#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wqx s THR 37 N 0.00 0.15 -0.01 2.62 -4.23 -1.26 -4.61 115.64 108.29 2wqx s THR 37 Ca 0.00 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.31 2wqx s THR 37 Cb 0.00 -1.07 -0.04 0.00 1.34 0.00 0.00 72.50 72.73 2wqx s THR 37 CO 0.00 -0.66 0.02 0.27 -0.54 0.00 0.00 174.62 173.71 2wqx s ILE 38 N -3.03 4.34 -0.04 2.99 -4.36 -1.26 -5.05 121.20 114.79 2wqx s ILE 38 Ca -0.01 -0.50 0.00 0.00 -0.26 0.00 0.00 60.65 59.88 2wqx s ILE 38 Cb 0.01 -2.93 0.01 0.00 1.25 0.00 0.00 42.46 40.80 2wqx s ILE 38 CO -0.07 0.40 0.78 0.35 0.24 0.00 0.00 174.94 176.65 2wqx n THR 39 N 1.44 0.54 -4.06 8.37 -2.24 -1.26 -4.42 114.28 112.65 2wqx n THR 39 Ca -0.15 -0.77 -0.10 0.00 -2.27 0.00 0.00 64.05 60.76 2wqx n THR 39 Cb 0.53 0.73 -0.11 0.00 -2.10 0.00 0.00 70.33 69.38 2wqx n THR 39 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2wqx s VAL 40 N -0.56 0.34 0.21 2.28 -7.23 -1.26 -5.11 120.40 109.08 2wqx s VAL 40 Ca 0.01 -1.32 -0.32 0.00 -1.81 0.00 0.00 61.98 58.54 2wqx s VAL 40 Cb 0.00 -0.86 -0.14 0.00 0.56 0.00 0.00 36.38 35.94 2wqx s VAL 40 CO 0.01 -0.64 1.34 -2.65 -0.31 0.00 0.00 175.10 172.85 2wqx n PRO 41 N 0.97 1.77 -3.94 4.82 -0.02 -1.26 -4.84 135.00 132.50 2wqx n PRO 41 Ca -0.20 0.63 -0.15 0.00 -2.02 0.00 0.00 63.50 61.76 2wqx n PRO 41 Cb 0.57 -2.25 -0.15 0.00 -0.02 0.00 0.00 33.50 31.65 2wqx n PRO 41 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2wqx s THR 42 N -0.05 0.15 0.11 3.45 2.01 0.05 -4.82 115.64 116.55 2wqx s THR 42 Ca 0.70 0.03 -0.36 0.00 0.31 0.00 0.00 61.69 62.38 2wqx s THR 42 Cb -0.71 -0.21 -0.16 0.00 0.01 0.00 0.00 72.50 71.43 2wqx s THR 42 CO 0.50 0.10 1.44 -2.65 -0.69 0.00 0.00 174.62 173.32 2wqx n PRO 43 N 3.71 1.53 -0.31 4.92 -0.02 -1.26 0.30 135.00 143.87 2wqx n PRO 43 Ca -0.22 0.55 0.16 0.00 -2.02 0.00 0.00 63.50 61.98 2wqx n PRO 43 Cb 0.54 -2.24 0.35 0.00 -0.02 0.00 0.00 33.50 32.12 2wqx n PRO 43 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2wqx h ILE 44 N 3.49 0.37 0.00 4.25 2.04 -1.21 -0.25 117.51 126.19 2wqx h ILE 44 Ca -0.47 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.24 2wqx h ILE 44 Cb 1.30 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2wqx h ILE 44 CO 0.82 0.06 -0.22 0.50 0.00 0.00 0.00 178.15 179.31 2wqx h LYS 45 N 0.32 0.00 -0.28 2.37 3.64 -0.95 -1.42 116.57 120.24 2wqx h LYS 45 Ca 0.61 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.94 2wqx h LYS 45 Cb 1.26 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 2wqx h LYS 45 CO -0.60 0.22 -0.02 0.37 -2.27 0.00 0.00 179.45 177.14 2wqx h GLN 46 N 0.00 0.51 -0.01 1.90 4.15 -1.31 -3.36 115.11 116.99 2wqx h GLN 46 Ca -0.00 -0.18 -0.06 0.00 0.77 0.00 0.00 58.65 59.18 2wqx h GLN 46 Cb 0.65 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.31 2wqx h GLN 46 CO 0.03 0.69 -0.22 0.82 -1.93 0.00 0.00 178.83 178.22 2wqx h ILE 47 N 0.29 1.53 -3.46 2.39 2.04 -1.19 -3.41 117.51 115.69 2wqx h ILE 47 Ca 0.08 -1.85 -0.77 0.00 1.00 0.00 0.00 64.86 63.31 2wqx h ILE 47 Cb 0.47 2.68 -0.25 0.00 -0.74 0.00 0.00 36.82 38.97 2wqx h ILE 47 CO 0.02 0.51 -0.08 -0.36 0.00 0.00 0.00 178.15 178.24 2wqx s PHE 48 N -3.27 3.51 0.36 1.37 0.08 -0.57 -3.95 117.98 115.51 2wqx s PHE 48 Ca -0.16 -1.68 0.05 0.00 0.12 0.00 0.00 56.93 55.26 2wqx s PHE 48 Cb 0.01 -3.79 0.68 0.00 -0.57 0.00 0.00 43.02 39.36 2wqx s PHE 48 CO 0.74 -1.00 1.94 0.66 -0.10 0.00 0.00 175.22 177.45 2wqx h SER 49 N 8.30 0.49 -3.23 1.36 4.64 -1.76 -3.38 113.55 119.97 2wqx h SER 49 Ca -0.09 -0.06 -0.54 0.00 -0.47 0.00 0.00 61.79 60.62 2wqx h SER 49 Cb 1.07 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 63.01 2wqx h SER 49 CO 0.89 0.49 0.55 -0.62 -0.87 0.00 0.00 176.83 177.28 2wqx s ASP 50 N -6.71 7.17 0.17 4.97 -1.08 -1.26 -4.94 116.67 114.99 2wqx s ASP 50 Ca -0.08 1.78 -0.14 0.00 -0.52 0.00 0.00 52.55 53.59 2wqx s ASP 50 Cb 0.16 -2.57 0.07 0.00 -1.46 0.00 0.00 42.92 39.12 2wqx s ASP 50 CO 0.75 -0.45 1.82 0.44 0.52 0.00 0.00 175.17 178.26 2wqx h ASP 51 N 7.05 0.63 -0.46 -0.34 3.32 -1.94 0.21 116.42 124.89 2wqx h ASP 51 Ca -0.37 -0.04 -0.07 0.00 0.02 0.00 0.00 57.03 56.57 2wqx h ASP 51 Cb 1.19 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.56 2wqx h ASP 51 CO 0.82 0.48 0.04 0.00 -1.72 0.00 0.00 179.24 178.87 2wqx h ALA 52 N 1.18 1.09 -0.19 3.45 0.00 -1.88 -0.47 119.26 122.44 2wqx h ALA 52 Ca 0.19 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2wqx h ALA 52 Cb -0.05 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 2wqx h ALA 52 CO -0.04 0.58 -0.20 0.35 0.00 0.00 0.00 179.25 179.95 2wqx h PHE 53 N 0.80 0.56 -0.64 0.00 3.57 -1.51 -1.69 116.94 118.04 2wqx h PHE 53 Ca 0.16 -0.17 0.13 0.00 3.53 0.00 0.00 57.97 61.62 2wqx h PHE 53 Cb 0.42 -0.12 -0.12 0.00 2.79 0.00 0.00 35.95 38.93 2wqx h PHE 53 CO 0.02 0.83 -0.11 0.00 -2.23 0.00 0.00 178.31 176.83 2wqx h ALA 54 N 0.64 0.49 -0.80 2.41 0.00 -0.41 -0.55 119.26 121.03 2wqx h ALA 54 Ca 0.03 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2wqx h ALA 54 Cb 0.74 0.44 -0.04 0.00 0.00 0.00 0.00 17.79 18.93 2wqx h ALA 54 CO 0.05 -0.42 0.42 0.93 0.00 0.00 0.00 179.25 180.23 2wqx h GLU 55 N 0.03 1.12 -0.41 0.00 4.39 -0.96 -0.67 114.58 118.09 2wqx h GLU 55 Ca 0.32 -0.14 0.06 0.00 0.34 0.00 0.00 59.36 59.94 2wqx h GLU 55 Cb 0.50 -0.21 -0.06 0.00 -0.10 0.00 0.00 28.75 28.88 2wqx h GLU 55 CO -0.62 0.84 0.08 1.15 -1.16 0.00 0.00 179.01 179.30 2wqx h THR 56 N 1.11 0.79 -0.24 1.13 2.02 -0.36 -1.49 112.91 115.87 2wqx h THR 56 Ca 0.28 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.38 2wqx h THR 56 Cb 0.06 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 2wqx h THR 56 CO -0.04 0.04 0.11 0.40 0.37 0.00 0.00 175.52 176.40 2wqx h ILE 57 N 0.21 1.15 -0.54 3.11 1.08 -0.49 -0.40 117.51 121.64 2wqx h ILE 57 Ca 0.20 -0.43 0.11 0.00 -0.39 0.00 0.00 64.86 64.35 2wqx h ILE 57 Cb 0.24 0.99 -0.09 0.00 -3.07 0.00 0.00 36.82 34.89 2wqx h ILE 57 CO -0.26 0.15 -0.01 0.50 -0.69 0.00 0.00 178.15 177.83 2wqx h LYS 58 N 0.25 0.10 -0.31 2.37 3.64 -1.03 -0.19 116.57 121.40 2wqx h LYS 58 Ca 0.08 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.33 2wqx h LYS 58 Cb 0.13 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 2wqx h LYS 58 CO -0.01 0.07 -0.33 -0.44 -2.27 0.00 0.00 179.45 176.47 2wqx h ASP 59 N 0.10 0.71 -0.78 4.20 3.32 -1.13 0.22 116.42 123.06 2wqx h ASP 59 Ca 0.27 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 57.01 2wqx h ASP 59 Cb 0.42 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 2wqx h ASP 59 CO -0.46 0.99 0.40 -1.13 -1.72 0.00 0.00 179.24 177.31 2wqx h ASN 60 N 0.58 1.01 -0.12 6.45 -0.73 -0.48 -2.42 115.58 119.87 2wqx h ASN 60 Ca 0.06 -0.12 0.00 0.00 1.87 0.00 0.00 56.30 58.11 2wqx h ASN 60 Cb 0.84 -0.26 0.00 0.00 0.27 0.00 0.00 38.32 39.17 2wqx h ASN 60 CO 0.07 0.84 0.00 0.18 -0.37 0.00 0.00 177.43 178.15 2wqx n LEU 61 N -4.39 1.87 -2.48 0.34 4.77 -0.14 -4.94 117.00 112.03 2wqx n LEU 61 Ca 0.07 -0.72 -0.17 0.00 -0.03 0.00 0.00 56.01 55.16 2wqx n LEU 61 Cb 0.12 -0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.13 2wqx n LEU 