 0.00 0.09 0.00 0.00 58.65 58.46 2b1x h GLN 370 Cb 0.31 -0.13 0.01 0.00 0.08 0.00 0.00 27.48 27.75 2b1x h GLN 370 CO 0.02 0.44 -0.99 -0.44 0.09 0.00 0.00 178.83 177.94 2b1x h ASP 371 N 0.62 0.61 -0.55 0.06 3.32 -1.56 -2.75 116.42 116.18 2b1x h ASP 371 Ca 0.16 -0.50 0.10 0.00 0.02 0.00 0.00 57.03 56.81 2b1x h ASP 371 Cb -0.01 -0.19 -0.08 0.00 0.22 0.00 0.00 39.33 39.27 2b1x h ASP 371 CO -0.03 1.31 0.08 0.44 -1.72 0.00 0.00 179.24 179.32 2b1x h ASP 372 N 0.25 -0.07 -0.45 6.45 3.32 -1.20 -1.19 116.42 123.53 2b1x h ASP 372 Ca -0.10 0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.07 2b1x h ASP 372 Cb 1.64 0.17 -0.03 0.00 0.22 0.00 0.00 39.33 41.33 2b1x h ASP 372 CO 0.18 -0.02 0.29 0.00 -1.72 0.00 0.00 179.24 177.97 2b1x h ALA 373 N 1.45 0.57 -0.53 3.45 0.00 -1.04 -2.06 119.26 121.10 2b1x h ALA 373 Ca 0.28 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.20 2b1x h ALA 373 Cb 0.42 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2b1x h ALA 373 CO -0.40 -0.01 0.31 1.49 0.00 0.00 0.00 179.25 180.65 2b1x h GLU 374 N 0.58 0.60 -0.60 0.00 4.57 -1.16 -1.87 114.58 116.71 2b1x h GLU 374 Ca 0.17 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.33 2b1x h GLU 374 Cb -0.04 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.38 2b1x h GLU 374 CO -0.05 0.40 0.38 -0.91 -1.18 0.00 0.00 179.01 177.65 2b1x h ASN 375 N 0.62 0.64 -0.39 1.04 2.35 -0.84 -1.99 115.58 117.02 2b1x h ASN 375 Ca 0.22 -0.01 -0.13 0.00 -0.55 0.00 0.00 56.30 55.83 2b1x h ASN 375 Cb 0.03 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 2b1x h ASN 375 CO -0.10 0.45 -0.25 -0.50 -1.65 0.00 0.00 177.43 175.38 2b1x h TRP 376 N 0.76 1.04 -0.28 1.19 6.55 -1.15 -1.81 115.95 122.25 2b1x h TRP 376 Ca 0.23 -0.26 -0.11 0.00 0.95 0.00 0.00 58.89 59.70 2b1x h TRP 376 Cb -0.03 -0.24 -0.01 0.00 -0.86 0.00 0.00 29.16 28.02 2b1x h TRP 376 CO -0.04 1.05 -0.28 0.07 -1.05 0.00 0.00 178.44 178.19 2b1x h ARG 377 N 0.77 0.58 0.04 0.49 0.11 -1.24 -1.98 114.38 113.15 2b1x h ARG 377 Ca 0.09 -0.24 -0.00 0.00 0.10 0.00 0.00 59.98 59.93 2b1x h ARG 377 Cb 0.81 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.87 2b1x h ARG 377 CO 0.07 0.80 -0.02 1.03 0.10 0.00 0.00 179.97 181.95 2b1x h SER 378 N 0.50 -0.05 -0.46 0.08 0.87 -1.18 -1.81 113.55 111.51 2b1x h SER 378 Ca 0.06 -0.10 0.06 0.00 -1.23 0.00 0.00 61.79 60.58 2b1x h SER 378 Cb 0.75 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 62.67 2b1x h SER 378 CO 0.06 0.07 0.17 0.40 -0.53 0.00 0.00 176.83 177.00 2b1x h ILE 379 N -0.16 0.86 -0.54 2.23 2.04 -1.29 -2.70 117.51 117.95 2b1x h ILE 379 Ca -0.01 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.75 2b1x h ILE 379 Cb 0.14 0.49 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2b1x h ILE 379 CO 0.01 0.06 0.34 0.74 0.00 0.00 0.00 178.15 179.30 2b1x