#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 4.31 0.85 3.17 1.43 -1.26 -5.04 118.68 122.14 2b1x s LEU 2 Ca 0.00 2.16 -0.12 0.00 -1.03 0.00 0.00 54.13 55.14 2b1x s LEU 2 Cb 0.00 -3.94 0.11 0.00 0.03 0.00 0.00 46.19 42.39 2b1x s LEU 2 CO 0.00 -0.36 1.17 -0.94 0.23 0.00 0.00 176.35 176.45 2b1x s SER 3 N -1.25 3.36 0.21 2.29 1.04 -1.26 -4.84 113.70 113.25 2b1x s SER 3 Ca 0.52 2.26 -0.09 0.00 0.48 0.00 0.00 55.95 59.12 2b1x s SER 3 Cb -0.27 -2.58 0.16 0.00 0.10 0.00 0.00 66.02 63.44 2b1x s SER 3 CO 0.34 -2.82 1.85 0.78 0.98 0.00 0.00 173.24 174.37 2b1x h ASN 4 N -1.32 0.94 -0.23 7.02 2.35 -1.99 -1.15 115.58 121.21 2b1x h ASN 4 Ca -0.45 -0.07 0.03 0.00 -0.55 0.00 0.00 56.30 55.26 2b1x h ASN 4 Cb 1.28 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 39.38 2b1x h ASN 4 CO 0.44 0.74 0.04 -0.33 -1.65 0.00 0.00 177.43 176.67 2b1x h GLU 5 N 1.07 0.12 -0.32 0.81 3.07 -1.99 -0.32 114.58 117.02 2b1x h GLU 5 Ca 0.28 -0.01 -0.05 0.00 -0.50 0.00 0.00 59.36 59.08 2b1x h GLU 5 Cb -0.03 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.84 2b1x h GLU 5 CO -0.05 0.08 0.00 1.25 -1.40 0.00 0.00 179.01 178.89 2b1x h LEU 6 N 0.12 0.55 -0.06 1.33 5.85 -1.89 -1.51 115.31 119.70 2b1x h LEU 6 Ca 0.10 -0.31 0.03 0.00 0.84 0.00 0.00 57.88 58.55 2b1x h LEU 6 Cb 0.11 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 2b1x h LEU 6 CO -0.14 0.72 -0.14 -0.09 -0.34 0.00 0.00 178.44 178.44 2b1x h ARG 7 N 0.36 -0.20 -0.95 1.25 2.43 -0.93 -0.58 114.38 115.76 2b1x h ARG 7 Ca 0.09 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 2b1x h ARG 7 Cb 0.44 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.99 2b1x h ARG 7 CO 0.02 -0.13 0.59 1.96 -1.51 0.00 0.00 179.97 180.89 2b1x h GLN 8 N -0.21 1.29 -0.47 0.20 4.20 -1.02 -0.87 115.11 118.23 2b1x h GLN 8 Ca 0.07 -0.11 0.03 0.00 0.06 0.00 0.00 58.65 58.70 2b1x h GLN 8 Cb 0.31 -0.27 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 2b1x h GLN 8 CO -0.19 0.89 0.26 1.15 -0.67 0.00 0.00 178.83 180.27 2b1x h THR 9 N 1.31 1.01 -0.47 -0.54 2.02 -0.72 -0.79 112.91 114.73 2b1x h THR 9 Ca 0.34 -0.18 -0.12 0.00 0.77 0.00 0.00 66.41 67.22 2b1x h THR 9 Cb -0.08 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 2b1x h THR 9 CO -0.07 0.09 -0.20 -0.07 0.37 0.00 0.00 175.52 175.65 2b1x h LEU 10 N 0.51 0.95 -0.52 2.58 3.38 -0.52 0.20 115.31 121.89 2b1x h LEU 10 Ca 0.20 -0.34 -0.09 0.00 0.09 0.00 0.00 57.88 57.73 2b1x h LEU 10 Cb 0.06 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 2b1x h LEU 10 CO -0.11 1.11 -0.02 1.56 0.09 0.00 0.00 178.44 181.07 2b1x h GLN 11 N 0.81 0.93 -0.65 1.13 4.20 -1.00 0.12 115.11 120.65 2b1x h GLN 11 Ca 0.11 -0.31 -0.08 0.00 0.06 0.00 0.00 58.65 58.44 2b1x h GLN 11 Cb 0.75 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.43 2b1x h GLN 11 CO 0.06 0.96 0.09 -0.22 -0.67 0.00 0.00 178.83 179.05 2b1x h LYS 12 N 0.80 1.08 -0.70 1.46 3.64 -0.96 -2.87 116.57 119.02 2b1x h LYS 12 Ca 0.15 -0.30 -0.04 0.00 -1.27 0.00 0.00 60.65 59.19 2b1x h LYS 12 Cb 0.55 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.22 2b1x h LYS 12 CO 0.03 1.00 0.27 0.78 -2.27 0.00 0.00 179.45 179.26 2b1x h GLY 13 N 1.00 1.12 1.55 5.01 0.00 -0.43 0.17 103.07 111.49 2b1x h GLY 13 Ca 0.20 -0.62 0.01 0.00 0.00 0.00 0.00 47.33 46.92 2b1x h GLY 13 CO 0.01 0.58 0.29 -2.00 0.00 0.00 0.00 176.54 175.42 2b1x h LEU 14 N 0.99 0.48 -0.01 3.11 5.85 -0.57 -0.81 115.31 124.34 2b1x h LEU 14 Ca 0.23 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.81 2b1x h LEU 14 Cb 0.22 -0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.14 2b1x h LEU 14 CO -0.02 0.35 -0.48 -0.74 -0.34 0.00 0.00 178.44 177.21 2b1x h HIS 15 N 0.57 0.51 -0.41 1.25 2.76 -1.24 -3.36 115.15 115.23 2b1x h HIS 15 Ca 0.16 -0.27 -0.03 0.00 -2.20 0.00 0.00 60.37 58.03 2b1x h HIS 15 Cb -0.03 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 28.85 2b1x h HIS 15 CO -0.00 1.07 0.12 -0.44 -1.30 0.00 0.00 177.93 177.38 2b1x h ASP 16 N -0.19 0.54 -0.54 3.26 3.32 -0.39 -2.89 116.42 119.53 2b1x h ASP 16 Ca -0.06 -0.07 0.03 0.00 0.02 0.00 0.00 57.03 56.95 2b1x h ASP 16 Cb 1.19 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 2b1x h ASP 16 CO 0.10 0.53 0.36 1.62 -1.72 0.00 0.00 179.24 180.12 2b1x h VAL 17 N 0.59 1.07 -0.08 -1.35 3.04 -0.88 0.16 116.25 118.79 2b1x h VAL 17 Ca 0.14 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 2b1x h VAL 17 Cb 0.19 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 29.85 2b1x h VAL 17 CO -0.01 0.12 0.00 0.59 -1.01 0.00 0.00 177.57 177.26 2b1x n ASN 18 N -4.47 2.32 0.00 3.17 3.02 -1.20 -3.77 115.26 114.34 2b1x n ASN 18 Ca 0.06 -1.65 0.00 0.00 -0.03 0.00 0.00 54.58 52.97 2b1x n ASN 18 Cb 0.13 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 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 0.78 0.00 0.26 6.41 3.41 -0.95 -4.70 113.62 118.83 2b1x n SER 19 Ca 0.09 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.84 2b1x n SER 19 Cb 0.37 -0.27 0.70 0.00 -0.26 0.00 0.00 64.21 64.75 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 -5.25 4.04 3.32 -1.72 -3.47 116.42 113.34 2b1x h ASP 20 Ca 0.00 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.72 2b1x h ASP 20 Cb 0.00 0.00 0.13 0.00 0.22 0.00 0.00 39.33 39.68 2b1x h ASP 20 CO 0.00 0.12 -0.63 0.79 -1.72 0.00 0.00 179.24 177.80 2b1x n TRP 21 N -3.43 -2.34 -4.48 4.55 7.02 0.51 -4.75 117.44 114.51 2b1x n TRP 21 Ca -0.01 0.87 -0.23 0.00 -1.02 0.00 0.00 57.50 57.11 2b1x n TRP 21 Cb 0.28 -4.62 -0.11 0.00 -2.42 0.00 0.00 31.31 24.45 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 -3.29 1.42 -0.02 -0.99 -4.23 -1.09 -1.47 115.64 105.97 2b1x s THR 22 Ca 0.34 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.82 2b1x s THR 22 Cb -0.15 -2.80 0.01 0.00 1.34 0.00 0.00 72.50 70.90 2b1x s THR 22 CO 0.64 -0.04 0.05 -0.69 -0.54 0.00 0.00 174.62 174.04 2b1x s VAL 23 N -3.14 -0.01 0.23 2.29 1.01 -0.88 -2.54 120.40 117.36 2b1x s VAL 23 Ca 0.35 0.02 -0.32 0.00 0.00 0.00 0.00 61.98 62.04 2b1x s VAL 23 Cb 0.08 -0.08 -0.13 0.00 0.00 0.00 0.00 36.38 36.25 2b1x s VAL 23 CO 0.16 0.01 1.51 -2.65 0.00 0.00 0.00 175.10 174.12 2b1x n PRO 24 N 3.17 2.23 0.24 2.72 -0.02 -1.26 0.69 135.00 142.76 2b1x n PRO 24 Ca -0.14 0.80 0.16 0.00 -2.02 0.00 0.00 63.50 62.30 2b1x n PRO 24 Cb 0.59 -2.52 0.72 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 4.91 1.00 0.00 3.55 0.00 -1.32 -3.16 119.26 124.24 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 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2b1x h ALA 25 CO 0.81 0.00 0.00 0.00 0.00 0.00 0.00 179.25 180.06 2b1x n ALA 26 N -1.97 1.19 0.96 0.00 0.00 -1.13 -2.75 120.51 116.82 2b1x n ALA 26 Ca 0.00 0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.71 2b1x n ALA 26 Cb 0.22 -1.28 0.60 0.00 0.00 0.00 0.00 19.45 18.99 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 -2.11 0.07 -0.06 0.00 -5.35 -1.19 -4.23 119.36 106.50 2b1x n ILE 27 Ca -0.00 0.02 -0.16 0.00 -0.27 0.00 0.00 62.75 62.33 2b1x n ILE 27 Cb 0.07 -0.54 -0.13 0.00 -1.74 0.00 0.00 39.64 37.31 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 1.63 -2.36 7.28 2.04 -1.80 -3.44 117.51 120.85 2b1x h ILE 28 Ca 0.00 -2.36 -0.50 0.00 1.00 0.00 0.00 64.86 63.01 2b1x h ILE 28 Cb 0.48 3.21 -0.36 0.00 -0.74 0.00 0.00 36.82 39.41 2b1x h ILE 28 CO 0.00 0.59 -0.78 0.21 0.00 0.00 0.00 178.15 178.17 2b1x s ASN 29 N -6.43 2.33 -0.19 1.72 2.47 -1.26 -4.70 114.94 108.88 2b1x s ASN 29 Ca -0.19 -1.89 -0.12 0.00 0.42 0.00 0.00 52.86 51.08 2b1x s ASN 29 Cb -0.01 -0.03 0.06 0.00 -1.45 0.00 0.00 41.25 39.82 2b1x s ASN 29 CO 0.70 -0.30 0.47 -0.62 -3.72 0.00 0.00 177.10 173.63 2b1x s ASP 30 N 1.29 -0.59 0.28 -4.21 -1.08 -1.26 -4.41 116.67 106.68 2b1x s ASP 30 Ca 0.17 1.02 -0.03 0.00 -0.52 0.00 0.00 52.55 53.18 2b1x s ASP 30 Cb -0.20 0.91 0.39 0.00 -1.46 0.00 0.00 42.92 42.56 2b1x s ASP 30 CO -0.03 -0.20 1.94 -0.65 0.52 0.00 0.00 175.17 176.75 2b1x h PRO 31 N 6.84 1.13 -0.21 4.34 0.11 -1.96 -1.19 132.00 141.05 2b1x h PRO 31 Ca -0.34 -0.08 -0.10 0.00 0.11 0.00 0.00 66.00 65.59 2b1x h PRO 31 Cb 1.19 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 2b1x h PRO 31 CO 0.26 0.77 -0.25 1.49 -0.21 0.00 0.00 178.00 180.06 2b1x h GLU 32 N 1.16 0.55 -0.27 1.05 4.81 -1.99 -2.09 114.58 117.80 2b1x h GLU 32 Ca 0.31 -0.30 0.06 0.00 -0.13 0.00 0.00 59.36 59.30 2b1x h GLU 32 Cb -0.09 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.23 2b1x h GLU 32 CO -0.06 0.90 -0.35 0.28 -0.73 0.00 0.00 179.01 179.05 2b1x h VAL 33 N 0.23 0.22 -0.81 0.32 2.07 -1.86 0.02 116.25 116.45 2b1x h VAL 33 Ca 0.03 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.64 2b1x h VAL 33 Cb 0.82 0.22 -0.07 0.00 -1.52 0.00 0.00 31.29 30.74 2b1x h VAL 33 CO 0.06 0.00 0.46 -0.74 0.02 0.00 0.00 177.57 177.37 2b1x h HIS 34 N -0.34 0.84 -0.15 1.57 -0.00 -1.15 0.10 115.15 116.02 2b1x h HIS 34 Ca 0.13 0.03 -0.19 0.00 -0.00 0.00 0.00 60.37 60.34 2b1x h HIS 34 Cb 0.56 -0.26 0.01 0.00 -0.00 0.00 0.00 27.41 27.72 2b1x h HIS 34 CO -0.49 0.36 -0.63 -0.44 -0.00 0.00 0.00 177.93 176.72 2b1x h ASP 35 N 0.79 0.82 -0.24 3.26 3.32 -0.77 -0.46 116.42 123.14 2b1x h ASP 35 Ca 0.38 -0.62 -0.04 0.00 0.02 0.00 0.00 57.03 56.77 2b1x h ASP 35 Cb 0.33 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2b1x h ASP 35 CO -0.23 1.30 -0.02 0.58 -1.72 0.00 0.00 179.24 179.15 2b1x h VAL 36 N 0.39 1.27 -0.81 -1.35 2.07 -0.74 -3.17 116.25 113.91 2b1x h VAL 36 Ca -0.04 -0.96 0.13 0.00 0.82 0.00 0.00 66.70 66.66 2b1x h VAL 36 Cb 1.26 1.41 -0.09 0.00 -1.52 0.00 0.00 31.29 32.36 2b1x h VAL 36 CO 0.13 0.30 0.41 -0.08 0.02 0.00 0.00 177.57 178.35 2b1x h GLU 37 N 0.20 0.59 -0.59 1.57 4.81 -0.69 0.17 114.58 120.64 2b1x h GLU 37 Ca 0.07 -0.04 0.12 0.00 -0.13 0.00 0.00 59.36 59.38 2b1x h GLU 37 Cb 0.45 -0.13 -0.10 0.00 0.63 0.00 0.00 28.75 29.60 2b1x h GLU 37 CO 0.02 0.39 -0.01 -0.09 -0.73 0.00 0.00 179.01 178.59 2b1x h ARG 38 N 0.61 0.11 0.01 1.92 2.43 -1.05 0.34 114.38 118.75 2b1x h ARG 38 Ca 0.43 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.59 2b1x h ARG 38 Cb 0.57 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 2b1x h ARG 38 CO -0.34 0.07 -0.00 1.49 -1.51 0.00 0.00 179.97 179.68 2b1x h GLU 39 N 0.11 -0.01 0.00 0.20 4.81 -1.49 -0.75 114.58 117.44 2b1x h GLU 39 Ca 0.31 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.37 2b1x h GLU 39 Cb 0.49 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 2b1x h GLU 39 CO -0.51 0.80 -0.79 0.00 -0.73 0.00 0.00 179.01 177.78 2b1x h ARG 40 N -0.89 0.00 0.00 1.92 3.08 -0.49 -2.04 114.38 115.96 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 0.82 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.87 2b1x h ARG 40 CO 0.00 0.79 -0.77 -0.89 -1.07 0.00 0.00 179.97 178.04 2b1x n ILE 41 N -3.52 1.21 0.64 2.04 -0.00 0.12 -4.41 119.36 115.44 2b1x n ILE 41 Ca -0.00 0.21 0.12 0.00 -0.00 0.00 0.00 62.75 63.08 2b1x n ILE 41 Cb 0.78 -2.20 0.46 0.00 -0.00 0.00 0.00 39.64 38.69 2b1x n ILE 41 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 2b1x n PHE 42 N -4.11 0.61 1.45 1.39 3.01 -0.90 -0.86 117.46 118.05 2b1x n PHE 42 Ca -0.11 0.20 0.14 0.00 1.01 0.00 0.00 57.45 58.69 2b1x n PHE 42 Cb 0.40 -0.82 0.58 0.00 -0.01 0.00 0.00 39.48 39.63 2b1x n PHE 42 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2b1x n GLY 43 N 0.92 -0.69 0.00 1.37 0.00 -0.32 -4.52 105.19 101.95 2b1x n GLY 43 Ca 0.05 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.67 0.00 -1.47 1.61 8.25 -0.73 -3.42 115.22 118.79 2b1x n HIS 44 Ca 0.16 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.33 2b1x n HIS 44 Cb 0.29 0.00 0.14 0.00 1.12 0.00 0.00 29.99 31.54 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 -1.44 1.66 -0.14 -1.41 0.00 -0.04 -4.62 121.76 115.78 2b1x s ALA 45 Ca 0.00 -0.48 -0.20 0.00 0.00 0.00 0.00 51.96 51.29 2b1x s ALA 45 Cb 0.00 -3.05 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 2b1x s ALA 45 CO 0.00 -2.35 0.56 -1.58 0.00 0.00 0.00 175.76 172.39 2b1x s TRP 46 N -3.22 3.48 -0.08 0.00 0.52 -1.26 -4.40 118.94 113.98 2b1x s TRP 46 Ca 0.64 0.95 0.04 0.00 0.02 0.00 0.00 56.10 57.75 2b1x s TRP 46 Cb -0.15 -2.67 -0.01 0.00 -1.15 0.00 0.00 33.47 29.49 2b1x s TRP 46 CO 0.54 0.04 -0.22 0.08 0.02 0.00 0.00 176.95 177.42 2b1x s VAL 47 N 1.07 2.33 0.24 4.03 1.01 0.93 -4.27 120.40 125.73 2b1x s VAL 47 Ca 0.29 -0.95 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 2b1x s VAL 47 Cb -0.16 -1.89 -0.09 0.00 0.00 0.00 0.00 36.38 34.24 2b1x s VAL 47 CO 0.12 0.56 1.33 0.12 0.00 0.00 0.00 175.10 177.23 2b1x s PHE 48 N -0.02 3.17 -0.08 5.22 5.36 -1.26 -0.80 117.98 129.57 2b1x s PHE 48 Ca -0.07 1.24 -0.03 0.00 -0.96 0.00 0.00 56.93 57.11 2b1x s PHE 48 Cb -0.15 -3.66 -0.04 0.00 -0.34 0.00 0.00 43.02 38.84 2b1x s PHE 48 CO 0.05 -2.00 -0.10 1.28 -1.46 0.00 0.00 175.22 172.99 2b1x n LEU 49 N 2.11 0.97 -3.53 6.12 4.77 0.39 -4.91 117.00 122.92 2b1x n LEU 49 Ca 0.05 0.07 -0.09 0.00 -0.03 0.00 0.00 56.01 56.01 2b1x n LEU 49 Cb 0.42 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 41.25 2b1x n LEU 49 CO 0.59 0.24 0.60 0.00 -1.33 0.00 0.00 177.39 177.49 2b1x s ALA 50 N -2.15 -1.71 -0.10 -1.18 0.00 -1.18 -4.86 121.76 110.59 2b1x s ALA 50 Ca -0.11 0.69 -0.09 0.00 0.00 0.00 0.00 51.96 52.45 2b1x s ALA 50 Cb 0.04 0.59 -0.04 0.00 0.00 0.00 0.00 23.12 23.71 2b1x s ALA 50 CO 0.15 -0.77 0.20 -1.58 0.00 0.00 0.00 175.76 173.76 2b1x s HIS 51 N -3.35 3.62 0.44 0.00 2.46 -1.26 -0.56 115.29 116.64 2b1x s HIS 51 Ca 0.05 0.63 0.17 0.00 0.47 0.00 0.00 55.06 56.39 2b1x s HIS 51 Cb -0.01 -2.03 1.11 0.00 -0.13 0.00 0.00 32.58 31.51 2b1x s HIS 51 CO -0.08 0.70 1.93 0.93 -2.47 0.00 0.00 174.74 175.75 2b1x h GLU 52 N 4.99 0.34 0.00 2.88 5.08 -1.25 -0.03 114.58 126.59 2b1x h GLU 52 Ca -0.54 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 2b1x h GLU 52 Cb 1.22 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2b1x h GLU 52 CO 0.60 0.23 0.00 -1.13 -1.00 0.00 0.00 179.01 177.70 2b1x n SER 53 N -4.46 0.26 0.16 1.42 3.41 -1.26 -1.92 113.62 111.24 2b1x n SER 53 Ca 0.14 0.61 0.07 0.00 -0.26 0.00 0.00 58.87 59.42 2b1x n SER 53 Cb 0.55 -0.65 0.07 0.00 -0.26 0.00 0.00 64.21 63.93 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 -2.13 4.33 5.08 -1.33 -3.37 114.58 117.16 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 0.08 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.92 2b1x h GLU 54 CO 0.00 0.25 -0.84 0.44 -1.00 0.00 0.00 179.01 177.86 2b1x n ILE 55 N -3.11 1.97 0.16 3.13 -5.35 -0.81 -4.83 119.36 110.53 2b1x n ILE 55 Ca 0.02 -5.18 