#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o9r s LYS 2 N 0.00 0.32 0.46 3.17 -2.85 -1.26 -5.15 119.74 114.43 1o9r s LYS 2 Ca 0.00 -0.63 -0.23 0.00 -1.00 0.00 0.00 55.97 54.11 1o9r s LYS 2 Cb 0.00 0.11 -0.07 0.00 -2.06 0.00 0.00 37.83 35.81 1o9r s LYS 2 CO 0.00 -0.05 1.18 -0.08 0.10 0.00 0.00 175.35 176.50 1o9r s THR 3 N -1.54 3.05 -0.05 3.79 -1.32 -1.26 -4.78 115.64 113.52 1o9r s THR 3 Ca -0.15 0.80 0.05 0.00 -1.21 0.00 0.00 61.69 61.18 1o9r s THR 3 Cb -0.09 -3.41 -0.02 0.00 -1.51 0.00 0.00 72.50 67.46 1o9r s THR 3 CO -0.01 0.00 -0.20 -1.00 -2.21 0.00 0.00 174.62 171.20 1o9r s HIS 4 N -1.51 2.55 0.15 9.09 0.09 -0.52 -5.05 115.29 120.09 1o9r s HIS 4 Ca 0.63 -0.40 -0.30 0.00 -0.00 0.00 0.00 55.06 54.99 1o9r s HIS 4 Cb -0.30 -1.61 -0.07 0.00 -0.00 0.00 0.00 32.58 30.61 1o9r s HIS 4 CO 0.36 0.00 1.10 0.15 -0.00 0.00 0.00 174.74 176.35 1o9r s LYS 5 N -0.48 4.57 0.02 1.40 1.02 -1.26 -4.52 119.74 120.49 1o9r s LYS 5 Ca 0.06 1.69 -0.07 0.00 0.02 0.00 0.00 55.97 57.68 1o9r s LYS 5 Cb -0.12 -3.30 -0.00 0.00 -0.52 0.00 0.00 37.83 33.89 1o9r s LYS 5 CO 0.01 0.03 0.12 -0.08 -0.92 0.00 0.00 175.35 174.51 1o9r s THR 6 N 0.04 0.10 -0.46 2.17 -1.32 -1.26 -5.02 115.64 109.89 1o9r s THR 6 Ca 0.51 -0.84 0.26 0.00 -1.21 0.00 0.00 61.69 60.41 1o9r s THR 6 Cb -0.29 -0.60 0.30 0.00 -1.51 0.00 0.00 72.50 70.41 1o9r s THR 6 CO 0.33 -0.46 1.76 0.11 -2.21 0.00 0.00 174.62 174.16 1o9r h LYS 7 N 4.03 0.00 -6.34 7.08 1.79 -1.96 -3.45 116.57 117.72 1o9r h LYS 7 Ca -0.31 0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.53 1o9r h LYS 7 Cb 1.19 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.88 1o9r h LYS 7 CO 0.44 0.00 0.90 -1.71 -1.08 0.00 0.00 179.45 178.00 1o9r n ASN 8 N -2.56 3.01 -1.31 0.86 4.05 -1.26 -4.86 115.26 113.19 1o9r n ASN 8 Ca 0.03 1.04 0.08 0.00 0.45 0.00 0.00 54.58 56.18 1o9r n ASN 8 Cb 0.37 -1.35 0.29 0.00 1.23 0.00 0.00 39.78 40.32 1o9r n ASN 8 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 177.26 173.31 1o9r n ASP 9 N 4.90 3.85 -4.68 1.20 5.68 -1.26 -4.94 116.55 121.30 1o9r n ASP 9 Ca 0.21 -2.31 -0.44 0.00 -0.50 0.00 0.00 54.79 51.74 1o9r n ASP 9 Cb 0.26 -0.50 -0.02 0.00 -1.14 0.00 0.00 41.12 39.72 1o9r n ASP 9 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1o9r n LEU 10 N 0.93 3.31 -4.65 -2.12 7.94 -1.26 -4.85 117.00 116.31 1o9r n LEU 10 Ca 0.21 1.15 -0.40 0.00 -1.11 0.00 0.00 56.01 55.85 1o9r n LEU 10 Cb 0.71 -1.46 0.02 0.00 0.53 0.00 0.00 43.42 43.23 1o9r n LEU 10 CO 0.19 -0.39 0.69 -2.65 -1.11 0.00 0.00 177.39 174.11 1o9r n PRO 11 N 1.97 1.44 -0.36 1.96 -0.02 -1.26 -4.67 135.00 134.06 1o9r n PRO 11 Ca 0.11 0.52 0.06 0.00 -2.02 0.00 0.00 63.50 62.17 1o9r n PRO 11 Cb 0.32 -2.20 0.23 0.00 -0.02 0.00 0.00 33.50 31.83 1o9r n PRO 11 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1o9r h SER 12 N 1.46 0.95 0.11 2.55 0.02 -1.97 -0.07 113.55 116.60 1o9r h SER 12 Ca -0.47 0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 60.39 1o9r h SER 12 Cb 1.33 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 1o9r h SER 12 CO 0.56 0.54 -0.43 0.78 -1.14 0.00 0.00 176.83 177.14 1o9r h ASN 13 N 1.04 0.42 -0.31 3.07 2.35 -2.00 -1.30 115.58 118.85 1o9r h ASN 13 Ca 0.48 -0.19 -0.03 0.00 -0.55 0.00 0.00 56.30 56.01 1o9r h ASN 13 Cb 0.40 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1o9r h ASN 13 CO -0.24 0.81 0.08 0.00 -1.65 0.00 0.00 177.43 176.43 1o9r h ALA 14 N 1.21 0.41 -0.24 -0.83 0.00 -1.52 -1.53 119.26 116.76 1o9r h ALA 14 Ca 0.03 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.81 1o9r h ALA 14 Cb 0.90 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 1o9r h ALA 14 CO 0.07 0.07 -0.08 0.87 0.00 0.00 0.00 179.25 180.19 1o9r h LYS 15 N 0.35 -0.02 -0.18 0.00 1.57 -0.82 0.51 116.57 117.98 1o9r h LYS 15 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1o9r h LYS 15 Cb 0.29 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1o9r h LYS 15 CO 0.00 -0.02 0.11 0.77 -0.57 0.00 0.00 179.45 179.74 1o9r h SER 16 N -0.02 0.18 -0.15 0.86 0.02 -1.06 0.10 113.55 113.47 1o9r h SER 16 Ca 0.12 -0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.10 1o9r h SER 16 Cb 0.21 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.68 1o9r h SER 16 CO -0.26 0.13 -0.02 0.74 -1.14 0.00 0.00 176.83 176.28 1o9r h THR 17 N 0.23 0.88 -0.01 -2.27 2.02 -1.09 -2.73 112.91 109.92 1o9r h THR 17 Ca 0.07 -0.01 -0.13 0.00 0.77 0.00 0.00 66.41 67.11 1o9r h THR 17 Cb -0.01 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1o9r h THR 17 CO -0.03 0.00 -0.60 0.58 0.37 0.00 0.00 175.52 175.85 1o9r h VAL 18 N 0.03 1.42 -0.98 3.16 2.07 -0.67 -2.46 116.25 118.83 1o9r h VAL 18 Ca 0.07 -2.05 0.02 0.00 0.82 0.00 0.00 66.70 65.56 1o9r h VAL 18 Cb 0.09 2.09 -0.05 0.00 -1.52 0.00 0.00 31.29 31.91 1o9r h VAL 18 CO -0.13 0.59 0.65 0.40 0.02 0.00 0.00 177.57 179.09 1o9r h ILE 19 N 0.03 1.23 -0.53 4.57 2.04 -0.91 0.58 117.51 124.52 1o9r h ILE 19 Ca -0.01 -0.45 -0.05 0.00 1.00 0.00 0.00 64.86 65.36 1o9r h ILE 19 Cb 1.07 -0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1o9r h ILE 19 CO 0.08 0.24 0.15 1.23 0.00 0.00 0.00 178.15 179.84 1o9r h GLY 20 N 1.30 0.90 1.00 5.37 0.00 -1.14 -0.09 103.07 110.41 1o9r h GLY 20 Ca 0.36 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1o9r h GLY 20 CO -0.09 0.51 0.23 -2.22 0.00 0.00 0.00 176.54 174.97 1o9r h ILE 21 N 0.73 1.09 -0.19 2.60 2.04 -1.05 -1.14 117.51 121.60 1o9r h ILE 21 Ca 0.17 -0.18 -0.04 0.00 1.00 0.00 0.00 64.86 65.80 1o9r h ILE 21 Cb 0.31 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1o9r h ILE 21 CO -0.00 0.09 -0.04 -0.07 0.00 0.00 0.00 178.15 178.13 1o9r h LEU 22 N 0.46 0.37 -1.08 1.44 3.38 -0.67 -1.43 