h THR 380 N 0.34 1.09 0.32 -0.27 2.02 -1.22 0.54 112.91 115.73 2b1x h THR 380 Ca 0.21 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 2b1x h THR 380 Cb 0.20 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 2b1x h THR 380 CO -0.21 0.12 -0.16 -0.09 0.37 0.00 0.00 175.52 175.55 2b1x h ARG 381 N 0.67 -0.42 0.00 6.66 2.43 -1.14 -2.92 114.38 119.67 2b1x h ARG 381 Ca 0.21 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.38 2b1x h ARG 381 Cb -0.02 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2b1x h ARG 381 CO -0.08 -0.28 -0.13 -0.24 -1.51 0.00 0.00 179.97 177.74 2b1x h VAL 382 N -0.43 0.28 0.00 0.20 3.04 -1.26 -2.76 116.25 115.31 2b1x h VAL 382 Ca -0.04 -0.99 0.00 0.00 -1.01 0.00 0.00 66.70 64.66 2b1x h VAL 382 Cb 0.34 1.79 0.00 0.00 -2.01 0.00 0.00 31.29 31.41 2b1x h VAL 382 CO 0.07 0.13 0.00 0.23 -1.01 0.00 0.00 177.57 176.98 2b1x n MET 383 N -3.21 0.71 0.00 4.17 2.81 0.16 -2.49 117.12 119.26 2b1x n MET 383 Ca 0.01 0.01 0.15 0.00 -1.81 0.00 0.00 57.70 56.06 2b1x n MET 383 Cb 0.44 -1.50 0.72 0.00 -0.71 0.00 0.00 33.22 32.17 2b1x n MET 383 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2b1x n GLY 384 N 1.00 -1.32 3.74 3.03 0.00 -1.04 -4.39 105.19 106.21 2b1x n GLY 384 Ca 0.19 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 2b1x n GLY 384 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b1x s GLY 385 N -2.67 2.98 0.31 -0.02 0.00 -1.04 -4.95 107.32 101.94 2b1x s GLY 385 Ca 0.25 0.76 0.00 0.00 0.00 0.00 0.00 44.72 45.73 2b1x s GLY 385 CO 0.48 1.49 1.91 0.06 0.00 0.00 0.00 173.10 177.04 2b1x h GLN 386 N 4.64 0.83 -0.16 2.90 3.07 -1.91 -0.64 115.11 123.84 2b1x h GLN 386 Ca -0.45 -0.11 -0.16 0.00 0.09 0.00 0.00 58.65 58.02 2b1x h GLN 386 Cb 1.21 -0.15 0.01 0.00 0.08 0.00 0.00 27.48 28.62 2b1x h GLN 386 CO 0.70 0.65 -0.54 0.35 0.09 0.00 0.00 178.83 180.08 2b1x h PHE 387 N 0.82 0.86 -0.90 0.06 3.57 -1.97 -3.13 116.94 116.25 2b1x h PHE 387 Ca 0.20 -0.35 0.14 0.00 3.53 0.00 0.00 57.97 61.49 2b1x h PHE 387 Cb 0.11 -0.14 -0.07 0.00 2.79 0.00 0.00 35.95 38.64 2b1x h PHE 387 CO 0.01 1.14 0.58 0.00 -2.23 0.00 0.00 178.31 177.81 2b1x h ALA 388 N 0.55 1.81 0.00 2.41 0.00 -1.72 -2.15 119.26 120.17 2b1x h ALA 388 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2b1x h ALA 388 Cb 1.16 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2b1x h ALA 388 CO 0.11 -0.05 0.00 0.87 0.00 0.00 0.00 179.25 180.18 2b1x h LYS 389 N 0.71 0.00 -0.00 0.00 1.57 -1.08 -2.37 116.57 115.40 2b1x h LYS 389 Ca 0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.23 2b1x h LYS 389 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 2b1x h LYS 389 CO -0.21 0.00 -0.17 0.25 -0.57 0.00 0.00 179.45 178.75 2b1x n THR 390 N -2.62 0.00 -1.87 -0.16 -2.24 -0.81 -2.98 114.28 103.61 2b1x n THR 390 Ca 0.02 -0.06 -0.00 