0.01 0.00 -0.27 0.00 0.00 62.75 57.32 2b1x n ILE 55 Cb 0.65 -0.98 0.26 0.00 -1.74 0.00 0.00 39.64 37.83 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 2.97 0.00 -6.14 6.28 0.13 -1.71 -3.42 132.00 130.10 2b1x h PRO 56 Ca 0.12 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.66 2b1x h PRO 56 Cb 0.68 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.75 2b1x h PRO 56 CO 0.71 0.50 -0.55 -1.21 -0.23 0.00 0.00 178.00 177.22 2b1x s GLU 57 N -3.86 3.03 0.20 0.86 0.41 -1.26 -5.04 118.70 113.03 2b1x s GLU 57 Ca -0.02 -0.73 -0.33 0.00 -0.41 0.00 0.00 54.97 53.48 2b1x s GLU 57 Cb 0.13 -2.76 -0.13 0.00 -1.78 0.00 0.00 34.13 29.60 2b1x s GLU 57 CO 0.74 0.53 1.63 0.54 -0.49 0.00 0.00 175.26 178.21 2b1x n ARG 58 N -0.08 2.44 0.00 1.61 1.74 -1.26 -1.32 116.66 119.78 2b1x n ARG 58 Ca -0.08 0.88 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 2b1x n ARG 58 Cb 0.53 -2.67 0.00 0.00 -1.02 0.00 0.00 32.46 29.30 2b1x n ARG 58 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2b1x n GLY 59 N 3.47 2.00 3.76 -0.13 0.00 0.11 -4.89 105.19 109.52 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 -1.57 6.98 0.07 1.61 1.01 -0.44 -0.99 116.67 123.34 2b1x s ASP 60 Ca 0.00 2.48 -0.06 0.00 0.71 0.00 0.00 52.55 55.68 2b1x s ASP 60 Cb 0.00 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.28 2b1x s ASP 60 CO 0.00 -0.39 0.12 -0.72 0.21 0.00 0.00 175.17 174.39 2b1x s TYR 61 N -0.90 0.24 0.11 4.23 -0.85 -0.20 -1.37 117.35 118.62 2b1x s TYR 61 Ca 0.49 -0.67 0.05 0.00 -0.52 0.00 0.00 57.07 56.42 2b1x s TYR 61 Cb -0.36 -0.16 -0.04 0.00 0.38 0.00 0.00 41.96 41.79 2b1x s TYR 61 CO 0.46 -0.46 -0.12 0.14 -1.52 0.00 0.00 175.55 174.05 2b1x s VAL 62 N -3.54 1.13 -0.24 -3.49 -7.23 -0.18 -2.06 120.40 104.79 2b1x s VAL 62 Ca 0.03 -1.74 -0.06 0.00 -1.81 0.00 0.00 61.98 58.40 2b1x s VAL 62 Cb 0.04 -1.50 -0.02 0.00 0.56 0.00 0.00 36.38 35.46 2b1x s VAL 62 CO -0.09 -0.54 0.03 -0.69 -0.31 0.00 0.00 175.10 173.51 2b1x s VAL 63 N -2.47 4.02 0.40 1.32 1.01 0.21 -0.93 120.40 123.97 2b1x s VAL 63 Ca 0.09 -0.27 0.04 0.00 0.00 0.00 0.00 61.98 61.84 2b1x s VAL 63 Cb -0.03 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.47 2b1x s VAL 63 CO 0.01 0.37 0.15 0.54 0.00 0.00 0.00 175.10 176.17 2b1x n ARG 64 N 4.85 0.57 -4.06 2.72 5.12 -0.38 -4.96 116.66 120.53 2b1x n ARG 64 Ca -0.17 -3.40 -0.13 0.00 -1.93 0.00 0.00 57.85 52.22 2b1x n ARG 64 Cb 0.51 1.90 -0.12 0.00 -1.16 0.00 0.00 32.46 33.59 2b1x n ARG 64 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 2b1x s TYR 65 N -3.08 0.56 -0.26 -1.55 1.51 -1.26 -0.63 117.35 112.65 2b1x s TYR 65 Ca 0.21 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 55.86 2b1x s TYR 65 Cb 0.01 -0.35 0.05 0.00 -0.11 0.00 0.00 41.96 41.56 2b1x s TYR 65 CO 0.15 -0.08 -0.09 0.42 -1.11 0.00 0.00 175.55 174.84 2b1x s ILE 66 N -1.15 2.43 0.00 2.71 1.01 -0.35 -4.90 121.20 120.96 2b1x s ILE 66 Ca -0.09 -1.44 0.00 0.00 0.00 0.00 0.00 60.65 59.12 2b1x s ILE 66 Cb -0.08 -2.36 0.00 0.00 0.01 0.00 0.00 42.46 40.02 2b1x s ILE 66 CO 0.00 0.03 0.00 -1.20 0.00 0.00 0.00 174.94 173.77 2b1x n SER 67 N 4.52 0.00 0.08 3.58 7.64 -1.26 -0.88 113.62 127.29 2b1x n SER 67 Ca -0.15 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.85 2b1x n SER 67 Cb 0.44 0.00 0.45 0.00 -1.01 0.00 0.00 64.21 64.09 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 0.14 -2.65 1.43 4.71 -1.26 -4.81 120.64 132.20 2b1x n GLU 68 Ca 0.00 0.27 -0.42 0.00 -0.01 0.00 0.00 57.16 57.00 2b1x n GLU 68 Cb 0.00 -1.72 -0.03 0.00 -1.01 0.00 0.00 31.44 28.67 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 -3.88 7.35 -0.15 1.62 1.01 -0.06 -5.02 116.67 117.54 2b1x s ASP 69 Ca 0.08 1.79 -0.03 0.00 0.71 0.00 0.00 52.55 55.10 2b1x s ASP 69 Cb 0.12 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.44 2b1x s ASP 69 CO 0.44 -0.24 -0.05 -1.58 0.21 0.00 0.00 175.17 173.95 2b1x s GLN 70 N 0.63 3.61 -0.02 8.23 0.74 -1.26 -1.21 119.66 130.38 2b1x s GLN 70 Ca 0.51 -0.55 0.05 0.00 0.05 0.00 0.00 55.36 55.43 2b1x s GLN 70 Cb -0.24 -2.86 -0.01 0.00 1.10 0.00 0.00 33.01 31.00 2b1x s GLN 70 CO 0.29 0.25 -0.18 -0.06 -0.55 0.00 0.00 175.29 175.04 2b1x s PHE 71 N 0.33 1.61 -0.16 1.67 0.40 0.20 -0.26 117.98 121.77 2b1x s PHE 71 Ca -0.05 -0.33 -0.27 0.00 -0.60 0.00 0.00 56.93 55.68 2b1x s PHE 71 Cb -0.14 -1.04 -0.01 0.00 0.51 0.00 0.00 43.02 42.33 2b1x s PHE 71 CO 0.03 -0.05 0.90 0.42 0.70 0.00 0.00 175.22 177.23 2b1x s ILE 72 N -0.36 4.83 -0.27 0.64 1.01 0.10 -1.24 121.20 125.92 2b1x s ILE 72 Ca 0.05 1.79 -0.04 0.00 0.00 0.00 0.00 60.65 62.45 2b1x s ILE 72 Cb -0.07 -4.20 0.01 0.00 0.01 0.00 0.00 42.46 38.21 2b1x s ILE 72 CO -0.00 -0.00 0.01 -0.69 0.00 0.00 0.00 174.94 174.25 2b1x s VAL 73 N 2.22 3.46 0.12 2.92 1.01 -0.11 -1.19 120.40 128.84 2b1x s VAL 73 Ca 0.42 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.54 2b1x s VAL 73 Cb -0.17 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 2b1x s VAL 73 CO 0.13 0.17 0.14 0.00 0.00 0.00 0.00 175.10 175.54 2b1x s ARG 75 N -3.97 3.70 0.70 0.00 3.52 -0.47 -0.60 118.95 121.83 2b1x s ARG 75 Ca 0.16 -0.47 -0.09 0.00 -0.13 0.00 0.00 55.73 55.20 2b1x s ARG 75 Cb 0.06 -3.54 0.16 0.00 -1.56 0.00 0.00 34.95 30.06 2b1x s ARG 75 CO -0.03 -0.25 0.95 -0.40 -0.81 0.00 0.00 175.30 174.77 2b1x n ASP 76 N 5.00 0.39 0.13 -2.12 5.68 0.27 0.09 116.55 126.00 2b1x n ASP 76 Ca -0.15 -1.54 0.12 0.00 -0.50 0.00 0.00 54.79 52.72 2b1x n ASP 76 Cb 0.51 -0.70 0.48 0.00 -1.14 0.00 0.00 41.12 40.27 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 -2.95 0.21 -0.08 0.11 -0.58 -1.26 -0.58 120.64 115.50 2b1x n GLU 77 Ca 0.13 0.39 0.12 0.00 -0.42 0.00 0.00 57.16 57.37 2b1x n GLU 77 Cb 0.45 -1.86 0.30 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 0.23 0.81 1.59 0.62 0.00 -1.26 -4.96 105.19 102.22 2b1x n GLY 78 Ca 0.03 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 1.30 0.58 3.85 -0.02 0.00 0.25 -5.06 105.19 106.09 2b1x n GLY 79 Ca 0.17 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.57 3.87 -0.07 1.61 2.12 -1.26 -4.74 118.70 119.67 2b1x s GLU 80 Ca 0.00 0.34 -0.28 0.00 0.36 0.00 0.00 54.97 55.39 2b1x s GLU 80 Cb 0.00 -3.07 -0.02 0.00 0.26 0.00 0.00 34.13 31.30 2b1x s GLU 80 CO 0.00 0.59 0.91 0.42 -0.54 0.00 0.00 175.26 176.64 2b1x s ILE 81 N -1.30 4.88 0.16 -3.70 -1.09 -1.26 -0.56 121.20 118.34 2b1x s ILE 81 Ca 0.31 1.87 0.11 0.00 -2.23 0.00 0.00 60.65 60.70 2b1x s ILE 81 Cb -0.15 -4.23 -0.04 0.00 -1.58 0.00 0.00 42.46 36.45 2b1x s ILE 81 CO 0.17 0.11 -0.24 -0.13 -1.23 0.00 0.00 174.94 173.61 2b1x s ARG 82 N 1.44 1.43 -0.17 2.79 1.81 0.23 -4.98 118.95 121.50 2b1x s ARG 82 Ca 0.46 -1.43 -0.00 0.00 -1.72 0.00 0.00 55.73 53.03 2b1x s ARG 82 Cb -0.19 -1.79 0.04 0.00 -0.45 0.00 0.00 34.95 32.56 2b1x s ARG 82 CO 0.21 0.40 -0.06 0.20 -0.68 0.00 0.00 175.30 175.37 2b1x s GLY 83 N -2.41 0.98 -0.12 -3.53 0.00 -1.26 -1.37 107.32 99.61 2b1x s GLY 83 Ca 0.17 -0.85 0.01 0.00 0.00 0.00 0.00 44.72 44.04 2b1x s GLY 83 CO 0.08 0.90 -0.15 0.30 0.00 0.00 0.00 173.10 174.23 2b1x s HIS 84 N 1.61 2.76 0.19 1.90 0.09 -0.33 -0.75 115.29 120.76 2b1x s HIS 84 Ca 0.01 -0.73 -0.33 0.00 -0.00 0.00 0.00 55.06 54.02 2b1x s HIS 84 Cb -0.15 -1.82 -0.13 0.00 -0.00 0.00 0.00 32.58 30.49 2b1x s HIS 84 CO -0.08 -0.25 1.66 -0.11 -0.00 0.00 0.00 174.74 175.96 2b1x n LEU 85 N 3.52 3.66 -3.24 0.89 7.94 0.31 0.03 117.00 130.12 2b1x n LEU 85 Ca -0.18 1.07 -0.37 0.00 -1.11 0.00 0.00 56.01 55.42 2b1x n LEU 85 Cb 0.53 -1.52 -0.03 0.00 0.53 0.00 0.00 43.42 42.93 2b1x n LEU 85 CO 0.30 -0.00 2.86 -3.20 -1.11 0.00 0.00 177.39 176.24 2b1x n ASN 86 N 3.68 8.18 -3.49 1.96 5.15 0.64 -4.57 115.26 126.80 2b1x n ASN 86 Ca 0.16 -2.79 -0.17 0.00 -0.60 0.00 0.00 54.58 51.19 2b1x n ASN 86 Cb 0.33 -1.47 -0.12 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 0.78 -0.41 0.39 5.20 0.00 -1.26 -3.99 121.76 122.48 2b1x s ALA 87 Ca 0.64 0.41 -0.25 0.00 0.00 0.00 0.00 51.96 52.76 2b1x s ALA 87 Cb 0.20 -1.33 -0.11 0.00 0.00 0.00 0.00 23.12 21.88 2b1x s ALA 87 CO -0.07 -1.15 1.09 0.00 0.00 0.00 0.00 175.76 175.62 2b1x h ARG 89 N 1.82 0.00 0.00 0.00 2.47 -1.90 -0.70 114.38 116.07 2b1x h ARG 89 Ca -0.45 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 2b1x h ARG 89 Cb 1.32 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.64 2b1x h ARG 89 CO 0.59 0.00 0.00 1.58 0.56 0.00 0.00 179.97 182.70 2b1x n HIS 90 N -2.37 0.00 -0.60 3.04 -0.00 -1.26 -4.71 115.22 109.32 2b1x n HIS 90 Ca 0.02 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.23 2b1x n HIS 90 Cb 0.27 -0.30 0.04 0.00 -0.12 0.00 0.00 29.99 29.88 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 -1.39 1.84 -0.61 1.57 3.00 -1.26 -5.02 116.66 114.80 2b1x n ARG 91 Ca 0.00 -1.58 0.00 0.00 -0.00 0.00 0.00 57.85 56.27 2b1x n ARG 91 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 32.46 31.45 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 -0.62 0.70 3.74 5.14 0.00 -0.27 -4.95 105.19 108.93 2b1x n GLY 92 Ca 0.04 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 2.60 0.03 1.61 1.75 -1.26 -3.98 119.30 119.64 2b1x s MET 93 Ca 0.00 1.78 -0.30 0.00 -1.25 0.00 0.00 55.69 55.91 2b1x s MET 93 Cb 0.00 -1.89 -0.07 0.00 2.84 0.00 0.00 34.83 35.71 2b1x s MET 93 CO 0.00 -1.48 1.65 -0.65 -0.65 0.00 0.00 175.02 173.89 2b1x s GLN 94 N -3.63 4.20 0.00 4.11 -0.21 -1.26 0.73 119.66 123.60 2b1x s GLN 94 Ca 0.76 2.29 0.28 0.00 0.02 0.00 0.00 55.36 58.70 2b1x s GLN 94 Cb -0.29 -3.73 1.05 0.00 1.00 0.00 0.00 33.01 31.04 2b1x s GLN 94 CO 0.39 -0.76 1.75 1.33 -2.12 0.00 0.00 175.29 175.88 2b1x n VAL 95 N 4.96 0.00 -3.64 1.09 0.24 -1.26 -4.65 118.33 115.06 2b1x n VAL 95 Ca 0.16 -0.10 -0.17 0.00 -2.04 0.00 0.00 64.34 62.19 2b1x n VAL 95 Cb 0.41 0.13 -0.15 0.00 -1.47 0.00 0.00 33.84 32.76 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 5.32 1.91 -2.40 0.00 1.74 -1.26 -4.97 116.66 117.00 2b1x n ARG 97 Ca -0.05 -1.83 -0.27 0.00 -0.77 0.00 0.00 57.85 54.93 2b1x n ARG 97 Cb 0.50 -1.36 0.02 0.00 -1.02 0.00 0.00 32.46 30.60 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 -1.28 3.29 -0.36 7.54 0.00 -1.26 -5.01 121.76 124.68 2b1x s ALA 98 Ca 0.26 -0.58 0.23 0.00 0.00 0.00 0.00 51.96 51.87 2b1x s ALA 98 Cb 0.16 -2.66 0.16 0.00 0.00 0.00 0.00 23.12 20.79 2b1x s ALA 98 CO 0.23 -0.69 1.25 0.93 0.00 0.00 0.00 175.76 177.48 2b1x h GLU 99 N -0.10 0.00 -1.57 0.00 5.08 -1.94 -3.42 114.58 112.63 2b1x h GLU 99 Ca -0.46 0.00 0.25 0.00 -1.00 0.00 0.00 59.36 58.15 2b1x h GLU 99 Cb 1.24 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.31 2b1x h GLU 99 CO 0.61 0.00 0.78 0.00 -1.00 0.00 0.00 179.01 179.40 2b1x s MET 100 N -3.29 0.39 0.00 2.33 0.23 -1.26 -0.61 119.30 117.08 2b1x s MET 100 Ca 0.03 -0.16 0.00 0.00 -1.03 0.00 0.00 55.69 54.53 2b1x s MET 100 Cb 0.09 0.17 0.00 0.00 -1.53 0.00 0.00 34.83 33.56 2b1x s MET 100 CO 0.74 -0.17 0.00 0.41 -2.03 0.00 0.00 175.02 173.97 2b1x n GLY 101 N -0.17 -0.78 2.75 3.16 0.00 -0.87 -5.00 105.19 104.27 2b1x n GLY 101 Ca -0.02 -1.10 -0.17 0.00 0.00 0.00 0.00 46.02 44.73 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 0.50 -0.02 1.61 3.84 -1.26 -1.03 114.94 114.58 2b1x s ASN 102 Ca 0.00 0.04 -0.20 0.00 0.21 0.00 0.00 52.86 52.91 2b1x s ASN 102 Cb 0.00 -0.12 0.04 0.00 -0.55 0.00 0.00 41.25 40.61 2b1x s ASN 102 CO 0.00 -0.17 0.42 0.28 -2.79 0.00 0.00 177.10 174.85 2b1x s THR 103 N 1.44 0.04 -0.30 -5.21 -1.32 -0.16 -4.96 115.64 105.17 2b1x s THR 103 Ca -0.04 -0.35 0.21 0.00 -1.21 0.00 0.00 61.69 60.30 2b1x s THR 103 Cb -0.13 -0.76 0.14 0.00 -1.51 0.00 0.00 72.50 70.24 2b1x s THR 103 CO -0.03 -0.19 1.34 0.77 -2.21 0.00 0.00 174.62 174.30 2b1x h SER 104 N 3.52 0.00 -5.02 8.08 4.64 -1.94 -3.40 113.55 119.42 2b1x h SER 104 Ca -0.29 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.89 2b1x h SER 104 Cb 1.17 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.07 2b1x h SER 104 CO 0.40 0.14 -0.56 -1.00 -0.87 0.00 0.00 176.83 174.95 2b1x s HIS 105 N -3.19 0.16 -0.21 4.77 3.76 -1.26 -1.89 115.29 117.43 2b1x s HIS 105 Ca 0.03 -0.38 -0.04 0.00 -0.15 0.00 0.00 55.06 54.53 2b1x s HIS 105 Cb 0.07 -0.12 -0.01 0.00 1.11 0.00 0.00 32.58 33.63 2b1x s HIS 105 CO 0.73 -0.29 -0.05 -0.06 -0.85 0.00 0.00 174.74 174.22 2b1x s PHE 106 N -1.89 2.95 -0.20 1.40 0.40 0.75 -4.90 117.98 116.50 2b1x s PHE 106 Ca -0.11 -0.87 -0.02 0.00 -0.60 0.00 0.00 56.93 55.32 2b1x s PHE 106 Cb -0.06 -2.08 -0.00 0.00 0.51 0.00 0.00 43.02 41.39 2b1x s PHE 106 CO -0.01 -0.49 -0.09 0.50 0.70 0.00 0.00 175.22 175.82 2b1x s ARG 107 N 1.34 3.31 -0.05 0.44 6.06 -1.26 -0.47 118.95 128.33 2b1x s ARG 107 Ca 0.04 -0.67 -0.30 0.00 -2.50 0.00 0.00 55.73 52.30 2b1x s ARG 107 Cb -0.14 -2.86 -0.04 0.00 0.06 0.00 0.00 34.95 31.97 2b1x s ARG 107 CO -0.02 -0.12 1.26 0.00 -2.50 0.00 0.00 175.30 173.92 2b1x h PRO 109 N 7.65 0.00 0.25 0.00 0.11 -1.91 -0.17 132.00 137.92 2b1x h PRO 109 Ca -0.35 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 2b1x h PRO 109 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2b1x h PRO 109 CO 0.89 0.01 -0.12 -0.92 -0.21 0.00 0.00 178.00 177.66 2b1x h TYR 110 N 0.00 -0.31 0.00 0.65 -0.00 -1.93 -3.40 116.97 111.98 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 0.06 0.10 0.00 0.00 -0.00 0.00 0.00 36.73 36.89 2b1x h TYR 110 CO 0.00 -0.19 0.00 0.72 -0.00 0.00 0.00 178.16 178.69 2b1x n HIS 111 N -4.80 0.00 -0.90 -3.82 8.25 -1.25 -5.03 115.22 107.67 2b1x n HIS 111 Ca -0.04 -0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.18 2b1x n HIS 111 Cb 0.13 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.22 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 -0.23 0.50 3.74 -1.41 0.00 -0.08 -4.62 105.19 103.08 2b1x n GLY 112 Ca 0.00 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.90 2.72 -4.26 1.61 7.02 -1.26 -4.56 117.44 115.81 2b1x n TRP 113 Ca 0.00 0.42 -0.27 0.00 -1.02 0.00 0.00 57.50 56.63 2b1x n TRP 113 Cb 0.00 -2.52 -0.17 0.00 -2.42 0.00 0.00 31.31 26.21 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 -0.72 1.28 -0.07 -0.99 2.01 0.10 -1.28 115.64 115.97 2b1x s THR 114 Ca 0.58 -0.49 0.02 0.00 0.31 0.00 0.00 61.69 62.11 2b1x s THR 114 Cb -0.52 -1.20 -0.02 0.00 0.01 0.00 0.00 72.50 70.76 2b1x s THR 114 CO 0.58 0.40 -0.13 -0.31 -0.69 0.00 0.00 174.62 174.47 2b1x s TYR 115 N 1.20 2.75 0.70 4.92 1.51 0.38 -0.77 117.35 128.03 2b1x s TYR 115 Ca -0.03 -0.25 -0.16 0.00 -1.01 0.00 0.00 57.07 55.62 2b1x s TYR 115 Cb -0.14 -1.69 0.02 0.00 -0.11 0.00 0.00 41.96 40.04 2b1x s TYR 115 CO -0.04 0.11 1.19 0.45 -1.11 0.00 0.00 175.55 176.16 2b1x s SER 116 N -0.49 