61 CO 0.39 0.36 -0.20 0.29 -1.33 0.00 0.00 177.39 176.90 2wqx n LYS 62 N 0.45 -2.14 -1.48 3.23 4.76 -0.40 -4.99 118.16 117.59 2wqx n LYS 62 Ca 0.17 0.81 -0.30 0.00 -2.87 0.00 0.00 58.31 56.12 2wqx n LYS 62 Cb 0.38 -5.47 0.08 0.00 -1.84 0.00 0.00 35.03 28.19 2wqx n LYS 62 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2wqx s LYS 63 N -5.10 2.35 0.01 1.97 -0.14 0.63 -4.99 119.74 114.47 2wqx s LYS 63 Ca 0.03 0.86 -0.19 0.00 -1.36 0.00 0.00 55.97 55.30 2wqx s LYS 63 Cb -0.01 -1.93 -0.24 0.00 -1.68 0.00 0.00 37.83 33.97 2wqx s LYS 63 CO 0.03 -1.49 1.10 0.87 -0.76 0.00 0.00 175.35 175.10 2wqx h LYS 64 N -1.00 0.43 -4.55 1.68 1.57 -1.94 -3.43 116.57 109.33 2wqx h LYS 64 Ca -0.45 -0.47 -0.21 0.00 -1.87 0.00 0.00 60.65 57.64 2wqx h LYS 64 Cb 1.24 0.14 -0.15 0.00 0.08 0.00 0.00 32.23 33.54 2wqx h LYS 64 CO 0.57 1.13 -0.66 0.45 -0.57 0.00 0.00 179.45 180.36 2wqx s SER 65 N -6.81 0.75 0.40 0.86 0.15 -1.26 -5.04 113.70 102.75 2wqx s SER 65 Ca -0.13 -1.14 0.27 0.00 0.70 0.00 0.00 55.95 55.66 2wqx s SER 65 Cb 0.04 0.19 0.94 0.00 -1.71 0.00 0.00 66.02 65.48 2wqx s SER 65 CO 0.83 -0.62 1.80 -0.37 1.20 0.00 0.00 173.24 176.08 2wqx h VAL 66 N 2.87 0.00 -0.00 4.45 -1.51 -1.93 -3.00 116.25 117.12 2wqx h VAL 66 Ca -0.35 -0.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.56 2wqx h VAL 66 Cb 1.19 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 31.84 2wqx h VAL 66 CO 0.62 0.00 -0.09 0.35 -1.23 0.00 0.00 177.57 177.22 2wqx n THR 67 N -2.75 0.00 -2.24 7.19 -2.24 -1.26 -0.34 114.28 112.64 2wqx n THR 67 Ca 0.03 -0.05 -0.42 0.00 -2.27 0.00 0.00 64.05 61.34 2wqx n THR 67 Cb 0.36 -0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.41 2wqx n THR 67 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2wqx s ASP 68 N -2.48 6.91 0.19 3.42 1.01 -1.14 -4.67 116.67 119.92 2wqx s ASP 68 Ca 0.29 2.26 -0.30 0.00 0.71 0.00 0.00 52.55 55.51 2wqx s ASP 68 Cb 0.20 -2.59 -0.09 0.00 1.01 0.00 0.00 42.92 41.45 2wqx s ASP 68 CO 0.47 -0.58 1.33 0.00 0.21 0.00 0.00 175.17 176.61 2wqx s ALA 69 N 0.88 3.54 0.26 5.23 0.00 -1.26 -2.04 121.76 128.37 2wqx s ALA 69 Ca 0.61 1.13 0.11 0.00 0.00 0.00 0.00 51.96 53.82 2wqx s ALA 69 Cb -0.35 -3.50 -0.05 0.00 0.00 0.00 0.00 23.12 19.23 2wqx s ALA 69 CO 0.32 -0.57 -0.20 0.14 0.00 0.00 0.00 175.76 175.45 2wqx s VAL 70 N 0.24 2.37 0.25 0.00 -7.23 0.15 -4.76 120.40 111.41 2wqx s VAL 70 Ca 0.58 -2.33 0.09 0.00 -1.81 0.00 0.00 61.98 58.52 2wqx s VAL 70 Cb -0.37 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 2wqx s VAL 70 CO 0.38 -0.38 -0.01 0.42 -0.31 0.00 0.00 175.10 175.20 2wqx s THR 71 N -2.43 3.47 0.42 5.32 -4.23 -1.26 -0.77 115.64 116.15 2wqx s THR 71 Ca 0.28 -1.82 0.10 0.00 -1.18 0.00 0.00 61.69 59.06 2wqx s THR 71 Cb -0.05 -2.83 0.29 0.00 1.34 0.00 0.00 72.50 71.26 2wqx s THR 71 CO 0.13 -0.31 2.02 -0.61 -0.54 0.00 0.00 174.62 175.31 2wqx h GLN 72 N 2.09 0.50 -0.86 3.99 5.75 -1.89 -1.16 115.11 123.54 2wqx h GLN 72 Ca -0.45 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.01 2wqx h GLN 72 Cb 1.24 -0.11 -0.04 0.00 1.07 0.00 0.00 27.48 29.63 2wqx h GLN 72 CO 0.59 0.33 0.49 -0.91 -2.65 0.00 0.00 178.83 176.68 2wqx h ASN 73 N 0.52 1.05 -0.28 -0.69 2.35 -1.95 -0.70 115.58 115.88 2wqx h ASN 73 Ca 0.22 -0.08 -0.19 0.00 -0.55 0.00 0.00 56.30 55.70 2wqx h ASN 73 Cb 0.21 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2wqx h ASN 73 CO -0.06 0.83 -0.56 -0.33 -1.65 0.00 0.00 177.43 175.66 2wqx h GLU 74 N 1.19 0.88 -0.35 0.81 5.08 -1.66 -2.86 114.58 117.66 2wqx h GLU 74 Ca 0.30 -0.56 -0.06 0.00 -1.00 0.00 0.00 59.36 58.04 2wqx h GLU 74 Cb -0.00 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2wqx h GLU 74 CO -0.05 1.20 -0.03 -0.07 -1.00 0.00 0.00 179.01 179.05 2wqx h LEU 75 N 0.67 0.54 -1.77 1.33 3.38 -1.00 -1.65 115.31 116.80 2wqx h LEU 75 Ca 0.01 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2wqx h LEU 75 Cb 1.17 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 2wqx h LEU 75 CO 0.12 0.63 -0.13 0.78 0.09 0.00 0.00 178.44 179.94 2wqx h ASN 76 N 0.54 0.00 0.81 -0.43 2.35 -1.03 -2.35 115.58 115.48 2wqx h ASN 76 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2wqx h ASN 76 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 2wqx h ASN 76 CO 0.02 0.13 0.00 -1.54 -1.65 0.00 0.00 177.43 174.38 2wqx n SER 77 N -3.50 0.01 -4.61 5.81 3.41 -0.62 -4.55 113.62 109.56 2wqx n SER 77 Ca -0.01 0.50 -0.43 0.00 -0.26 0.00 0.00 58.87 58.67 2wqx n SER 77 Cb 0.28 -0.50 -0.02 0.00 -0.26 0.00 0.00 64.21 63.70 2wqx n SER 77 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2wqx s ILE 78 N -3.00 4.29 -0.13 -1.33 1.01 -0.88 -4.84 121.20 116.32 2wqx s ILE 78 Ca 0.11 1.39 0.18 0.00 0.00 0.00 0.00 60.65 62.33 2wqx s ILE 78 Cb 0.15 -4.50 -0.23 0.00 0.01 0.00 0.00 42.46 37.89 2wqx s ILE 78 CO 0.43 -0.79 0.43 -0.67 0.00 0.00 0.00 174.94 174.33 2wqx n ASP 79 N 7.55 0.32 -3.76 3.58 2.03 -1.26 -2.41 116.55 122.60 2wqx n ASP 79 Ca 0.12 0.14 -0.12 0.00 0.52 0.00 0.00 54.79 55.45 2wqx n ASP 79 Cb 0.48 0.89 -0.12 0.00 -0.72 0.00 0.00 41.12 41.65 2wqx n ASP 79 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2wqx s GLN 80 N -2.85 0.27 -0.13 -0.67 0.74 -1.26 0.42 119.66 116.17 2wqx s GLN 80 Ca -0.07 0.44 0.00 0.00 0.05 0.00 0.00 55.36 55.78 2wqx s GLN 80 Cb 0.09 0.04 0.02 0.00 1.10 0.00 0.00 33.01 34.26 2wqx s GLN 80 CO 0.84 -0.09 -0.11 0.42 -0.55 0.00 0.00 175.29 175.80 2wqx s ILE 81 N 0.61 1.32 -0.40 -2.34 1.01 -0.67 -5.02 121.20 115.70 2wqx s ILE 81 Ca -0.04 -0.48 -0.05 0.00 0.00 0.00 0.00 60.65 60.09 2wqx s ILE 81 Cb -0.05 -1.27 0.10 0.00 0.01 0.00 0.00 42.46 41.24 2wqx s ILE 81 CO -0.04 0.42 0.21 -0.63 0.00 0.00 0.00 174.94 174.90 2wqx s ILE 82 N 1.53 3.57 -0.36 2.92 1.01 -1.26 -0.64 121.20 127.97 2wqx s ILE 82 Ca 0.04 -1.80 0.14 0.00 0.00 0.00 0.00 60.65 59.03 2wqx s ILE 82 Cb -0.13 -3.33 0.39 0.00 0.01 0.00 0.00 42.46 39.41 2wqx s ILE 82 CO -0.09 -0.59 0.85 0.00 0.00 0.00 0.00 174.94 175.12 2wqx n ALA 83 N 4.71 2.37 -1.77 9.38 0.00 0.56 -4.98 120.51 130.78 2wqx n ALA 83 Ca -0.06 -3.13 -0.40 0.00 0.00 0.00 0.00 53.44 49.85 2wqx n ALA 83 Cb 0.42 -0.