0.00 -2.27 0.00 0.00 64.05 61.74 2b1x n THR 390 Cb 0.30 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.52 2b1x n THR 390 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b1x n GLY 391 N 1.34 0.19 3.33 3.38 0.00 -0.89 -4.92 105.19 107.62 2b1x n GLY 391 Ca 0.12 -1.87 -0.23 0.00 0.00 0.00 0.00 46.02 44.04 2b1x n GLY 391 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2b1x s GLU 392 N -2.59 1.26 0.10 1.61 1.03 -1.26 -0.78 118.70 118.07 2b1x s GLU 392 Ca 0.01 -1.34 -0.17 0.00 0.03 0.00 0.00 54.97 53.50 2b1x s GLU 392 Cb -0.00 -1.44 -0.07 0.00 -0.80 0.00 0.00 34.13 31.82 2b1x s GLU 392 CO 0.00 0.31 0.56 -0.51 -1.33 0.00 0.00 175.26 174.30 2b1x s LEU 393 N -2.38 4.45 -0.40 1.83 1.43 0.28 -4.72 118.68 119.17 2b1x s LEU 393 Ca 0.13 1.19 -0.17 0.00 -1.03 0.00 0.00 54.13 54.25 2b1x s LEU 393 Cb -0.08 -3.04 0.01 0.00 0.03 0.00 0.00 46.19 43.12 2b1x s LEU 393 CO 0.06 0.21 0.42 0.21 0.23 0.00 0.00 176.35 177.48 2b1x s ASN 394 N -1.35 6.19 -0.35 2.29 3.84 -1.26 -2.04 114.94 122.27 2b1x s ASN 394 Ca 0.32 -0.58 0.07 0.00 0.21 0.00 0.00 52.86 52.88 2b1x s ASN 394 Cb -0.18 -2.22 0.49 0.00 -0.55 0.00 0.00 41.25 38.80 2b1x s ASN 394 CO 0.19 -0.53 1.49 -1.22 -2.79 0.00 0.00 177.10 174.23 2b1x n TYR 395 N 5.55 1.84 1.53 0.43 4.02 -0.48 -4.81 117.16 125.24 2b1x n TYR 395 Ca -0.08 -1.98 0.06 0.00 -0.01 0.00 0.00 57.90 55.90 2b1x n TYR 395 Cb 0.48 -0.60 0.27 0.00 -0.02 0.00 0.00 39.34 39.47 2b1x n TYR 395 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2b1x n GLN 396 N -0.99 1.38 -1.61 -0.72 6.02 -1.09 -4.76 117.38 115.62 2b1x n GLN 396 Ca 0.41 -0.59 -0.43 0.00 -0.01 0.00 0.00 57.00 56.38 2b1x n GLN 396 Cb 0.97 -1.24 -0.03 0.00 1.02 0.00 0.00 30.24 30.96 2b1x n GLN 396 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 177.06 175.93 2b1x n MET 397 N -0.11 2.11 0.00 -1.09 1.56 -1.26 -1.30 117.12 117.03 2b1x n MET 397 Ca 0.11 0.63 0.00 0.00 -0.27 0.00 0.00 57.70 58.17 2b1x n MET 397 Cb 0.17 -3.15 0.00 0.00 2.15 0.00 0.00 33.22 32.39 2b1x n MET 397 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2b1x n GLY 398 N 5.54 0.24 3.67 -5.12 0.00 -1.26 -3.62 105.19 104.63 2b1x n GLY 398 Ca 0.28 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.84 2b1x n GLY 398 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2b1x n ARG 399 N -1.83 2.09 -0.98 1.61 0.63 -0.42 -0.22 116.66 117.55 2b1x n ARG 399 Ca 0.00 0.76 0.00 0.00 -0.92 0.00 0.00 57.85 57.69 2b1x n ARG 399 Cb 0.00 -2.53 0.00 0.00 0.45 0.00 0.00 32.46 30.38 2b1x n ARG 399 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2b1x n GLY 400 N 3.48 0.76 0.23 5.14 0.00 -1.26 -4.79 105.19 108.76 2b1x n GLY 400 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2b1x n GLY 400 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2b1x n VAL 401 N -2.34 0.00 -1.72 