4.50 0.00 2.29 0.15 0.89 -0.17 113.70 120.86 2b1x s SER 116 Ca 0.07 2.31 0.08 0.00 0.70 0.00 0.00 55.95 59.11 2b1x s SER 116 Cb -0.12 -2.58 0.36 0.00 -1.71 0.00 0.00 66.02 61.96 2b1x s SER 116 CO 0.02 -2.05 1.24 -0.46 1.20 0.00 0.00 173.24 173.18 2b1x n ASN 117 N -2.48 0.00 0.32 5.45 0.23 -0.79 -0.03 115.26 117.96 2b1x n ASN 117 Ca 0.13 0.45 0.20 0.00 -0.53 0.00 0.00 54.58 54.83 2b1x n ASN 117 Cb 0.50 -0.47 1.07 0.00 -2.08 0.00 0.00 39.78 38.81 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 0.11 0.00 5.53 2.02 -1.90 -3.42 112.91 115.25 2b1x h THR 118 Ca 0.00 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.06 2b1x h THR 118 Cb 0.13 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2b1x h THR 118 CO 0.00 0.01 0.00 0.61 0.37 0.00 0.00 175.52 176.51 2b1x n GLY 119 N -0.90 3.16 3.75 2.16 0.00 0.96 -5.01 105.19 109.31 2b1x n GLY 119 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.11 6.81 -0.35 1.61 0.01 -1.25 -1.22 113.70 118.20 2b1x s SER 120 Ca 0.00 2.55 -0.29 0.00 1.31 0.00 0.00 55.95 59.52 2b1x s SER 120 Cb 0.00 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.61 2b1x s SER 120 CO 0.00 -0.56 1.36 -0.22 0.41 0.00 0.00 173.24 174.23 2b1x s LEU 121 N -0.74 3.74 -0.01 2.44 2.96 -1.26 -0.08 118.68 125.73 2b1x s LEU 121 Ca 0.55 1.02 0.10 0.00 -0.22 0.00 0.00 54.13 55.58 2b1x s LEU 121 Cb -0.39 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 42.62 2b1x s LEU 121 CO 0.44 -1.25 0.30 1.33 -1.32 0.00 0.00 176.35 175.85 2b1x n VAL 122 N 6.63 0.00 -3.73 1.68 0.24 0.05 -4.67 118.33 118.52 2b1x n VAL 122 Ca 0.16 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 62.09 2b1x n VAL 122 Cb 0.47 0.54 -0.12 0.00 -1.47 0.00 0.00 33.84 33.26 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 -2.71 -0.20 -0.11 7.63 0.00 -0.92 -5.01 107.32 106.00 2b1x s GLY 123 Ca -0.01 1.06 -0.01 0.00 0.00 0.00 0.00 44.72 45.76 2b1x s GLY 123 CO 0.42 1.18 -0.06 0.14 0.00 0.00 0.00 173.10 174.78 2b1x s VAL 124 N 0.96 0.93 0.34 1.40 1.01 -1.26 -0.72 120.40 123.06 2b1x s VAL 124 Ca -0.07 -0.27 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 2b1x s VAL 124 Cb -0.07 -1.00 -0.12 0.00 0.00 0.00 0.00 36.38 35.19 2b1x s VAL 124 CO -0.07 0.31 1.40 -2.65 0.00 0.00 0.00 175.10 174.10 2b1x n PRO 125 N 4.97 2.37 -2.18 2.72 -0.02 -1.26 -2.58 135.00 139.02 2b1x n PRO 125 Ca -0.12 0.83 -0.19 0.00 -2.02 0.00 0.00 63.50 62.01 2b1x n PRO 125 Cb 0.50 -2.49 -0.02 0.00 -0.02 0.00 0.00 33.50 31.46 2b1x n PRO 125 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b1x n ALA 126 N 0.74 -0.49 -0.36 3.55 0.00 -1.26 -4.88 120.51 117.82 2b1x n ALA 126 Ca 0.05 0.18 0.27 0.00 0.00 0.00 0.00 53.44 53.95 2b1x n ALA 126 Cb 0.37 -1.99 0.53 0.00 0.00 0.00 0.00 19.45 18.36 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 0.00 1.83 0.00 0.00 0.00 -1.91 0.16 103.07 103.14 2b1x h GLY 127 Ca -0.43 -0.20 -0.10 0.00 0.00 0.00 0.00 47.33 46.60 2b1x h GLY 127 CO 0.53 -0.46 -0.89 0.58 0.00 0.00 0.00 176.54 176.30 2b1x n LYS 128 N -4.94 0.50 0.13 4.80 -0.00 -1.26 -0.92 118.16 116.47 2b1x n LYS 128 Ca 0.33 0.51 0.01 0.00 -0.00 0.00 0.00 58.31 59.17 2b1x n LYS 128 Cb 1.10 -1.69 0.35 0.00 -0.00 0.00 0.00 35.03 34.80 2b1x n LYS 128 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 2b1x h ASP 129 N -1.00 0.17 0.00 -5.58 3.45 -1.90 -0.52 116.42 111.04 2b1x h ASP 129 Ca -0.15 -0.05 -0.37 0.00 0.43 0.00 0.00 57.03 56.90 2b1x h ASP 129 Cb 0.86 -0.05 -0.06 0.00 -0.56 0.00 0.00 39.33 39.52 2b1x h ASP 129 CO -0.09 0.43 -2.34 0.00 -1.57 0.00 0.00 179.24 175.67 2b1x n ALA 130 N -2.48 1.47 0.95 3.45 0.00 0.52 -4.68 120.51 119.74 2b1x n ALA 130 Ca -0.01 -1.00 0.10 0.00 0.00 0.00 0.00 53.44 52.53 2b1x n ALA 130 Cb 0.34 0.01 -0.04 0.00 0.00 0.00 0.00 19.45 19.77 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 -3.40 0.00 -2.72 0.00 4.02 -1.03 -4.98 117.16 109.05 2b1x n TYR 131 Ca -0.43 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.27 2b1x n TYR 131 Cb 0.92 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.24 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 1.41 -0.50 2.33 2.72 0.00 -0.20 -1.14 105.19 109.79 2b1x n GLY 132 Ca 0.07 0.05 -0.15 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.11 -4.31 0.01 1.61 5.03 -0.09 -4.86 115.26 110.53 2b1x n ASN 133 Ca -0.14 0.22 0.11 0.00 0.87 0.00 0.00 54.58 55.63 2b1x n ASN 133 Cb 0.62 -3.74 0.05 0.00 -1.02 0.00 0.00 39.78 35.69 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 -2.55 0.09 -2.57 3.52 1.13 -0.29 -4.87 117.38 111.83 2b1x n GLN 134 Ca -0.17 -0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.46 2b1x n GLN 134 Cb 0.58 -1.53 -0.02 0.00 0.11 0.00 0.00 30.24 29.39 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 -3.29 3.99 -0.81 1.08 2.96 -1.26 -4.96 118.68 116.39 2b1x s LEU 135 Ca 0.08 1.23 -0.24 0.00 -0.22 0.00 0.00 54.13 54.98 2b1x s LEU 135 Cb 0.16 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 43.36 2b1x s LEU 135 CO 0.79 -0.87 1.23 -0.75 -1.32 0.00 0.00 176.35 175.43 2b1x s LYS 136 N 3.65 3.31 0.31 1.98 2.20 -1.26 -4.91 119.74 125.03 2b1x s LYS 136 Ca 0.49 -0.76 0.04 0.00 -0.36 0.00 0.00 55.97 55.38 2b1x s LYS 136 Cb -0.15 -4.56 0.66 0.00 -1.51 0.00 0.00 37.83 32.28 2b1x s LYS 136 CO 0.15 -2.04 1.85 0.87 -0.36 0.00 0.00 175.35 175.81 2b1x h LYS 137 N 9.73 0.84 0.00 4.03 1.57 -1.93 -0.80 116.57 130.02 2b1x h LYS 137 Ca -0.12 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 2b1x h LYS 137 Cb 1.04 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.16 2b1x h LYS 137 CO 1.27 0.56 0.00 -1.13 -0.57 0.00 0.00 179.45 179.58 2b1x n SER 138 N -4.60 0.00 -0.01 0.86 3.41 -1.26 -1.21 113.62 110.80 2b1x n SER 138 Ca 0.19 0.33 0.12 0.00 -0.26 0.00 0.00 58.87 59.25 2b1x n SER 138 Cb 0.41 -0.39 0.27 0.00 -0.26 0.00 0.00 64.21 64.23 2b1x n SER 138 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2b1x n ASP 139 N -1.39 0.51 -1.62 4.04 10.43 -0.31 -4.37 116.55 123.85 2b1x n ASP 139 Ca 0.03 -0.26 -0.04 0.00 2.57 0.00 0.00 54.79 57.08 2b1x n ASP 139 Cb 0.08 0.22 0.09 0.00 1.84 0.00 0.00 41.12 43.35 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 -1.45 1.01 -1.01 1.24 7.02 -0.35 -5.06 117.44 118.84 2b1x n TRP 140 Ca 0.06 -1.61 -0.31 0.00 -1.02 0.00 0.00 57.50 54.62 2b1x n TRP 140 Cb 0.34 -0.25 0.14 0.00 -2.42 0.00 0.00 31.31 29.11 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 -3.18 3.52 0.34 -0.99 0.01 -1.21 -4.50 114.94 108.91 2b1x s ASN 141 Ca 0.39 1.86 -0.29 0.00 -0.71 0.00 0.00 52.86 54.11 2b1x s ASN 141 Cb 0.38 -2.45 -0.11 0.00 0.41 0.00 0.00 41.25 39.47 2b1x s ASN 141 CO -0.05 -2.67 1.55 0.18 -1.51 0.00 0.00 177.10 174.60 2b1x n LEU 142 N -3.93 4.62 -4.67 0.60 4.77 -0.35 -4.88 117.00 113.16 2b1x n LEU 142 Ca 0.09 1.19 -0.42 0.00 -0.03 0.00 0.00 56.01 56.84 2b1x n LEU 142 Cb 0.53 -1.61 -0.03 0.00 -2.33 0.00 0.00 43.42 39.98 2b1x n LEU 142 CO 0.53 0.19 1.33 -0.13 -1.33 0.00 0.00 177.39 177.97 2b1x s ARG 143 N -1.28 4.20 0.61 3.23 0.52 -1.26 -4.86 118.95 120.10 2b1x s ARG 143 Ca 0.59 2.21 -0.17 0.00 -0.52 0.00 0.00 55.73 57.83 2b1x s ARG 143 Cb -0.48 -3.83 -0.03 0.00 0.52 0.00 0.00 34.95 31.14 2b1x s ARG 143 CO 0.56 -0.78 1.11 -2.14 0.02 0.00 0.00 175.30 174.07 2b1x s PRO 144 N 3.43 3.08 0.10 3.54 0.02 -1.26 -0.53 135.00 143.38 2b1x s PRO 144 Ca 0.72 1.45 -0.33 0.00 0.02 0.00 0.00 61.00 62.86 2b1x s PRO 144 Cb -0.35 -1.98 -0.12 0.00 0.02 0.00 0.00 34.50 32.07 2b1x s PRO 144 CO 0.30 -1.04 1.74 -0.12 -0.33 0.00 0.00 177.00 177.56 2b1x n MET 145 N -1.94 2.44 -0.27 5.54 0.00 0.07 -4.76 117.12 118.19 2b1x n MET 145 Ca 0.11 0.88 0.05 0.00 -0.00 0.00 0.00 57.70 58.74 2b1x n MET 145 Cb 0.52 -2.72 0.27 0.00 0.00 0.00 0.00 33.22 31.29 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 7.58 0.92 -3.82 2.12 0.11 -1.86 -3.38 132.00 133.67 2b1x h PRO 146 Ca -0.46 -0.06 -0.44 0.00 0.11 0.00 0.00 66.00 65.16 2b1x h PRO 146 Cb 1.24 -0.21 -0.37 0.00 0.11 0.00 0.00 31.00 31.77 2b1x h PRO 146 CO 0.93 0.61 -0.77 -0.80 -0.21 0.00 0.00 178.00 177.75 2b1x s ASN 147 N -6.05 1.51 -0.04 -2.05 0.01 -0.61 -4.72 114.94 102.99 2b1x s ASN 147 Ca -0.11 -0.11 0.04 0.00 -0.71 0.00 0.00 52.86 51.96 2b1x s ASN 147 Cb 0.20 -0.48 0.00 0.00 0.41 0.00 0.00 41.25 41.38 2b1x s ASN 147 CO 0.79 -0.16 -0.14 -0.22 -1.51 0.00 0.00 177.10 175.87 2b1x s LEU 148 N 1.72 1.85 0.23 0.60 2.96 -1.26 -0.88 118.68 123.90 2b1x s LEU 148 Ca 0.02 -0.29 -0.21 0.00 -0.22 0.00 0.00 54.13 53.42 2b1x s LEU 148 Cb -0.13 -0.81 0.04 0.00 0.50 0.00 0.00 46.19 45.79 2b1x s LEU 148 CO -0.04 0.11 0.65 0.00 -1.32 0.00 0.00 176.35 175.75 2b1x s ALA 149 N 0.13 -1.30 -0.01 5.97 0.00 -0.89 -5.04 121.76 120.61 2b1x s ALA 149 Ca -0.04 -0.04 0.05 0.00 0.00 0.00 0.00 51.96 51.93 2b1x s ALA 149 Cb -0.11 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.87 2b1x s ALA 149 CO 0.02 -0.92 -0.18 0.45 0.00 0.00 0.00 175.76 175.13 2b1x s SER 150 N -2.86 2.06 -0.18 0.00 0.15 -1.26 -0.87 113.70 110.74 2b1x s SER 150 Ca 0.08 -0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.41 2b1x s SER 150 Cb -0.04 -0.23 0.04 0.00 -1.71 0.00 0.00 66.02 64.09 2b1x s SER 150 CO -0.01 0.21 -0.08 -0.47 1.20 0.00 0.00 173.24 174.09 2b1x s TYR 151 N -0.43 2.13 -1.45 3.44 6.14 -0.43 -4.87 117.35 121.88 2b1x s TYR 151 Ca 0.07 -1.38 -0.01 0.00 0.64 0.00 0.00 57.07 56.38 2b1x s TYR 151 Cb -0.07 -1.51 0.01 0.00 0.42 0.00 0.00 41.96 40.81 2b1x s TYR 151 CO -0.01 -0.69 0.37 1.63 0.64 0.00 0.00 175.55 177.49 2b1x n LYS 152 N 4.76 -2.89 0.00 4.97 4.76 -1.26 -1.53 118.16 126.98 2b1x n LYS 152 Ca -0.14 0.35 0.00 0.00 -2.87 0.00 0.00 58.31 55.65 2b1x n LYS 152 Cb 0.47 -4.41 0.00 0.00 -1.84 0.00 0.00 35.03 29.25 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 -2.04 3.36 3.60 0.72 0.00 -1.26 -4.92 105.19 104.65 2b1x n GLY 153 Ca -0.29 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 4.10 -0.21 0.99 1.02 -0.58 -0.61 118.68 123.39 2b1x s LEU 154 Ca 0.00 0.47 -0.22 0.00 0.02 0.00 0.00 54.13 54.40 2b1x s LEU 154 Cb 0.00 -3.06 -0.02 0.00 0.02 0.00 0.00 46.19 43.13 2b1x s LEU 154 CO 0.00 -0.70 0.70 -0.63 0.02 0.00 0.00 176.35 175.74 2b1x s ILE 155 N 3.08 4.96 0.23 -0.59 1.01 0.27 -1.31 121.20 128.85 2b1x s ILE 155 Ca 0.32 1.33 0.11 0.00 0.00 0.00 0.00 60.65 62.41 2b1x s ILE 155 Cb -0.13 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.28 2b1x s ILE 155 CO 0.16 0.05 -0.16 -0.36 0.00 0.00 0.00 174.94 174.62 2b1x s PHE 156 N 2.22 2.43 0.06 3.97 0.40 -0.05 -0.46 117.98 126.56 2b1x s PHE 156 Ca 0.31 -0.30 0.03 0.00 -0.60 0.00 0.00 56.93 56.38 2b1x s PHE 156 Cb -0.16 -1.14 -0.03 0.00 0.51 0.00 0.00 43.02 42.21 2b1x s PHE 156 CO 0.10 0.59 -0.10 0.20 0.70 0.00 0.00 175.22 176.71 2b1x s GLY 157 N -3.11 0.68 0.02 4.36 0.00 0.02 -2.10 107.32 107.18 2b1x s GLY 157 Ca 0.26 -0.95 0.04 0.00 0.00 0.00 0.00 44.72 44.07 2b1x s GLY 157 CO 0.14 -1.00 -0.12 -0.45 0.00 0.00 0.00 173.10 171.67 2b1x s SER 158 N -1.90 1.38 0.00 1.64 0.15 -0.06 -0.05 113.70 114.85 2b1x s SER 158 Ca -0.03 -0.35 0.29 0.00 0.70 0.00 0.00 55.95 56.56 2b1x s SER 158 Cb -0.07 -0.10 1.28 0.00 -1.71 0.00 0.00 66.02 65.41 2b1x s SER 158 CO 0.00 0.05 1.92 0.18 1.20 0.00 0.00 173.24 176.59 2b1x n LEU 159 N 2.26 0.14 -4.50 3.45 4.32 -1.26 -1.57 117.00 119.84 2b1x n LEU 159 Ca -0.17 0.27 -0.41 0.00 -0.02 0.00 0.00 56.01 55.69 2b1x n LEU 159 Cb 0.55 -0.33 -0.11 0.00 -1.62 0.00 0.00 43.42 41.92 2b1x n LEU 159 CO 0.23 0.03 -0.12 -0.62 -1.22 0.00 0.00 177.39 175.69 2b1x s ASP 160 N -2.73 6.02 0.59 -1.43 2.15 -1.22 -4.77 116.67 115.28 2b1x s ASP 160 Ca 0.22 -0.54 0.37 0.00 0.43 0.00 0.00 52.55 53.03 2b1x s ASP 160 Cb 0.20 -2.13 1.68 0.00 -0.30 0.00 0.00 42.92 42.37 2b1x s ASP 160 CO 0.51 -0.28 2.10 1.55 -0.17 0.00 0.00 175.17 178.88 2b1x h PRO 161 N 8.51 0.00 -0.54 4.34 0.13 -1.86 -2.46 132.00 140.12 2b1x h PRO 161 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2b1x h PRO 161 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2b1x h PRO 161 CO 0.65 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.14 2b1x n HIS 162 N -3.09 1.51 -1.45 1.56 8.25 -1.26 -4.93 115.22 115.81 2b1x n HIS 162 Ca -0.00 -0.68 -0.36 0.00 -0.26 0.00 0.00 57.72 56.41 2b1x n HIS 162 Cb 0.24 -0.32 0.09 0.00 1.12 0.00 0.00 29.99 31.11 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 0.66 0.21 -1.32 -1.41 0.00 -0.93 -4.98 120.51 112.73 2b1x n ALA 163 Ca 0.25 -0.14 -0.35 0.00 0.00 0.00 0.00 53.44 53.20 2b1x n ALA 163 Cb 0.96 -2.19 0.10 0.00 0.00 0.00 0.00 19.45 18.32 2b1x n ALA 163 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2b1x n ASP 164 N -1.89 1.15 -4.72 0.00 8.00 -1.26 -4.97 116.55 112.86 2b1x n ASP 164 Ca 0.14 0.67 -0.35 0.00 0.71 0.00 0.00 54.79 55.96 2b1x n ASP 164 Cb 0.49 -1.49 0.09 0.00 -0.02 0.00 0.00 41.12 40.19 2b1x n ASP 164 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2b1x s SER 165 N -1.81 4.17 0.29 -2.24 1.04 -1.26 -4.75 113.70 109.13 2b1x s SER 165 Ca 0.76 2.42 0.03 0.00 0.48 0.00 0.00 55.95 59.64 2b1x s SER 165 Cb -0.33 -2.60 0.64 0.00 0.10 0.00 0.00 66.02 63.83 2b1x s SER 165 CO 0.48 -2.29 1.79 0.25 0.98 0.00 0.00 173.24 174.46 2b1x h LEU 166 N -0.22 0.79 -0.52 2.42 6.46 -1.98 -0.20 115.31 122.07 2b1x h LEU 166 Ca -0.48 0.08 -0.10 0.00 -0.12 0.00 0.00 57.88 57.26 2b1x h LEU 166 Cb 1.31 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 41.15 2b1x h LEU 166 CO 0.50 0.34 -0.07 -0.33 -0.62 0.00 0.00 178.44 178.26 2b1x h GLU 167 N 0.82 0.97 -0.49 1.25 5.08 -1.95 0.34 114.58 120.60 2b1x h GLU 167 Ca 0.53 -0.34 -0.11 0.00 -1.00 0.00 0.00 59.36 58.44 2b1x h GLU 167 Cb 0.71 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2b1x h GLU 167 CO -0.34 1.01 -0.14 -0.44 -1.00 0.00 0.00 179.01 178.10 2b1x h ASP 168 N 0.83 0.94 -0.41 1.42 3.32 -1.80 0.25 116.42 120.98 2b1x h ASP 168 Ca 0.14 -0.31 -0.04 0.00 0.02 0.00 0.00 57.03 56.83 2b1x h ASP 168 Cb 0.62 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2b1x h ASP 168 CO 0.04 1.07 0.09 0.22 -1.72 0.00 0.00 179.24 178.95 2b1x h TYR 169 N 0.83 0.69 -0.44 4.55 3.20 -0.68 -2.73 116.97 122.38 2b1x h TYR 169 Ca 0.13 -0.08 -0.13 0.00 3.14 0.00 0.00 58.73 61.78 2b1x h TYR 169 Cb 0.68 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 2b1x h TYR 169 CO 0.04 0.66 -0.26 -0.07 -1.64 0.00 0.00 178.16 176.89 2b1x h LEU 170 N 0.52 0.95 0.00 2.82 3.38 -0.93 -3.45 115.31 118.60 2b1x h LEU 170 Ca 0.13 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2b1x h LEU 170 Cb 0.32 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2b1x h LEU 170 CO 0.00 1.15 0.00 0.61 0.09 0.00 0.00 178.44 