115.31 117.79 1o9r h LEU 22 Ca 0.13 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 1o9r h LEU 22 Cb -0.04 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1o9r h LEU 22 CO -0.03 0.64 0.05 0.78 0.09 0.00 0.00 178.44 179.98 1o9r h ASN 23 N 0.09 0.67 -0.47 -0.43 2.35 -0.99 0.14 115.58 116.94 1o9r h ASN 23 Ca 0.05 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 1o9r h ASN 23 Cb 0.48 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1o9r h ASN 23 CO 0.02 0.70 0.19 -0.08 -1.65 0.00 0.00 177.43 176.61 1o9r h GLU 24 N 0.68 0.70 -0.65 0.81 4.81 -1.09 -2.49 114.58 117.34 1o9r h GLU 24 Ca 0.14 -0.12 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 1o9r h GLU 24 Cb 0.34 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1o9r h GLU 24 CO 0.01 0.63 0.14 0.77 -0.73 0.00 0.00 179.01 179.82 1o9r h SER 25 N 0.62 0.99 -0.78 1.04 0.02 -0.87 -2.94 113.55 111.63 1o9r h SER 25 Ca 0.16 -0.21 0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1o9r h SER 25 Cb 0.18 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.41 1o9r h SER 25 CO -0.01 0.97 0.47 0.25 -1.14 0.00 0.00 176.83 177.36 1o9r h LEU 26 N 0.99 0.74 -0.63 5.07 5.85 -0.54 -0.19 115.31 126.61 1o9r h LEU 26 Ca 0.21 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 1o9r h LEU 26 Cb 0.38 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 1o9r h LEU 26 CO 0.00 0.49 0.12 0.00 -0.34 0.00 0.00 178.44 178.71 1o9r h ALA 27 N 1.37 0.83 -0.03 1.25 0.00 -1.27 -0.12 119.26 121.29 1o9r h ALA 27 Ca 0.33 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 1o9r h ALA 27 Cb 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1o9r h ALA 27 CO -0.16 0.58 -0.64 0.77 0.00 0.00 0.00 179.25 179.80 1o9r h SER 28 N 0.94 0.15 -0.50 0.00 0.02 -1.40 -1.40 113.55 111.37 1o9r h SER 28 Ca 0.19 -0.09 -0.13 0.00 -0.84 0.00 0.00 61.79 60.92 1o9r h SER 28 Cb 0.41 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 1o9r h SER 28 CO 0.01 0.75 -0.18 0.58 -1.14 0.00 0.00 176.83 176.85 1o9r h VAL 29 N 0.09 1.27 -0.50 2.27 2.07 -0.75 -0.56 116.25 120.14 1o9r h VAL 29 Ca -0.01 -1.34 -0.12 0.00 0.82 0.00 0.00 66.70 66.05 1o9r h VAL 29 Cb 1.14 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1o9r h VAL 29 CO 0.09 0.47 -0.15 0.40 0.02 0.00 0.00 177.57 178.40 1o9r h ILE 30 N 0.88 1.27 -0.79 4.57 2.04 -0.91 -0.07 117.51 124.51 1o9r h ILE 30 Ca 0.12 -1.31 -0.03 0.00 1.00 0.00 0.00 64.86 64.65 1o9r h ILE 30 Cb 0.76 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 1o9r h ILE 30 CO 0.06 0.45 0.39 -0.78 0.00 0.00 0.00 178.15 178.28 1o9r h ASP 31 N 0.85 1.03 -0.16 1.72 1.82 -1.19 -0.98 116.42 119.50 1o9r h ASP 31 Ca 0.12 -0.13 -0.04 0.00 -0.39 0.00 0.00 57.03 56.59 1o9r h ASP 31 Cb 0.72 -0.26 -0.02 0.00 0.68 0.00 0.00 39.33 40.45 1o9r h ASP 31 CO 0.06 0.86 -0.02 0.25 -1.61 0.00 0.00 179.24 178.78 1o9r h LEU 32 N 1.11 0.40 -0.75 2.28 5.85 -0.81 -0.26 115.31 123.14 1o9r h LEU 32 Ca 0.27 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.83 1o9r h LEU 32 Cb 0.10 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1o9r h LEU 32 CO -0.04 0.48 -0.04 0.00 -0.34 0.00 0.00 178.44 178.51 1o9r h ALA 33 N 1.57 0.95 -0.51 1.25 0.00 0.03 -0.41 119.26 122.13 1o9r h ALA 33 Ca 0.09 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1o9r h ALA 33 Cb 0.31 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1o9r h ALA 33 CO 0.01 0.63 0.08 -0.07 0.00 0.00 0.00 179.25 179.89 1o9r h LEU 34 N 0.84 0.82 -1.51 0.00 3.38 -0.37 -2.68 115.31 115.79 1o9r h LEU 34 Ca 0.15 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1o9r h LEU 34 Cb 0.55 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1o9r h LEU 34 CO 0.03 0.88 0.29 0.58 0.09 0.00 0.00 178.44 180.31 1o9r h VAL 35 N 0.73 1.13 -0.41 1.22 2.07 -0.81 -0.56 116.25 119.62 1o9r h VAL 35 Ca 0.16 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 1o9r h VAL 35 Cb 0.41 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1o9r h VAL 35 CO 0.01 0.13 -0.01 0.74 0.02 0.00 0.00 177.57 178.46 1o9r h THR 36 N 0.63 1.26 -0.36 2.57 2.02 -0.75 -1.00 112.91 117.28 1o9r h THR 36 Ca 0.17 -1.04 -0.15 0.00 0.77 0.00 0.00 66.41 66.16 1o9r h THR 36 Cb -0.04 1.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1o9r h THR 36 CO -0.03 0.35 -0.38 0.11 0.37 0.00 0.00 175.52 175.94 1o9r h LYS 37 N 0.57 0.85 -0.76 6.66 1.79 -1.27 -1.07 116.57 123.35 1o9r h LYS 37 Ca 0.12 -0.44 0.09 0.00 -2.18 0.00 0.00 60.65 58.24 1o9r h LYS 37 Cb 0.50 0.01 -0.07 0.00 -1.58 0.00 0.00 32.23 31.08 1o9r h LYS 37 CO 0.02 1.08 0.40 0.37 -1.08 0.00 0.00 179.45 180.25 1o9r h GLN 38 N 0.70 0.66 -0.13 3.15 5.75 -0.70 -0.71 115.11 123.83 1o9r h GLN 38 Ca 0.06 -0.04 -0.06 0.00 -0.15 0.00 0.00 58.65 58.46 1o9r h GLN 38 Cb 0.95 -0.15 -0.00 0.00 1.07 0.00 0.00 27.48 29.35 1o9r h GLN 38 CO 0.09 0.44 -0.16 0.00 -2.65 0.00 0.00 178.83 176.55 1o9r h ALA 39 N 1.44 0.19 -0.78 3.38 0.00 -1.12 -2.93 119.26 119.44 1o9r h ALA 39 Ca 0.37 -0.34 0.17 0.00 0.00 0.00 0.00 54.91 55.11 1o9r h ALA 39 Cb 0.36 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.00 1o9r h ALA 39 CO -0.26 0.09 0.26 1.25 0.00 0.00 0.00 179.25 180.59 1o9r h HIS 40 N -0.07 0.43 -0.04 0.00 -0.00 -0.59 -1.22 115.15 113.67 1o9r h HIS 40 Ca 0.02 0.04 -0.20 0.00 -0.00 0.00 0.00 60.37 60.23 1o9r h HIS 40 Cb 0.71 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.41 28.05 1o9r h HIS 40 CO 0.09 -0.04 -0.82 -1.49 -0.00 0.00 0.00 177.93 175.67 1o9r h TRP 41 N 0.35 0.51 -0.02 5.26 6.55 -1.15 -3.37 115.95 124.08 1o9r h TRP 41 Ca 0.45 -0.25 0.00 0.00 0.95 0.00 0.00 58.89 60.04 1o9r h TRP 41 Cb 0.77 -0.07 0.00 0.00 -0.86 0.00 0.00 29.16 29.00 1o9r h TRP 41 CO -0.21 1.03 -0.32 0.09 -1.05 0.00 