1.61 0.31 0.70 -5.08 118.33 111.81 2b1x n VAL 401 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.91 2b1x n VAL 401 Cb 0.01 -0.38 -0.03 0.00 -0.91 0.00 0.00 33.84 32.53 2b1x n VAL 401 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2b1x s LEU 402 N -4.27 4.38 -0.05 7.52 1.43 0.03 -5.02 118.68 122.71 2b1x s LEU 402 Ca 0.00 2.83 0.04 0.00 -1.03 0.00 0.00 54.13 55.96 2b1x s LEU 402 Cb 0.00 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.64 2b1x s LEU 402 CO 0.00 -0.99 -0.15 -1.61 0.23 0.00 0.00 176.35 173.83 2b1x s GLU 403 N 1.88 1.67 0.44 1.70 2.02 -1.26 -5.06 118.70 120.09 2b1x s GLU 403 Ca 0.78 -0.53 -0.24 0.00 0.02 0.00 0.00 54.97 55.00 2b1x s GLU 403 Cb -0.48 -1.44 -0.10 0.00 0.10 0.00 0.00 34.13 32.21 2b1x s GLU 403 CO 0.34 0.18 0.98 -2.30 0.02 0.00 0.00 175.26 174.49 2b1x n PRO 404 N 3.29 1.27 -2.53 0.39 -0.02 -1.26 -4.57 135.00 131.57 2b1x n PRO 404 Ca -0.19 0.46 -0.43 0.00 -2.02 0.00 0.00 63.50 61.32 2b1x n PRO 404 Cb 0.53 -2.03 -0.02 0.00 -0.02 0.00 0.00 33.50 31.96 2b1x n PRO 404 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2b1x s ASP 405 N -0.80 6.79 0.48 2.55 -1.08 0.55 -4.91 116.67 120.26 2b1x s ASP 405 Ca 0.64 1.09 0.28 0.00 -0.52 0.00 0.00 52.55 54.04 2b1x s ASP 405 Cb -0.54 -2.54 0.92 0.00 -1.46 0.00 0.00 42.92 39.29 2b1x s ASP 405 CO 0.56 -1.00 1.82 1.55 0.52 0.00 0.00 175.17 178.62 2b1x h PRO 406 N 8.72 0.00 -0.02 4.34 0.13 -1.91 -3.23 132.00 140.04 2b1x h PRO 406 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2b1x h PRO 406 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2b1x h PRO 406 CO 1.04 0.07 -0.10 0.09 -0.23 0.00 0.00 178.00 178.88 2b1x n ASN 407 N -3.16 1.88 -4.72 1.44 3.02 -1.26 -4.95 115.26 107.51 2b1x n ASN 407 Ca 0.02 -1.53 -0.42 0.00 -0.03 0.00 0.00 54.58 52.62 2b1x n ASN 407 Cb 0.42 0.08 -0.03 0.00 -0.61 0.00 0.00 39.78 39.63 2b1x n ASN 407 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2b1x s TRP 408 N -2.14 3.31 -1.77 3.10 -0.11 -1.22 -4.92 118.94 115.20 2b1x s TRP 408 Ca 0.31 1.13 0.25 0.00 1.22 0.00 0.00 56.10 59.01 2b1x s TRP 408 Cb 0.20 -3.58 0.53 0.00 -1.50 0.00 0.00 33.47 29.13 2b1x s TRP 408 CO 0.38 -1.91 1.43 0.25 -4.62 0.00 0.00 176.95 172.48 2b1x n THR 409 N 3.62 0.00 -3.04 5.86 -2.24 -1.26 -4.91 114.28 112.31 2b1x n THR 409 Ca 0.09 -0.15 -0.19 0.00 -2.27 0.00 0.00 64.05 61.53 2b1x n THR 409 Cb 0.44 0.61 0.01 0.00 -2.10 0.00 0.00 70.33 69.29 2b1x n THR 409 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2b1x s GLY 410 N -2.53 1.79 0.91 3.38 0.00 -1.26 -5.02 107.32 104.59 2b1x s GLY 410 Ca 0.22 -1.47 -0.14 0.00 0.00 0.00 0.00 44.72 43.33 2b1x s GLY 410 CO 0.55 -1.30 1.21 2.56 0.00 0.00 0.00 173.10 176.13 2b1x s PRO 411 N -4.42 1.13 0.00 2.90 0.04 -1.26 -4.98 135.00 128.41 2b1x s PRO 411 Ca 0.52 