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.90 2wqx n ALA 83 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2wqx s ASN 84 N -2.59 6.61 -1.34 0.00 0.01 -1.13 -3.90 114.94 112.59 2wqx s ASN 84 Ca 0.34 2.57 -0.03 0.00 -0.71 0.00 0.00 52.86 55.03 2wqx s ASN 84 Cb 0.39 -2.64 0.02 0.00 0.41 0.00 0.00 41.25 39.43 2wqx s ASN 84 CO -0.03 -0.64 0.79 0.59 -1.51 0.00 0.00 177.10 176.30 2wqx n ASN 85 N 0.46 -2.06 -0.03 -1.22 3.02 0.10 -4.89 115.26 110.64 2wqx n ASN 85 Ca 0.02 -0.79 0.03 0.00 -0.03 0.00 0.00 54.58 53.81 2wqx n ASN 85 Cb 0.44 -4.12 0.05 0.00 -0.61 0.00 0.00 39.78 35.53 2wqx n ASN 85 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2wqx n SER 86 N -3.02 2.04 -3.80 6.41 7.64 -1.25 -5.02 113.62 116.62 2wqx n SER 86 Ca -0.23 -2.34 -0.28 0.00 1.01 0.00 0.00 58.87 57.03 2wqx n SER 86 Cb 0.65 -0.15 0.05 0.00 -1.01 0.00 0.00 64.21 63.75 2wqx n SER 86 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2wqx n ASP 87 N -0.80 -5.43 -4.65 6.43 2.03 -1.26 -4.83 116.55 108.05 2wqx n ASP 87 Ca 0.05 -0.69 -0.41 0.00 0.52 0.00 0.00 54.79 54.27 2wqx n ASP 87 Cb 0.39 -4.30 -0.06 0.00 -0.72 0.00 0.00 41.12 36.43 2wqx n ASP 87 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2wqx s ILE 88 N -3.30 4.97 -0.17 5.18 1.01 -1.26 -4.75 121.20 122.87 2wqx s ILE 88 Ca 0.64 1.25 0.21 0.00 0.00 0.00 0.00 60.65 62.75 2wqx s ILE 88 Cb -0.31 -3.98 -0.10 0.00 0.01 0.00 0.00 42.46 38.08 2wqx s ILE 88 CO 0.79 0.05 0.86 0.29 0.00 0.00 0.00 174.94 176.93 2wqx n LYS 89 N 5.43 0.62 -3.66 2.79 5.02 -1.26 -0.66 118.16 126.43 2wqx n LYS 89 Ca 0.00 0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.25 2wqx n LYS 89 Cb 0.49 -1.75 -0.08 0.00 -0.02 0.00 0.00 35.03 33.67 2wqx n LYS 89 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2wqx s SER 90 N -5.27 -0.71 -0.37 4.39 0.15 -1.26 -4.34 113.70 106.28 2wqx s SER 90 Ca -0.03 1.26 0.07 0.00 0.70 0.00 0.00 55.95 57.95 2wqx s SER 90 Cb 0.10 1.21 0.64 0.00 -1.71 0.00 0.00 66.02 66.26 2wqx s SER 90 CO 0.82 -0.22 1.77 1.33 1.20 0.00 0.00 173.24 178.14 2wqx n VAL 91 N 3.49 2.96 -1.72 4.45 0.24 -1.26 -4.41 118.33 122.08 2wqx n VAL 91 Ca -0.17 -2.06 -0.42 0.00 -2.04 0.00 0.00 64.34 59.65 2wqx n VAL 91 Cb 0.57 -0.40 -0.03 0.00 -1.47 0.00 0.00 33.84 32.51 2wqx n VAL 91 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 2wqx n GLN 92 N -0.90 2.74 0.00 7.34 -0.06 -1.26 -1.11 117.38 124.13 2wqx n GLN 92 Ca 0.48 0.99 0.00 0.00 -2.00 0.00 0.00 57.00 56.47 2wqx n GLN 92 Cb 1.43 -2.82 0.00 0.00 -4.06 0.00 0.00 30.24 24.79 2wqx n GLN 92 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2wqx n GLY 93 N 3.75 2.31 0.29 1.69 0.00 -1.25 -3.43 105.19 108.55 2wqx n GLY 93 Ca 0.15 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.35 2wqx n GLY 93 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2wqx h ILE 94 N 0.00 0.25 -0.31 -0.61 2.10 -1.42 -2.45 117.51 115.07 2wqx h ILE 94 Ca 0.00 -0.32 0.09 0.00 1.08 0.00 0.00 64.86 65.71 2wqx h ILE 94 Cb 0.00 1.24 -0.01 0.00 -1.09 0.00 0.00 36.82 36.96 2wqx h ILE 94 CO 0.00 0.04 0.28 1.56 -1.08 0.00 0.00 178.15 178.96 2wqx h GLN 95 N 0.00 0.00 -0.63 2.19 7.50 -1.79 -1.80 115.11 120.58 2wqx h GLN 95 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2wqx h GLN 95 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.77 2wqx h GLN 95 CO 0.01 0.00 0.00 0.66 -1.50 0.00 0.00 178.83 178.00 2wqx n TYR 96 N -4.00 0.51 -3.36 2.96 4.01 -0.92 -4.47 117.16 111.89 2wqx n TYR 96 Ca 0.05 -0.19 -0.31 0.00 -0.16 0.00 0.00 57.90 57.28 2wqx n TYR 96 Cb 0.44 -0.14 -0.06 0.00 -0.31 0.00 0.00 39.34 39.27 2wqx n TYR 96 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2wqx n LEU 97 N 0.18 4.39 0.31 7.72 4.32 -0.68 -4.56 117.00 128.68 2wqx n LEU 97 Ca 0.08 -5.36 0.18 0.00 -0.02 0.00 0.00 56.01 50.89 2wqx n LEU 97 Cb 0.41 -0.84 1.01 0.00 -1.62 0.00 0.00 43.42 42.37 2wqx n LEU 97 CO 0.08 1.93 1.13 1.55 -1.22 0.00 0.00 177.39 180.86 2wqx h PRO 98 N 4.64 0.00 -0.10 3.23 0.13 -1.82 -2.73 132.00 135.35 2wqx h PRO 98 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2wqx h PRO 98 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2wqx h PRO 98 CO 0.95 0.01 0.00 0.09 -0.23 0.00 0.00 178.00 178.82 2wqx n ASN 99 N -3.53 2.74 -4.70 1.44 3.02 -1.26 -4.35 115.26 108.62 2wqx n ASN 99 Ca -0.03 -1.89 -0.42 0.00 -0.03 0.00 0.00 54.58 52.21 2wqx n ASN 99 Cb 0.10 -0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.19 2wqx n ASN 99 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2wqx s VAL 100 N -1.89 3.22 -0.24 2.41 0.11 -1.01 -4.50 120.40 118.50 2wqx s VAL 100 Ca 0.32 0.74 0.11 0.00 -2.93 0.00 0.00 61.98 60.22 2wqx s VAL 100 Cb 0.21 -3.48 -0.15 0.00 -1.53 0.00 0.00 36.38 31.43 2wqx s VAL 100 CO 0.31 0.02 0.34 0.35 -3.33 0.00 0.00 175.10 172.79 2wqx n THR 101 N 4.45 0.00 -3.69 5.04 -2.24 0.17 -3.30 114.28 114.71 2wqx n THR 101 Ca 0.14 -0.25 -0.21 0.00 -2.27 0.00 0.00 64.05 61.46 2wqx n THR 101 Cb 0.41 0.58 -0.18 0.00 -2.10 0.00 0.00 70.33 69.04 2wqx n THR 101 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2wqx s LYS 102 N -2.46 0.06 -0.20 -0.78 1.02 -1.02 0.36 119.74 116.72 2wqx s LYS 102 Ca -0.00 0.31 0.01 0.00 0.02 0.00 0.00 55.97 56.31 2wqx s LYS 102 Cb 0.08 -0.64 0.04 0.00 -0.52 0.00 0.00 37.83 36.78 2wqx s LYS 102 CO 0.46 -0.33 -0.14 -0.51 -0.92 0.00 0.00 175.35 173.91 2wqx s LEU 103 N 2.13 2.35 -0.59 3.17 1.43 -0.45 -1.67 118.68 125.04 2wqx s LEU 103 Ca 0.05 -0.84 -0.11 0.00 -1.03 0.00 0.00 54.13 52.20 2wqx s LEU 103 Cb -0.12 -1.36 0.15 0.00 0.03 0.00 0.00 46.19 44.89 2wqx s LEU 103 CO -0.04 -0.09 0.50 -0.36 0.23 0.00 0.00 176.35 176.59 2wqx s PHE 104 N 1.32 3.46 -0.21 0.29 2.99 0.18 -1.26 117.98 124.76 2wqx s PHE 104 Ca 0.00 -1.86 0.12 0.00 0.00 0.00 0.00 56.93 55.20 2wqx s PHE 104 Cb -0.15 -3.62 0.43 0.00 0.00 0.00 0.00 43.02 39.68 2wqx s PHE 104 CO -0.10 -0.98 1.20 1.28 -0.00 0.00 0.00 175.22 176.63 2wqx n LEU 105 N 4.60 2.99 -4.77 -0.37 4.77 0.47 -0.32 117.00 124.37 2wqx n LEU 105 Ca -0.02 -3.87 -0.39 0.00 -0.03 0.00 0.00 56.01 51.69 2wqx n LEU 105 Cb 0.42 -0.40 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 2wqx n LEU 105 CO 0.42 1.46 0.89 0.20 -1.33 0.00 0.00 177.39 179.04 2wqx s ASN 106 N -3.21 6.66 -0.22 -1.43 0.01 -1.17 -3.71 114.94 111.87 2wqx s ASN 106 Ca 0.40 2.48 -0.01 0.00 -0.71 0.00 0.00 52.86 55.03 2wqx s ASN 106 Cb 0.38 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 39.41 2wqx s ASN 106 CO -0.05 -0.59 0.09 0.61 -1.51 0.00 0.00 177.10 175.64 2wqx n GLY 107 N 0.77 0.50 0.00 0.66 0.00 -0.08 0.01 105.19 107.04 2wqx n GLY 107 Ca 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2wqx n GLY 107 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wqx n ASN 108 N 1.14 1.73 -2.21 1.61 3.02 -1.24 -3.15 115.26 116.17 2wqx n ASN 108 Ca -0.02 -0.66 -0.20 0.00 -0.03 0.00 0.00 54.58 53.68 2wqx n ASN 108 Cb 0.52 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.71 2wqx n ASN 108 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2wqx n LYS 109 N -0.09 3.23 -2.74 3.52 4.76 0.16 -4.33 118.16 122.68 2wqx n LYS 109 Ca 0.00 -4.07 -0.39 0.00 -2.87 0.00 0.00 58.31 50.98 2wqx n LYS 109 Cb 0.00 -2.14 -0.06 0.00 -1.84 0.00 0.00 35.03 30.99 2wqx n LYS 109 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2wqx s LEU 110 N -3.62 4.53 -0.06 -0.35 2.01 -1.21 -4.52 118.68 115.46 2wqx s LEU 110 Ca 0.46 1.93 0.04 0.00 0.01 0.00 0.00 54.13 56.57 2wqx s LEU 110 Cb 0.39 -3.76 -0.06 0.00 0.01 0.00 0.00 46.19 42.77 2wqx s LEU 110 CO 0.01 0.06 0.00 0.35 1.01 0.00 0.00 176.35 177.77 2wqx n THR 111 N 1.13 0.37 -4.10 5.49 -2.24 -1.26 -0.41 114.28 113.25 2wqx n THR 111 Ca -0.00 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.24 2wqx n THR 111 Cb 0.48 -0.83 -0.16 0.00 -2.10 0.00 0.00 70.33 67.72 2wqx n THR 111 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wqx s ASP 112 N -3.89 3.53 -0.08 3.42 2.15 -1.26 -4.14 116.67 116.40 2wqx s ASP 112 Ca -0.04 -0.88 0.16 0.00 0.43 0.00 0.00 52.55 52.22 2wqx s ASP 112 Cb 0.02 -1.50 0.53 0.00 -0.30 0.00 0.00 42.92 41.67 2wqx s ASP 