0.00 178.44 177.98 1o9r n ASN 42 N -3.77 2.06 -4.79 -3.49 3.02 -0.83 -4.99 115.26 102.47 1o9r n ASN 42 Ca -0.05 -1.53 -0.36 0.00 -0.03 0.00 0.00 54.58 52.62 1o9r n ASN 42 Cb 0.76 0.37 -0.04 0.00 -0.61 0.00 0.00 39.78 40.26 1o9r n ASN 42 CO 0.00 0.00 0.00 -1.48 -2.62 0.00 0.00 177.26 173.16 1o9r s LEU 43 N -2.16 4.06 -0.07 3.41 0.05 -0.52 -4.61 118.68 118.84 1o9r s LEU 43 Ca 0.18 2.00 -0.08 0.00 0.05 0.00 0.00 54.13 56.28 1o9r s LEU 43 Cb 0.16 -4.29 0.02 0.00 -2.05 0.00 0.00 46.19 40.04 1o9r s LEU 43 CO 0.44 -0.55 0.21 -0.54 -0.55 0.00 0.00 176.35 175.37 1o9r s LYS 44 N -2.69 0.31 0.00 1.48 1.02 0.41 -4.98 119.74 115.29 1o9r s LYS 44 Ca 0.60 0.18 0.00 0.00 0.02 0.00 0.00 55.97 56.77 1o9r s LYS 44 Cb -0.20 0.15 0.00 0.00 -0.52 0.00 0.00 37.83 37.26 1o9r s LYS 44 CO 0.25 -0.05 0.00 0.41 -0.92 0.00 0.00 175.35 175.04 1o9r n GLY 45 N 2.65 -0.95 0.25 -3.33 0.00 -1.26 -1.94 105.19 100.60 1o9r n GLY 45 Ca -0.15 -1.58 0.11 0.00 0.00 0.00 0.00 46.02 44.40 1o9r n GLY 45 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1o9r h PRO 46 N 2.89 0.00 -0.72 1.61 0.11 -2.01 -1.36 132.00 132.52 1o9r h PRO 46 Ca 0.00 0.00 -0.45 0.00 0.11 0.00 0.00 66.00 65.66 1o9r h PRO 46 Cb 0.00 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 30.85 1o9r h PRO 46 CO 0.00 0.16 0.18 1.04 -0.21 0.00 0.00 178.00 179.17 1o9r n GLN 47 N -3.68 2.46 -0.05 1.05 1.13 -1.26 -4.81 117.38 112.22 1o9r n GLN 47 Ca -0.02 -3.36 -0.15 0.00 -1.94 0.00 0.00 57.00 51.53 1o9r n GLN 47 Cb 0.28 -2.10 -0.10 0.00 0.11 0.00 0.00 30.24 28.43 1o9r n GLN 47 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 1o9r h PHE 48 N 1.48 -1.64 -0.67 1.08 3.57 -1.62 -2.28 116.94 116.85 1o9r h PHE 48 Ca 0.44 0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.93 1o9r h PHE 48 Cb 1.67 0.74 -0.03 0.00 2.79 0.00 0.00 35.95 41.12 1o9r h PHE 48 CO 1.23 -0.53 0.15 0.97 -2.23 0.00 0.00 178.31 177.90 1o9r h ILE 49 N -0.53 1.26 -0.51 1.41 6.09 -1.87 0.11 117.51 123.47 1o9r h ILE 49 Ca 0.04 -0.97 -0.04 0.00 -1.37 0.00 0.00 64.86 62.53 1o9r h ILE 49 Cb 0.65 0.58 -0.02 0.00 0.47 0.00 0.00 36.82 38.50 1o9r h ILE 49 CO -0.48 0.37 0.18 0.00 -3.07 0.00 0.00 178.15 175.15 1o9r h ALA 50 N 1.13 0.67 -0.19 0.18 0.00 -1.90 -0.85 119.26 118.29 1o9r h ALA 50 Ca 0.21 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.76 1o9r h ALA 50 Cb 0.38 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1o9r h ALA 50 CO 0.00 0.30 -0.60 0.28 0.00 0.00 0.00 179.25 179.24 1o9r h VAL 51 N 0.69 1.30 -0.45 0.00 2.07 -1.25 -1.82 116.25 116.79 1o9r h VAL 51 Ca 0.17 -1.82 0.08 0.00 0.82 0.00 0.00 66.70 65.94 1o9r h VAL 51 Cb 0.24 1.91 -0.06 0.00 -1.52 0.00 0.00 31.29 31.85 1o9r h VAL 51 CO -0.01 0.57 0.08 -0.74 0.02 0.00 0.00 177.57 177.50 1o9r h HIS 52 N 0.46 0.13 -0.40 1.57 6.17 -0.68 -1.73 115.15 120.68 1o9r h HIS 52 Ca -0.02 0.03 -0.15 0.00 0.71 0.00 0.00 60.37 60.94 1o9r h HIS 52 Cb 1.23 0.01 -0.01 0.00 2.52 0.00 0.00 27.41 31.16 1o9r h HIS 52 CO 0.09 -0.01 -0.33 0.93 0.71 0.00 0.00 177.93 179.32 1o9r h GLU 53 N 0.21 0.90 -0.94 5.26 5.08 -1.13 -3.03 114.58 120.93 1o9r h GLU 53 Ca 0.22 -0.44 0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1o9r h GLU 53 Cb 0.29 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.48 1o9r h GLU 53 CO -0.30 1.10 0.61 1.25 -1.00 0.00 0.00 179.01 180.66 1o9r h LEU 54 N 0.75 1.00 -1.92 1.33 5.85 -1.00 -1.73 115.31 119.60 1o9r h LEU 54 Ca 0.07 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1o9r h LEU 54 Cb 0.91 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.72 1o9r h LEU 54 CO 0.08 0.67 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.66 1o9r h LEU 55 N 1.15 0.00 -0.65 2.25 3.38 -1.20 -1.19 115.31 119.05 1o9r h LEU 55 Ca 0.39 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.23 1o9r h LEU 55 Cb 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1o9r h LEU 55 CO -0.14 0.12 -0.33 0.44 0.09 0.00 0.00 178.44 178.62 1o9r h ASP 56 N 0.00 0.72 -0.56 -0.43 3.45 -1.28 -0.33 116.42 117.99 1o9r h ASP 56 Ca -0.00 -0.30 -0.07 0.00 0.43 0.00 0.00 57.03 57.09 1o9r h ASP 56 Cb 0.29 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 38.83 1o9r h ASP 56 CO 0.02 0.99 0.10 0.74 -1.57 0.00 0.00 179.24 179.52 1o9r h THR 57 N 0.59 1.25 -0.71 0.35 2.02 -1.07 -1.83 112.91 113.51 1o9r h THR 57 Ca 0.06 -0.97 -0.07 0.00 0.77 0.00 0.00 66.41 66.21 1o9r h THR 57 Cb 0.84 0.68 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 1o9r h THR 57 CO 0.07 0.36 0.19 -0.26 0.37 0.00 0.00 175.52 176.25 1o9r h PHE 58 N 0.91 1.18 -0.83 3.16 0.05 -1.07 -2.27 116.94 118.07 1o9r h PHE 58 Ca 0.19 -0.13 -0.03 0.00 3.82 0.00 0.00 57.97 61.82 1o9r h PHE 58 Cb 0.39 -0.34 -0.04 0.00 2.00 0.00 0.00 35.95 37.97 1o9r h PHE 58 CO 0.03 0.95 0.41 -0.09 -0.18 0.00 0.00 178.31 179.43 1o9r h ARG 59 N 1.07 1.18 -0.80 1.51 9.65 -0.66 -0.44 114.38 125.87 1o9r h ARG 59 Ca 0.23 -0.16 -0.03 0.00 -1.10 0.00 0.00 59.98 58.91 1o9r h ARG 59 Cb 0.35 -0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 28.67 1o9r h ARG 59 CO -0.00 0.89 0.37 1.15 2.80 0.00 0.00 179.97 185.17 1o9r h THR 60 N 1.17 1.26 -0.34 0.20 2.02 -1.10 -0.13 112.91 115.98 1o9r h THR 60 Ca 0.29 -0.75 -0.02 0.00 0.77 0.00 0.00 66.41 66.70 1o9r h THR 60 Cb 0.09 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 1o9r h THR 60 CO -0.04 0.31 0.14 1.56 0.37 0.00 0.00 175.52 177.87 1o9r h GLN 61 N 1.15 0.51 -0.63 6.66 4.20 -0.92 -1.03 115.11 125.06 1o9r h GLN 61 Ca 0.27 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.88 1o9r h GLN 61 Cb 0.15 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 1o9r h GLN 61 CO -0.03 0.50 0.36 -0.07 -0.67 0.00 0.00 178.83 178.92 1o9r h LEU 62 N 0.41 0.76 -0.64 