180.29 2b1x n GLY 171 N -0.09 3.14 0.24 0.83 0.00 0.07 -1.87 105.19 107.51 2b1x n GLY 171 Ca -0.00 -0.18 0.16 0.00 0.00 0.00 0.00 46.02 46.00 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 3.07 0.00 0.13 1.61 3.32 -1.88 -2.51 116.42 120.17 2b1x h ASP 172 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2b1x h ASP 172 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2b1x h ASP 172 CO 0.00 0.00 -0.07 0.25 -1.72 0.00 0.00 179.24 177.70 2b1x h LEU 173 N 0.00 0.00 -1.28 1.55 6.46 -1.75 -2.72 115.31 117.56 2b1x h LEU 173 Ca 0.00 0.00 0.15 0.00 -0.12 0.00 0.00 57.88 57.91 2b1x h LEU 173 Cb 0.21 0.00 -0.07 0.00 -0.73 0.00 0.00 40.66 40.07 2b1x h LEU 173 CO 0.00 0.07 0.58 0.11 -0.62 0.00 0.00 178.44 178.58 2b1x h LYS 174 N 0.00 0.65 -1.00 1.25 1.57 -1.59 -0.37 116.57 117.08 2b1x h LYS 174 Ca -0.00 -0.04 0.11 0.00 -1.87 0.00 0.00 60.65 58.85 2b1x h LYS 174 Cb 0.15 -0.15 -0.08 0.00 0.08 0.00 0.00 32.23 32.23 2b1x h LYS 174 CO 0.01 0.43 0.63 0.35 -0.57 0.00 0.00 179.45 180.30 2b1x h PHE 175 N 0.67 1.15 0.09 -1.35 3.04 -1.72 -1.72 116.94 117.09 2b1x h PHE 175 Ca 0.46 0.03 -0.31 0.00 3.98 0.00 0.00 57.97 62.13 2b1x h PHE 175 Cb 0.78 -0.37 -0.02 0.00 2.56 0.00 0.00 35.95 38.91 2b1x h PHE 175 CO -0.00 0.48 -1.67 1.88 -2.02 0.00 0.00 178.31 176.98 2b1x h TYR 176 N 1.02 0.34 -0.92 0.41 -1.99 -1.29 -3.31 116.97 111.23 2b1x h TYR 176 Ca 0.49 -0.25 0.08 0.00 2.00 0.00 0.00 58.73 61.05 2b1x h TYR 176 Cb 0.44 -0.01 -0.07 0.00 2.00 0.00 0.00 36.73 39.08 2b1x h TYR 176 CO -0.00 1.38 0.57 -0.07 -0.00 0.00 0.00 178.16 180.03 2b1x h LEU 177 N 0.05 0.87 -0.98 3.88 3.38 -0.94 -2.26 115.31 119.32 2b1x h LEU 177 Ca -0.29 0.03 0.13 0.00 0.09 0.00 0.00 57.88 57.84 2b1x h LEU 177 Cb 2.01 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 42.52 2b1x h LEU 177 CO 0.12 0.53 0.61 0.44 0.09 0.00 0.00 178.44 180.23 2b1x h ASP 178 N 0.99 0.87 0.14 -0.43 3.32 -1.41 0.21 116.42 120.12 2b1x h ASP 178 Ca 0.42 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.50 2b1x h ASP 178 Cb 0.27 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.71 2b1x h ASP 178 CO -0.21 0.44 -0.10 0.40 -1.72 0.00 0.00 179.24 178.06 2b1x h ILE 179 N 0.93 0.88 0.00 0.35 2.04 -1.52 0.07 117.51 120.27 2b1x h ILE 179 Ca 0.50 -0.36 -0.36 0.00 1.00 0.00 0.00 64.86 65.64 2b1x h ILE 179 Cb 0.53 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 37.75 2b1x h ILE 179 CO -0.28 0.10 -2.36 0.52 0.00 0.00 0.00 178.15 176.12 2b1x n VAL 180 N -4.15 1.37 -0.00 1.67 0.31 -0.58 -4.69 118.33 112.26 2b1x n VAL 180 Ca -0.03 -0.69 0.03 0.00 -0.01 0.00 0.00 64.34 63.64 2b1x n VAL 180 Cb 0.18 -0.90 -0.12 0.00 -0.91 0.00 0.00 33.84 32.09 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 -2.95 0.41 -0.61 7.52 4.77 0.63 -4.65 117.00 122.11 2b1x n LEU 181 Ca -0.37 0.17 0.05 0.00 -0.03 0.00 0.00 56.01 55.83 2b1x n LEU 181 Cb 1.05 0.13 0.20 0.00 -2.33 0.00 0.00 43.42 42.47 2b1x n LEU 181 CO 0.33 0.14 0.47 -0.67 -1.33 0.00 0.00 177.39 176.33 2b1x n ASP 182 N -2.64 2.06 0.22 -1.43 2.03 0.00 -4.54 116.55 112.26 2b1x n ASP 182 Ca -0.12 -3.69 0.10 0.00 0.52 0.00 0.00 54.79 51.60 2b1x n ASP 182 Cb 0.79 -0.53 0.44 0.00 -0.72 0.00 0.00 41.12 41.10 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 0.84 0.00 -5.52 -0.67 3.08 -1.83 -3.44 114.38 106.85 2b1x h ARG 183 Ca 0.04 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.63 2b1x h ARG 183 Cb 1.14 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 30.96 2b1x h ARG 183 CO 0.08 0.22 -0.80 -1.54 -1.07 0.00 0.00 179.97 176.87 2b1x s SER 184 N -6.18 1.86 0.16 7.04 1.04 -1.26 -1.63 113.70 114.73 2b1x s SER 184 Ca 0.01 -0.57 -0.16 0.00 0.48 0.00 0.00 55.95 55.71 2b1x s SER 184 Cb 0.10 -0.09 0.07 0.00 0.10 0.00 0.00 66.02 66.19 2b1x s SER 184 CO 0.64 -0.01 1.75 0.44 0.98 0.00 0.00 173.24 177.04 2b1x h ASP 185 N 4.49 0.14 1.14 7.02 3.32 -1.90 -2.48 116.42 128.15 2b1x h ASP 185 Ca -0.41 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2b1x h ASP 185 Cb 1.18 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2b1x h ASP 185 CO 0.41 0.11 0.00 0.00 -1.72 0.00 0.00 179.24 178.05 2b1x n ALA 186 N -2.34 2.32 0.00 3.45 0.00 -1.26 -5.02 120.51 117.65 2b1x n ALA 186 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2b1x n ALA 186 Cb 0.13 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.11 2b1x n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b1x n GLY 187 N 1.44 -1.06 3.85 0.00 0.00 -0.93 -4.81 105.19 103.68 2b1x n GLY 187 Ca 0.07 -1.63 -0.32 0.00 0.00 0.00 0.00 46.02 44.14 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 -2.07 3.77 -0.05 0.99 1.02 -1.26 -0.84 118.68 120.24 2b1x s LEU 188 Ca 0.00 1.40 0.03 0.00 0.02 0.00 0.00 54.13 55.59 2b1x s LEU 188 Cb 0.00 -4.30 0.00 0.00 0.02 0.00 0.00 46.19 41.91 2b1x s LEU 188 CO 0.00 -0.46 -0.13 0.00 0.02 0.00 0.00 176.35 175.77 2b1x s GLN 189 N -3.80 1.55 -0.01 1.70 -2.07 0.04 -4.70 119.66 112.36 2b1x s GLN 189 Ca 0.56 -0.47 -0.30 0.00 -1.82 0.00 0.00 55.36 53.33 2b1x s GLN 189 Cb -0.10 -1.34 -0.05 0.00 -1.09 0.00 0.00 33.01 30.43 2b1x s GLN 189 CO 0.28 0.14 1.30 0.08 -1.32 0.00 0.00 175.29 175.77 2b1x s VAL 190 N 0.29 3.95 -0.31 3.63 1.01 -1.26 -1.91 120.40 125.79 2b1x s VAL 190 Ca -0.07 1.32 -0.24 0.00 0.00 0.00 0.00 61.98 62.99 2b1x s VAL 190 Cb -0.12 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.41 2b1x s VAL 190 CO 0.02 0.01 0.80 -0.69 0.00 0.00 0.00 175.10 175.24 2b1x s VAL 191 N 2.17 4.78 0.00 2.92 1.01 -0.43 -4.81 120.40 126.04 2b1x s VAL 191 Ca 0.60 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.76 2b1x s VAL 191 Cb -0.29 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 31.93 2b1x s VAL 191 CO 0.25 -0.27 0.00 0.61 0.00 0.00 0.00 175.10 175.69 2b1x n GLY 192 N 4.21 1.59 3.37 4.51 0.00 -1.26 -4.73 105.19 112.89 2b1x n GLY 192 Ca 0.04 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.00 -0.03 0.53 4.61 0.00 -1.26 -5.05 121.76 119.56 2b1x s ALA 193 Ca 0.00 -0.89 -0.20 0.00 0.00 0.00 0.00 51.96 50.88 2b1x s ALA 193 Cb 0.00 0.91 -0.06 0.00 0.00 0.00 0.00 23.12 23.97 2b1x s ALA 193 CO 0.00 -0.68 1.12 -1.25 0.00 0.00 0.00 175.76 174.95 2b1x s PRO 194 N -3.98 3.43 0.09 0.00 0.04 -1.26 -4.78 135.00 128.55 2b1x s PRO 194 Ca 0.18 1.60 -0.31 0.00 0.04 0.00 0.00 61.00 62.51 2b1x s PRO 194 Cb 0.03 -2.04 -0.06 0.00 0.04 0.00 0.00 34.50 32.46 2b1x s PRO 194 CO 0.02 -0.78 1.23 -0.65 0.04 0.00 0.00 177.00 176.85 2b1x s GLN 195 N -3.24 4.43 -0.11 4.56 -0.21 -0.45 -4.84 119.66 119.81 2b1x s GLN 195 Ca 0.72 1.83 0.01 0.00 0.02 0.00 0.00 55.36 57.94 2b1x s GLN 195 Cb -0.23 -3.31 0.02 0.00 1.00 0.00 0.00 33.01 30.48 2b1x s GLN 195 CO 0.27 -0.25 -0.11 1.03 -2.12 0.00 0.00 175.29 174.10 2b1x s ARG 196 N 0.84 1.85 0.13 2.91 0.52 -1.26 -0.73 118.95 123.21 2b1x s ARG 196 Ca 0.59 -0.41 -0.16 0.00 -0.52 0.00 0.00 55.73 55.23 2b1x s ARG 196 Cb -0.31 -1.70 0.03 0.00 0.52 0.00 0.00 34.95 33.49 2b1x s ARG 196 CO 0.31 -0.15 0.40 1.67 0.02 0.00 0.00 175.30 177.55 2b1x s TRP 197 N 1.28 -0.15 -0.22 -0.53 -2.14 -0.91 -4.98 118.94 111.29 2b1x s TRP 197 Ca -0.02 -0.18 -0.10 0.00 2.66 0.00 0.00 56.10 58.46 2b1x s TRP 197 Cb -0.14 0.25 -0.05 0.00 -3.10 0.00 0.00 33.47 30.43 2b1x s TRP 197 CO -0.04 -0.72 0.13 0.08 -2.66 0.00 0.00 176.95 173.74 2b1x s VAL 198 N -3.82 5.24 -0.09 -0.66 1.01 -1.26 -0.63 120.40 120.19 2b1x s VAL 198 Ca 0.04 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.17 2b1x s VAL 198 Cb 0.02 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 2b1x s VAL 198 CO -0.10 0.38 -0.13 -0.63 0.00 0.00 0.00 175.10 174.63 2b1x s ILE 199 N 0.82 3.15 -1.39 2.22 1.01 -0.28 -4.99 121.20 121.74 2b1x s ILE 199 Ca 0.07 -0.66 -0.15 0.00 0.00 0.00 0.00 60.65 59.91 2b1x s ILE 199 Cb -0.13 -2.29 0.02 0.00 0.01 0.00 0.00 42.46 40.08 2b1x s ILE 199 CO 0.02 0.56 2.19 -0.90 0.00 0.00 0.00 174.94 176.81 2b1x n ASP 200 N 2.91 3.75 -3.85 3.58 5.75 -1.26 -1.08 116.55 126.35 2b1x n ASP 200 Ca -0.18 -2.82 -0.10 0.00 -0.01 0.00 0.00 54.79 51.68 2b1x n ASP 200 Cb 0.52 -1.61 -0.08 0.00 -1.03 0.00 0.00 41.12 38.93 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 3.41 -0.31 0.28 2.12 0.00 -0.93 -4.32 121.76 122.01 2b1x s ALA 201 Ca 0.48 -0.42 -0.29 0.00 0.00 0.00 0.00 51.96 51.73 2b1x s ALA 201 Cb 0.14 0.37 -0.10 0.00 0.00 0.00 0.00 23.12 23.53 2b1x s ALA 201 CO -0.07 -0.43 1.09 1.21 0.00 0.00 0.00 175.76 177.57 2b1x s ASN 202 N -2.42 7.27 0.43 0.00 3.84 -1.26 -2.56 114.94 120.25 2b1x s ASN 202 Ca -0.01 2.25 0.17 0.00 0.21 0.00 0.00 52.86 55.48 2b1x s ASN 202 Cb 0.01 -2.63 1.09 0.00 -0.55 0.00 0.00 41.25 39.18 2b1x s ASN 202 CO -0.07 -0.14 1.91 4.11 -2.79 0.00 0.00 177.10 180.12 2b1x h TRP 203 N 3.79 0.46 0.00 0.43 5.08 -1.85 -2.58 115.95 121.28 2b1x h TRP 203 Ca -0.47 0.01 -0.02 0.00 1.08 0.00 0.00 58.89 59.50 2b1x h TRP 203 Cb 1.21 -0.14 -0.00 0.00 -3.00 0.00 0.00 29.16 27.22 2b1x h TRP 203 CO 0.59 0.16 -0.09 0.87 -1.28 0.00 0.00 178.44 178.69 2b1x h LYS 204 N 0.38 0.00 -0.50 0.12 1.57 -1.92 -2.02 116.57 114.20 2b1x h LYS 204 Ca 0.39 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.12 2b1x h LYS 204 Cb 0.95 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.24 2b1x h LYS 204 CO -0.12 0.09 0.12 -0.07 -0.57 0.00 0.00 179.45 178.89 2b1x h LEU 205 N 0.00 0.71 -0.22 2.94 3.38 -1.86 1.00 115.31 121.26 2b1x h LEU 205 Ca -0.00 -0.12 -0.21 0.00 0.09 0.00 0.00 57.88 57.63 2b1x h LEU 205 Cb 0.24 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.81 2b1x h LEU 205 CO 0.01 0.71 -0.72 1.23 0.09 0.00 0.00 178.44 179.77 2b1x h GLY 206 N 0.93 0.86 0.88 0.83 0.00 -1.55 -2.23 103.07 102.80 2b1x h GLY 206 Ca 0.16 -1.16 -0.02 0.00 0.00 0.00 0.00 47.33 46.31 2b1x h GLY 206 CO -0.00 1.04 0.07 0.00 0.00 0.00 0.00 176.54 177.65 2b1x h ALA 207 N 0.62 0.34 -0.66 3.60 0.00 -1.34 -2.18 119.26 119.63 2b1x h ALA 207 Ca -0.03 -0.15 0.09 0.00 0.00 0.00 0.00 54.91 54.81 2b1x h ALA 207 Cb 1.34 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 18.96 2b1x h ALA 207 CO 0.15 -0.02 0.31 0.22 0.00 0.00 0.00 179.25 179.91 2b1x h ASP 208 N 0.24 0.38 -0.13 0.00 1.82 -0.84 -0.64 116.42 117.26 2b1x h ASP 208 Ca 0.08 0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 56.76 2b1x h ASP 208 Cb 0.26 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.27 2b1x h ASP 208 CO -0.00 0.22 -0.01 -1.13 -1.61 0.00 0.00 179.24 176.72 2b1x h ASN 209 N 0.54 0.23 1.53 2.28 -0.73 -1.14 -3.23 115.58 115.06 2b1x h ASN 209 Ca 0.33 -0.33 -0.05 0.00 1.87 0.00 0.00 56.30 58.12 2b1x h ASN 209 Cb 0.35 -0.06 -0.01 0.00 0.27 0.00 0.00 38.32 38.87 2b1x h ASN 209 CO -0.27 0.50 -0.22 -0.26 -0.37 0.00 0.00 177.43 176.80 2b1x h PHE 210 N -0.05 0.00 0.00 0.67 -1.00 -1.27 -1.27 116.94 114.01 2b1x h PHE 210 Ca 0.03 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.74 2b1x h PHE 210 Cb 0.39 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.94 2b1x h PHE 210 CO 0.04 0.22 -0.36 -0.24 -1.61 0.00 0.00 178.31 176.36 2b1x h VAL 211 N 0.00 1.05 0.00 -0.55 3.04 -1.13 -1.93 116.25 116.73 2b1x h VAL 211 Ca -0.00 -1.33 0.00 0.00 -1.01 0.00 0.00 66.70 64.36 2b1x h VAL 211 Cb 1.05 1.76 0.00 0.00 -2.01 0.00 0.00 31.29 32.09 2b1x h VAL 211 CO 0.03 0.35 0.00 0.61 -1.01 0.00 0.00 177.57 177.55 2b1x n GLY 212 N -0.20 0.74 3.26 3.17 0.00 -1.23 -3.47 105.19 107.46 2b1x n GLY 212 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 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 5.90 -0.07 1.61 -1.08 -0.48 -4.65 116.67 117.90 2b1x s ASP 213 Ca 0.00 -1.80 0.20 0.00 -0.52 0.00 0.00 52.55 50.43 2b1x s ASP 213 Cb 0.00 -2.09 -0.30 0.00 -1.46 0.00 0.00 42.92 39.07 2b1x s ASP 213 CO 0.00 -0.74 0.35 0.00 0.52 0.00 0.00 175.17 175.30 2b1x n ALA 214 N 5.05 2.43 -0.29 3.66 0.00 -1.26 -4.56 120.51 125.53 2b1x n ALA 214 Ca -0.11 -0.72 0.11 0.00 0.00 0.00 0.00 53.44 52.73 2b1x n ALA 214 Cb 0.41 -0.57 0.28 0.00 0.00 0.00 0.00 19.45 19.57 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 0.58 0.00 0.00 3.20 -1.87 -1.64 116.97 117.24 2b1x h TYR 215 Ca -0.15 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.77 2b1x h TYR 215 Cb 1.30 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.45 2b1x h TYR 215 CO 0.00 -0.04 0.00 1.12 -1.64 0.00 0.00 178.16 177.60 2b1x h HIS 216 N 0.39 0.00 -0.65 -3.82 2.07 -1.99 -3.11 115.15 108.04 2b1x h HIS 216 Ca 0.52 0.00 0.06 0.00 -2.85 0.00 0.00 60.37 58.10 2b1x h HIS 216 Cb 0.96 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.89 2b1x h HIS 216 CO -0.16 0.00 0.36 1.15 -3.07 0.00 0.00 177.93 176.21 2b1x h THR 217 N 0.00 0.97 -0.66 6.12 2.02 -1.61 -0.28 112.91 119.47 2b1x h THR 217 Ca 0.00 -0.23 0.04 0.00 0.77 0.00 0.00 66.41 66.99 2b1x h THR 217 Cb 0.10 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 66.71 2b1x h THR 217 CO 0.00 0.12 0.44 0.24 0.37 0.00 0.00 175.52 176.69 2b1x h MET 218 N 0.68 0.74 0.00 6.66 2.86 -1.76 -1.90 114.93 122.20 2b1x h MET 218 Ca 0.29 -0.04 -0.25 0.00 -2.06 0.00 0.00 59.70 57.64 2b1x h MET 218 Cb 0.17 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 2b1x h MET 218 CO -0.18 0.49 -1.74 -0.12 1.06 0.00 0.00 176.91 176.43 2b1x n MET 219 N -4.46 0.42 -0.25 1.72 0.00 -1.07 -3.65 117.12 109.83 2b1x n MET 219 Ca 0.08 0.18 0.00 0.00 0.00 0.00 0.00 57.70 57.97 2b1x n MET 219 Cb 0.15 -1.22 0.13 0.00 0.00 0.00 0.00 33.22 32.28 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 -0.74 0.93 -0.61 1.12 2.02 -1.18 -2.69 112.91 111.76 2b1x h THR 220 Ca -0.37 -0.25 -0.29 0.00 0.77 0.00 0.00 66.41 66.27 2b1x h THR 220 Cb 1.25 0.16 -0.17 0.00 -1.74 0.00 0.00 68.15 67.64 2b1x h THR 220 CO -0.22 0.13 0.22 1.41 0.37 0.00 0.00 175.52 177.43 2b1x n HIS 221 N -4.78 1.92 -0.35 3.16 8.25 -0.72 -4.63 115.22 118.07 2b1x n HIS 221 Ca 0.10 -1.60 0.06 0.00 -0.26 0.00 0.00 57.72 56.03 2b1x n HIS 221 Cb 0.22 -0.66 0.23 0.00 1.12 0.00 0.00 29.99 30.90 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 1.24 0.94 -0.82 -0.41 9.65 -1.48 -0.22 114.38 123.27 2b1x h ARG 222 Ca 0.36 -0.06 0.10 0.00 -1.10 0.00 0.00 59.98 59.28 2b1x h ARG 222 Cb 2.14 -0.21 -0.08 0.00 -1.39 0.00 0.00 29.97 30.44 2b1x h ARG 222 CO 0.67 0.62 0.46 0.66 2.80 0.00 0.00 179.97 185.18 2b1x h SER 223 N 0.97 0.64 0.57 -3.80 4.64 -1.84 -1.08 113.55 113.65 2b1x h SER 223 Ca 0.48 0.06 -0.14 0.00 -0.47 0.00 0.00 61.79 61.72 2b1x h SER 223 Cb 0.47 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 2b1x h SER 223 CO -0.26 0.35 -0.64 0.24 -0.87 0.00 0.00 176.83 175.64 2b1x h MET 224 N 0.75 0.07 -0.60 4.77 2.86 -1.46 -1.96 114.93 119.36 2b1x h MET 224 Ca 0.41 