112 CO 0.21 -0.06 1.45 2.30 -0.17 0.00 0.00 175.17 178.90 2wqx n ILE 113 N 4.56 1.57 0.18 4.11 -5.35 -1.26 -4.56 119.36 118.61 2wqx n ILE 113 Ca -0.19 -1.26 0.14 0.00 -0.27 0.00 0.00 62.75 61.18 2wqx n ILE 113 Cb 0.48 0.21 0.72 0.00 -1.74 0.00 0.00 39.64 39.30 2wqx n ILE 113 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 2wqx h LYS 114 N 2.93 0.00 0.00 6.28 1.57 -1.93 0.64 116.57 126.06 2wqx h LYS 114 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2wqx h LYS 114 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2wqx h LYS 114 CO 0.13 0.00 0.00 -2.30 -0.57 0.00 0.00 179.45 176.71 2wqx n PRO 115 N -4.28 0.05 0.00 3.15 -0.02 -1.26 -1.87 135.00 130.77 2wqx n PRO 115 Ca 0.02 0.29 0.13 0.00 -2.02 0.00 0.00 63.50 61.91 2wqx n PRO 115 Cb 0.28 -1.50 0.32 0.00 -0.02 0.00 0.00 33.50 32.58 2wqx n PRO 115 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wqx n LEU 116 N -1.41 0.95 -0.33 2.45 4.77 0.22 -3.82 117.00 119.83 2wqx n LEU 116 Ca 0.03 -0.23 0.05 0.00 -0.03 0.00 0.00 56.01 55.83 2wqx n LEU 116 Cb 0.09 -0.14 0.23 0.00 -2.33 0.00 0.00 43.42 41.27 2wqx n LEU 116 CO 0.08 0.19 1.25 0.00 -1.33 0.00 0.00 177.39 177.57 2wqx h ALA 117 N 3.52 1.51 -0.42 -1.18 0.00 -1.46 -2.16 119.26 119.08 2wqx h ALA 117 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2wqx h ALA 117 Cb 0.52 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2wqx h ALA 117 CO 0.00 0.31 0.02 0.09 0.00 0.00 0.00 179.25 179.67 2wqx n ASN 118 N -4.53 4.65 -4.38 0.00 3.02 -1.26 -4.57 115.26 108.18 2wqx n ASN 118 Ca 0.16 -3.02 -0.43 0.00 -0.03 0.00 0.00 54.58 51.25 2wqx n ASN 118 Cb 0.26 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 38.81 2wqx n ASN 118 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wqx n LEU 119 N -0.07 5.42 0.21 3.41 4.77 -0.81 -4.83 117.00 125.10 2wqx n LEU 119 Ca 0.25 -4.31 0.15 0.00 -0.03 0.00 0.00 56.01 52.07 2wqx n LEU 119 Cb 1.05 -1.64 0.61 0.00 -2.33 0.00 0.00 43.42 41.11 2wqx n LEU 119 CO 0.24 0.67 0.93 0.11 -1.33 0.00 0.00 177.39 178.01 2wqx h LYS 120 N 7.01 0.00 -0.14 3.23 1.57 -1.86 -1.77 116.57 124.60 2wqx h LYS 120 Ca 0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 2wqx h LYS 120 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 2wqx h LYS 120 CO 1.39 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 180.36 2wqx n ASN 121 N -2.67 1.72 -4.68 0.86 3.02 -1.26 -4.34 115.26 107.91 2wqx n ASN 121 Ca 0.01 -1.68 -0.43 0.00 -0.03 0.00 0.00 54.58 52.45 2wqx n ASN 121 Cb 0.25 -0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.31 2wqx n ASN 121 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wqx n LEU 122 N 0.36 3.97 -0.06 3.41 4.77 -0.67 -4.36 117.00 124.43 2wqx n LEU 122 Ca 0.17 0.97 -0.09 0.00 -0.03 0.00 0.00 56.01 57.03 2wqx n LEU 122 Cb 0.35 -1.52 -0.05 0.00 -2.33 0.00 0.00 43.42 39.87 2wqx n LEU 122 CO 0.14 0.14 -0.88 0.61 -1.33 0.00 0.00 177.39 176.07 2wqx n GLY 123 N 4.27 -0.17 3.15 -0.72 0.00 0.16 -2.41 105.19 109.47 2wqx n GLY 123 Ca 0.19 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 2wqx n GLY 123 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2wqx s TRP 124 N -2.22 2.15 -0.17 1.61 0.51 -0.54 -0.67 118.94 119.61 2wqx s TRP 124 Ca -0.16 -0.85 -0.04 0.00 -2.12 0.00 0.00 56.10 52.94 2wqx s TRP 124 Cb 0.05 -1.47 0.06 0.00 -0.81 0.00 0.00 33.47 31.29 2wqx s TRP 124 CO 0.24 -0.36 0.05 -1.17 -0.51 0.00 0.00 176.95 175.20 2wqx s LEU 125 N 0.45 0.81 -0.31 2.99 2.96 -0.48 -1.35 118.68 123.75 2wqx s LEU 125 Ca -0.17 -0.68 -0.03 0.00 -0.22 0.00 0.00 54.13 53.03 2wqx s LEU 125 Cb -0.17 -0.44 0.05 0.00 0.50 0.00 0.00 46.19 46.12 2wqx s LEU 125 CO 0.07 -0.31 0.03 -0.36 -1.32 0.00 0.00 176.35 174.46 2wqx s PHE 126 N 1.98 3.26 -0.14 5.38 0.08 -0.39 -1.03 117.98 127.12 2wqx s PHE 126 Ca 0.01 -1.73 0.16 0.00 0.12 0.00 0.00 56.93 55.49 2wqx s PHE 126 Cb -0.16 -2.16 0.42 0.00 -0.57 0.00 0.00 43.02 40.55 2wqx s PHE 126 CO -0.08 -0.78 1.20 1.28 -0.10 0.00 0.00 175.22 176.74 2wqx n LEU 127 N 4.68 2.11 -4.77 -0.37 4.77 0.93 -0.39 117.00 123.96 2wqx n LEU 127 Ca -0.13 -3.23 -0.40 0.00 -0.03 0.00 0.00 56.01 52.22 2wqx n LEU 127 Cb 0.44 -0.35 0.02 0.00 -2.33 0.00 0.00 43.42 41.20 2wqx n LEU 127 CO 0.28 1.08 1.04 -1.81 -1.33 0.00 0.00 177.39 176.66 2wqx s ASP 128 N -2.80 5.90 -1.09 -1.43 1.01 -1.18 -3.32 116.67 113.76 2wqx s ASP 128 Ca 0.36 2.86 -0.06 0.00 0.71 0.00 0.00 52.55 56.42 2wqx s ASP 128 Cb 0.37 -2.65 0.01 0.00 1.01 0.00 0.00 42.92 41.66 2wqx s ASP 128 CO -0.10 -1.15 0.95 -0.62 0.21 0.00 0.00 175.17 174.45 2wqx n GLU 129 N -0.21 -6.36 -1.05 8.23 -0.58 0.10 -0.91 120.64 119.87 2wqx n GLU 129 Ca 0.05 0.68 0.00 0.00 -0.42 0.00 0.00 57.16 57.47 2wqx n GLU 129 Cb 0.42 -5.25 0.00 0.00 -0.57 0.00 0.00 31.44 26.04 2wqx n GLU 129 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2wqx n ASN 130 N -2.25 1.51 -2.60 1.62 3.02 -1.21 -3.61 115.26 111.74 2wqx n ASN 130 Ca -0.02 -0.60 -0.27 0.00 -0.03 0.00 0.00 54.58 53.66 2wqx n ASN 130 Cb 0.56 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.72 2wqx n ASN 130 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2wqx n LYS 131 N -0.15 3.32 -2.91 3.52 5.02 0.45 -4.17 118.16 123.23 2wqx n LYS 131 Ca 0.00 -4.56 -0.43 0.00 -2.02 0.00 0.00 58.31 51.30 2wqx n LYS 131 Cb 0.00 -2.22 -0.05 0.00 -0.02 0.00 0.00 35.03 32.74 2wqx n LYS 131 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2wqx s VAL 132 N -5.21 4.53 -0.16 -0.18 1.01 -1.19 -4.17 120.40 115.03 2wqx s VAL 132 Ca 0.48 0.28 0.09 0.00 0.00 0.00 0.00 61.98 62.83 2wqx s VAL 132 Cb 0.37 -4.44 -0.16 0.00 0.00 0.00 0.00 36.38 32.15 2wqx s VAL 132 CO -0.17 -0.93 -0.02 0.29 0.00 0.00 0.00 175.10 174.26 2wqx n LYS 133 N 7.07 1.19 -3.21 2.72 5.02 -1.26 -4.73 118.16 124.96 2wqx n LYS 133 Ca 0.01 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 55.93 2wqx n LYS 133 Cb 0.48 -1.38 -0.07 0.00 -0.02 0.00 0.00 35.03 34.03 2wqx n LYS 133 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wqx s ASP 134 N -5.19 6.42 0.00 4.39 -1.08 -1.26 -4.83 116.67 115.11 2wqx s ASP 134 Ca -0.14 0.36 0.24 0.00 -0.52 0.00 0.00 52.55 52.50 2wqx s ASP 134 Cb 0.05 -2.29 0.33 0.00 -1.46 0.00 0.00 42.92 39.55 2wqx s ASP 134 CO 0.55 -0.38 1.34 0.18 0.52 0.00 0.00 175.17 177.38 2wqx n LEU 135 N 5.67 2.83 0.26 -1.34 4.77 -1.26 -4.57 117.00 123.37 2wqx n LEU 135 Ca -0.04 -0.98 0.13 0.00 -0.03 0.00 0.00 56.01 55.10 2wqx n LEU 135 Cb 0.49 -0.03 0.72 0.00 -2.33 0.00 0.00 43.42 42.28 2wqx n LEU 135 CO 0.43 0.49 0.97 0.77 -1.33 0.00 0.00 177.39 178.72 2wqx h SER 136 N 4.35 0.00 0.74 -1.43 4.64 -1.92 -1.75 113.55 118.18 2wqx h SER 136 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wqx h SER 136 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 2wqx h SER 136 CO 0.00 0.12 0.00 -1.20 -0.87 0.00 0.00 176.83 174.88 2wqx n SER 137 N -3.58 0.30 -0.00 4.97 7.64 -1.26 -2.55 113.62 119.14 2wqx n SER 137 Ca -0.02 0.56 0.14 0.00 1.01 0.00 0.00 58.87 60.57 2wqx n SER 137 Cb 0.25 -0.63 0.64 0.00 -1.01 0.00 0.00 64.21 63.46 2wqx n SER 137 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2wqx n LEU 138 