1.46 3.38 -0.66 -0.41 115.31 119.60 1o9r h LEU 62 Ca 0.12 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1o9r h LEU 62 Cb 0.18 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1o9r h LEU 62 CO -0.01 0.60 0.30 0.44 0.09 0.00 0.00 178.44 179.86 1o9r h ASP 63 N 0.86 0.85 -0.30 -0.43 3.45 -0.64 0.12 116.42 120.33 1o9r h ASP 63 Ca 0.22 -0.14 -0.15 0.00 0.43 0.00 0.00 57.03 57.40 1o9r h ASP 63 Cb -0.00 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 38.55 1o9r h ASP 63 CO -0.04 0.76 -0.39 0.78 -1.57 0.00 0.00 179.24 178.77 1o9r h ASN 64 N 0.89 0.86 0.00 6.45 2.35 -0.65 -1.36 115.58 124.12 1o9r h ASN 64 Ca 0.22 -0.50 -0.14 0.00 -0.55 0.00 0.00 56.30 55.33 1o9r h ASN 64 Cb 0.14 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.25 1o9r h ASN 64 CO -0.03 1.19 -0.46 0.45 -1.65 0.00 0.00 177.43 176.93 1o9r h HIS 65 N 0.55 0.66 -0.63 1.19 3.86 -1.03 -1.20 115.15 118.56 1o9r h HIS 65 Ca 0.04 -0.21 0.00 0.00 -1.16 0.00 0.00 60.37 59.04 1o9r h HIS 65 Cb 0.98 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 29.29 1o9r h HIS 65 CO 0.07 0.90 0.41 0.78 0.86 0.00 0.00 177.93 180.95 1o9r h GLY 66 N 1.07 0.89 0.98 2.45 0.00 -0.71 -0.57 103.07 107.18 1o9r h GLY 66 Ca 0.03 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1o9r h GLY 66 CO 0.09 0.33 0.24 -1.80 0.00 0.00 0.00 176.54 175.40 1o9r h ASP 67 N 0.85 0.70 -0.61 0.19 1.82 -1.07 0.13 116.42 118.43 1o9r h ASP 67 Ca 0.23 -0.14 -0.09 0.00 -0.39 0.00 0.00 57.03 56.63 1o9r h ASP 67 Cb -0.08 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 39.73 1o9r h ASP 67 CO -0.05 0.65 0.03 0.74 -1.61 0.00 0.00 179.24 179.00 1o9r h THR 68 N 0.70 1.26 -0.24 2.25 2.02 -0.81 -0.27 112.91 117.82 1o9r h THR 68 Ca 0.18 -1.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.21 1o9r h THR 68 Cb 0.15 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 1o9r h THR 68 CO -0.02 0.41 0.06 0.40 0.37 0.00 0.00 175.52 176.74 1o9r h ILE 69 N 0.98 1.21 -0.68 3.11 2.04 -0.89 -2.08 117.51 121.20 1o9r h ILE 69 Ca 0.18 -0.68 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 1o9r h ILE 69 Cb 0.53 1.21 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 1o9r h ILE 69 CO 0.03 0.22 0.30 0.00 0.00 0.00 0.00 178.15 178.70 1o9r h ALA 70 N 0.88 0.88 -0.64 1.87 0.00 -0.75 -2.14 119.26 119.35 1o9r h ALA 70 Ca 0.08 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1o9r h ALA 70 Cb 0.28 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1o9r h ALA 70 CO 0.00 0.47 0.40 0.93 0.00 0.00 0.00 179.25 181.05 1o9r h GLU 71 N 0.95 0.85 -0.57 0.00 5.08 -1.00 -2.28 114.58 117.62 1o9r h GLU 71 Ca 0.23 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 1o9r h GLU 71 Cb 0.16 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1o9r h GLU 71 CO -0.03 0.59 0.05 -0.09 -1.00 0.00 0.00 179.01 178.53 1o9r h ARG 72 N 0.87 0.94 -0.46 2.33 9.65 -0.83 -0.78 114.38 126.10 1o9r h ARG 72 Ca 0.23 -0.25 0.09 0.00 -1.10 0.00 0.00 59.98 58.95 1o9r h ARG 72 Cb -0.06 -0.11 -0.08 0.00 -1.39 0.00 0.00 29.97 28.33 1o9r h ARG 72 CO -0.05 0.90 -0.06 0.28 2.80 0.00 0.00 179.97 183.85 1o9r h VAL 73 N 0.88 0.59 -0.26 0.20 2.07 -0.82 -2.04 116.25 116.87 1o9r h VAL 73 Ca 0.17 -0.02 -0.14 0.00 0.82 0.00 0.00 66.70 67.53 1o9r h VAL 73 Cb 0.45 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1o9r h VAL 73 CO 0.02 0.01 -0.41 -0.37 0.02 0.00 0.00 177.57 176.84 1o9r h VAL 74 N 0.05 1.30 -0.55 2.57 -1.51 -1.23 -0.44 116.25 116.43 1o9r h VAL 74 Ca 0.23 -1.58 0.06 0.00 -1.23 0.00 0.00 66.70 64.18 1o9r h VAL 74 Cb 0.34 1.53 -0.03 0.00 -2.13 0.00 0.00 31.29 31.00 1o9r h VAL 74 CO -0.43 0.50 0.37 1.56 -1.23 0.00 0.00 177.57 178.34 1o9r h GLN 75 N 0.52 0.49 -0.39 5.19 4.20 -0.82 -0.59 115.11 123.72 1o9r h GLN 75 Ca 0.04 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1o9r h GLN 75 Cb 0.93 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.60 1o9r h GLN 75 CO 0.08 0.32 0.00 1.28 -0.67 0.00 0.00 178.83 179.85 1o9r n LEU 76 N -4.47 1.69 0.00 1.46 4.77 -0.80 -4.90 117.00 114.74 1o9r n LEU 76 Ca 0.08 -0.85 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 1o9r n LEU 76 Cb 0.25 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1o9r n LEU 76 CO 0.34 0.36 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1o9r n GLY 77 N 0.77 0.61 1.71 -0.72 0.00 -0.23 -4.90 105.19 102.44 1o9r n GLY 77 Ca 0.09 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 1o9r n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o9r n GLY 78 N -2.77 1.01 3.25 -0.02 0.00 -0.22 -1.43 105.19 105.01 1o9r n GLY 78 Ca 0.00 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.65 1o9r n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1o9r s THR 79 N -1.07 2.79 0.12 2.61 2.01 -1.26 -4.14 115.64 116.70 1o9r s THR 79 Ca 0.29 -0.71 -0.30 0.00 0.31 0.00 0.00 61.69 61.28 1o9r s THR 79 Cb -0.02 -2.22 -0.07 0.00 0.01 0.00 0.00 72.50 70.21 1o9r s THR 79 CO 0.19 0.49 1.22 0.00 -0.69 0.00 0.00 174.62 175.83 1o9r s ALA 80 N 1.17 3.44 -0.55 7.40 0.00 -1.26 -4.93 121.76 127.03 1o9r s ALA 80 Ca 0.01 0.93 -0.02 0.00 0.00 0.00 0.00 51.96 52.88 1o9r s ALA 80 Cb -0.14 -3.44 0.14 0.00 0.00 0.00 0.00 23.12 19.68 1o9r s ALA 80 CO -0.05 -0.43 0.35 -0.51 0.00 0.00 0.00 175.76 175.13 1o9r s LEU 81 N 0.51 5.19 -0.00 0.00 1.43 -1.26 -4.88 118.68 119.67 1o9r s LEU 81 Ca 0.57 -2.60 0.01 0.00 -1.03 0.00 0.00 54.13 51.08 1o9r s LEU 81 Cb -0.32 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.08 1o9r s LEU 81 CO 0.32 -0.42 0.83 0.61 0.23 0.00 0.00 176.35 177.93 1o9r n GLY 82 N 3.82 0.93 3.77 -3.19 0.00 -1.26 -4.61 105.19 104.65 1o9r n GLY 82 Ca 0.04 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1o9r n GLY 82 