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.53 2b1x s PRO 411 Cb -0.10 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2b1x s PRO 411 CO 0.34 -2.14 0.00 0.41 0.04 0.00 0.00 177.00 175.65 2b1x n GLY 412 N -3.07 0.32 3.54 0.56 0.00 -1.26 -4.86 105.19 100.41 2b1x n GLY 412 Ca 0.10 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 2b1x n GLY 412 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2b1x s GLU 413 N -1.20 3.54 -0.04 1.61 2.12 0.13 -4.90 118.70 119.96 2b1x s GLU 413 Ca 0.00 -0.51 0.06 0.00 0.36 0.00 0.00 54.97 54.89 2b1x s GLU 413 Cb 0.00 -3.80 -0.01 0.00 0.26 0.00 0.00 34.13 30.57 2b1x s GLU 413 CO 0.00 -0.49 -0.23 0.00 -0.54 0.00 0.00 175.26 174.00 2b1x s ALA 414 N 1.90 1.97 -0.01 6.30 0.00 -1.26 -1.06 121.76 129.59 2b1x s ALA 414 Ca 0.09 -0.97 0.08 0.00 0.00 0.00 0.00 51.96 51.16 2b1x s ALA 414 Cb -0.17 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.36 2b1x s ALA 414 CO 0.11 0.42 -0.25 0.71 0.00 0.00 0.00 175.76 176.74 2b1x s TYR 415 N -0.28 2.28 -0.01 0.00 1.51 0.01 -0.33 117.35 120.52 2b1x s TYR 415 Ca 0.01 -0.43 0.00 0.00 -1.01 0.00 0.00 57.07 55.65 2b1x s TYR 415 Cb -0.11 -1.45 0.01 0.00 -0.11 0.00 0.00 41.96 40.29 2b1x s TYR 415 CO 0.02 -0.02 1.53 -0.35 -1.11 0.00 0.00 175.55 175.62 2b1x n PRO 416 N 2.37 1.03 -3.76 -1.71 -0.04 -1.26 -1.57 135.00 130.06 2b1x n PRO 416 Ca -0.16 -0.06 -0.09 0.00 -0.04 0.00 0.00 63.50 63.15 2b1x n PRO 416 Cb 0.51 -1.02 -0.03 0.00 -0.04 0.00 0.00 33.50 32.92 2b1x n PRO 416 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2b1x s LEU 417 N -0.07 -0.15 -0.11 1.53 2.34 -0.87 -4.66 118.68 116.68 2b1x s LEU 417 Ca 0.01 -0.49 0.15 0.00 0.06 0.00 0.00 54.13 53.86 2b1x s LEU 417 Cb 0.01 2.43 0.31 0.00 -0.56 0.00 0.00 46.19 48.38 2b1x s LEU 417 CO 0.00 -1.17 1.21 -0.67 -1.06 0.00 0.00 176.35 174.66 2b1x n ASP 418 N -0.40 2.74 -4.37 1.48 2.03 0.25 -2.36 116.55 115.91 2b1x n ASP 418 Ca -0.08 -2.83 -0.46 0.00 0.52 0.00 0.00 54.79 51.94 2b1x n ASP 418 Cb 0.61 -0.38 -0.02 0.00 -0.72 0.00 0.00 41.12 40.61 2b1x n ASP 418 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2b1x s TYR 419 N -2.45 3.65 0.22 -0.67 4.12 -1.26 -4.31 117.35 116.66 2b1x s TYR 419 Ca 0.29 -1.93 -0.17 0.00 0.02 0.00 0.00 57.07 55.29 2b1x s TYR 419 Cb 0.24 -3.95 0.02 0.00 -1.52 0.00 0.00 41.96 36.75 2b1x s TYR 419 CO 0.05 -1.12 0.54 0.00 0.02 0.00 0.00 175.55 175.04 2b1x s ALA 420 N 0.68 -0.77 -0.08 3.71 0.00 -1.26 -4.84 121.76 119.19 2b1x s ALA 420 Ca 0.24 -0.44 0.12 0.00 0.00 0.00 0.00 51.96 51.87 2b1x s ALA 420 Cb -0.08 0.91 0.18 0.00 0.00 0.00 0.00 23.12 24.13 2b1x s ALA 420 CO -0.09 -0.86 1.08 0.39 0.00 0.00 0.00 175.76 176.29 2b1x n GLU 421 N -0.37 0.92 -0.30 0.00 1.02 -1.24 -4.79 120.64 115.88 2b1x n GLU 421 Ca -0.06 -1.98 -0.06 0.00 -0.02 0.00 0.00 57.16 55.04 2b1x n GLU 421 Cb 0.62 -1.14 