N -1.82 0.01 -0.34 -3.43 4.77 -0.66 -4.15 117.00 111.38 2wqx n LEU 138 Ca 0.04 0.45 0.14 0.00 -0.03 0.00 0.00 56.01 56.61 2wqx n LEU 138 Cb 0.24 -0.46 0.34 0.00 -2.33 0.00 0.00 43.42 41.21 2wqx n LEU 138 CO 0.19 0.00 1.20 0.50 -1.33 0.00 0.00 177.39 177.95 2wqx h LYS 139 N 0.00 0.70 -0.67 3.23 3.64 -1.69 -1.46 116.57 120.33 2wqx h LYS 139 Ca 0.00 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2wqx h LYS 139 Cb 0.46 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2wqx h LYS 139 CO 0.00 0.46 0.00 -0.25 -2.27 0.00 0.00 179.45 177.39 2wqx n ASP 140 N -4.74 4.25 -3.71 4.20 8.00 -1.26 -4.68 116.55 118.60 2wqx n ASP 140 Ca 0.23 -2.20 -0.42 0.00 0.71 0.00 0.00 54.79 53.11 2wqx n ASP 140 Cb 0.60 -0.51 -0.00 0.00 -0.02 0.00 0.00 41.12 41.18 2wqx n ASP 140 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2wqx n LEU 141 N 1.33 7.18 0.00 0.64 4.77 -0.55 -4.78 117.00 125.59 2wqx n LEU 141 Ca 0.24 -4.56 0.08 0.00 -0.03 0.00 0.00 56.01 51.74 2wqx n LEU 141 Cb 0.73 -1.50 0.38 0.00 -2.33 0.00 0.00 43.42 40.70 2wqx n LEU 141 CO 0.19 1.52 0.72 0.29 -1.33 0.00 0.00 177.39 178.78 2wqx n LYS 142 N 3.89 0.20 -0.10 3.23 4.76 -1.26 -1.61 118.16 127.27 2wqx n LYS 142 Ca 0.50 0.15 0.12 0.00 -2.87 0.00 0.00 58.31 56.21 2wqx n LYS 142 Cb 0.33 -1.50 0.17 0.00 -1.84 0.00 0.00 35.03 32.20 2wqx n LYS 142 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2wqx n LYS 143 N -1.30 2.41 -2.21 1.97 5.02 -1.26 -4.88 118.16 117.90 2wqx n LYS 143 Ca 0.07 -2.09 -0.43 0.00 -2.02 0.00 0.00 58.31 53.84 2wqx n LYS 143 Cb 0.13 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.62 2wqx n LYS 143 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2wqx s LEU 144 N -1.73 4.25 -0.13 -0.35 2.96 -0.63 -4.25 118.68 118.80 2wqx s LEU 144 Ca 0.34 1.97 0.12 0.00 -0.22 0.00 0.00 54.13 56.34 2wqx s LEU 144 Cb 0.22 -3.54 -0.17 0.00 0.50 0.00 0.00 46.19 43.20 2wqx s LEU 144 CO 0.31 -0.84 0.06 0.29 -1.32 0.00 0.00 176.35 174.85 2wqx n LYS 145 N 6.86 1.71 -3.98 1.98 4.76 0.16 -3.94 118.16 125.69 2wqx n LYS 145 Ca 0.16 -0.01 -0.25 0.00 -2.87 0.00 0.00 58.31 55.33 2wqx n LYS 145 Cb 0.44 -1.35 -0.17 0.00 -1.84 0.00 0.00 35.03 32.11 2wqx n LYS 145 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2wqx s SER 146 N -4.62 1.84 -0.04 4.39 0.15 -0.72 -1.17 113.70 113.53 2wqx s SER 146 Ca -0.07 -0.23 0.03 0.00 0.70 0.00 0.00 55.95 56.38 2wqx s SER 146 Cb 0.04 -0.70 0.01 0.00 -1.71 0.00 0.00 66.02 63.66 2wqx s SER 146 CO 0.56 -0.11 -0.11 -0.22 1.20 0.00 0.00 173.24 174.56 2wqx s LEU 147 N 1.56 1.75 -0.09 3.45 2.96 -0.30 -1.38 118.68 126.63 2wqx s LEU 147 Ca 0.01 -0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 53.66 2wqx s LEU 147 Cb -0.13 -0.71 0.02 0.00 0.50 0.00 0.00 46.19 45.88 2wqx s LEU 147 CO -0.05 0.07 -0.04 -0.55 -1.32 0.00 0.00 176.35 174.46 2wqx s SER 148 N 0.31 1.78 -0.24 3.68 0.15 -0.20 -1.69 113.70 117.50 2wqx s SER 148 Ca -0.07 -0.20 0.20 0.00 0.70 0.00 0.00 55.95 56.59 2wqx s SER 148 Cb -0.11 -0.64 0.49 0.00 -1.71 0.00 0.00 66.02 64.05 2wqx s SER 148 CO 0.02 -0.13 1.13 0.18 1.20 0.00 0.00 173.24 175.64 2wqx n LEU 149 N 4.86 2.21 -4.76 3.45 4.77 0.70 -0.05 117.00 128.18 2wqx n LEU 149 Ca -0.12 -3.29 -0.39 0.00 -0.03 0.00 0.00 56.01 52.18 2wqx n LEU 149 Cb 0.50 0.24 0.02 0.00 -2.33 0.00 0.00 43.42 41.85 2wqx n LEU 149 CO 0.15 1.20 0.98 -1.61 -1.33 0.00 0.00 177.39 176.79 2wqx s GLU 150 N -3.38 3.54 -1.29 3.23 2.02 -1.23 -3.56 118.70 118.03 2wqx s GLU 150 Ca 0.33 2.20 -0.02 0.00 0.02 0.00 0.00 54.97 57.50 2wqx s GLU 150 Cb 0.35 -2.49 0.01 0.00 0.10 0.00 0.00 34.13 32.10 2wqx s GLU 150 CO -0.04 -0.86 0.85 0.72 0.02 0.00 0.00 175.26 175.95 2wqx n HIS 151 N -0.49 -2.09 0.21 1.61 8.25 -0.36 -0.72 115.22 121.63 2wqx n HIS 151 Ca 0.07 0.89 0.05 0.00 -0.26 0.00 0.00 57.72 58.47 2wqx n HIS 151 Cb 0.44 -4.63 0.08 0.00 1.12 0.00 0.00 29.99 27.01 2wqx n HIS 151 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2wqx n ASN 152 N -3.06 2.26 -1.80 0.41 3.02 -1.23 -3.90 115.26 110.95 2wqx n ASN 152 Ca -0.25 -1.65 -0.15 0.00 -0.03 0.00 0.00 54.58 52.49 2wqx n ASN 152 Cb 0.66 -0.08 -0.00 0.00 -0.61 0.00 0.00 39.78 39.74 2wqx n ASN 152 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wqx n GLY 153 N 0.55 -0.25 3.72 7.41 0.00 -1.26 -4.09 105.19 111.27 2wqx n GLY 153 Ca 0.08 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.46 2wqx n GLY 153 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wqx s ILE 154 N -2.79 4.72 0.00 -0.61 1.01 -1.26 -4.67 121.20 117.60 2wqx s ILE 154 Ca 0.03 1.92 0.00 0.00 0.00 0.00 0.00 60.65 62.60 2wqx s ILE 154 Cb -0.01 -4.26 0.00 0.00 0.01 0.00 0.00 42.46 38.20 2wqx s ILE 154 CO 0.03 0.27 0.00 -1.54 0.00 0.00 0.00 174.94 173.70 2wqx n SER 155 N 3.25 4.76 -4.32 3.58 3.41 -1.26 0.02 113.62 123.07 2wqx n SER 155 Ca 0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.27 2wqx n SER 155 Cb 0.50 0.75 -0.13 0.00 -0.26 0.00 0.00 64.21 65.07 2wqx n SER 155 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wqx s ASP 156 N -2.33 4.89 -0.15 4.04 -1.08 -1.26 -4.42 116.67 116.36 2wqx s ASP 156 Ca 0.00 -0.68 0.17 0.00 -0.52 0.00 0.00 52.55 51.52 2wqx s ASP 156 Cb 0.00 -1.83 0.42 0.00 -1.46 0.00 0.00 42.92 40.05 2wqx s ASP 156 CO 0.00 -0.15 1.31 2.30 0.52 0.00 0.00 175.17 179.15 2wqx n ILE 157 N 4.82 2.04 0.25 4.11 -5.35 -1.26 -4.75 119.36 119.22 2wqx n ILE 157 Ca -0.15 -1.93 0.09 0.00 -0.27 0.00 0.00 62.75 60.49 2wqx n ILE 157 Cb 0.48 -0.18 0.66 0.00 -1.74 0.00 0.00 39.64 38.86 2wqx n ILE 157 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2wqx h ASN 158 N 1.15 0.00 0.12 7.28 2.35 -1.92 -1.75 115.58 122.81 2wqx h ASN 158 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2wqx h ASN 158 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 2wqx h ASN 158 CO 0.13 0.09 0.00 1.23 -1.65 0.00 0.00 177.43 177.23 2wqx h GLY 159 N 0.33 0.00 2.00 2.83 0.00 -1.91 -2.56 103.07 103.76 2wqx h GLY 159 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wqx h GLY 159 CO 0.01 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.96 2wqx h LEU 160 N 0.00 0.00 -1.93 3.11 3.38 -1.65 -3.05 115.31 115.17 2wqx h LEU 160 Ca 0.00 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.20 2wqx h LEU 160 Cb 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2wqx h LEU 160 CO 0.00 0.00 0.65 1.62 0.09 0.00 0.00 178.44 180.80 2wqx h VAL 161 N 0.00 0.44 -0.03 1.22 3.04 -1.66 -0.00 116.25 119.26 2wqx h VAL 161 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2wqx h VAL 161 Cb 0.43 0.53 0.00 0.00 -2.01 0.00 0.00 31.29 30.24 2wqx h VAL 161 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.57 177.97 2wqx n HIS 162 N -4.02 0.04 -2.93 3.17 8.25 -1.15 -4.12 115.22 114.45 2wqx n HIS 162 Ca 0.16 -0.02 -0.24 0.00 -0.26 0.00 0.00 57.72 57.36 2wqx n HIS 162 Cb 0.93 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.01 2wqx n HIS 162 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2wqx n LEU 163 N -0.57 3.63 0.04 2.41 4.77 -0.02 -4.85 117.00 122.42 2wqx n LEU 163 Ca 0.13 -5.42 0.07 0.00 -0.03 0.00 0.00 56.01 50.75 2wqx n LEU 163 Cb 