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.95 2b1x h MET 224 Cb 0.41 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.06 2b1x h MET 224 CO -0.27 0.69 0.19 0.28 1.06 0.00 0.00 176.91 178.86 2b1x h VAL 225 N 0.05 1.24 -0.08 -2.22 2.07 -0.44 -0.14 116.25 116.73 2b1x h VAL 225 Ca -0.01 -0.82 -0.10 0.00 0.82 0.00 0.00 66.70 66.59 2b1x h VAL 225 Cb 1.14 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 2b1x h VAL 225 CO 0.09 0.31 -0.39 -0.33 0.02 0.00 0.00 177.57 177.27 2b1x h GLU 226 N 0.85 0.17 -0.00 1.57 5.08 -0.98 -2.45 114.58 118.81 2b1x h GLU 226 Ca 0.19 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2b1x h GLU 226 Cb 0.28 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2b1x h GLU 226 CO -0.01 0.54 -0.07 1.28 -1.00 0.00 0.00 179.01 179.75 2b1x n LEU 227 N -4.05 0.08 0.00 1.33 4.77 -0.76 -4.92 117.00 113.45 2b1x n LEU 227 Ca -0.01 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 2b1x n LEU 227 Cb 0.45 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2b1x n LEU 227 CO 0.41 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 2b1x n GLY 228 N 1.48 0.74 0.09 -0.72 0.00 -0.67 -4.75 105.19 101.37 2b1x n GLY 228 Ca 0.08 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 0.21 -4.91 0.99 4.32 -0.15 -4.92 117.00 112.54 2b1x n LEU 229 Ca 0.00 0.10 -0.26 0.00 -0.02 0.00 0.00 56.01 55.82 2b1x n LEU 229 Cb 0.00 0.42 -0.04 0.00 -1.62 0.00 0.00 43.42 42.18 2b1x n LEU 229 CO 0.00 0.47 -0.13 0.00 -1.22 0.00 0.00 177.39 176.51 2b1x s ALA 230 N -2.53 3.88 0.14 -1.18 0.00 -0.95 -4.70 121.76 116.43 2b1x s ALA 230 Ca -0.09 -1.06 -0.33 0.00 0.00 0.00 0.00 51.96 50.48 2b1x s ALA 230 Cb 0.07 -1.69 -0.13 0.00 0.00 0.00 0.00 23.12 21.37 2b1x s ALA 230 CO 0.83 0.55 1.68 -2.30 0.00 0.00 0.00 175.76 176.52 2b1x n PRO 231 N -0.46 2.39 0.18 0.00 -0.02 -1.26 -4.47 135.00 131.37 2b1x n PRO 231 Ca -0.07 0.86 0.07 0.00 -2.02 0.00 0.00 63.50 62.35 2b1x n PRO 231 Cb 0.54 -2.68 0.13 0.00 -0.02 0.00 0.00 33.50 31.47 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 6.83 0.00 -6.24 0.52 0.13 -1.95 -3.45 132.00 127.85 2b1x h PRO 232 Ca -0.45 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.12 2b1x h PRO 232 Cb 1.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.34 2b1x h PRO 232 CO 0.92 0.25 1.03 0.34 -0.23 0.00 0.00 178.00 180.32 2b1x s ASP 233 N -6.32 6.68 0.46 1.44 -1.08 -1.26 -4.89 116.67 111.71 2b1x s ASP 233 Ca 0.05 1.84 0.31 0.00 -0.52 0.00 0.00 52.55 54.23 2b1x s ASP 233 Cb 0.07 -2.53 1.63 0.00 -1.46 0.00 0.00 42.92 40.63 2b1x s ASP 233 CO 0.70 -0.97 1.96 1.55 0.52 0.00 0.00 175.17 178.93 2b1x h PRO 234 N 9.42 0.00 -0.61 4.34 0.13 -2.03 -1.31 132.00 141.94 2b1x h PRO 234 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2b1x h PRO 234 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2b1x h PRO 234 CO 0.98 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.79 2b1x n GLN 235 N -2.64 2.50 -0.25 0.86 6.02 -1.26 -4.68 117.38 117.94 2b1x n GLN 235 Ca -0.01 -2.32 0.21 0.00 -0.01 0.00 0.00 57.00 54.86 2b1x n GLN 235 Cb 0.10 -1.51 0.54 0.00 1.02 0.00 0.00 30.24 30.38 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 3.90 0.50 -0.00 1.08 -5.15 -1.62 -0.53 116.94 115.11 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 0.89 -0.15 0.00 0.00 0.22 0.00 0.00 35.95 36.91 2b1x h PHE 236 CO 0.40 0.11 -0.12 0.00 -2.00 0.00 0.00 178.31 176.70 2b1x n ALA 237 N -2.53 2.74 0.23 12.09 0.00 -1.26 -2.92 120.51 128.87 2b1x n ALA 237 Ca 0.20 -0.23 0.09 0.00 0.00 0.00 0.00 53.44 53.50 2b1x n ALA 237 Cb 0.76 -1.35 0.56 0.00 0.00 0.00 0.00 19.45 19.42 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 0.31 0.00 -6.27 0.00 3.38 -1.45 0.45 115.31 111.73 2b1x h LEU 238 Ca 0.00 0.00 -0.75 0.00 0.09 0.00 0.00 57.88 57.22 2b1x h LEU 238 Cb 0.39 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.00 2b1x h LEU 238 CO 0.00 0.21 2.15 -1.22 0.09 0.00 0.00 178.44 179.67 2b1x n TYR 239 N -3.81 2.87 -3.78 1.13 4.02 -1.15 -4.53 117.16 111.92 2b1x n TYR 239 Ca -0.02 -2.80 0.00 0.00 -0.01 0.00 0.00 57.90 55.08 2b1x n TYR 239 Cb 0.31 -1.95 0.00 0.00 -0.02 0.00 0.00 39.34 37.69 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 2.66 0.73 2.90 2.72 0.00 -1.25 -0.94 105.19 112.01 2b1x n GLY 240 Ca 0.44 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.01 0.17 -0.28 1.61 2.56 0.73 -2.24 118.70 119.25 2b1x s GLU 241 Ca 0.07 -0.07 -0.05 0.00 0.00 0.00 0.00 54.97 54.91 2b1x s GLU 241 Cb -0.00 -0.16 0.01 0.00 2.00 0.00 0.00 34.13 35.98 2b1x s GLU 241 CO 0.00 0.04 0.03 -1.58 -0.56 0.00 0.00 175.26 173.20 2b1x s HIS 242 N -0.03 3.12 -0.01 5.30 5.65 -0.62 -1.05 115.29 127.64 2b1x s HIS 242 Ca 0.01 -1.17 0.04 0.00 0.25 0.00 0.00 55.06 54.19 2b1x s HIS 242 Cb -0.01 -2.19 -0.01 0.00 -1.18 0.00 0.00 32.58 29.19 2b1x s HIS 242 CO -0.00 -0.63 -0.15 0.42 -0.65 0.00 0.00 174.74 173.74 2b1x s ILE 243 N 1.44 1.17 0.14 0.89 1.01 0.09 -0.94 121.20 125.00 2b1x s ILE 243 Ca 0.02 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.03 2b1x s ILE 243 Cb -0.17 -0.98 -0.04 0.00 0.01 0.00 0.00 42.46 41.28 2b1x s ILE 243 CO 0.00 0.33 0.07 -1.38 0.00 0.00 0.00 174.94 173.96 2b1x s HIS 244 N -0.29 0.91 0.32 3.97 -3.43 -0.23 -0.71 115.29 115.83 2b1x s HIS 244 Ca 0.05 -1.26 0.03 0.00 -0.80 0.00 0.00 55.06 53.08 2b1x s HIS 244 Cb -0.06 -0.49 -0.04 0.00 -1.43 0.00 0.00 32.58 30.56 2b1x s HIS 244 CO -0.00 -0.54 0.16 0.99 -2.00 0.00 0.00 174.74 173.35 2b1x s THR 245 N -4.07 0.35 1.09 -5.38 2.01 -0.39 0.07 115.64 109.32 2b1x s THR 245 Ca 0.26 -2.00 -0.12 0.00 0.31 0.00 0.00 61.69 60.14 2b1x s THR 245 Cb 0.07 -2.50 0.24 0.00 0.01 0.00 0.00 72.50 70.33 2b1x s THR 245 CO 0.03 0.00 1.06 -0.83 -0.69 0.00 0.00 174.62 174.19 2b1x s GLY 246 N -3.40 1.57 -1.28 4.40 0.00 -1.26 -3.98 107.32 103.37 2b1x s GLY 246 Ca 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 44.72 44.97 2b1x s GLY 246 CO 0.18 0.56 0.00 1.42 0.00 0.00 0.00 173.10 175.26 2b1x n HIS 247 N -4.64 -0.46 -0.45 1.90 8.25 -1.26 -3.21 115.22 115.35 2b1x n HIS 247 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 2b1x n HIS 247 Cb 0.55 -2.83 0.00 0.00 1.12 0.00 0.00 29.99 28.82 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 -1.09 2.04 3.79 -1.41 0.00 -1.26 -4.54 105.19 102.72 2b1x n GLY 248 Ca -0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 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 -3.40 3.62 0.16 1.61 4.02 -1.20 -3.78 115.29 116.33 2b1x s HIS 249 Ca 0.00 1.74 -0.21 0.00 1.02 0.00 0.00 55.06 57.61 2b1x s HIS 249 Cb 0.00 -2.90 0.06 0.00 -1.02 0.00 0.00 32.58 28.72 2b1x s HIS 249 CO 0.00 0.16 0.55 0.20 1.02 0.00 0.00 174.74 176.67 2b1x s GLY 250 N -1.72 -0.48 0.16 -2.22 0.00 -1.07 -1.26 107.32 100.73 2b1x s GLY 250 Ca 0.52 0.29 -0.10 0.00 0.00 0.00 0.00 44.72 45.42 2b1x s GLY 250 CO 0.22 0.01 0.32 0.48 0.00 0.00 0.00 173.10 174.13 2b1x s LEU 251 N -2.78 0.85 0.12 0.66 2.34 0.11 -1.39 118.68 118.59 2b1x s LEU 251 Ca 0.02 -0.78 0.10 0.00 0.06 0.00 0.00 54.13 53.53 2b1x s LEU 251 Cb -0.01 1.34 -0.04 0.00 -0.56 0.00 0.00 46.19 46.93 2b1x s LEU 251 CO -0.11 -0.90 -0.24 -0.83 -1.06 0.00 0.00 176.35 173.21 2b1x s GLY 252 N -2.94 1.43 -0.08 -3.48 0.00 0.44 -0.73 107.32 101.95 2b1x s GLY 252 Ca 0.14 -1.38 -0.01 0.00 0.00 0.00 0.00 44.72 43.48 2b1x s GLY 252 CO -0.02 -1.38 -0.03 -0.42 0.00 0.00 0.00 173.10 171.25 2b1x s ILE 253 N -1.19 0.65 -0.06 0.90 1.01 -0.21 -2.24 121.20 120.06 2b1x s ILE 253 Ca 0.11 -0.07 0.06 0.00 0.00 0.00 0.00 60.65 60.75 2b1x s ILE 253 Cb -0.10 -0.74 -0.01 0.00 0.01 0.00 0.00 42.46 41.63 2b1x s ILE 253 CO 0.05 0.30 -0.24 -0.63 0.00 0.00 0.00 174.94 174.43 2b1x s ILE 254 N 1.74 1.96 0.46 2.92 1.01 0.21 -0.19 121.20 129.31 2b1x s ILE 254 Ca 0.03 -1.01 0.03 0.00 0.00 0.00 0.00 60.65 59.70 2b1x s ILE 254 Cb -0.13 -1.67 -0.02 0.00 0.01 0.00 0.00 42.46 40.65 2b1x s ILE 254 CO -0.06 0.55 0.04 -0.83 0.00 0.00 0.00 174.94 174.64 2b1x s GLY 255 N -0.08 2.81 0.72 6.18 0.00 -0.11 -0.42 107.32 116.43 2b1x s GLY 255 Ca -0.05 -0.89 -0.11 0.00 0.00 0.00 0.00 44.72 43.67 2b1x s GLY 255 CO 0.04 -2.06 1.07 2.56 0.00 0.00 0.00 173.10 174.71 2b1x s PRO 256 N -3.81 2.69 0.81 2.90 0.04 -1.26 -4.75 135.00 131.62 2b1x s PRO 256 Ca 0.15 0.98 -0.11 0.00 0.04 0.00 0.00 61.00 62.06 2b1x s PRO 256 Cb 0.03 -1.96 0.08 0.00 0.04 0.00 0.00 34.50 32.69 2b1x s PRO 256 CO 0.08 -1.28 1.09 -1.25 0.04 0.00 0.00 177.00 175.68 2b1x s PRO 257 N -5.02 1.96 0.38 0.56 0.04 -1.26 -4.94 135.00 126.72 2b1x s PRO 257 Ca 0.59 0.96 0.16 0.00 0.04 0.00 0.00 61.00 62.75 2b1x s PRO 257 Cb -0.15 -1.88 1.02 0.00 0.04 0.00 0.00 34.50 33.54 2b1x s PRO 257 CO 0.55 -1.80 1.80 -1.35 0.04 0.00 0.00 177.00 176.24 2b1x h PRO 258 N -1.23 0.46 -1.14 0.56 0.11 -2.02 -2.01 132.00 126.72 2b1x h PRO 258 Ca -0.46 -0.03 -0.33 0.00 0.11 0.00 0.00 66.00 65.29 2b1x h PRO 258 Cb 1.25 -0.10 -0.17 0.00 0.11 0.00 0.00 31.00 32.08 2b1x h PRO 258 CO 0.54 0.30 0.42 0.41 -0.21 0.00 0.00 178.00 179.47 2b1x n GLY 259 N -1.46 3.78 2.76 -0.55 0.00 -1.26 -4.66 105.19 103.80 2b1x n GLY 259 Ca 0.23 -0.86 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.00 0.34 -0.02 1.61 0.00 -0.76 -5.13 119.30 113.34 2b1x s MET 260 Ca 0.34 -0.19 -0.30 0.00 0.00 0.00 0.00 55.69 55.55 2b1x s MET 260 Cb 0.28 -0.66 -0.03 0.00 0.00 0.00 0.00 34.83 34.42 2b1x s MET 260 CO 0.04 -1.04 1.06 -1.25 0.00 0.00 0.00 175.02 173.83 2b1x s PRO 261 N 2.30 4.48 0.09 4.11 0.05 -1.26 -4.57 135.00 140.20 2b1x s PRO 261 Ca 0.10 1.52 0.08 0.00 0.05 0.00 0.00 61.00 62.74 2b1x s PRO 261 Cb -0.14 -3.47 -0.03 0.00 0.05 0.00 0.00 34.50 30.91 2b1x s PRO 261 CO -0.31 -0.20 -0.20 -0.51 0.05 0.00 0.00 177.00 175.83 2b1x s LEU 262 N 1.38 2.27 0.20 -3.56 1.43 -1.26 -5.11 118.68 114.03 2b1x s LEU 262 Ca 0.53 -0.64 -0.31 0.00 -1.03 0.00 0.00 54.13 52.68 2b1x s LEU 262 Cb -0.23 -0.84 -0.16 0.00 0.03 0.00 0.00 46.19 45.00 2b1x s LEU 262 CO 0.25 0.06 1.02 -2.65 0.23 0.00 0.00 176.35 175.26 2b1x n PRO 263 N 1.26 0.98 -1.07 1.29 -0.02 -1.26 -4.92 135.00 131.25 2b1x n PRO 263 Ca -0.19 0.35 -0.32 0.00 -2.02 0.00 0.00 63.50 61.31 2b1x n PRO 263 Cb 0.54 -1.73 0.12 0.00 -0.02 0.00 0.00 33.50 32.41 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 -0.78 1.68 -1.46 -0.52 2.02 -1.26 -3.45 118.70 114.93 2b1x s GLU 264 Ca 0.69 1.52 -0.11 0.00 0.02 0.00 0.00 54.97 57.09 2b1x s GLU 264 Cb -0.84 -1.80 0.06 0.00 0.10 0.00 0.00 34.13 31.64 2b1x s GLU 264 CO 0.55 -2.13 0.99 1.19 0.02 0.00 0.00 175.26 175.88 2b1x n PHE 265 N -3.58 -2.38 -1.88 1.61 3.01 0.17 -1.44 117.46 112.98 2b1x n PHE 265 Ca 0.12 0.92 -0.18 0.00 1.01 0.00 0.00 57.45 59.32 2b1x n PHE 265 Cb 0.52 -4.29 -0.05 0.00 -0.01 0.00 0.00 39.48 35.65 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 -4.69 -1.58 -2.12 -1.08 2.81 -1.25 -1.33 117.12 107.88 2b1x n MET 266 Ca -0.02 1.00 -0.20 0.00 -1.81 0.00 0.00 57.70 56.67 2b1x n MET 266 Cb 0.56 -5.46 -0.03 0.00 -0.71 0.00 0.00 33.22 27.57 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 -0.58 0.31 3.68 3.03 0.00 -0.52 -4.28 105.19 106.83 2b1x n GLY 267 Ca -0.20 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.67 4.84 -4.69 0.99 4.77 -0.45 -4.93 117.00 114.86 2b1x n LEU 268 Ca -0.22 0.72 -0.37 0.00 -0.03 0.00 0.00 56.01 56.10 2b1x n LEU 268 Cb 0.67 -1.50 0.07 0.00 -2.33 0.00 0.00 43.42 40.34 2b1x n LEU 268 CO 0.28 -1.50 0.78 -2.65 -1.33 0.00 0.00 177.39 172.97 2b1x n PRO 269 N -2.27 0.94 -0.26 3.23 -0.02 -1.26 -4.73 135.00 130.63 2b1x n PRO 269 Ca 0.14 0.38 0.06 0.00 -2.02 0.00 0.00 63.50 62.05 2b1x n PRO 269 Cb 0.49 -2.42 0.19 0.00 -0.02 0.00 0.00 33.50 31.74 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 0.33 0.39 -0.04 -0.52 3.07 -2.00 -1.38 114.58 114.43 2b1x h GLU 270 Ca -0.50 -0.02 -0.10 0.00 -0.50 0.00 0.00 59.36 58.24 2b1x h GLU 270 Cb 1.34 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 29.15 2b1x h GLU 270 CO 0.51 0.26 -0.46 -2.95 -1.40 0.00 0.00 179.01 174.98 2b1x h ASN 271 N 0.40 0.09 0.01 1.42 -1.07 -1.96 -1.56 115.58 112.92 2b1x h ASN 271 Ca 0.42 -0.04 -0.19 0.00 0.07 0.00 0.00 56.30 56.55 2b1x h ASN 271 Cb 0.66 -0.03 0.00 0.00 -2.07 0.00 0.00 38.32 36.88 2b1x h ASN 271 CO -0.43 0.54 -0.69 0.40 0.07 0.00 0.00 177.43 177.33 2b1x h ILE 272 N 0.07 1.32 -0.08 6.14 1.08 -1.72 -2.75 117.51 121.58 2b1x h ILE 272 Ca 0.00 -1.96 -0.00 0.00 -0.39 0.00 0.00 64.86 62.51 2b1x h ILE 272 Cb 0.84 1.94 -0.00 0.00 -3.07 0.00 0.00 36.82 36.52 2b1x h ILE 272 CO 0.06 0.61 0.04 0.58 -0.69 0.00 0.00 178.15 178.75 2b1x h VAL 273 N 0.44 1.10 -0.48 1.67 2.07 -0.86 0.07 116.25 120.27 2b1x h VAL 273 Ca -0.02 -0.27 0.10 0.00 0.82 0.00 0.00 66.70 67.32 2b1x h VAL 273 Cb 1.28 1.14 -0.10 0.00 -1.52 0.00 0.00 31.29 32.09 2b1x h VAL 273 CO 0.13 0.08 -0.19 -0.33 0.02 0.00 0.00 177.57 177.28 2b1x h GLU 274 N 0.02 -0.09 -0.48 1.57 5.08 -1.35 -1.37 114.58 117.96 2b1x h GLU 274 Ca 0.03 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 2b1x h GLU 274 Cb 0.10 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2b1x h GLU 274 CO -0.00 -0.06 -0.00 0.93 -1.00 0.00 0.00 179.01 178.88 2b1x h GLU 275 N -0.09 0.84 -0.82 2.33 5.08 -1.24 -3.02 114.58 117.67 2b1x h GLU 275 Ca 0.23 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2b1x h GLU 275 Cb 0.44 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 2b1x h GLU 275 CO -0.54 0.89 0.46 1.37 -1.00 0.00 0.00 179.01 180.19 2b1x h LEU 276 N 0.70 1.01 -2.24 1.33 8.10 -0.01 0.19 115.31 124.39 2b1x h LEU 276 Ca 0.14 -0.08 -0.01 0.00 0.11 0.00 0.00 57.88 58.03 2b1x h LEU 276 Cb 0.51 -0.26 -0.00 0.00 -0.44 0.00 0.00 40.66 40.47 2b1x h LEU 276 CO 0.02 0.81 -0.06 -0.33 -4.11 0.00 0.00 178.44 174.78 2b1x h GLU 277 N 1.14 0.00 0.00 0.17 5.08 -1.14 -0.38 114.58 119.46 2b1x h GLU 277 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2b1x h GLU 277 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2b1x h GLU 277 CO -0.05 0.06 -1.64 -2.13 -1.00 0.00 0.00 179.01 174.25 2b1x n ARG 278 N -3.59 0.67 -0.02 2.33 0.63 -0.86 -4.51 116.66 111.31 2b1x n ARG 278 Ca -0.02 -0.13 -0.07 0.00 -0.92 0.00 0.00 57.85 56.71 2b1x n ARG 278 Cb 0.16 -1.40 -0.13 0.00 0.45 0.00 0.00 32.46 31.54 2b1x n ARG 278 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2b1x n ARG 279 N -1.99 0.64 -4.00 -0.14 1.74 0.61 -4.95 116.66 108.57 2b1x n ARG 279 Ca -0.02 0.24 -0.26 0.00 -0.77 0.00 0.00 57.85 57.03 2b1x n ARG 279 Cb 0.43 -1.76 -0.04 0.00 -1.02 0.00 0.00 32.46 30.07 2b1x n ARG 279 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2b1x s LEU 280 N -5.92 4.13 0.74 0.55 1.43 -0.21 -5.05 118.68 114.34 2b1x s LEU 280 Ca -0.05 