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1o9r s SER 83 N -0.71 4.13 0.25 1.61 1.04 -1.26 -4.75 113.70 114.00 1o9r s SER 83 Ca 0.01 1.46 -0.04 0.00 0.48 0.00 0.00 55.95 57.86 1o9r s SER 83 Cb 0.01 -2.17 0.47 0.00 0.10 0.00 0.00 66.02 64.43 1o9r s SER 83 CO 0.00 -2.22 1.73 0.25 0.98 0.00 0.00 173.24 173.98 1o9r h LEU 84 N -1.26 0.26 -0.60 2.42 5.85 -1.99 -0.16 115.31 119.83 1o9r h LEU 84 Ca -0.47 0.11 -0.14 0.00 0.84 0.00 0.00 57.88 58.22 1o9r h LEU 84 Cb 1.27 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 1o9r h LEU 84 CO 0.56 0.09 -0.45 1.56 -0.34 0.00 0.00 178.44 179.86 1o9r h GLN 85 N 0.43 0.59 -0.49 1.25 7.50 -1.99 -0.65 115.11 121.75 1o9r h GLN 85 Ca 0.42 -0.32 -0.10 0.00 0.50 0.00 0.00 58.65 59.14 1o9r h GLN 85 Cb 0.65 0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.18 1o9r h GLN 85 CO -0.42 0.92 -0.10 0.00 -1.50 0.00 0.00 178.83 177.73 1o9r h ALA 86 N 1.03 0.68 -0.60 3.87 0.00 -1.71 -1.23 119.26 121.30 1o9r h ALA 86 Ca 0.03 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1o9r h ALA 86 Cb 0.97 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1o9r h ALA 86 CO 0.09 0.58 0.16 0.28 0.00 0.00 0.00 179.25 180.35 1o9r h VAL 87 N 0.80 1.25 -0.57 0.00 2.07 -0.92 -1.76 116.25 117.12 1o9r h VAL 87 Ca 0.13 -0.88 -0.08 0.00 0.82 0.00 0.00 66.70 66.69 1o9r h VAL 87 Cb 0.66 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 1o9r h VAL 87 CO 0.05 0.33 0.04 0.28 0.02 0.00 0.00 177.57 178.29 1o9r h SER 88 N 0.86 0.91 1.52 0.57 0.02 -0.86 0.20 113.55 116.76 1o9r h SER 88 Ca 0.19 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1o9r h SER 88 Cb 0.33 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1o9r h SER 88 CO -0.00 0.94 0.00 0.77 -1.14 0.00 0.00 176.83 177.40 1o9r h SER 89 N 0.88 0.00 0.00 3.07 4.64 -1.01 -3.37 113.55 117.76 1o9r h SER 89 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1o9r h SER 89 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1o9r h SER 89 CO 0.02 0.00 -0.79 0.41 -0.87 0.00 0.00 176.83 175.60 1o9r n THR 90 N -2.92 0.00 -1.73 2.95 -1.04 -0.68 -5.04 114.28 105.82 1o9r n THR 90 Ca 0.03 -0.20 -0.39 0.00 -2.04 0.00 0.00 64.05 61.45 1o9r n THR 90 Cb 0.42 0.63 0.04 0.00 -1.82 0.00 0.00 70.33 69.60 1o9r n THR 90 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 1o9r n THR 91 N -1.42 3.47 0.99 12.58 5.66 0.03 -4.74 114.28 130.86 1o9r n THR 91 Ca -0.00 -0.50 0.12 0.00 -3.05 0.00 0.00 64.05 60.62 1o9r n THR 91 Cb 0.07 -1.64 0.10 0.00 -1.55 0.00 0.00 70.33 67.32 1o9r n THR 91 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1o9r n LYS 92 N -0.72 2.33 -3.15 1.09 4.76 -1.26 -4.99 118.16 116.22 1o9r n LYS 92 Ca 0.09 -1.93 -0.38 0.00 -2.87 0.00 0.00 58.31 53.22 1o9r n LYS 92 Cb 0.43 -1.46 -0.06 0.00 -1.84 0.00 0.00 35.03 32.10 1o9r n LYS 92 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1o9r s LEU 93 N -1.99 4.53 0.48 -0.35 1.43 -1.26 -5.05 118.68 116.46 1o9r s LEU 93 Ca 0.28 1.42 -0.21 0.00 -1.03 0.00 0.00 54.13 54.59 1o9r s LEU 93 Cb 0.20 -3.14 -0.08 0.00 0.03 0.00 0.00 46.19 43.20 1o9r s LEU 93 CO 0.30 0.22 1.07 -0.54 0.23 0.00 0.00 176.35 177.63 1o9r s LYS 94 N -1.25 3.75 0.20 1.70 -0.14 -1.26 -4.95 119.74 117.79 1o9r s LYS 94 Ca 0.33 1.49 -0.32 0.00 -1.36 0.00 0.00 55.97 56.11 1o9r s LYS 94 Cb -0.20 -2.17 -0.14 0.00 -1.68 0.00 0.00 37.83 33.63 1o9r s LYS 94 CO 0.22 -0.49 1.30 0.00 -0.76 0.00 0.00 175.35 175.62 1o9r n ALA 95 N -0.85 0.24 -2.01 5.17 0.00 -1.26 -4.91 120.51 116.89 1o9r n ALA 95 Ca 0.09 0.44 -0.41 0.00 0.00 0.00 0.00 53.44 53.56 1o9r n ALA 95 Cb 0.51 -2.16 -0.04 0.00 0.00 0.00 0.00 19.45 17.75 1o9r n ALA 95 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1o9r s TYR 96 N -0.08 3.71 0.19 0.00 5.04 -1.26 -4.98 117.35 119.96 1o9r s TYR 96 Ca 0.71 1.71 -0.31 0.00 -2.44 0.00 0.00 57.07 56.74 1o9r s TYR 96 Cb -0.74 -3.18 -0.10 0.00 0.35 0.00 0.00 41.96 38.29 1o9r s TYR 96 CO 0.50 -0.25 1.47 -1.25 -1.34 0.00 0.00 175.55 174.69 1o9r s PRO 97 N -0.58 4.26 0.00 4.97 0.04 -1.26 -4.91 135.00 137.51 1o9r s PRO 97 Ca 0.47 2.27 0.23 0.00 0.04 0.00 0.00 61.00 64.01 1o9r s PRO 97 Cb -0.28 -3.16 0.43 0.00 0.04 0.00 0.00 34.50 31.53 1o9r s PRO 97 CO 0.34 -0.49 1.40 0.25 0.04 0.00 0.00 177.00 178.54 1o9r n THR 98 N 3.29 0.41 -1.08 1.26 -2.24 -1.26 -4.23 114.28 110.41 1o9r n THR 98 Ca 0.10 -0.68 0.09 0.00 -2.27 0.00 0.00 64.05 61.29 1o9r n THR 98 Cb 0.40 1.01 0.19 0.00 -2.10 0.00 0.00 70.33 69.83 1o9r n THR 98 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1o9r n ASP 99 N 1.38 2.94 -4.72 3.42 5.75 -1.26 -5.00 116.55 119.06 1o9r n ASP 99 Ca 0.18 -3.13 -0.31 0.00 -0.01 0.00 0.00 54.79 51.52 1o9r n ASP 99 Cb 0.59 -0.49 -0.08 0.00 -1.03 0.00 0.00 41.12 40.11 1o9r n ASP 99 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1o9r s ILE 100 N -2.90 4.27 0.00 2.12 -4.36 -1.26 -5.01 121.20 114.06 1o9r s ILE 100 Ca 0.37 -0.78 0.00 0.00 -0.26 0.00 0.00 60.65 59.98 1o9r s ILE 100 Cb 0.32 -3.00 0.00 0.00 1.25 0.00 0.00 42.46 41.02 1o9r s ILE 100 CO 0.05 0.20 0.00 -1.22 0.24 0.00 0.00 174.94 174.21 1o9r n TYR 101 N 0.78 0.00 -1.69 1.37 4.02 -1.26 -4.83 117.16 115.55 1o9r n TYR 101 Ca -0.11 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.36 1o9r n TYR 101 Cb 0.52 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.84 1o9r n TYR 101 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1o9r n LYS 102 N -1.54 2.04 -0.26 -0.72 5.02 -1.26 -0.45 118.16 121.00 1o9r n LYS 102 Ca 0.00 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 57.01 1o9r n LYS 102 Cb 0.06 -2.32 0.13 0.00 -0.02 0.00 0.00 35.03 32.87 1o9r n LYS 102 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1o9r h ILE 103 N 2.40 0.96 -0.15 -0.18 2.04 -1.77 -1.44 117.51 119.37 1o9r h ILE 103 Ca -0.46 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.11 1o9r h ILE 103 Cb 1.29 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1o9r h ILE 103 CO 0.62 0.14 -0.05 -0.74 0.00 0.00 0.00 178.15 178.12 1o9r h HIS 104 N 0.76 0.21 -0.36 1.37 2.76 -1.89 0.26 115.15 118.27 1o9r h HIS 104 Ca 0.34 -0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.36 1o9r h HIS 104 Cb 0.24 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 1o9r h HIS 104 CO -0.07 0.27 -0.34 -0.44 -1.30 0.00 0.00 177.93 176.06 1o9r h ASP 105 N 0.21 0.91 -0.27 3.26 3.32 -1.64 -0.99 116.42 121.21 1o9r h ASP 105 Ca 0.05 -0.46 -0.04 0.00 0.02 0.00 0.00 57.03 56.60 1o9r h ASP 105 Cb 0.23 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1o9r h ASP 105 CO 0.01 1.19 0.03 0.45 -1.72 0.00 0.00 179.24 179.19 1o9r h HIS 106 N 0.65 0.50 -0.88 4.55 3.86 -0.79 -2.15 115.15 120.90 1o9r h HIS 106 Ca 0.06 -0.08 0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1o9r h HIS 106 Cb 0.92 -0.13 -0.07 0.00 1.06 0.00 0.00 27.41 29.19 1o9r h HIS 106 CO 0.07 0.59 0.53 -0.07 0.86 0.00 0.00 177.93 179.91 1o9r h LEU 107 N 0.27 0.80 -0.38 2.43 3.38 -0.37 0.12 115.31 121.56 1o9r h LEU 107 Ca 0.08 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1o9r h LEU 107 Cb 0.37 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1o9r h LEU 107 CO 0.01 0.48 0.21 0.44 0.09 0.00 0.00 178.44 179.67 1o9r h ASP 108 N 0.92 0.47 -0.67 -0.43 3.45 -0.99 0.96 116.42 120.14 1o9r h ASP 108 Ca 0.40 -0.08 -0.04 0.00 0.43 0.00 0.00 57.03 57.74 1o9r h ASP 108 Cb 0.29 -0.12 -0.03 0.00 -0.56 0.00 0.00 39.33 38.91 1o9r h ASP 108 CO -0.21 0.42 0.25 0.00 -1.57 0.00 0.00 179.24 178.13 1o9r h ALA 109 N 1.07 0.87 -0.43 3.45 0.00 -1.05 -2.13 119.26 121.04 1o9r h ALA 109 Ca 0.13 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1o9r h ALA 109 Cb 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1o9r h ALA 109 CO -0.02 0.50 -0.12 -0.07 0.00 0.00 0.00 179.25 179.54 1o9r h LEU 110 N 0.95 0.85 -0.96 0.00 3.38 -0.56 -2.85 115.31 116.12 1o9r h LEU 110 Ca 0.22 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1o9r h LEU 110 Cb 0.23 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1o9r h LEU 110 CO -0.02 1.02 0.63 0.40 0.09 0.00 0.00 178.44 180.57 1o9r h ILE 111 N 0.67 1.19 -0.51 1.22 2.04 -0.66 0.35 117.51 121.81 1o9r h ILE 111 Ca 0.11 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.56 1o9r h ILE 111 Cb 0.66 -0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 1o9r h ILE 111 CO 0.04 0.23 0.30 -0.33 0.00 0.00 0.00 178.15 178.40 1o9r h GLU 112 N 1.25 0.58 0.15 2.37 5.08 -1.35 0.11 114.58 122.78 1o9r h GLU 112 Ca 0.37 -0.04 -0.31 0.00 -1.00 0.00 0.00 59.36 58.39 1o9r h GLU 112 Cb -0.05 -0.13 0.03 0.00 0.50 0.00 0.00 28.75 29.10 1o9r h GLU 112 CO -0.11 0.39 -1.30 0.00 -1.00 0.00 0.00 179.01 176.99 1o9r h ARG 113 N 0.60 0.57 -0.63 2.33 3.08 -1.20 -2.20 114.38 116.94 1o9r h ARG 113 Ca 0.21 -0.82 -0.04 0.00 0.07 0.00 0.00 59.98 59.40 1o9r h ARG 113 Cb 0.02 0.28 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 1o9r h ARG 113 CO -0.09 1.38 0.24 1.88 -1.07 0.00 0.00 179.97 182.30 1o9r h TYR 114 N 0.23 0.94 -0.40 3.04 0.05 -0.28 -1.19 116.97 119.36 1o9r h TYR 114 Ca -0.20 -0.06 -0.02 0.00 0.05 0.00 0.00 58.73 58.50 1o9r h TYR 114 Cb 1.98 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 39.42 1o9r h TYR 114 CO 0.11 0.73 0.18 0.78 -1.05 0.00 0.00 178.16 178.91 1o9r h GLY 115 N 1.01 0.62 0.98 3.88 0.00 -0.71 0.12 103.07 108.97 1o9r h GLY 115 Ca 0.21 -0.32 0.01 0.00 0.00 0.00 0.00 47.33 47.23 1o9r h GLY 115 CO -0.02 0.30 0.15 0.83 0.00 0.00 0.00 176.54 177.80 1o9r h GLU 116 N 0.50 0.30 -0.46 4.80 5.08 -1.07 -0.48 114.58 123.24 1o9r h GLU 116 Ca 0.14 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.34 1o9r h GLU 116 Cb 0.14 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 1o9r h GLU 116 CO -0.02 0.20 -0.23 0.28 -1.00 0.00 0.00 179.01 178.24 1o9r h VAL 117 N 0.31 1.27 -0.93 3.13 2.07 -1.13 -0.19 116.25 120.78 1o9r h VAL 117 Ca 0.09 -1.40 0.05 0.00 0.82 0.00 0.00 66.70 66.26 1o9r h VAL 117 Cb -0.02 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 1o9r h VAL 117 CO -0.03 0.48 0.61 0.00 0.02 0.00 0.00 177.57 178.65 1o9r h ALA 118 N 0.85 1.43 0.03 1.67 0.00 -0.59 -0.23 119.26 122.42 1o9r h ALA 118 Ca 0.10 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.76 1o9r h ALA 118 Cb 0.82 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1o9r h ALA 118 CO 0.07 0.46 -0.97 -0.91 0.00 0.00 0.00 179.25 177.90 1o9r h ASN 119 N 1.13 0.29 -0.23 0.00 2.35 -0.90 -1.04 115.58 117.19 1o9r h ASN 119 Ca 0.38 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1o9r h ASN 119 Cb 0.08 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1o9r h ASN 119 CO -0.13 1.10 0.15 -0.03 -1.65 0.00 0.00 177.43 176.87 1o9r h MET 120 N 0.10 0.30 -0.39 0.81 1.85 -0.61 -2.00 114.93 115.00 1o9r h MET 120 Ca -0.06 -0.02 -0.07 0.00 -0.61 0.00 0.00 59.70 58.94 1o9r h MET 120 Cb 1.64 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 33.58 1o9r h MET 120 CO 0.15 0.21 -0.05 0.82 -0.40 0.00 0.00 176.91 177.64 1o9r h ILE 121 N 0.31 1.23 -0.77 1.77 1.08 -0.91 -1.00 117.51 119.21 1o9r h ILE 121 Ca 0.08 -0.98 0.01 0.00 -0.39 0.00 0.00 64.86 63.58 1o9r h ILE 121 Cb -0.03 0.99 -0.04 0.00 -3.07 0.00 0.00 36.82 34.67 1o9r h ILE 121 CO -0.02 0.34 0.51 -0.09 -0.69 0.00 0.00 178.15 178.20 1o9r h ARG 122 N 0.60 0.99 -0.07 2.37 2.43 -0.93 -1.72 114.38 118.06 1o9r h ARG 122 Ca 0.12 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.08 1o9r h ARG 122 Cb 0.45 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1o9r h ARG 122 CO 0.02 0.66 -0.60 -0.22 -1.51 0.00 0.00 179.97 178.32 1o9r h LYS 123 N 1.02 0.24 -0.09 0.20 3.64 -1.00 -3.01 116.57 117.56 1o9r h LYS 123 Ca 0.29 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1o9r h LYS 123 Cb -0.08 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1o9r h LYS 123 CO -0.08 0.76 -0.12 0.00 -2.27 0.00 0.00 179.45 177.74 1o9r h ALA 124 N 1.20 1.63 0.12 5.00 0.00 -0.31 -1.03 119.26 125.87 1o9r h ALA 124 Ca -0.01 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1o9r h ALA 124 Cb 1.