0.10 -0.24 0.30 0.00 -2.33 0.00 0.00 43.42 41.25 2wqx n LEU 163 CO 0.10 2.30 0.72 -0.81 -1.33 0.00 0.00 177.39 178.36 2wqx n PRO 164 N -0.16 0.05 0.00 3.23 -0.04 -1.26 -1.77 135.00 135.05 2wqx n PRO 164 Ca 0.30 0.36 0.14 0.00 -0.04 0.00 0.00 63.50 64.26 2wqx n PRO 164 Cb 0.49 -1.61 0.56 0.00 -0.04 0.00 0.00 33.50 32.90 2wqx n PRO 164 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wqx n GLN 165 N -1.70 0.49 -1.72 0.54 0.00 -1.26 -4.26 117.38 109.47 2wqx n GLN 165 Ca 0.02 -0.17 -0.42 0.00 0.00 0.00 0.00 57.00 56.43 2wqx n GLN 165 Cb 0.14 -1.50 -0.01 0.00 0.00 0.00 0.00 30.24 28.87 2wqx n GLN 165 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2wqx n LEU 166 N -1.11 3.90 -0.02 2.61 4.77 -0.73 -4.75 117.00 121.67 2wqx n LEU 166 Ca 0.12 1.18 -0.00 0.00 -0.03 0.00 0.00 56.01 57.28 2wqx n LEU 166 Cb 0.30 -1.53 -0.06 0.00 -2.33 0.00 0.00 43.42 39.80 2wqx n LEU 166 CO 0.26 -0.20 -0.69 -0.62 -1.33 0.00 0.00 177.39 174.81 2wqx n GLU 167 N 1.25 1.70 -4.08 3.23 1.02 -0.32 -2.83 120.64 120.61 2wqx n GLU 167 Ca 0.06 -0.03 -0.18 0.00 -0.02 0.00 0.00 57.16 56.99 2wqx n GLU 167 Cb 0.36 -1.20 -0.16 0.00 -0.02 0.00 0.00 31.44 30.42 2wqx n GLU 167 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2wqx s SER 168 N -3.53 0.69 -0.19 1.62 0.01 -0.56 -1.00 113.70 110.74 2wqx s SER 168 Ca -0.03 -0.09 -0.04 0.00 1.31 0.00 0.00 55.95 57.10 2wqx s SER 168 Cb 0.04 -0.33 0.10 0.00 0.21 0.00 0.00 66.02 66.03 2wqx s SER 168 CO 0.33 -0.06 0.28 -0.22 0.41 0.00 0.00 173.24 173.97 2wqx s LEU 169 N 0.87 -0.31 -0.29 2.44 2.96 0.47 -1.15 118.68 123.67 2wqx s LEU 169 Ca -0.10 0.14 -0.04 0.00 -0.22 0.00 0.00 54.13 53.90 2wqx s LEU 169 Cb -0.13 0.68 0.03 0.00 0.50 0.00 0.00 46.19 47.26 2wqx s LEU 169 CO -0.00 -0.29 0.03 -0.31 -1.32 0.00 0.00 176.35 174.45 2wqx s TYR 170 N 2.41 3.15 -0.08 5.38 2.02 -0.68 -1.05 117.35 128.51 2wqx s TYR 170 Ca 0.07 -1.37 0.13 0.00 -0.37 0.00 0.00 57.07 55.53 2wqx s TYR 170 Cb -0.15 -2.17 0.25 0.00 -0.40 0.00 0.00 41.96 39.50 2wqx s TYR 170 CO -0.12 -0.68 1.12 1.28 -1.57 0.00 0.00 175.55 175.58 2wqx n LEU 171 N 4.76 1.46 -4.52 -1.29 4.77 0.97 -0.22 117.00 122.93 2wqx n LEU 171 Ca -0.15 -2.41 -0.41 0.00 -0.03 0.00 0.00 56.01 53.01 2wqx n LEU 171 Cb 0.46 -0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 2wqx n LEU 171 CO 0.29 0.67 0.27 0.61 -1.33 0.00 0.00 177.39 177.90 2wqx n GLY 172 N -0.59 -0.99 3.24 -0.72 0.00 -1.13 -3.86 105.19 101.13 2wqx n GLY 172 Ca 0.10 0.07 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 2wqx n GLY 172 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wqx n ASN 173 N 0.90 -2.36 -0.86 1.61 4.13 0.23 -1.23 115.26 117.68 2wqx n ASN 173 Ca 0.11 -0.56 0.00 0.00 1.68 0.00 0.00 54.58 55.81 2wqx n ASN 173 Cb 0.40 -4.73 0.00 0.00 -1.54 0.00 0.00 39.78 33.91 2wqx n ASN 173 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2wqx n ASN 174 N -2.92 1.66 -2.43 6.41 3.02 -1.08 -2.86 115.26 117.06 2wqx n ASN 174 Ca -0.24 -0.47 -0.27 0.00 -0.03 0.00 0.00 54.58 53.56 2wqx n ASN 174 Cb 0.65 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.82 2wqx n ASN 174 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2wqx n LYS 175 N 0.00 3.41 -3.34 3.52 5.02 0.10 -4.40 118.16 122.48 2wqx n LYS 175 Ca 0.00 -4.39 -0.38 0.00 -2.02 0.00 0.00 58.31 51.52 2wqx n LYS 175 Cb 0.00 -2.26 -0.06 0.00 -0.02 0.00 0.00 35.03 32.69 2wqx n LYS 175 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wqx s ILE 176 N -5.36 4.94 -0.03 -0.18 1.01 -1.16 -4.17 121.20 116.25 2wqx s ILE 176 Ca 0.49 1.06 0.01 0.00 0.00 0.00 0.00 60.65 62.21 2wqx s ILE 176 Cb 0.41 -3.83 -0.03 0.00 0.01 0.00 0.00 42.46 39.01 2wqx s ILE 176 CO -0.17 0.50 -0.01 0.35 0.00 0.00 0.00 174.94 175.61 2wqx n THR 177 N 2.29 0.21 -3.68 2.92 -2.24 -1.26 -1.25 114.28 111.26 2wqx n THR 177 Ca -0.10 -0.10 -0.39 0.00 -2.27 0.00 0.00 64.05 61.19 2wqx n THR 177 Cb 0.51 -0.76 -0.11 0.00 -2.10 0.00 0.00 70.33 67.87 2wqx n THR 177 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wqx s ASP 178 N -3.90 5.46 -0.33 3.42 2.15 -1.26 -4.44 116.67 117.76 2wqx s ASP 178 Ca -0.03 -1.54 0.09 0.00 0.43 0.00 0.00 52.55 51.50 2wqx s ASP 178 Cb 0.01 -1.92 0.71 0.00 -0.30 0.00 0.00 42.92 41.43 2wqx s ASP 178 CO 0.10 -0.49 1.78 2.30 -0.17 0.00 0.00 175.17 178.70 2wqx n ILE 179 N 4.81 2.92 -0.24 4.11 -5.35 -1.26 -4.70 119.36 119.66 2wqx n ILE 179 Ca -0.09 -1.77 0.03 0.00 -0.27 0.00 0.00 62.75 60.65 2wqx n ILE 179 Cb 0.43 -0.37 0.13 0.00 -1.74 0.00 0.00 39.64 38.09 2wqx n ILE 179 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2wqx h THR 180 N 2.29 0.39 0.00 7.28 2.02 -1.91 -1.14 112.91 121.84 2wqx h THR 180 Ca 0.30 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.45 2wqx h THR 180 Cb 2.33 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 69.02 2wqx h THR 180 CO 0.74 0.02 -0.01 1.62 0.37 0.00 0.00 175.52 178.27 2wqx h VAL 181 N 0.10 0.47 0.00 3.16 3.04 -1.91 -2.75 116.25 118.35 2wqx h VAL 181 Ca 0.37 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 66.04 2wqx h VAL 181 Cb 0.63 1.02 0.00 0.00 -2.01 0.00 0.00 31.29 30.93 2wqx h VAL 181 CO -0.62 0.01 0.00 -0.07 -1.01 0.00 0.00 177.57 175.87 2wqx h LEU 182 N 0.00 0.00 -2.05 3.16 3.38 -1.51 -1.76 115.31 116.53 2wqx h LEU 182 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2wqx h LEU 182 Cb 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2wqx h LEU 182 CO 0.00 0.00 -0.09 0.77 0.09 0.00 0.00 178.44 179.21 2wqx h SER 183 N 0.00 0.00 1.38 -0.43 4.64 -1.47 -1.09 113.55 116.58 2wqx h SER 183 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wqx h SER 183 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2wqx h SER 183 CO 0.00 0.09 0.00 0.54 -0.87 0.00 0.00 176.83 176.59 2wqx n ARG 184 N -3.67 0.21 -2.57 4.77 5.12 -0.66 -4.43 116.66 115.44 2wqx n ARG 184 Ca -0.02 0.17 -0.42 0.00 -1.93 0.00 0.00 57.85 55.66 2wqx n ARG 184 Cb 0.20 -1.75 0.01 0.00 -1.16 0.00 0.00 32.46 29.76 2wqx n ARG 184 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2wqx n LEU 185 N -2.11 7.17 -0.03 0.55 4.32 -0.41 -4.66 117.00 121.82 2wqx n LEU 185 Ca 0.06 -5.15 0.13 0.00 -0.02 0.00 0.00 56.01 51.03 2wqx n LEU 185 Cb 0.41 -1.28 0.75 0.00 -1.62 0.00 0.00 43.42 41.69 2wqx n LEU 185 CO 0.30 1.87 0.99 0.35 -1.22 0.00 0.00 177.39 179.67 2wqx n THR 186 N 1.11 0.01 1.06 -5.08 -2.24 -1.26 -2.48 114.28 105.40 2wqx n THR 186 Ca 0.44 -0.02 0.11 0.00 -2.27 0.00 0.00 64.05 62.31 2wqx n THR 186 Cb 0.29 -0.36 0.09 0.00 -2.10 0.00 0.00 70.33 68.25 2wqx n THR 186 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2wqx n LYS 187 N -0.84 0.99 -1.68 -0.78 4.76 -1.26 -4.57 118.16 114.78 2wqx n LYS 187 Ca 0.19 -0.77 -0.47 0.00 -2.87 0.00 0.00 58.31 54.40 2wqx n LYS 187 Cb 0.10 -1.48 -0.04 0.00 -1.84 0.00 0.00 35.03 31.77 2wqx n LYS 187 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2wqx n LEU 188 N -0.33 3.45 -0.00 -0.35 4.77 -1.04 -4.49 117.00 119.00 2wqx n LEU 188 Ca 0.09 1.00 0.07 0.00 -0.03 0.00 0.00 56.01 57.14 2wqx n LEU 188 Cb 0.42 -1.41 -0.09 0.00 -2.33 0.00 0.00 43.42 40.01 2wqx n LEU 188 CO 0.29 -0.08 -0.34 -0.90 -1.33 0.00 0.00 177.39 175.03 2wqx n ASP 189 N 5.64 1.23 -3.81 -1.43 5.68 -0.17 -2.98 116.55 120.71 2wqx n ASP 189 Ca 0.20 -0.42 -0.22 0.00 -0.50 0.00 0.00 54.79 53.85 2wqx n ASP 189 Cb 0.31 1.30 -0.17 0.00 -1.14 0.00 0.00 41.12 41.42 2wqx n ASP 189 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2wqx s THR 190 N -2.59 0.43 -0.09 2.12 2.01 -0.82 -0.91 115.64 115.80 2wqx s THR 190 Ca 0.00 0.05 -0.04 0.00 0.31 0.00 0.00 61.69 62.01 2wqx s THR 190 Cb 0.09 -0.55 0.05 0.00 0.01 0.00 0.00 72.50 72.10 2wqx s THR 190 CO 0.56 0.25 0.17 -0.22 -0.69 0.00 0.00 174.62 174.69 2wqx s LEU 191 N 1.66 -0.01 -0.16 4.42 2.96 -0.58 -0.40 118.68 126.57 2wqx s LEU 191 Ca 0.00 0.37 0.01 0.00 -0.22 0.00 0.00 54.13 54.29 2wqx s LEU 191 Cb -0.13 0.35 0.01 0.00 0.50 0.00 0.00 46.19 46.92 2wqx s LEU 191 CO -0.04 -0.23 -0.18 -0.55 -1.32 0.00 0.00 176.35 174.03 2wqx s SER 192 N 2.17 3.41 -0.08 3.68 0.15 -0.21 -1.70 113.70 121.12 2wqx s SER 192 Ca 0.01 -0.55 0.12 0.00 0.70 0.00 0.00 55.95 56.24 2wqx s SER 192 Cb -0.12 -1.52 0.19 0.00 -1.71 0.00 0.00 66.02 62.86 2wqx s SER 192 CO -0.06 0.06 1.10 0.18 1.20 0.00 0.00 173.24 175.71 2wqx n LEU 193 N 4.23 1.48 -4.72 3.45 4.77 0.76 -0.02 117.00 126.94 2wqx n LEU 193 Ca -0.20 -2.33 -0.37 0.00 -0.03 0.00 0.00 56.01 53.09 2wqx n LEU 193 Cb 0.51 -0.27 0.07 0.00 -2.33 0.00 0.00 43.42 41.41 2wqx n LEU 193 CO 0.28 0.55 0.89 -1.84 -1.33 0.00 0.00 177.39 175.93 2wqx n GLU 194 N -0.90 1.05 -3.40 3.23 0.28 -0.83 -3.66 120.64 116.41 2wqx n GLU 194 Ca 0.10 0.42 -0.17 0.00 -0.16 0.00 0.00 57.16 57.35 2wqx n GLU 194 Cb 0.67 -2.52 0.08 0.00 1.43 0.00 0.00 31.44 31.09 2wqx n GLU 194 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2wqx n ASP 195 N -1.99 -3.53 0.00 -1.84 -0.08 -0.20 -0.60 116.55 108.31 2wqx n ASP 195 Ca 0.16 -0.67 0.00 0.00 -1.51 0.00 0.00 54.79 52.76 2wqx n ASP 195 Cb 0.48 -5.03 0.00 0.00 2.34 0.00 0.00 41.12 38.91 2wqx n ASP 195 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2wqx n ASN 196 N -3.15 0.37 -2.77 1.67 3.02 -1.12 -2.62 115.26 110.66 2wqx n ASN 196 Ca -0.22 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.31 2wqx n ASN 196 Cb 0.65 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.87 2wqx n ASN 196 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wqx n GLN 197 N 0.00 1.77 -3.07 3.52 6.02 -0.38 -4.37 117.38 120.87 2wqx n GLN 197 Ca 0.00 -3.52 -0.40 0.00 -0.01 0.00 0.00 57.00 53.07 2wqx n GLN 197 Cb 0.00 -1.61 -0.05 0.00 1.02 0.00 0.00 30.24 29.61 2wqx n GLN 197 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2wqx s ILE 198 N -3.78 5.01 -0.24 5.09 1.01 -1.21 -4.39 121.20 122.69 2wqx s ILE 198 Ca 0.28 1.41 -0.12 0.00 0.00 0.00 0.00 60.65 62.23 2wqx s ILE 198 Cb 0.34 -4.02 -0.10 0.00 0.01 0.00 0.00 42.46 38.69 2wqx s ILE 198 CO -0.03 0.28 -0.31 -1.14 0.00 0.00 0.00 174.94 173.75 2wqx n ARG 199 N 3.57 0.50 -3.11 2.79 0.63 -1.26 -0.27 116.66 119.53 2wqx n ARG 199 Ca -0.02 0.22 -0.43 0.00 -0.92 0.00 0.00 57.85 56.70 2wqx n ARG 199 Cb 0.51 -1.35 -0.06 0.00 0.45 0.00 0.00 32.46 32.01 2wqx n ARG 199 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 2wqx s ARG 200 N -2.44 3.20 0.00 -0.14 3.52 -1.26 -4.61 118.95 117.22 2wqx s ARG 200 Ca -0.33 -0.62 0.24 0.00 -0.13 0.00 0.00 55.73 54.88 2wqx s ARG 200 Cb 0.13 -4.03 0.31 0.00 -1.56 0.00 0.00 34.95 29.79 2wqx s ARG 200 CO 0.42 -1.16 1.33 0.44 -0.81 0.00 0.00 175.30 175.51 2wqx n ILE 201 N 5.77 0.25 -0.33 4.11 -5.35 -1.26 -4.61 119.36 117.94 2wqx n ILE 201 Ca -0.04 -0.62 0.23 0.00 -0.27 0.00 0.00 62.75 62.05 2wqx n ILE 201 Cb 0.47 1.25 0.46 0.00 -1.74 0.00 0.00 39.64 40.07 2wqx n ILE 201 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 2wqx h VAL 202 N 4.60 0.29 0.00 7.28 2.07 -1.92 -1.01 116.25 127.55 2wqx h VAL 202 Ca 0.00 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.42 2wqx h VAL 202 Cb 0.99 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 2wqx h VAL 202 CO 0.00 0.06 0.07 -2.65 0.02 0.00 0.00 177.57 175.07 2wqx n PRO 203 N -5.08 0.02 0.00 1.57 -0.02 -1.26 -1.32 135.00 128.91 2wqx n PRO 203 Ca 0.31 0.47 0.12 0.00 -2.02 0.00 0.00 63.50 62.38 2wqx n PRO 203 Cb 0.96 -1.65 0.19 0.00 -0.02 0.00 0.00 33.50 32.97 2wqx n PRO 203 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wqx n LEU 204 N -1.59 0.89 0.13 2.45 4.77 -0.38 -3.27 117.00 120.00 2wqx n LEU 204 Ca -0.00 -0.24 0.02 0.00 -0.03 0.00 0.00 56.01 55.76 2wqx n LEU 204 Cb 0.08 -0.14 0.39 0.00 -2.33 0.00 0.00 43.42 41.41 2wqx n LEU 204 CO 0.02 0.19 0.87 0.00 -1.33 0.00 0.00 177.39 177.14 2wqx h ALA 205 N 3.27 1.49 -0.03 -1.18 0.00 -1.30 -2.51 119.26 119.00 2wqx h ALA 205 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2wqx h ALA 205 Cb 0.53 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2wqx h ALA 205 CO 0.00 0.36 -0.04 0.54 0.00 0.00 0.00 179.25 180.11 2wqx n ARG 206 N -4.25 2.08 -1.36 0.00 5.12 -1.26 -4.62 116.66 112.37 2wqx n ARG 206 Ca -0.01 -1.64 -0.39 0.00 -1.93 0.00 0.00 57.85 53.88 2wqx n ARG 206 Cb 0.29 -1.47 -0.02 0.00 -1.16 0.00 0.00 32.46 30.10 2wqx n ARG 206 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2wqx n LEU 207 N 0.97 8.18 0.05 0.55 4.32 -0.95 -4.73 117.00 125.39 2wqx n LEU 207 Ca 0.15 -4.24 0.05 0.00 -0.02 0.00 0.00 56.01 51.95 2wqx n LEU 207 Cb 0.54 -1.55 0.26 0.00 -1.62 0.00 0.00 43.42 41.04 2wqx n LEU 207 CO 0.17 1.79 0.67 0.41 -1.22 0.00 0.00 177.39 179.21 2wqx n THR 208 N 3.93 1.42 1.54 -5.08 -1.04 -1.26 -2.27 114.28 111.52 2wqx n THR 208 Ca 0.72 0.46 0.15 0.00 -2.04 0.00 0.00 64.05 63.34 2wqx n THR 208 Cb 0.26 -1.40 0.79 0.00 -1.82 0.00 0.00 70.33 68.16 2wqx n THR 208 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2wqx n LYS 209 N -1.75 0.56 -2.09 -2.82 5.02 -1.26 -4.37 118.16 111.45 2wqx n LYS 209 Ca 0.01 -0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 2wqx n LYS 209 Cb 0.07 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.55 2wqx n LYS 209 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wqx s LEU 210 N -2.45 4.37 -0.02 -0.35 1.43 -0.96 -4.23 118.68 116.47 2wqx s LEU 210 Ca 0.32 2.42 0.01 0.00 -1.03 0.00 0.00 54.13 55.85 2wqx s LEU 210 Cb 0.21 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.82 2wqx s LEU 210 CO 0.44 -0.72 -0.01 0.00 0.23 0.00 0.00 176.35 176.30 2wqx n GLN 211 N 4.06 1.46 -4.02 1.70 6.02 -0.09 -3.44 117.38 123.07 2wqx n GLN 211 Ca 0.12 0.01 -0.31 0.00 -0.01 0.00 0.00 57.00 56.81 2wqx n GLN 211 Cb 0.41 -1.04 -0.16 0.00 1.02 0.00 0.00 30.24 30.47 2wqx n GLN 211 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2wqx s ASN 212 N -3.81 3.55 -0.08 1.08 -0.87 -0.92 -0.58 114.94 113.31 2wqx s ASN 212 Ca -0.02 -0.95 0.00 0.00 -1.57 0.00 0.00 52.86 50.32 2wqx s ASN 212 Cb 0.01 -1.32 0.02 0.00 -0.02 0.00 0.00 41.25 39.94 2wqx s ASN 212 CO 0.05 -0.13 -0.06 -0.22 -2.57 0.00 0.00 177.10 174.16 2wqx s LEU 213 N 1.33 1.17 -0.30 0.60 2.96 -0.49 -1.53 118.68 122.42 2wqx s LEU 213 Ca -0.02 -0.23 0.02 0.00 -0.22 0.00 0.00 54.13 53.68 2wqx s LEU 213 Cb -0.16 -0.69 0.07 0.00 0.50 0.00 0.00 46.19 45.91 2wqx s LEU 213 CO -0.08 -0.10 -0.02 -0.31 -1.32 