0.06 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 2b1x s LEU 280 Cb 0.08 -2.72 0.04 0.00 0.03 0.00 0.00 46.19 43.62 2b1x s LEU 280 CO 0.82 0.07 1.10 0.42 0.23 0.00 0.00 176.35 178.99 2b1x s THR 281 N -1.72 3.26 0.42 5.49 -4.23 -1.26 -4.77 115.64 112.82 2b1x s THR 281 Ca 0.33 0.47 0.14 0.00 -1.18 0.00 0.00 61.69 61.45 2b1x s THR 281 Cb -0.11 -2.96 0.34 0.00 1.34 0.00 0.00 72.50 71.12 2b1x s THR 281 CO 0.26 -0.47 1.93 -0.65 -0.54 0.00 0.00 174.62 175.15 2b1x h PRO 282 N -0.74 0.45 -0.62 3.99 0.11 -1.98 0.92 132.00 134.14 2b1x h PRO 282 Ca -0.45 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 2b1x h PRO 282 Cb 1.24 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2b1x h PRO 282 CO 0.52 0.30 0.04 0.93 -0.21 0.00 0.00 178.00 179.57 2b1x h GLU 283 N 0.46 1.06 -0.36 1.05 3.07 -1.96 -1.32 114.58 116.58 2b1x h GLU 283 Ca 0.35 -0.32 -0.16 0.00 -0.50 0.00 0.00 59.36 58.73 2b1x h GLU 283 Cb 0.73 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 28.53 2b1x h GLU 283 CO -0.12 1.02 -0.41 1.96 -1.40 0.00 0.00 179.01 180.06 2b1x h GLN 284 N 0.97 0.91 -0.43 2.33 4.20 -1.61 -2.58 115.11 118.90 2b1x h GLN 284 Ca 0.18 -0.50 0.05 0.00 0.06 0.00 0.00 58.65 58.44 2b1x h GLN 284 Cb 0.51 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.27 2b1x h GLN 284 CO 0.02 1.15 0.15 0.28 -0.67 0.00 0.00 178.83 179.77 2b1x h VAL 285 N 0.72 0.87 0.00 -0.54 2.07 -0.66 -1.29 116.25 117.41 2b1x h VAL 285 Ca 0.05 -0.11 -0.14 0.00 0.82 0.00 0.00 66.70 67.32 2b1x h VAL 285 Cb 1.01 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2b1x h VAL 285 CO 0.10 0.06 -0.69 -0.33 0.02 0.00 0.00 177.57 176.73 2b1x h GLU 286 N 0.32 0.00 -0.36 1.57 4.39 -1.19 0.27 114.58 119.58 2b1x h GLU 286 Ca 0.20 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.83 2b1x h GLU 286 Cb 0.19 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2b1x h GLU 286 CO -0.20 0.69 -0.07 0.82 -1.16 0.00 0.00 179.01 179.09 2b1x h ILE 287 N 0.00 1.27 -0.05 3.13 2.04 -1.25 -3.27 117.51 119.38 2b1x h ILE 287 Ca -0.01 -1.12 -0.10 0.00 1.00 0.00 0.00 64.86 64.64 2b1x h ILE 287 Cb 1.37 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 2b1x h ILE 287 CO 0.09 0.37 -0.43 0.15 0.00 0.00 0.00 178.15 178.33 2b1x h PHE 288 N 0.47 0.12 -0.54 1.37 3.57 -0.91 -3.38 116.94 117.63 2b1x h PHE 288 Ca 0.09 -0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.67 2b1x h PHE 288 Cb 0.56 -0.03 -0.11 0.00 2.79 0.00 0.00 35.95 39.17 2b1x h PHE 288 CO 0.05 0.52 -0.17 -0.09 -2.23 0.00 0.00 178.31 176.39 2b1x h ARG 289 N 0.09 -0.03 -0.64 1.11 2.43 -1.00 -2.07 114.38 114.27 2b1x h ARG 289 Ca 0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2b1x h ARG 289 Cb 0.79 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 2b1x h ARG 289 CO 0.06 -0.02 0.00 -0.35 -1.51 0.00 0.00 179.97 178.15 2b1x n PRO 290 N -5.40 3.52 -2.07 0.20 -0.04 -1.26 -0.65 135.00 129.29 2b1x n PRO 290 Ca 0.05 -2.44 -0.41 0.00 -0.04 0.00 0.00 63.50 60.66 2b1x n PRO 290 Cb 0.30 -1.88 -0.02 0.00 -0.04 0.00 0.00 33.50 31.86 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 -1.96 2.69 -0.06 0.52 2.01 -0.78 -3.98 115.64 114.09 2b1x s THR 291 Ca 0.43 0.65 0.02 0.00 0.31 0.00 0.00 61.69 63.10 2b1x s THR 291 Cb 0.29 -3.42 -0.05 0.00 0.01 0.00 0.00 72.50 69.34 2b1x s THR 291 CO 0.19 0.14 -0.03 0.00 -0.69 0.00 0.00 174.62 174.23 2b1x n ALA 292 N 1.33 1.87 -3.55 7.40 0.00 0.44 -3.81 120.51 124.19 2b1x n ALA 292 Ca 0.02 -0.29 -0.15 0.00 0.00 0.00 0.00 53.44 53.03 2b1x n ALA 292 Cb 0.41 0.27 -0.16 0.00 0.00 0.00 0.00 19.45 19.98 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 0.07 -0.08 0.00 0.40 -0.40 -1.92 117.98 113.93 2b1x s PHE 293 Ca -0.06 0.08 0.03 0.00 -0.60 0.00 0.00 56.93 56.38 2b1x s PHE 293 Cb 0.02 -0.22 0.01 0.00 0.51 0.00 0.00 43.02 43.34 2b1x s PHE 293 CO 0.16 -0.08 -0.17 0.42 0.70 0.00 0.00 175.22 176.26 2b1x s ILE 294 N 0.82 1.50 -0.00 0.64 1.01 0.06 -0.62 121.20 124.61 2b1x s ILE 294 Ca -0.07 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 59.90 2b1x s ILE 294 Cb -0.10 -1.33 -0.00 0.00 0.01 0.00 0.00 42.46 41.03 2b1x s ILE 294 CO -0.02 0.44 -0.03 -1.38 0.00 0.00 0.00 174.94 173.94 2b1x s HIS 295 N 0.58 0.29 0.06 3.97 -3.43 -0.95 -0.03 115.29 115.78 2b1x s HIS 295 Ca -0.15 -0.06 -0.28 0.00 -0.80 0.00 0.00 55.06 53.77 2b1x s HIS 295 Cb -0.16 -0.18 0.10 0.00 -1.43 0.00 0.00 32.58 30.90 2b1x s HIS 295 CO 0.05 -0.01 1.15 0.20 -2.00 0.00 0.00 174.74 174.14 2b1x s GLY 296 N -0.10 -0.32 -0.07 -1.38 0.00 -0.73 -0.42 107.32 104.31 2b1x s GLY 296 Ca 0.01 0.41 0.02 0.00 0.00 0.00 0.00 44.72 45.16 2b1x s GLY 296 CO -0.00 0.31 -0.11 -1.59 0.00 0.00 0.00 173.10 171.71 2b1x s THR 297 N -2.74 1.04 -0.50 0.90 2.01 -0.49 -0.35 115.64 115.51 2b1x s THR 297 Ca 0.14 -0.41 -0.23 0.00 0.31 0.00 0.00 61.69 61.50 2b1x s THR 297 Cb 0.02 -0.97 0.04 0.00 0.01 0.00 0.00 72.50 71.59 2b1x s THR 297 CO -0.01 0.34 0.82 -0.69 -0.69 0.00 0.00 174.62 174.38 2b1x s VAL 298 N 0.79 4.59 0.25 3.82 1.01 0.85 -2.59 120.40 129.12 2b1x s VAL 298 Ca -0.12 0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 2b1x s VAL 298 Cb -0.15 -4.41 -0.14 0.00 0.00 0.00 0.00 36.38 31.68 2b1x s VAL 298 CO 0.02 -0.90 1.21 0.33 0.00 0.00 0.00 175.10 175.76 2b1x n PHE 299 N 6.91 1.68 0.00 5.22 7.35 -1.26 -2.50 117.46 134.87 2b1x n PHE 299 Ca 0.00 0.60 -0.20 0.00 -0.76 0.00 0.00 57.45 57.09 2b1x n PHE 299 Cb 0.47 -2.34 -0.14 0.00 0.35 0.00 0.00 39.48 37.82 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 3.08 0.21 0.00 -7.13 0.13 -1.92 -3.44 132.00 122.94 2b1x h PRO 300 Ca -0.43 -0.36 -0.06 0.00 -0.87 0.00 0.00 66.00 64.28 2b1x h PRO 300 Cb 1.31 0.13 -0.13 0.00 0.13 0.00 0.00 31.00 32.44 2b1x h PRO 300 CO 0.68 1.17 -0.62 0.27 -0.23 0.00 0.00 178.00 179.27 2b1x n ASN 301 N -4.14 0.84 -4.58 1.44 6.94 -1.13 -4.89 115.26 109.75 2b1x n ASN 301 Ca -0.19 -2.35 -0.37 0.00 -0.02 0.00 0.00 54.58 51.64 2b1x n ASN 301 Cb 0.80 -0.30 -0.11 0.00 -2.36 0.00 0.00 39.78 37.81 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 -0.74 3.90 0.21 -4.53 2.96 -1.04 -1.10 118.68 118.34 2b1x s LEU 302 Ca 0.20 -0.02 0.10 0.00 -0.22 0.00 0.00 54.13 54.20 2b1x s LEU 302 Cb 0.21 -2.06 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 2b1x s LEU 302 CO -0.06 -0.00 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.36 2b1x s SER 303 N 1.45 3.83 -0.04 3.68 0.01 0.02 -0.11 113.70 122.54 2b1x s SER 303 Ca 0.07 -0.78 0.03 0.00 1.31 0.00 0.00 55.95 56.58 2b1x s SER 303 Cb -0.15 -0.47 0.00 0.00 0.21 0.00 0.00 66.02 65.61 2b1x s SER 303 CO 0.07 0.09 -0.14 -0.63 0.41 0.00 0.00 173.24 173.04 2b1x s ILE 304 N -1.87 1.19 -0.13 1.44 1.01 0.52 -0.77 121.20 122.59 2b1x s ILE 304 Ca 0.25 -0.56 -0.01 0.00 0.00 0.00 0.00 60.65 60.32 2b1x s ILE 304 Cb -0.08 -1.04 0.04 0.00 0.01 0.00 0.00 42.46 41.39 2b1x s ILE 304 CO 0.13 0.35 -0.03 -0.83 0.00 0.00 0.00 174.94 174.56 2b1x s GLY 305 N 0.24 0.78 -0.36 6.18 0.00 0.15 -1.86 107.32 112.45 2b1x s GLY 305 Ca -0.06 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.11 2b1x s GLY 305 CO 0.02 1.02 0.08 0.21 0.00 0.00 0.00 173.10 174.43 2b1x s ASN 306 N 1.76 4.81 0.09 1.64 3.04 0.96 -0.59 114.94 126.65 2b1x s ASN 306 Ca 0.03 -2.19 0.08 0.00 0.04 0.00 0.00 52.86 50.81 2b1x s ASN 306 Cb -0.14 -1.66 -0.03 0.00 -1.54 0.00 0.00 41.25 37.88 2b1x s ASN 306 CO -0.07 -0.39 -0.20 -0.36 -3.04 0.00 0.00 177.10 173.04 2b1x s PHE 307 N 0.86 1.69 -0.33 0.43 2.99 -0.59 -0.76 117.98 122.28 2b1x s PHE 307 Ca 0.11 -0.41 -0.10 0.00 0.00 0.00 0.00 56.93 56.52 2b1x s PHE 307 Cb -0.20 -0.95 -0.00 0.00 0.00 0.00 0.00 43.02 41.87 2b1x s PHE 307 CO -0.07 0.16 0.18 -1.17 -0.00 0.00 0.00 175.22 174.32 2b1x s LEU 308 N -1.72 4.31 -0.06 -0.37 0.20 -0.81 -1.31 118.68 118.92 2b1x s LEU 308 Ca 0.05 -0.62 -0.19 0.00 0.69 0.00 0.00 54.13 54.06 2b1x s LEU 308 Cb -0.10 -2.03 0.04 0.00 -0.43 0.00 0.00 46.19 43.68 2b1x s LEU 308 CO 0.03 -0.25 0.44 -0.32 -0.29 0.00 0.00 176.35 175.96 2b1x s MET 309 N 1.61 0.73 0.41 1.98 1.75 -0.79 -4.86 119.30 120.14 2b1x s MET 309 Ca 0.04 0.13 -0.24 0.00 -1.25 0.00 0.00 55.69 54.36 2b1x s MET 309 Cb -0.18 0.34 -0.08 0.00 2.84 0.00 0.00 34.83 37.75 2b1x s MET 309 CO 0.07 -0.19 1.14 0.20 -0.65 0.00 0.00 175.02 175.59 2b1x s GLY 310 N -0.89 2.82 0.00 2.11 0.00 -1.26 -0.92 107.32 109.17 2b1x s GLY 310 Ca -0.10 0.89 0.28 0.00 0.00 0.00 0.00 44.72 45.80 2b1x s GLY 310 CO 0.05 1.38 1.83 0.58 0.00 0.00 0.00 173.10 176.93 2b1x n LYS 311 N -0.08 0.21 -3.86 2.90 2.85 -1.26 -4.78 118.16 114.14 2b1x n LYS 311 Ca 0.05 -0.05 -0.03 0.00 -1.05 0.00 0.00 58.31 57.23 2b1x n LYS 311 Cb 0.48 -1.50 0.01 0.00 -0.65 0.00 0.00 35.03 33.37 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 -2.83 -0.02 0.00 -5.58 3.84 -1.26 -4.74 116.67 106.08 2b1x s ASP 312 Ca 0.19 -0.64 0.12 0.00 -0.00 0.00 0.00 52.55 52.21 2b1x s ASP 312 Cb 0.19 0.50 0.61 0.00 -1.38 0.00 0.00 42.92 42.84 2b1x s ASP 312 CO 0.54 -0.99 1.28 0.00 -0.00 0.00 0.00 175.17 176.00 2b1x n HIS 313 N -0.66 0.00 0.13 2.11 1.44 -1.26 -3.00 115.22 113.98 2b1x n HIS 313 Ca -0.04 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.71 2b1x n HIS 313 Cb 0.60 -0.27 0.05 0.00 0.12 0.00 0.00 29.99 30.49 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 -1.27 1.92 -4.33 2.39 4.77 -1.26 -4.94 117.00 114.28 2b1x n LEU 314 Ca 0.06 -1.38 -0.31 0.00 -0.03 0.00 0.00 56.01 54.35 2b1x n LEU 314 Cb 0.09 -0.05 -0.15 0.00 -2.33 0.00 0.00 43.42 40.98 2b1x n LEU 314 CO 0.09 0.44 -0.57 -0.44 -1.33 0.00 0.00 177.39 175.58 2b1x s SER 315 N -0.72 3.11 0.44 -1.43 0.01 -1.16 -5.11 113.70 108.84 2b1x s SER 315 Ca 0.10 -0.53 -0.25 0.00 1.31 0.00 0.00 55.95 56.57 2b1x s SER 315 Cb 0.06 -0.31 -0.09 0.00 0.21 0.00 0.00 66.02 65.89 2b1x s SER 315 CO 0.09 0.29 1.38 0.00 0.41 0.00 0.00 173.24 175.40 2b1x n ALA 316 N 2.10 1.79 -1.78 1.44 0.00 -1.26 -4.50 120.51 118.31 2b1x n ALA 316 Ca -0.16 0.26 -0.35 0.00 0.00 0.00 0.00 53.44 53.18 2b1x n ALA 316 Cb 0.51 -2.35 -0.00 0.00 0.00 0.00 0.00 19.45 17.61 2b1x n ALA 316 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2b1x s PRO 317 N -2.36 3.47 0.10 0.00 0.04 -1.26 -4.59 135.00 130.40 2b1x s PRO 317 Ca 0.61 1.62 0.05 0.00 0.04 0.00 0.00 61.00 63.32 2b1x s PRO 317 Cb -0.47 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.95 2b1x s PRO 317 CO 0.58 -0.76 -0.14 -0.08 0.04 0.00 0.00 177.00 176.64 2b1x s THR 318 N -1.74 1.19 0.39 1.26 -1.32 -0.10 -4.79 115.64 110.53 2b1x s THR 318 Ca 0.71 -1.53 -0.24 0.00 -1.21 0.00 0.00 61.69 59.41 2b1x s THR 318 Cb -0.24 -1.31 -0.09 0.00 -1.51 0.00 0.00 72.50 69.35 2b1x s THR 318 CO 0.28 -0.35 1.07 0.00 -2.21 0.00 0.00 174.62 173.41 2b1x s ALA 319 N -1.80 3.11 0.03 11.08 0.00 -1.26 -1.88 121.76 131.03 2b1x s ALA 319 Ca 0.04 0.76 -0.04 0.00 0.00 0.00 0.00 51.96 52.71 2b1x s ALA 319 Cb -0.07 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 2b1x s ALA 319 CO 0.02 -0.27 0.07 -0.59 0.00 0.00 0.00 175.76 174.99 2b1x s PHE 320 N -1.59 0.20 -0.11 0.00 -0.12 -0.42 -4.57 117.98 111.37 2b1x s PHE 320 Ca 0.57 -0.47 0.02 0.00 -0.05 0.00 0.00 56.93 57.00 2b1x s PHE 320 Cb -0.24 -0.15 -0.01 0.00 -0.63 0.00 0.00 43.02 41.99 2b1x s PHE 320 CO 0.30 -0.31 -0.19 -1.17 -0.05 0.00 0.00 175.22 173.80 2b1x s LEU 321 N -1.89 2.36 0.00 -1.99 2.96 -1.25 -1.54 118.68 117.34 2b1x s LEU 321 Ca -0.09 -0.46 0.04 0.00 -0.22 0.00 0.00 54.13 53.40 2b1x s LEU 321 Cb -0.04 -1.50 -0.01 0.00 0.50 0.00 0.00 46.19 45.14 2b1x s LEU 321 CO -0.03 0.16 -0.12 0.28 -1.32 0.00 0.00 176.35 175.32 2b1x s THR 322 N 0.35 0.97 0.04 3.68 -1.32 0.24 -1.40 115.64 118.20 2b1x s THR 322 Ca -0.15 -0.62 0.09 0.00 -1.21 0.00 0.00 61.69 59.80 2b1x s THR 322 Cb -0.17 -0.83 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 2b1x s THR 322 CO 0.07 0.20 -0.26 -0.76 -2.21 0.00 0.00 174.62 171.67 2b1x s LEU 323 N -0.47 2.20 -0.06 9.08 1.43 -0.86 -0.67 118.68 129.33 2b1x s LEU 323 Ca 0.04 -0.57 -0.08 0.00 -1.03 0.00 0.00 54.13 52.49 2b1x s LEU 323 Cb -0.05 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 44.87 2b1x s LEU 323 CO -0.00 0.26 0.20 0.00 0.23 0.00 0.00 176.35 177.05 2b1x s ARG 324 N -1.21 0.32 -0.14 1.70 3.03 0.05 -0.62 118.95 122.08 2b1x s ARG 324 Ca 0.12 0.13 -0.11 0.00 2.03 0.00 0.00 55.73 57.90 2b1x s ARG 324 Cb -0.10 0.15 -0.05 0.00 -1.03 0.00 0.00 34.95 33.92 2b1x s ARG 324 CO 0.02 -0.06 0.23 -0.51 -1.13 0.00 0.00 175.30 173.85 2b1x s LEU 325 N -0.27 4.31 -0.97 -1.89 1.43 -0.24 -0.80 118.68 120.25 2b1x s LEU 325 Ca -0.04 0.49 -0.13 0.00 -1.03 0.00 0.00 54.13 53.42 2b1x s LEU 325 Cb -0.03 -2.25 0.22 0.00 0.03 0.00 0.00 46.19 44.16 2b1x s LEU 325 CO 0.01 0.24 1.00 0.26 0.23 0.00 0.00 176.35 178.08 2b1x s TRP 326 N -0.18 3.78 -0.25 0.29 0.52 -0.25 -1.74 118.94 121.10 2b1x s TRP 326 Ca 0.15 -2.12 -0.28 0.00 0.02 0.00 0.00 56.10 53.87 2b1x s TRP 326 Cb -0.13 -3.95 0.01 0.00 -1.15 0.00 0.00 33.47 28.25 2b1x s TRP 326 CO 0.04 -1.10 1.00 -1.58 0.02 0.00 0.00 176.95 175.33 2b1x s HIS 327 N 0.30 3.29 -0.11 -1.98 2.46 -0.38 -4.86 115.29 114.02 2b1x s HIS 327 Ca 0.27 1.34 -0.29 0.00 0.47 0.00 0.00 55.06 56.84 2b1x s HIS 327 Cb -0.08 -3.31 -0.04 0.00 -0.13 0.00 0.00 32.58 29.01 2b1x s HIS 327 CO -0.08 -0.53 1.49 -1.25 -2.47 0.00 0.00 174.74 171.90 2b1x s PRO 328 N 3.22 4.19 -0.14 2.88 0.04 -1.26 -0.69 135.00 143.24 2b1x s PRO 328 Ca 0.42 1.95 0.13 0.00 0.04 0.00 0.00 61.00 63.55 2b1x s PRO 328 Cb -0.14 -3.90 -0.18 0.00 0.04 0.00 0.00 34.50 30.32 2b1x s PRO 328 CO 0.08 -0.80 0.06 1.28 0.04 0.00 0.00 177.00 177.66 2b1x n LEU 329 N 6.95 0.00 -3.85 -3.56 4.77 -0.63 -4.74 117.00 115.94 2b1x n LEU 329 Ca 0.16 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.17 2b1x n LEU 329 Cb 0.44 0.35 0.01 0.00 -2.33 0.00 0.00 43.42 41.88 2b1x n LEU 329 CO 0.60 0.35 1.16 -0.83 -1.33 0.00 0.00 177.39 177.33 2b1x s GLY 330 N -4.76 -0.29 0.55 -0.72 0.00 -0.87 -4.92 107.32 96.32 2b1x s GLY 330 Ca -0.07 0.39 0.23 0.00 0.00 0.00 0.00 44.72 45.27 2b1x s GLY 330 CO 0.60 3.98 2.15 -0.56 0.00 0.00 0.00 173.10 179.27 2b1x h PRO 331 N 2.00 0.00 0.00 2.90 0.13 -1.93 -2.76 132.00 132.34 2b1x h PRO 331 Ca -0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 2b1x h PRO 331 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 2b1x h PRO 331 CO 0.30 0.00 -0.27 -0.40 -0.23 0.00 0.00 178.00 177.39 2b1x n ASP 332 N -4.22 1.74 -3.74 1.44 5.68 -1.26 -4.07 116.55 112.11 2b1x n ASP 332 Ca -0.01 -3.05 -0.13 0.00 -0.50 0.00 0.00 54.79 51.10 2b1x n ASP 332 Cb 0.19 -0.41 -0.10 0.00 -1.14 0.00 0.00 41.12 39.66 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 -2.32 