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1o9r h ALA 124 CO 0.09 0.27 -0.20 0.82 0.00 0.00 0.00 179.25 180.23 1o9r h ILE 125 N 0.14 0.54 -0.53 0.00 2.04 -1.28 -0.19 117.51 118.23 1o9r h ILE 125 Ca 0.03 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.78 1o9r h ILE 125 Cb 0.30 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1o9r h ILE 125 CO 0.02 0.00 -0.09 0.44 0.00 0.00 0.00 178.15 178.51 1o9r h ASP 126 N -0.39 0.99 -0.02 1.72 3.32 -1.48 -1.23 116.42 119.33 1o9r h ASP 126 Ca 0.02 -0.32 -0.12 0.00 0.02 0.00 0.00 57.03 56.64 1o9r h ASP 126 Cb 0.40 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1o9r h ASP 126 CO -0.11 1.09 -0.34 0.44 -1.72 0.00 0.00 179.24 178.60 1o9r h ASP 127 N 0.89 0.51 -0.38 6.45 3.45 -1.11 0.56 116.42 126.78 1o9r h ASP 127 Ca 0.14 -0.21 -0.14 0.00 0.43 0.00 0.00 57.03 57.26 1o9r h ASP 127 Cb 0.65 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.27 1o9r h ASP 127 CO 0.04 0.82 -0.31 0.28 -1.57 0.00 0.00 179.24 178.51 1o9r h SER 128 N 0.42 0.93 -0.50 6.45 0.02 -0.80 -2.06 113.55 118.01 1o9r h SER 128 Ca 0.05 -0.45 -0.09 0.00 -0.84 0.00 0.00 61.79 60.47 1o9r h SER 128 Cb 0.80 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1o9r h SER 128 CO 0.07 1.18 -0.02 -0.78 -1.14 0.00 0.00 176.83 176.14 1o9r h ASP 129 N 0.70 0.89 0.25 3.07 3.58 -0.98 -1.55 116.42 122.37 1o9r h ASP 129 Ca 0.07 -0.32 -0.04 0.00 0.42 0.00 0.00 57.03 57.16 1o9r h ASP 129 Cb 0.89 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 1o9r h ASP 129 CO 0.08 0.99 -0.20 -0.33 -2.88 0.00 0.00 179.24 176.90 1o9r h GLU 130 N 0.76 0.00 0.00 0.28 5.08 -0.80 -0.29 114.58 119.61 1o9r h GLU 130 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1o9r h GLU 130 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1o9r h GLU 130 CO 0.03 0.20 0.00 0.00 -1.00 0.00 0.00 179.01 178.24 1o9r n ALA 131 N -2.45 2.50 -0.82 3.43 0.00 -0.78 -4.88 120.51 117.50 1o9r n ALA 131 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1o9r n ALA 131 Cb 0.27 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1o9r n ALA 131 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o9r n GLY 132 N 1.05 1.15 2.55 0.00 0.00 -0.12 -4.68 105.19 105.13 1o9r n GLY 132 Ca 0.17 -0.42 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 1o9r n GLY 132 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1o9r n ASP 133 N 0.91 0.87 0.28 1.61 2.03 -0.61 -4.92 116.55 116.71 1o9r n ASP 133 Ca 0.00 -2.71 0.14 0.00 0.52 0.00 0.00 54.79 52.74 1o9r n ASP 133 Cb 0.18 -0.63 0.81 0.00 -0.72 0.00 0.00 41.12 40.76 1o9r n ASP 133 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1o9r h PRO 134 N 5.39 0.00 -0.20 -0.67 0.13 -1.85 -1.59 132.00 133.21 1o9r h PRO 134 Ca 0.22 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.32 1o9r h PRO 134 Cb 0.85 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 1o9r h PRO 134 CO 0.51 0.08 0.03 1.15 -0.23 0.00 0.00 178.00 179.54 1o9r h THR 135 N 0.00 1.22 -0.71 1.56 2.02 -1.95 0.13 112.91 115.18 1o9r h THR 135 Ca -0.00 -0.73 -0.06 0.00 0.77 0.00 0.00 66.41 66.39 1o9r h THR 135 Cb 0.24 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 1o9r h THR 135 CO 0.01 0.23 0.20 0.74 0.37 0.00 0.00 175.52 177.07 1o9r h THR 136 N 0.13 1.26 -0.87 3.16 2.02 -1.87 -2.61 112.91 114.12 1o9r h THR 136 Ca 0.06 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 66.38 1o9r h THR 136 Cb 0.31 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 67.16 1o9r h THR 136 CO 0.00 0.35 0.57 0.00 0.37 0.00 0.00 175.52 176.82 1o9r h ALA 137 N 1.16 1.51 -0.15 6.16 0.00 -1.07 -0.88 119.26 126.00 1o9r h ALA 137 Ca 0.23 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1o9r h ALA 137 Cb 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1o9r h ALA 137 CO -0.00 0.38 -0.33 0.22 0.00 0.00 0.00 179.25 179.51 1o9r h ASP 138 N 1.02 0.30 -0.43 0.00 1.82 -0.61 0.11 116.42 118.63 1o9r h ASP 138 Ca 0.36 -0.11 -0.01 0.00 -0.39 0.00 0.00 57.03 56.88 1o9r h ASP 138 Cb 0.14 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.04 1o9r h ASP 138 CO -0.12 0.62 0.21 0.40 -1.61 0.00 0.00 179.24 178.73 1o9r h ILE 139 N 0.25 1.18 -0.02 2.25 2.04 -0.89 -0.34 117.51 121.97 1o9r h ILE 139 Ca 0.03 -0.49 -0.08 0.00 1.00 0.00 0.00 64.86 65.32 1o9r h ILE 139 Cb 0.71 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1o9r h ILE 139 CO 0.05 0.19 -0.36 -0.26 0.00 0.00 0.00 178.15 177.78 1o9r h PHE 140 N 0.55 0.05 -0.35 1.37 -1.00 -1.09 -2.25 116.94 114.23 1o9r h PHE 140 Ca 0.15 -0.01 -0.16 0.00 2.81 0.00 0.00 57.97 60.76 1o9r h PHE 140 Cb 0.11 -0.01 -0.00 0.00 3.61 0.00 0.00 35.95 39.65 1o9r h PHE 140 CO -0.01 0.40 -0.40 1.15 -1.61 0.00 0.00 178.31 177.84 1o9r h THR 141 N 0.04 1.28 -0.79 -1.55 2.02 -0.29 0.82 112.91 114.44 1o9r h THR 141 Ca 0.00 -1.58 -0.00 0.00 0.77 0.00 0.00 66.41 65.60 1o9r h THR 141 Cb 0.65 1.47 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 1o9r h THR 141 CO 0.05 0.52 0.49 0.00 0.37 0.00 0.00 175.52 176.95 1o9r h ALA 142 N 0.74 1.01 -0.59 6.16 0.00 -0.97 -0.70 119.26 124.92 1o9r h ALA 142 Ca 0.05 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1o9r h ALA 