0.07 0.00 -0.02 0.00 0.00 31.44 30.97 2b1x n GLU 421 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2b1x h ALA 422 N 0.00 1.06 -0.28 0.62 0.00 -1.88 -1.97 119.26 116.80 2b1x h ALA 422 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2b1x h ALA 422 Cb 1.11 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2b1x h ALA 422 CO 0.00 0.67 0.14 -0.91 0.00 0.00 0.00 179.25 179.14 2b1x h ASN 423 N 1.18 0.36 -0.66 0.00 2.35 -1.89 -1.15 115.58 115.77 2b1x h ASN 423 Ca 0.27 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 2b1x h ASN 423 Cb 0.19 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2b1x h ASN 423 CO -0.03 0.38 0.38 1.56 -1.65 0.00 0.00 177.43 178.07 2b1x h GLN 424 N 0.32 0.93 -0.34 0.81 7.50 -1.84 -1.13 115.11 121.36 2b1x h GLN 424 Ca 0.10 -0.09 -0.06 0.00 0.50 0.00 0.00 58.65 59.10 2b1x h GLN 424 Cb 0.11 -0.19 -0.01 0.00 0.05 0.00 0.00 27.48 27.44 2b1x h GLN 424 CO -0.01 0.68 -0.01 0.00 -1.50 0.00 0.00 178.83 177.98 2b1x h ARG 425 N 0.94 0.61 -0.80 1.46 3.08 -1.14 -1.46 114.38 117.07 2b1x h ARG 425 Ca 0.24 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2b1x h ARG 425 Cb 0.01 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 2b1x h ARG 425 CO -0.04 0.74 0.47 -0.97 -1.07 0.00 0.00 179.97 179.10 2b1x h ASN 426 N 0.41 0.97 -0.11 7.04 -1.24 -0.98 0.66 115.58 122.33 2b1x h ASN 426 Ca 0.09 -0.06 -0.02 0.00 0.71 0.00 0.00 56.30 57.03 2b1x h ASN 426 Cb 0.47 -0.25 -0.00 0.00 0.73 0.00 0.00 38.32 39.27 2b1x h ASN 426 CO 0.02 0.75 -0.00 0.15 -1.29 0.00 0.00 177.43 177.06 2b1x h PHE 427 N 1.11 0.22 -0.02 0.67 3.57 -0.99 -2.42 116.94 119.08 2b1x h PHE 427 Ca 0.29 -0.04 -0.14 0.00 3.53 0.00 0.00 57.97 61.61 2b1x h PHE 427 Cb -0.03 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 2b1x h PHE 427 CO 0.01 0.44 -0.64 -0.07 -2.23 0.00 0.00 178.31 175.82 2b1x h LEU 428 N -0.07 0.09 -0.15 0.59 3.38 -1.16 -1.22 115.31 116.78 2b1x h LEU 428 Ca 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2b1x h LEU 428 Cb 0.36 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2b1x h LEU 428 CO 0.01 0.71 0.09 -0.08 0.09 0.00 0.00 178.44 179.26 2b1x h GLU 429 N 0.06 0.19 -0.68 1.13 4.81 -0.84 0.29 114.58 119.54 2b1x h GLU 429 Ca -0.01 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 2b1x h GLU 429 Cb 1.15 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 2b1x h GLU 429 CO 0.09 0.15 0.25 -0.92 -0.73 0.00 0.00 179.01 177.85 2b1x h TYR 430 N 0.18 1.06 -0.44 0.92 3.20 -1.24 0.13 116.97 120.78 2b1x h TYR 430 Ca 0.05 -0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.85 2b1x h TYR 430 Cb -0.00 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 37.93 2b1x h TYR 430 CO -0.06 0.84 0.26 2.35 -1.64 0.00 0.00 178.16 179.90 2b1x h TRP 431 N 0.98 0.49 -0.58 -3.82 7.01 -1.02 -1.24 115.95 117.77 2b1x