0.54 0.13 0.11 2.20 -1.04 -2.20 119.74 117.15 2b1x s LYS 333 Ca 0.29 0.26 -0.07 0.00 -0.36 0.00 0.00 55.97 56.09 2b1x s LYS 333 Cb 0.27 0.25 -0.02 0.00 -1.51 0.00 0.00 37.83 36.82 2b1x s LYS 333 CO -0.01 -0.11 0.20 0.00 -0.36 0.00 0.00 175.35 175.07 2b1x s MET 334 N -0.39 1.01 -0.21 4.03 0.23 -0.24 -1.61 119.30 122.11 2b1x s MET 334 Ca -0.05 -1.18 -0.03 0.00 -1.03 0.00 0.00 55.69 53.40 2b1x s MET 334 Cb -0.03 0.33 -0.01 0.00 -1.53 0.00 0.00 34.83 33.59 2b1x s MET 334 CO 0.02 -0.34 -0.06 -2.00 -2.03 0.00 0.00 175.02 170.61 2b1x s GLU 335 N -3.96 3.37 0.07 3.16 2.12 0.13 -1.12 118.70 122.47 2b1x s GLU 335 Ca 0.15 -0.64 -0.25 0.00 0.36 0.00 0.00 54.97 54.59 2b1x s GLU 335 Cb 0.05 -2.94 -0.06 0.00 0.26 0.00 0.00 34.13 31.44 2b1x s GLU 335 CO -0.03 -0.13 0.78 0.08 -0.54 0.00 0.00 175.26 175.42 2b1x s VAL 336 N 1.29 4.66 -0.32 3.70 1.01 0.20 -1.24 120.40 129.70 2b1x s VAL 336 Ca 0.04 1.67 0.02 0.00 0.00 0.00 0.00 61.98 63.70 2b1x s VAL 336 Cb -0.14 -4.13 0.08 0.00 0.00 0.00 0.00 36.38 32.19 2b1x s VAL 336 CO -0.03 0.39 0.02 -0.04 0.00 0.00 0.00 175.10 175.44 2b1x s MET 337 N -0.23 1.91 -0.31 2.72 1.00 -0.71 -2.13 119.30 121.55 2b1x s MET 337 Ca 0.39 -1.63 -0.09 0.00 0.00 0.00 0.00 55.69 54.36 2b1x s MET 337 Cb -0.21 -3.16 -0.00 0.00 0.00 0.00 0.00 34.83 31.46 2b1x s MET 337 CO 0.24 -0.80 0.14 0.45 0.00 0.00 0.00 175.02 175.04 2b1x s SER 338 N 1.14 5.45 -0.12 3.03 0.15 0.09 -1.08 113.70 122.36 2b1x s SER 338 Ca 0.02 -0.57 -0.09 0.00 0.70 0.00 0.00 55.95 56.02 2b1x s SER 338 Cb -0.20 -1.97 -0.04 0.00 -1.71 0.00 0.00 66.02 62.09 2b1x s SER 338 CO -0.06 -0.20 0.17 -0.36 1.20 0.00 0.00 173.24 174.00 2b1x s PHE 339 N 1.59 3.58 -0.20 3.44 0.40 0.20 -1.34 117.98 125.65 2b1x s PHE 339 Ca 0.04 0.55 -0.10 0.00 -0.60 0.00 0.00 56.93 56.82 2b1x s PHE 339 Cb -0.17 -2.03 -0.05 0.00 0.51 0.00 0.00 43.02 41.28 2b1x s PHE 339 CO 0.05 0.64 0.12 0.12 0.70 0.00 0.00 175.22 176.85 2b1x s PHE 340 N -0.75 3.37 0.11 0.36 5.36 -1.26 -2.03 117.98 123.14 2b1x s PHE 340 Ca 0.15 0.27 0.09 0.00 -0.96 0.00 0.00 56.93 56.48 2b1x s PHE 340 Cb -0.12 -2.15 -0.04 0.00 -0.34 0.00 0.00 43.02 40.37 2b1x s PHE 340 CO 0.04 0.25 -0.22 -0.51 -1.46 0.00 0.00 175.22 173.32 2b1x s LEU 341 N 0.41 2.31 -0.00 6.12 1.02 -0.50 -1.31 118.68 126.73 2b1x s LEU 341 Ca 0.07 -0.71 -0.15 0.00 0.02 0.00 0.00 54.13 53.37 2b1x s LEU 341 Cb -0.11 -0.95 0.02 0.00 0.02 0.00 0.00 46.19 45.17 2b1x s LEU 341 CO -0.01 0.08 0.31 0.54 0.02 0.00 0.00 176.35 177.28 2b1x s VAL 342 N -1.19 0.06 0.24 -1.59 0.11 -0.80 -3.80 120.40 113.43 2b1x s VAL 342 Ca 0.08 -0.52 -0.31 0.00 -2.93 0.00 0.00 61.98 58.30 2b1x s VAL 342 Cb -0.10 -0.69 -0.12 0.00 -1.53 0.00 0.00 36.38 33.94 2b1x s VAL 342 CO 0.05 -0.29 1.68 -0.62 -3.33 0.00 0.00 175.10 172.59 2b1x n GLU 343 N 1.11 2.75 -0.26 1.54 4.71 -1.26 -0.78 120.64 128.45 2b1x n GLU 343 Ca -0.21 0.99 0.14 0.00 -0.01 0.00 0.00 57.16 58.07 2b1x n GLU 343 Cb 0.57 -2.81 0.42 0.00 -1.01 0.00 0.00 31.44 28.60 2b1x n GLU 343 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 2b1x h LYS 344 N 6.08 0.58 -0.22 3.49 1.57 -1.27 -2.17 116.57 124.64 2b1x h LYS 344 Ca -0.44 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2b1x h LYS 344 Cb 1.21 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.39 2b1x h LYS 344 CO 0.90 0.39 0.00 -0.25 -0.57 0.00 0.00 179.45 179.92 2b1x n ASP 345 N -4.56 2.46 -4.67 0.86 8.00 -1.26 -4.93 116.55 112.45 2b1x n ASP 345 Ca 0.18 -1.83 -0.42 0.00 0.71 0.00 0.00 54.79 53.43 2b1x n ASP 345 Cb 0.54 -0.13 0.01 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 n ALA 346 N 0.86 0.96 -1.61 2.24 0.00 -0.82 -4.92 120.51 117.22 2b1x n ALA 346 Ca 0.17 0.29 -0.36 0.00 0.00 0.00 0.00 53.44 53.54 2b1x n ALA 346 Cb 0.47 -2.21 0.08 0.00 0.00 0.00 0.00 19.45 17.79 2b1x n ALA 346 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2b1x n PRO 347 N 0.24 0.93 -0.05 0.00 -0.02 -1.26 -4.78 135.00 130.05 2b1x n PRO 347 Ca 0.07 0.38 0.05 0.00 -2.02 0.00 0.00 63.50 61.97 2b1x n PRO 347 Cb 0.38 -2.50 0.41 0.00 -0.02 0.00 0.00 33.50 31.77 2b1x n PRO 347 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2b1x h ASP 348 N 0.25 0.52 -0.60 2.55 3.45 -1.97 -1.87 116.42 118.75 2b1x h ASP 348 Ca -0.50 -0.01 -0.02 0.00 0.43 0.00 0.00 57.03 56.93 2b1x h ASP 348 Cb 1.33 -0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 39.95 2b1x h ASP 348 CO 0.51 0.36 0.31 4.11 -1.57 0.00 0.00 179.24 182.97 2b1x h TRP 349 N 0.60 0.86 -0.08 4.55 5.08 -2.00 -1.66 115.95 123.30 2b1x h TRP 349 Ca 0.19 -0.02 -0.21 0.00 1.08 0.00 0.00 58.89 59.93 2b1x h TRP 349 Cb 0.03 -0.27 0.01 0.00 -3.00 0.00 0.00 29.16 25.93 2b1x h TRP 349 CO -0.00 0.63 -0.77 0.35 -1.28 0.00 0.00 178.44 177.37 2b1x h PHE 350 N 0.87 0.93 -0.44 0.12 3.04 -1.72 -2.34 116.94 117.41 2b1x h PHE 350 Ca 0.22 -0.45 0.08 0.00 3.98 0.00 0.00 57.97 61.80 2b1x h PHE 350 Cb 0.08 -0.13 -0.07 0.00 2.56 0.00 0.00 35.95 38.39 2b1x h PHE 350 CO 0.01 1.27 0.02 0.87 -2.02 0.00 0.00 178.31 178.45 2b1x h LYS 351 N 0.33 0.12 -0.08 1.11 1.57 -0.99 0.13 116.57 118.76 2b1x h LYS 351 Ca -0.07 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2b1x h LYS 351 Cb 1.42 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.70 2b1x h LYS 351 CO 0.16 0.08 0.04 0.22 -0.57 0.00 0.00 179.45 179.37 2b1x h ASP 352 N 0.13 0.11 -0.53 0.86 3.58 -1.30 -1.70 116.42 117.57 2b1x h ASP 352 Ca 0.22 -0.14 0.06 0.00 0.42 0.00 0.00 57.03 57.59 2b1x h ASP 352 Cb 0.31 -0.03 -0.05 0.00 1.72 0.00 0.00 39.33 41.28 2b1x h ASP 352 CO -0.35 0.21 0.24 -0.33 -2.88 0.00 0.00 179.24 176.14 2b1x h GLU 353 N -0.01 0.46 -0.35 0.28 4.39 -1.08 -1.77 114.58 116.50 2b1x h GLU 353 Ca 0.03 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2b1x h GLU 353 Cb 0.14 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2b1x h GLU 353 CO -0.00 0.30 0.13 1.03 -1.16 0.00 0.00 179.01 179.31 2b1x h SER 354 N 0.47 0.49 -0.59 1.42 0.87 -0.71 -1.71 113.55 113.78 2b1x h SER 354 Ca 0.24 -0.18 0.11 0.00 -1.23 0.00 0.00 61.79 60.73 2b1x h SER 354 Cb 0.19 -0.13 -0.09 0.00 -0.44 0.00 0.00 62.40 61.94 2b1x h SER 354 CO -0.19 0.53 0.11 0.22 -0.53 0.00 0.00 176.83 176.97 2b1x h TYR 355 N 0.41 0.17 -0.07 2.24 3.20 -1.12 -1.07 116.97 120.73 2b1x h TYR 355 Ca 0.11 0.04 -0.13 0.00 3.14 0.00 0.00 58.73 61.89 2b1x h TYR 355 Cb 0.21 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 2b1x h TYR 355 CO 0.00 -0.04 -0.56 0.87 -1.64 0.00 0.00 178.16 176.79 2b1x h LYS 356 N 0.24 0.22 -0.29 1.82 1.79 -1.04 -0.05 116.57 119.26 2b1x h LYS 356 Ca 0.31 -0.14 -0.08 0.00 -2.18 0.00 0.00 60.65 58.56 2b1x h LYS 356 Cb 0.46 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 2b1x h LYS 356 CO -0.40 0.72 -0.13 0.77 -1.08 0.00 0.00 179.45 179.33 2b1x h SER 357 N 0.17 0.61 -0.28 0.86 0.02 -0.82 -2.71 113.55 111.38 2b1x h SER 357 Ca -0.00 -0.40 0.02 0.00 -0.84 0.00 0.00 61.79 60.57 2b1x h SER 357 Cb 1.04 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 2b1x h SER 357 CO 0.09 0.87 0.14 0.22 -1.14 0.00 0.00 176.83 177.01 2b1x h TYR 358 N 0.34 0.26 -0.10 3.45 3.20 -1.07 -3.26 116.97 119.79 2b1x h TYR 358 Ca 0.07 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.80 2b1x h TYR 358 Cb 0.64 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 2b1x h TYR 358 CO 0.06 0.15 -0.58 1.25 -1.64 0.00 0.00 178.16 177.40 2b1x h LEU 359 N 0.30 0.37 0.00 2.82 5.85 -0.80 0.13 115.31 123.98 2b1x h LEU 359 Ca 0.12 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.63 2b1x h LEU 359 Cb 0.03 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.96 2b1x h LEU 359 CO -0.08 0.87 -0.33 0.54 -0.34 0.00 0.00 178.44 179.10 2b1x n ARG 360 N -3.91 0.02 -0.07 1.25 3.00 -1.04 -3.90 116.66 112.01 2b1x n ARG 360 Ca -0.03 0.01 -0.15 0.00 -0.01 0.00 0.00 57.85 57.67 2b1x n ARG 360 Cb 0.61 -1.51 -0.05 0.00 0.00 0.00 0.00 32.46 31.50 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 0.91 -4.42 0.55 -2.24 -1.06 -1.14 114.28 105.33 2b1x n THR 361 Ca 0.06 -0.16 -0.30 0.00 -2.27 0.00 0.00 64.05 61.38 2b1x n THR 361 Cb 0.34 -1.74 -0.06 0.00 -2.10 0.00 0.00 70.33 66.77 2b1x n THR 361 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2b1x s PHE 362 N -2.31 1.93 0.00 4.78 0.40 0.42 -0.71 117.98 122.48 2b1x s PHE 362 Ca -0.21 -0.86 0.00 0.00 -0.60 0.00 0.00 56.93 55.26 2b1x s PHE 362 Cb 0.08 -1.75 0.00 0.00 0.51 0.00 0.00 43.02 41.85 2b1x s PHE 362 CO 0.27 0.03 0.00 0.41 0.70 0.00 0.00 175.22 176.63 2b1x n GLY 363 N -1.39 -2.31 0.35 4.36 0.00 -1.26 -3.62 105.19 101.32 2b1x n GLY 363 Ca -0.11 -1.55 0.15 0.00 0.00 0.00 0.00 46.02 44.52 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 0.00 0.83 -0.15 -0.61 2.10 -1.96 -1.90 117.51 115.84 2b1x h ILE 364 Ca 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 65.88 2b1x h ILE 364 Cb 0.00 0.65 0.00 0.00 -1.09 0.00 0.00 36.82 36.38 2b1x h ILE 364 CO 0.00 0.03 0.00 -1.54 -1.08 0.00 0.00 178.15 175.56 2b1x n SER 365 N -4.44 2.26 -4.77 2.19 3.41 -1.26 -4.76 113.62 106.25 2b1x n SER 365 Ca 0.08 -1.81 -0.39 0.00 -0.26 0.00 0.00 58.87 56.49 2b1x n SER 365 Cb 0.44 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 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 -0.87 2.96 0.46 5.00 0.00 -0.71 -4.87 107.32 109.29 2b1x s GLY 366 Ca 0.11 0.99 0.31 0.00 0.00 0.00 0.00 44.72 46.14 2b1x s GLY 366 CO 0.09 1.56 1.93 -1.33 0.00 0.00 0.00 173.10 175.35 2b1x h GLY 367 N 3.19 0.00 0.00 0.20 0.00 -0.94 -1.78 103.07 103.74 2b1x h GLY 367 Ca -0.48 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 2b1x h GLY 367 CO 0.65 0.00 -0.44 0.74 0.00 0.00 0.00 176.54 177.49 2b1x h PHE 368 N 0.00 0.00 0.00 5.60 -1.00 -1.16 -3.41 116.94 116.97 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 0.33 -0.19 1.49 -1.61 0.00 0.00 178.31 178.33 2b1x h GLU 369 N -1.00 0.00 -0.21 1.51 4.81 -1.30 -1.71 114.58 116.68 2b1x h GLU 369 Ca -0.06 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.10 2b1x h GLU 369 Cb 0.54 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 2b1x h GLU 369 CO -0.03 0.19 -0.18 -0.56 -0.73 0.00 0.00 179.01 177.70 2b1x h GLN 370 N 0.00 0.36 -0.02 1.92 3.07 -1.54 -0.79 115.11 118.11 2b1x h GLN 370 Ca -0.00 -0.11 -0.24 0.00 0.09 0.00 0.00 58.65 58.40 2b1x h GLN 370 Cb 0.50 -0.04 0.01 0.00 0.08 0.00 0.00 27.48 28.03 2b1x h GLN 370 CO 0.02 0.53 -0.95 -0.44 0.09 0.00 0.00 178.83 178.09 2b1x h ASP 371 N 0.33 0.68 -0.28 0.06 3.32 -1.55 -2.78 116.42 116.20 2b1x h ASP 371 Ca 0.06 -0.53 0.06 0.00 0.02 0.00 0.00 57.03 56.64 2b1x h ASP 371 Cb 0.51 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 39.79 2b1x h ASP 371 CO 0.03 1.33 -0.15 0.44 -1.72 0.00 0.00 179.24 179.16 2b1x h ASP 372 N 0.31 -0.51 -0.89 6.45 3.32 -1.15 -1.19 116.42 122.75 2b1x h ASP 372 Ca -0.09 0.12 0.07 0.00 0.02 0.00 0.00 57.03 57.15 2b1x h ASP 372 Cb 1.58 0.27 -0.07 0.00 0.22 0.00 0.00 39.33 41.34 2b1x h ASP 372 CO 0.17 -0.19 0.55 0.00 -1.72 0.00 0.00 179.24 178.06 2b1x h ALA 373 N 1.08 1.24 -0.44 3.45 0.00 -1.17 -1.54 119.26 121.89 2b1x h ALA 373 Ca 0.15 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2b1x h ALA 373 Cb 0.35 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2b1x h ALA 373 CO -0.36 0.29 0.15 1.49 0.00 0.00 0.00 179.25 180.82 2b1x h GLU 374 N 0.99 0.67 -0.44 0.00 4.57 -1.15 -2.05 114.58 117.18 2b1x h GLU 374 Ca 0.40 -0.14 0.03 0.00 -1.18 0.00 0.00 59.36 58.47 2b1x h GLU 374 Cb 0.21 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.67 2b1x h GLU 374 CO -0.19 0.64 0.23 -0.91 -1.18 0.00 0.00 179.01 177.60 2b1x h ASN 375 N 0.56 0.35 -0.23 1.04 2.35 -0.64 -2.18 115.58 116.83 2b1x h ASN 375 Ca 0.14 0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.82 2b1x h ASN 375 Cb 0.24 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 2b1x h ASN 375 CO -0.01 0.25 -0.16 -0.50 -1.65 0.00 0.00 177.43 175.36 2b1x h TRP 376 N 0.46 0.73 -0.08 1.19 6.55 -1.08 -1.83 115.95 121.89 2b1x h TRP 376 Ca 0.18 -0.14 -0.12 0.00 0.95 0.00 0.00 58.89 59.76 2b1x h TRP 376 Cb 0.07 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 28.17 2b1x h TRP 376 CO -0.09 0.78 -0.51 0.07 -1.05 0.00 0.00 178.44 177.64 2b1x h ARG 377 N 0.59 0.20 -0.06 0.49 0.11 -1.29 -2.02 114.38 112.40 2b1x h ARG 377 Ca 0.10 -0.12 -0.02 0.00 0.10 0.00 0.00 59.98 60.04 2b1x h ARG 377 Cb 0.61 0.01 -0.00 0.00 1.11 0.00 0.00 29.97 31.70 2b1x h ARG 377 CO 0.04 0.67 -0.03 1.03 0.10 0.00 0.00 179.97 181.78 2b1x h SER 378 N 0.16 0.14 -0.17 0.08 0.87 -1.02 -2.01 113.55 111.60 2b1x h SER 378 Ca 0.00 -0.42 0.05 0.00 -1.23 0.00 0.00 61.79 60.20 2b1x h SER 378 Cb 0.96 -0.04 -0.06 0.00 -0.44 0.00 0.00 62.40 62.83 2b1x h SER 378 CO 0.08 0.53 -0.19 0.40 -0.53 0.00 0.00 176.83 177.12 2b1x h ILE 379 N -0.25 0.51 -0.75 2.23 2.04 -1.36 -2.78 117.51 117.16 2b1x h ILE 379 Ca 0.01 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.95 2b1x h ILE 379 Cb 0.47 0.51 -0.07 0.00 -0.74 0.00 0.00 36.82 37.00 2b1x h ILE 379 CO 0.01 0.00 0.41 0.74 0.00 0.00 0.00 178.15 179.31 2b1x h THR 380 N -0.21 0.93 -0.10 -0.27 2.02 -1.31 0.99 112.91 114.94 2b1x h THR 380 Ca 0.11 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 2b1x h THR 380 Cb 0.38 0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 66.92 2b1x h THR 380 CO -0.30 0.13 0.03 -0.09 0.37 0.00 0.00 175.52 175.66 2b1x h ARG 381 N 0.72 0.17 0.00 6.66 2.43 -1.18 -2.97 114.38 120.22 2b1x h ARG 381 Ca 0.35 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.39 2b1x h ARG 381 Cb 0.29 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2b1x h ARG 381 CO -0.22 0.34 -0.45 -0.24 -1.51 0.00 0.00 179.97 177.89 2b1x h VAL 382 N -0.04 0.86 0.00 0.20 3.04 -1.18 -2.83 116.25 116.30 2b1x h VAL 382 Ca 0.03 -1.91 0.00 0.00 -1.01 0.00 0.00 66.70 63.82 2b1x h VAL 382 Cb 0.25 2.20 0.00 0.00 -2.01 0.00 0.00 31.29 31.73 2b1x h VAL 382 CO 0.00 0.44 0.00 0.23 -1.01 0.00 0.00 177.57 177.23 2b1x n MET 383 N -3.35 0.76 0.01 4.17 2.81 0.30 -2.24 117.12 119.59 2b1x n MET 383 Ca 0.01 0.00 0.14 0.00 -1.81 0.00 0.00 57.70 56.04 2b1x n MET 383 Cb 0.63 -1.49 0.57 0.00 -0.71 0.00 0.00 33.22 32.23 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 0.52 -1.52 3.74 3.03 0.00 -1.07 -4.35 105.19 105.54 2b1x n GLY 384 Ca 0.18 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.08 2.58 0.27 -0.02 0.00 -0.95 -4.95 107.32 101.17 2b1x s GLY 385 Ca 0.13 0.99 -0.01 0.00 0.00 0.00 0.00 44.72 45.84 2b1x s GLY 385 CO 0.55 1.94 1.85 0.06 0.00 0.00 0.00 173.10 177.50 2b1x h GLN 386 N 5.41 1.04 -0.13 2.90 3.07 -1.91 -0.74 115.11 124.75 2b1x h GLN 386 Ca -0.44 -0.06 -0.14 0.00 0.09 0.00 0.00 58.65 58.09 