142 Cb 1.00 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1o9r h ALA 142 CO 0.10 0.47 0.13 0.00 0.00 0.00 0.00 179.25 179.94 1o9r h ALA 143 N 1.26 0.78 -0.81 0.00 0.00 -1.20 -2.88 119.26 116.40 1o9r h ALA 143 Ca 0.29 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1o9r h ALA 143 Cb -0.06 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.46 1o9r h ALA 143 CO -0.06 0.50 0.53 1.03 0.00 0.00 0.00 179.25 181.26 1o9r h SER 144 N 0.86 0.84 -0.46 0.00 0.87 -0.44 0.58 113.55 115.80 1o9r h SER 144 Ca 0.18 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 1o9r h SER 144 Cb 0.38 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.13 1o9r h SER 144 CO 0.01 0.56 0.22 0.03 -0.53 0.00 0.00 176.83 177.12 1o9r h ARG 145 N 0.97 0.66 -0.35 2.24 3.08 -0.94 0.15 114.38 120.19 1o9r h ARG 145 Ca 0.33 -0.10 -0.17 0.00 0.07 0.00 0.00 59.98 60.12 1o9r h ARG 145 Cb 0.10 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 1o9r h ARG 145 CO -0.11 0.57 -0.43 -0.44 -1.07 0.00 0.00 179.97 178.49 1o9r h ASP 146 N 0.60 0.98 -0.66 7.04 3.45 -1.24 -2.09 116.42 124.49 1o9r h ASP 146 Ca 0.16 -0.47 -0.08 0.00 0.43 0.00 0.00 57.03 57.06 1o9r h ASP 146 Cb 0.13 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.59 1o9r h ASP 146 CO -0.02 1.27 0.09 -0.07 -1.57 0.00 0.00 179.24 178.94 1o9r h LEU 147 N 0.73 1.06 -0.78 1.55 3.38 -0.65 0.11 115.31 120.72 1o9r h LEU 147 Ca 0.05 -0.27 -0.13 0.00 0.09 0.00 0.00 57.88 57.62 1o9r h LEU 147 Cb 1.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1o9r h LEU 147 CO 0.10 1.06 -0.53 0.44 0.09 0.00 0.00 178.44 179.61 1o9r h ASP 148 N 1.02 0.25 -0.33 -0.43 3.45 -0.70 0.10 116.42 119.79 1o9r h ASP 148 Ca 0.20 -0.13 -0.16 0.00 0.43 0.00 0.00 57.03 57.37 1o9r h ASP 148 Cb 0.46 -0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.16 1o9r h ASP 148 CO 0.02 0.73 -0.42 0.50 -1.57 0.00 0.00 179.24 178.50 1o9r h LYS 149 N 0.18 0.87 -0.64 3.56 3.64 -1.17 -1.61 116.57 121.39 1o9r h LYS 149 Ca 0.00 -0.49 -0.07 0.00 -1.27 0.00 0.00 60.65 58.82 1o9r h LYS 149 Cb 0.99 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.82 1o9r h LYS 149 CO 0.08 1.13 0.11 0.77 -2.27 0.00 0.00 179.45 179.28 1o9r h SER 150 N 0.66 1.00 -0.36 4.20 0.02 -0.72 0.90 113.55 119.25 1o9r h SER 150 Ca 0.04 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 60.76 1o9r h SER 150 Cb 1.02 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 1o9r h SER 150 CO 0.10 0.99 0.20 0.25 -1.14 0.00 0.00 176.83 177.23 1o9r h LEU 151 N 0.99 0.45 -0.06 5.07 5.85 -0.73 -1.08 115.31 125.79 1o9r h LEU 151 Ca 0.20 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.85 1o9r h LEU 151 Cb 0.42 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1o9r h LEU 151 CO 0.01 0.41 -0.07 -0.25 -0.34 0.00 0.00 178.44 178.19 1o9r h TRP 152 N 0.46 -0.18 -0.70 1.25 7.01 -0.95 0.84 115.95 123.69 1o9r h TRP 152 Ca 0.13 0.01 0.12 0.00 2.11 0.00 0.00 58.89 61.25 1o9r h TRP 152 Cb 0.06 0.09 -0.08 0.00 -2.10 0.00 0.00 29.16 27.12 1o9r h TRP 152 CO -0.03 -0.11 0.29 0.74 -2.79 0.00 0.00 178.44 176.54 1o9r h PHE 153 N -0.10 0.51 0.03 2.65 0.05 -0.34 0.15 116.94 119.90 1o9r h PHE 153 Ca 0.05 0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.87 1o9r h PHE 153 Cb 0.17 -0.12 0.00 0.00 2.00 0.00 0.00 35.95 38.00 1o9r h PHE 153 CO -0.17 0.12 -0.01 -0.07 -0.18 0.00 0.00 178.31 177.99 1o9r h LEU 154 N 0.47 -0.03 -1.45 1.54 3.38 -0.80 -3.21 115.31 115.21 1o9r h LEU 154 Ca 0.37 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1o9r h LEU 154 Cb 0.49 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1o9r h LEU 154 CO -0.34 0.19 -0.11 -0.33 0.09 0.00 0.00 178.44 177.94 1o9r h GLU 155 N -0.26 0.23 0.00 1.13 5.08 -0.42 -2.44 114.58 117.90 1o9r h GLU 155 Ca -0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1o9r h GLU 155 Cb 0.24 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1o9r h GLU 155 CO 0.01 0.35 -0.05 0.00 -1.00 0.00 0.00 179.01 178.31 1o9r h ALA 156 N 1.68 1.14 0.00 3.43 0.00 -0.72 0.30 119.26 125.08 1o9r h ALA 156 Ca 0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1o9r h ALA 156 Cb 0.33 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1o9r h ALA 156 CO 0.02 0.07 -0.29 0.45 0.00 0.00 0.00 179.25 179.49 1o9r h HIS 157 N 0.00 0.00 -0.00 0.00 3.86 -1.46 -3.33 115.15 114.21 1o9r h HIS 157 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1o9r h HIS 157 Cb 0.28 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.75 1o9r h HIS 157 CO 0.00 0.29 -0.11 1.33 0.86 0.00 0.00 177.93 180.30 1o9r n VAL 158 N -3.46 0.00 0.22 2.45 0.24 -0.04 -4.65 118.33 113.08 1o9r n VAL 158 Ca -0.00 -0.45 0.08 0.00 -2.04 0.00 0.00 64.34 61.93 1o9r n VAL 158 Cb 0.46 1.08 0.51 0.00 -1.47 0.00 0.00 33.84 34.42 1o9r n VAL 158 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1o9r h GLN 159 N 0.73 0.00 -5.05 7.34 4.20 -1.31 -3.43 115.11 117.59 1o9r h GLN 159 Ca 0.00 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.38 1o9r h GLN 159 Cb 0.21 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 27.83 1o9r h GLN 159 CO 0.00 0.25 -0.72 -1.21 -0.67 0.00 0.00 178.83 176.48 1o9r s GLU 160 N -3.99 1.01 0.00 1.46 0.41 -1.26 -5.07 118.70 111.26 1o9r s GLU 160 Ca -0.02 -1.38 0.23 0.00 -0.41 0.00 0.00 54.97 53.39 1o9r s GLU 160 Cb 0.13 -0.61 0.05 0.00 -1.78 0.00 0.00 34.13 31.92 1o9r s GLU 160 CO 0.65 0.08 1.14 1.63 -0.49 0.00 0.00 175.26 178.27 1o9r n LYS 161 N -0.00 1.58 0.00 1.61 5.02 -1.26 -4.94 118.16 120.16 1o9r n LYS 161 Ca -0.12 -1.31 0.00 0.00 -2.02 0.00 0.00 58.31 54.87 1o9r n LYS 161 Cb 0.60 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 1o9r n LYS 161 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75