h TRP 431 Ca 0.23 0.02 -0.10 0.00 2.11 0.00 0.00 58.89 61.14 2b1x h TRP 431 Cb 0.24 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.12 2b1x h TRP 431 CO 0.02 0.29 -0.04 0.52 -2.79 0.00 0.00 178.44 176.44 2b1x h MET 432 N 0.53 1.04 -0.57 2.65 2.86 -0.64 -0.78 114.93 120.01 2b1x h MET 432 Ca 0.17 -0.34 0.03 0.00 -2.06 0.00 0.00 59.70 57.50 2b1x h MET 432 Cb 0.01 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 2b1x h MET 432 CO -0.08 1.03 0.34 1.96 1.06 0.00 0.00 176.91 181.22 2b1x h GLN 433 N 0.94 0.64 -0.49 1.72 4.20 -0.61 -1.89 115.11 119.61 2b1x h GLN 433 Ca 0.16 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.71 2b1x h GLN 433 Cb 0.59 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 2b1x h GLN 433 CO 0.04 0.42 -0.17 -0.07 -0.67 0.00 0.00 178.83 178.38 2b1x h LEU 434 N 0.66 0.97 -1.41 1.46 3.38 -0.83 -1.79 115.31 117.75 2b1x h LEU 434 Ca 0.24 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.89 2b1x h LEU 434 Cb 0.06 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2b1x h LEU 434 CO -0.12 1.12 0.42 0.24 0.09 0.00 0.00 178.44 180.19 2b1x h MET 435 N 0.84 0.76 -0.00 1.13 2.86 -0.90 -2.77 114.93 116.86 2b1x h MET 435 Ca 0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 2b1x h MET 435 Cb 0.73 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.22 2b1x h MET 435 CO 0.06 0.50 -0.47 1.28 1.06 0.00 0.00 176.91 179.34 2b1x n LEU 436 N -4.46 0.60 -4.61 1.22 4.77 -0.73 -4.88 117.00 108.91 2b1x n LEU 436 Ca 0.07 -0.06 -0.43 0.00 -0.03 0.00 0.00 56.01 55.56 2b1x n LEU 436 Cb 0.10 -0.22 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 2b1x n LEU 436 CO 0.35 0.14 1.49 0.00 -1.33 0.00 0.00 177.39 178.04 2b1x s ALA 437 N -2.92 3.01 0.11 -1.18 0.00 -0.70 -4.85 121.76 115.23 2b1x s ALA 437 Ca 0.13 0.36 -0.05 0.00 0.00 0.00 0.00 51.96 52.41 2b1x s ALA 437 Cb 0.18 -3.96 -0.17 0.00 0.00 0.00 0.00 23.12 19.17 2b1x s ALA 437 CO 0.67 -2.39 1.24 0.93 0.00 0.00 0.00 175.76 176.21 2b1x h GLU 438 N 12.18 0.36 -6.36 0.00 4.39 -1.89 -3.43 114.58 119.83 2b1x h GLU 438 Ca -0.34 -0.47 -0.69 0.00 0.34 0.00 0.00 59.36 58.20 2b1x h GLU 438 Cb 1.17 0.15 -0.29 0.00 -0.10 0.00 0.00 28.75 29.68 2b1x h GLU 438 CO 1.02 1.16 -0.86 -1.12 -1.16 0.00 0.00 179.01 178.04 2b1x s SER 439 N -7.13 3.27 0.51 1.42 0.01 -1.26 -5.13 113.70 105.39 2b1x s SER 439 Ca -0.05 -0.43 -0.15 0.00 1.31 0.00 0.00 55.95 56.63 2b1x s SER 439 Cb 0.08 -0.60 -0.13 0.00 0.21 0.00 0.00 66.02 65.58 2b1x s SER 439 CO 0.88 0.30 -0.21 -2.65 0.41 0.00 0.00 173.24 171.97 2b1x n PRO 440 N 2.58 0.00 -0.98 12.44 -0.02 -1.26 -5.16 135.00 142.60 2b1x n PRO 440 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2b1x n PRO 440 Cb 0.52 -0.86 0.00 0.00 -0.02 0.00 0.00 33.50 33.14 2b1x n PRO 440 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76