2b1x h GLN 386 Cb 1.21 -0.23 0.01 0.00 0.08 0.00 0.00 27.48 28.55 2b1x h GLN 386 CO 0.76 0.69 -0.48 0.35 0.09 0.00 0.00 178.83 180.24 2b1x h PHE 387 N 1.07 0.73 -0.87 0.06 3.57 -1.97 -3.12 116.94 116.42 2b1x h PHE 387 Ca 0.46 -0.31 0.13 0.00 3.53 0.00 0.00 57.97 61.79 2b1x h PHE 387 Cb 0.34 -0.12 -0.07 0.00 2.79 0.00 0.00 35.95 38.89 2b1x h PHE 387 CO -0.01 1.08 0.56 0.00 -2.23 0.00 0.00 178.31 177.71 2b1x h ALA 388 N 0.51 1.83 0.00 2.41 0.00 -1.73 -2.09 119.26 120.19 2b1x h ALA 388 Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2b1x h ALA 388 Cb 1.11 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2b1x h ALA 388 CO 0.10 -0.06 0.00 1.63 0.00 0.00 0.00 179.25 180.93 2b1x n LYS 389 N -4.55 0.19 0.00 0.00 5.02 -0.33 -2.09 118.16 116.40 2b1x n LYS 389 Ca 0.16 0.37 0.14 0.00 -2.02 0.00 0.00 58.31 56.96 2b1x n LYS 389 Cb 0.44 -1.82 0.58 0.00 -0.02 0.00 0.00 35.03 34.21 2b1x n LYS 389 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2b1x n THR 390 N -2.17 0.00 -1.74 -0.18 -2.24 -0.78 -2.82 114.28 104.35 2b1x n THR 390 Ca 0.03 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2b1x n THR 390 Cb 0.26 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 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 1.31 0.01 3.28 3.38 0.00 -0.89 -4.92 105.19 107.36 2b1x n GLY 391 Ca 0.13 -1.84 -0.21 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.63 1.13 -0.03 1.61 1.03 -1.26 -1.13 118.70 117.42 2b1x s GLU 392 Ca 0.00 -1.27 -0.18 0.00 0.03 0.00 0.00 54.97 53.55 2b1x s GLU 392 Cb 0.00 -1.17 -0.05 0.00 -0.80 0.00 0.00 34.13 32.10 2b1x s GLU 392 CO 0.00 0.24 0.52 -0.51 -1.33 0.00 0.00 175.26 174.18 2b1x s LEU 393 N -2.37 4.40 -0.41 1.83 1.43 0.22 -4.72 118.68 119.06 2b1x s LEU 393 Ca 0.10 1.03 -0.23 0.00 -1.03 0.00 0.00 54.13 54.00 2b1x s LEU 393 Cb -0.07 -2.78 0.02 0.00 0.03 0.00 0.00 46.19 43.39 2b1x s LEU 393 CO 0.05 0.15 0.80 0.21 0.23 0.00 0.00 176.35 177.78 2b1x s ASN 394 N -0.28 6.48 -0.29 2.29 3.84 -1.26 -2.07 114.94 123.65 2b1x s ASN 394 Ca 0.28 0.11 0.07 0.00 0.21 0.00 0.00 52.86 53.54 2b1x s ASN 394 Cb -0.17 -2.40 0.45 0.00 -0.55 0.00 0.00 41.25 38.59 2b1x s ASN 394 CO 0.15 -0.85 1.26 -1.22 -2.79 0.00 0.00 177.10 173.65 2b1x n TYR 395 N 6.63 2.05 1.35 0.43 4.02 -0.54 -4.82 117.16 126.27 2b1x n TYR 395 Ca 0.03 -2.06 0.11 0.00 -0.01 0.00 0.00 57.90 55.96 2b1x n TYR 395 Cb 0.48 -0.39 0.42 0.00 -0.02 0.00 0.00 39.34 39.82 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 -0.84 1.63 -1.53 -0.72 6.02 -1.18 -4.78 117.38 115.97 2b1x n GLN 396 Ca 0.39 -0.94 -0.47 0.00 -0.01 0.00 0.00 57.00 55.97 2b1x n GLN 396 Cb 0.89 -1.39 -0.05 0.00 1.02 0.00 0.00 30.24 30.72 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 0.16 1.58 0.00 -1.09 1.56 -1.26 -1.18 117.12 116.89 2b1x n MET 397 Ca 0.16 0.44 0.00 0.00 -0.27 0.00 0.00 57.70 58.03 2b1x n MET 397 Cb 0.30 -2.88 0.00 0.00 2.15 0.00 0.00 33.22 32.78 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 6.08 1.15 3.65 -5.12 0.00 -1.26 -3.45 105.19 106.24 2b1x n GLY 398 Ca 0.35 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.75 1.95 -0.96 1.61 0.63 -0.32 0.52 116.66 118.33 2b1x n ARG 399 Ca 0.00 0.70 0.00 0.00 -0.92 0.00 0.00 57.85 57.63 2b1x n ARG 399 Cb 0.00 -2.42 0.00 0.00 0.45 0.00 0.00 32.46 30.49 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 3.02 0.84 0.22 5.14 0.00 -1.26 -4.78 105.19 108.37 2b1x n GLY 400 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.13 0.00 -1.70 1.61 0.31 0.18 -5.08 118.33 111.52 2b1x n VAL 401 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.90 2b1x n VAL 401 Cb 0.01 -0.35 -0.03 0.00 -0.91 0.00 0.00 33.84 32.55 2b1x n VAL 401 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2b1x n LEU 402 N -2.09 3.73 -4.07 7.52 4.77 0.41 -5.02 117.00 122.25 2b1x n LEU 402 Ca 0.00 1.06 -0.24 0.00 -0.03 0.00 0.00 56.01 56.80 2b1x n LEU 402 Cb 0.24 -1.53 -0.16 0.00 -2.33 0.00 0.00 43.42 39.65 2b1x n LEU 402 CO 0.00 0.04 -0.47 -1.61 -1.33 0.00 0.00 177.39 174.02 2b1x s GLU 403 N 1.26 1.46 0.52 3.23 2.02 -1.26 -5.06 118.70 120.87 2b1x s GLU 403 Ca 0.77 -0.46 -0.22 0.00 0.02 0.00 0.00 54.97 55.08 2b1x s GLU 403 Cb -0.56 -1.28 -0.07 0.00 0.10 0.00 0.00 34.13 32.32 2b1x s GLU 403 CO 0.35 0.16 1.10 -2.30 0.02 0.00 0.00 175.26 174.59 2b1x n PRO 404 N 3.30 1.32 -2.73 0.39 -0.02 -1.26 -4.57 135.00 131.43 2b1x n PRO 404 Ca -0.19 0.49 -0.43 0.00 -2.02 0.00 0.00 63.50 61.35 2b1x n PRO 404 Cb 0.53 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 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 -0.95 6.71 0.50 2.55 -1.08 0.77 -4.90 116.67 120.28 2b1x s ASP 405 Ca 0.70 0.62 0.29 0.00 -0.52 0.00 0.00 52.55 53.64 2b1x s ASP 405 Cb -0.46 -2.50 0.96 0.00 -1.46 0.00 0.00 42.92 39.46 2b1x s ASP 405 CO 0.52 -0.95 1.83 1.55 0.52 0.00 0.00 175.17 178.63 2b1x h PRO 406 N 8.58 0.00 -0.06 4.34 0.13 -1.90 -3.20 132.00 139.89 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 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2b1x h PRO 406 CO 1.02 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.88 2b1x n ASN 407 N -3.07 2.54 -4.71 1.44 3.02 -1.26 -4.95 115.26 108.27 2b1x n ASN 407 Ca 0.02 -1.84 -0.42 0.00 -0.03 0.00 0.00 54.58 52.31 2b1x n ASN 407 Cb 0.39 -0.03 -0.03 0.00 -0.61 0.00 0.00 39.78 39.51 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 -1.95 3.27 -1.94 3.10 -0.11 -1.21 -4.93 118.94 115.16 2b1x s TRP 408 Ca 0.32 1.10 0.27 0.00 1.22 0.00 0.00 56.10 59.01 2b1x s TRP 408 Cb 0.20 -3.55 0.87 0.00 -1.50 0.00 0.00 33.47 29.50 2b1x s TRP 408 CO 0.31 -1.85 1.64 0.25 -4.62 0.00 0.00 176.95 172.68 2b1x n THR 409 N 4.08 0.00 -3.08 5.86 -2.24 -1.26 -4.91 114.28 112.73 2b1x n THR 409 Ca 0.11 -0.15 -0.17 0.00 -2.27 0.00 0.00 64.05 61.56 2b1x n THR 409 Cb 0.44 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 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 -2.37 1.97 0.88 3.38 0.00 -1.26 -5.03 107.32 104.89 2b1x s GLY 410 Ca 0.28 -1.69 -0.12 0.00 0.00 0.00 0.00 44.72 43.19 2b1x s GLY 410 CO 0.47 -1.51 1.16 2.56 0.00 0.00 0.00 173.10 175.78 2b1x s PRO 411 N -4.32 1.43 0.05 2.90 0.04 -1.26 -4.98 135.00 128.86 2b1x s PRO 411 Ca 0.54 0.17 0.00 0.00 0.04 0.00 0.00 61.00 61.75 2b1x s PRO 411 Cb -0.09 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2b1x s PRO 411 CO 0.32 -1.98 0.00 0.41 0.04 0.00 0.00 177.00 175.79 2b1x n GLY 412 N -2.74 -2.99 3.47 0.56 0.00 -1.26 -4.87 105.19 97.36 2b1x n GLY 412 Ca 0.08 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.68 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 -0.51 3.38 -0.04 1.61 2.12 0.11 -4.90 118.70 120.46 2b1x s GLU 413 Ca 0.00 -0.70 0.06 0.00 0.36 0.00 0.00 54.97 54.69 2b1x s GLU 413 Cb 0.00 -3.64 -0.01 0.00 0.26 0.00 0.00 34.13 30.74 2b1x s GLU 413 CO 0.00 -0.43 -0.23 0.00 -0.54 0.00 0.00 175.26 174.06 2b1x s ALA 414 N 1.65 1.99 -0.00 6.30 0.00 -1.26 -1.07 121.76 129.37 2b1x s ALA 414 Ca 0.05 -0.98 0.07 0.00 0.00 0.00 0.00 51.96 51.09 2b1x s ALA 414 Cb -0.17 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 2b1x s ALA 414 CO 0.08 0.42 -0.21 0.71 0.00 0.00 0.00 175.76 176.76 2b1x s TYR 415 N -0.28 2.49 0.00 0.00 1.51 -0.12 -0.16 117.35 120.79 2b1x s TYR 415 Ca 0.01 -0.31 0.00 0.00 -1.01 0.00 0.00 57.07 55.76 2b1x s TYR 415 Cb -0.12 -1.51 0.00 0.00 -0.11 0.00 0.00 41.96 40.22 2b1x s TYR 415 CO 0.02 0.12 1.18 -0.35 -1.11 0.00 0.00 175.55 175.40 2b1x n PRO 416 N 2.08 0.91 -3.80 -1.71 -0.04 -1.26 -1.59 135.00 129.59 2b1x n PRO 416 Ca -0.16 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.21 2b1x n PRO 416 Cb 0.52 -1.05 -0.03 0.00 -0.04 0.00 0.00 33.50 32.90 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 0.00 -0.12 -0.07 1.53 2.34 -0.95 -4.61 118.68 116.79 2b1x s LEU 417 Ca 0.00 -0.55 0.11 0.00 0.06 0.00 0.00 54.13 53.75 2b1x s LEU 417 Cb 0.00 2.42 0.30 0.00 -0.56 0.00 0.00 46.19 48.35 2b1x s LEU 417 CO 0.00 -1.19 1.24 -0.67 -1.06 0.00 0.00 176.35 174.66 2b1x n ASP 418 N -0.41 2.93 -4.37 1.48 2.03 0.16 -2.20 116.55 116.17 2b1x n ASP 418 Ca -0.07 -2.43 -0.45 0.00 0.52 0.00 0.00 54.79 52.36 2b1x n ASP 418 Cb 0.61 -0.30 -0.03 0.00 -0.72 0.00 0.00 41.12 40.68 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 -1.77 3.25 -0.00 -0.67 4.12 -1.25 -4.32 117.35 116.71 2b1x s TYR 419 Ca 0.25 -1.36 -0.28 0.00 0.02 0.00 0.00 57.07 55.70 2b1x s TYR 419 Cb 0.18 -3.99 0.10 0.00 -1.52 0.00 0.00 41.96 36.73 2b1x s TYR 419 CO 0.09 -1.22 0.87 0.00 0.02 0.00 0.00 175.55 175.31 2b1x s ALA 420 N 1.90 -1.81 -0.07 3.71 0.00 -1.26 -4.82 121.76 119.40 2b1x s ALA 420 Ca 0.16 1.01 0.10 0.00 0.00 0.00 0.00 51.96 53.23 2b1x s ALA 420 Cb -0.17 0.40 0.15 0.00 0.00 0.00 0.00 23.12 23.51 2b1x s ALA 420 CO -0.01 -0.68 1.04 0.39 0.00 0.00 0.00 175.76 176.51 2b1x n GLU 421 N -0.21 1.19 -0.26 0.00 1.02 -1.22 -4.76 120.64 116.40 2b1x n GLU 421 Ca -0.09 -1.89 -0.05 0.00 -0.02 0.00 0.00 57.16 55.10 2b1x n GLU 421 Cb 0.62 -1.12 0.06 0.00 -0.02 0.00 0.00 31.44 30.98 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 0.93 -0.70 0.62 0.00 -1.88 -2.18 119.26 116.05 2b1x h ALA 422 Ca 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2b1x h ALA 422 Cb 1.01 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2b1x h ALA 422 CO 0.00 0.39 0.40 -0.91 0.00 0.00 0.00 179.25 179.14 2b1x h ASN 423 N 0.99 0.86 -0.55 0.00 4.21 -1.89 -0.35 115.58 118.86 2b1x h ASN 423 Ca 0.26 -0.08 -0.05 0.00 1.21 0.00 0.00 56.30 57.64 2b1x h ASN 423 Cb -0.04 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 36.92 2b1x h ASN 423 CO -0.05 0.69 0.16 1.56 -1.29 0.00 0.00 177.43 178.50 2b1x h GLN 424 N 0.96 0.86 -0.69 0.81 7.50 -1.85 0.21 115.11 122.91 2b1x h GLN 424 Ca 0.25 -0.19 -0.01 0.00 0.50 0.00 0.00 58.65 59.20 2b1x h GLN 424 Cb 0.01 -0.12 -0.03 0.00 0.05 0.00 0.00 27.48 27.38 2b1x h GLN 424 CO -0.04 0.80 0.41 0.00 -1.50 0.00 0.00 178.83 178.49 2b1x h ARG 425 N 0.77 0.94 -0.69 1.46 3.08 -1.16 -0.47 114.38 118.30 2b1x h ARG 425 Ca 0.18 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 2b1x h ARG 425 Cb 0.30 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 2b1x h ARG 425 CO -0.00 0.67 0.21 -0.97 -1.07 0.00 0.00 179.97 178.81 2b1x h ASN 426 N 0.93 1.01 0.10 7.04 -1.24 -0.74 0.80 115.58 123.49 2b1x h ASN 426 Ca 0.25 -0.21 -0.00 0.00 0.71 0.00 0.00 56.30 57.04 2b1x h ASN 426 Cb -0.02 -0.27 -0.00 0.00 0.73 0.00 0.00 38.32 38.76 2b1x h ASN 426 CO -0.05 0.96 -0.08 0.15 -1.29 0.00 0.00 177.43 177.13 2b1x h PHE 427 N 1.02 -0.20 -0.11 0.67 3.57 -0.70 -2.66 116.94 118.52 2b1x h PHE 427 Ca 0.22 -0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.59 2b1x h PHE 427 Cb 0.31 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2b1x h PHE 427 CO 0.02 -0.12 -0.52 -0.07 -2.23 0.00 0.00 178.31 175.39 2b1x h LEU 428 N -0.18 0.35 -0.11 0.59 3.38 -0.88 -1.96 115.31 116.50 2b1x h LEU 428 Ca -0.00 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 57.82 2b1x h LEU 428 Cb 0.16 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2b1x h LEU 428 CO -0.00 0.81 -0.13 -0.08 0.09 0.00 0.00 178.44 179.13 2b1x h GLU 429 N 0.25 -0.15 -0.44 1.13 4.81 -0.81 0.19 114.58 119.55 2b1x h GLU 429 Ca 0.01 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 2b1x h GLU 429 Cb 1.01 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 2b1x h GLU 429 CO 0.09 -0.10 0.14 -0.92 -0.73 0.00 0.00 179.01 177.48 2b1x h TYR 430 N -0.16 0.71 -0.55 0.92 3.20 -1.34 0.40 116.97 120.15 2b1x h TYR 430 Ca 0.08 -0.07 0.09 0.00 3.14 0.00 0.00 58.73 61.97 2b1x h TYR 430 Cb 0.28 -0.21 -0.07 0.00 1.54 0.00 0.00 36.73 38.27 2b1x h TYR 430 CO -0.24 0.64 0.15 2.35 -1.64 0.00 0.00 178.16 179.42 2b1x h TRP 431 N 0.58 0.25 -0.12 -3.82 7.01 -1.16 0.16 115.95 118.83 2b1x h TRP 431 Ca 0.14 0.03 -0.11 0.00 2.11 0.00 0.00 58.89 61.07 2b1x h TRP 431 Cb 0.26 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.28 2b1x h TRP 431 CO 0.01 0.03 -0.40 0.52 -2.79 0.00 0.00 178.44 175.81 2b1x h MET 432 N 0.30 0.27 -0.35 2.65 2.86 -0.23 -1.15 114.93 119.28 2b1x h MET 432 Ca 0.28 -0.13 -0.14 0.00 -2.06 0.00 0.00 59.70 57.65 2b1x h MET 432 Cb 0.37 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 2b1x h MET 432 CO -0.33 0.63 -0.35 1.96 1.06 0.00 0.00 176.91 179.88 2b1x h GLN 433 N 0.23 0.85 -0.57 1.72 4.20 0.08 -2.53 115.11 119.08 2b1x h GLN 433 Ca 0.02 -0.45 -0.08 0.00 0.06 0.00 0.00 58.65 58.20 2b1x h GLN 433 Cb 0.80 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.58 2b1x h GLN 433 CO 0.06 1.09 0.03 -0.07 -0.67 0.00 0.00 178.83 179.27 2b1x h LEU 434 N 0.64 0.96 -1.99 1.46 3.38 -0.78 -2.03 115.31 116.96 2b1x h LEU 434 Ca 0.05 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 2b1x h LEU 434 Cb 0.94 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2b1x h LEU 434 CO 0.09 1.02 -0.05 0.24 0.09 0.00 0.00 178.44 179.82 2b1x h MET 435 N 0.88 0.00 -0.01 1.13 2.86 -1.11 -2.43 114.93 116.26 2b1x h MET 435 Ca 0.17 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2b1x h MET 435 Cb 0.50 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.16 2b1x h MET 435 CO 0.02 0.05 -0.53 1.28 1.06 0.00 0.00 176.91 178.80 2b1x n LEU 436 N -4.30 1.30 -4.62 1.22 4.77 -0.96 -4.91 117.00 109.50 2b1x n LEU 436 Ca -0.03 -0.45 -0.43 0.00 -0.03 0.00 0.00 56.01 55.07 2b1x n LEU 436 Cb 0.14 -0.07 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 2b1x n LEU 436 CO 0.33 0.26 1.37 0.00 -1.33 0.00 0.00 177.39 178.02 2b1x s ALA 437 N -2.67 3.17 0.10 -1.18 0.00 -0.78 -4.84 121.76 115.56 2b1x s ALA 437 Ca 0.17 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.41 2b1x s ALA 437 Cb 0.18 -3.89 -0.19 0.00 0.00 0.00 0.00 23.12 19.22 2b1x s ALA 437 CO 0.64 -2.12 1.22 0.93 0.00 0.00 0.00 175.76 176.43 2b1x h GLU 438 N 11.04 0.34 -5.81 0.00 4.39 -1.90 -3.43 114.58 119.21 2b1x h GLU 438 Ca -0.32 -0.46 -0.66 0.00 0.34 0.00 0.00 59.36 58.25 2b1x h GLU 438 Cb 1.15 0.15 -0.32 0.00 -0.10 0.00 0.00 28.75 29.63 2b1x h GLU 438 CO 1.02 1.17 -0.87 -1.12 -1.16 0.00 0.00 179.01 178.04 2b1x s SER 439 N -7.13 2.88 0.40 1.42 0.01 -1.26 -5.13 113.70 104.89 2b1x s SER 439 Ca -0.05 -0.48 -0.12 0.00 1.31 0.00 0.00 55.95 56.61 2b1x s SER 439 Cb 0.08 -0.84 -0.10 0.00 0.21 0.00 0.00 66.02 65.37 2b1x s SER 439 CO 0.88 0.22 -0.17 -2.65 0.41 0.00 0.00 173.24 171.93 2b1x n PRO 440 N 3.04 0.00 -0.96 12.44 -0.02 -1.26 -5.16 135.00 143.08 2b1x n PRO 440 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 2b1x n PRO 440 Cb 0.52 -0.67 0.00 0.00 -0.02 0.00 0.00 33.50 33.34 2b1x n PRO 440 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76