0.00 0.00 176.35 174.53 2wqx s TYR 214 N 1.44 3.44 0.00 5.38 2.02 -0.69 -1.75 117.35 127.19 2wqx s TYR 214 Ca -0.01 -2.44 0.00 0.00 -0.37 0.00 0.00 57.07 54.25 2wqx s TYR 214 Cb -0.13 -2.36 0.00 0.00 -0.40 0.00 0.00 41.96 39.07 2wqx s TYR 214 CO -0.04 -0.89 0.76 1.28 -1.57 0.00 0.00 175.55 175.08 2wqx n LEU 215 N 4.43 1.32 -4.63 -1.29 4.77 0.21 -0.17 117.00 121.64 2wqx n LEU 215 Ca -0.08 -1.32 -0.34 0.00 -0.03 0.00 0.00 56.01 54.25 2wqx n LEU 215 Cb 0.42 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.63 2wqx n LEU 215 CO 0.23 0.33 0.57 -1.54 -1.33 0.00 0.00 177.39 175.65 2wqx n SER 216 N -0.29 0.38 -3.04 -1.43 3.41 -0.99 -3.66 113.62 108.01 2wqx n SER 216 Ca 0.00 0.57 -0.18 0.00 -0.26 0.00 0.00 58.87 59.00 2wqx n SER 216 Cb 0.26 -1.43 0.07 0.00 -0.26 0.00 0.00 64.21 62.84 2wqx n SER 216 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wqx n LYS 217 N -2.65 -6.32 0.00 4.33 5.02 0.13 -1.04 118.16 117.63 2wqx n LYS 217 Ca 0.12 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 57.10 2wqx n LYS 217 Cb 0.51 -5.29 0.00 0.00 -0.02 0.00 0.00 35.03 30.22 2wqx n LYS 217 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2wqx n ASN 218 N -2.36 0.23 -2.41 4.39 3.02 -1.24 -2.78 115.26 114.12 2wqx n ASN 218 Ca -0.05 0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.28 2wqx n ASN 218 Cb 0.57 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.76 2wqx n ASN 218 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2wqx n HIS 219 N 0.00 2.73 -3.85 3.10 8.25 0.63 -0.96 115.22 125.12 2wqx n HIS 219 Ca 0.00 -2.75 -0.35 0.00 -0.26 0.00 0.00 57.72 54.36 2wqx n HIS 219 Cb 0.00 -0.21 -0.09 0.00 1.12 0.00 0.00 29.99 30.81 2wqx n HIS 219 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2wqx s ILE 220 N -4.79 5.02 -0.41 1.59 1.01 -1.23 -4.05 121.20 118.35 2wqx s ILE 220 Ca 0.44 0.05 0.05 0.00 0.00 0.00 0.00 60.65 61.20 2wqx s ILE 220 Cb 0.41 -3.29 -0.02 0.00 0.01 0.00 0.00 42.46 39.57 2wqx s ILE 220 CO -0.08 0.42 0.39 -1.54 0.00 0.00 0.00 174.94 174.13 2wqx n SER 221 N 3.78 0.71 -3.70 3.58 3.41 -1.26 -4.80 113.62 115.34 2wqx n SER 221 Ca -0.16 -0.86 -0.24 0.00 -0.26 0.00 0.00 58.87 57.36 2wqx n SER 221 Cb 0.52 0.61 -0.17 0.00 -0.26 0.00 0.00 64.21 64.91 2wqx n SER 221 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2wqx s ASP 222 N -1.07 1.86 0.00 4.04 2.15 -1.26 -0.02 116.67 122.38 2wqx s ASP 222 Ca 0.04 -0.29 0.24 0.00 0.43 0.00 0.00 52.55 52.97 2wqx s ASP 222 Cb 0.04 -0.33 0.44 0.00 -0.30 0.00 0.00 42.92 42.77 2wqx s ASP 222 CO 0.15 -0.27 1.40 0.18 -0.17 0.00 0.00 175.17 176.46 2wqx n LEU 223 N 5.21 2.72 -0.26 -1.34 4.77 -0.47 -4.49 117.00 123.13 2wqx n LEU 223 Ca -0.06 -0.99 0.07 0.00 -0.03 0.00 0.00 56.01 55.01 2wqx n LEU 223 Cb 0.49 -0.06 0.21 0.00 -2.33 0.00 0.00 43.42 41.73 2wqx n LEU 223 CO 0.09 0.49 0.94 0.03 -1.33 0.00 0.00 177.39 177.62 2wqx h ARG 224 N 4.05 0.26 -0.62 3.23 3.08 -1.75 0.12 114.38 122.75 2wqx h ARG 224 Ca 0.00 -0.02 0.18 0.00 0.07 0.00 0.00 59.98 60.21 2wqx h ARG 224 Cb 0.87 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 2wqx h ARG 224 CO 0.00 0.17 0.60 0.00 -1.07 0.00 0.00 179.97 179.67 2wqx h ALA 225 N 1.66 2.41 -0.01 0.04 0.00 -1.89 -2.16 119.26 119.30 2wqx h ALA 225 Ca 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2wqx h ALA 225 Cb 0.81 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2wqx h ALA 225 CO -0.55 -0.92 -0.19 1.28 0.00 0.00 0.00 179.25 178.88 2wqx n LEU 226 N -3.79 1.25 0.23 0.00 4.77 0.43 -3.81 117.00 116.08 2wqx n LEU 226 Ca 0.12 -0.37 0.08 0.00 -0.03 0.00 0.00 56.01 55.81 2wqx n LEU 226 Cb 0.83 -0.08 0.55 0.00 -2.33 0.00 0.00 43.42 42.39 2wqx n LEU 226 CO 0.30 0.22 0.88 0.08 -1.33 0.00 0.00 177.39 177.54 2wqx h ARG 227 N 1.67 0.00 -0.13 3.23 0.11 -1.44 -2.78 114.38 115.02 2wqx h ARG 227 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2wqx h ARG 227 Cb 0.53 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.61 2wqx h ARG 227 CO 0.00 0.21 0.00 0.41 0.10 0.00 0.00 179.97 180.69 2wqx n GLY 228 N -0.71 0.18 2.66 0.08 0.00 -1.26 -4.68 105.19 101.46 2wqx n GLY 228 Ca -0.02 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 2wqx n GLY 228 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wqx n LEU 229 N 0.24 7.33 0.00 0.99 4.77 -1.05 -4.71 117.00 124.57 2wqx n LEU 229 Ca 0.17 -4.50 0.10 0.00 -0.03 0.00 0.00 56.01 51.74 2wqx n LEU 229 Cb 0.32 -1.52 0.54 0.00 -2.33 0.00 0.00 43.42 40.43 2wqx n LEU 229 CO 0.13 1.55 0.83 2.29 -1.33 0.00 0.00 177.39 180.86 2wqx n LYS 230 N 4.04 0.34 -0.33 3.23 2.85 -1.26 -2.65 118.16 124.38 2wqx n LYS 230 Ca 0.54 0.08 0.12 0.00 -1.05 0.00 0.00 58.31 57.99 2wqx n LYS 230 Cb 0.33 -1.50 0.30 0.00 -0.65 0.00 0.00 35.03 33.51 2wqx n LYS 230 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2wqx n ASN 231 N -1.25 3.74 -4.72 -5.58 3.02 -1.26 -4.18 115.26 105.03 2wqx n ASN 231 Ca 0.11 -2.00 -0.42 0.00 -0.03 0.00 0.00 54.58 52.24 2wqx n ASN 231 Cb 0.15 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 38.86 2wqx n ASN 231 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2wqx s LEU 232 N -1.09 4.37 -0.19 3.41 1.43 -1.08 -4.44 118.68 121.08 2wqx s LEU 232 Ca 0.46 2.68 0.07 0.00 -1.03 0.00 0.00 54.13 56.31 2wqx s LEU 232 Cb 0.24 -3.60 -0.16 0.00 0.03 0.00 0.00 46.19 42.70 2wqx s LEU 232 CO 0.32 -0.84 -0.09 0.47 0.23 0.00 0.00 176.35 176.44 2wqx n ASP 233 N 3.65 1.82 -3.90 2.29 8.00 0.26 -0.47 116.55 128.21 2wqx n ASP 233 Ca 0.13 -0.07 -0.24 0.00 0.71 0.00 0.00 54.79 55.32 2wqx n ASP 233 Cb 0.38 0.14 -0.17 0.00 -0.02 0.00 0.00 41.12 41.46 2wqx n ASP 233 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2wqx s VAL 234 N -2.41 0.81 -0.04 2.53 1.01 -0.22 -4.45 120.40 117.63 2wqx s VAL 234 Ca -0.21 -0.20 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 2wqx s VAL 234 Cb 0.06 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.64 2wqx s VAL 234 CO 0.56 0.31 0.01 -0.22 0.00 0.00 0.00 175.10 175.76 2wqx s LEU 235 N 1.39 0.96 -0.08 3.92 2.96 -1.26 -1.39 118.68 125.17 2wqx s LEU 235 Ca -0.02 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.90 2wqx s LEU 235 Cb -0.13 -0.23 0.01 0.00 0.50 0.00 0.00 46.19 46.33 2wqx s LEU 235 CO -0.03 -0.13 -0.18 -1.61 -1.32 0.00 0.00 176.35 173.07 2wqx s GLU 236 N 1.29 2.29 -0.02 1.98 2.02 -0.71 -4.42 118.70 121.12 2wqx s GLU 236 Ca -0.06 -0.64 0.03 0.00 0.02 0.00 0.00 54.97 54.32 2wqx s GLU 236 Cb -0.13 -1.81 0.05 0.00 0.10 0.00 0.00 34.13 32.34 2wqx s GLU 236 CO -0.02 0.12 0.91 1.28 0.02 0.00 0.00 175.26 177.57 2wqx n LEU 237 N 3.60 0.56 -4.76 1.80 4.77 -1.26 -0.62 117.00 121.10 2wqx n LEU 237 Ca -0.21 -1.21 -0.39 0.00 -0.03 0.00 0.00 56.01 54.17 2wqx n LEU 237 Cb 0.52 -0.07 0.02 0.00 -2.33 0.00 0.00 43.42 41.56 2wqx n LEU 237 CO 0.26 0.29 1.01 -0.36 -1.33 0.00 0.00 177.39 177.26 2wqx s PHE 238 N -0.58 2.46 -1.01 -1.77 0.40 -1.21 -3.68 117.98 112.60 2wqx s PHE 238 Ca 0.06 1.34 -0.07 0.00 -0.60 0.00 0.00 56.93 57.66 2wqx s PHE 238 Cb 0.05 -3.81 -0.05 0.00 0.51 0.00 0.00 43.02 39.72 2wqx s PHE 238 CO 0.01 -2.72 0.86 0.43 0.70 0.00 0.00 175.22 174.49 2wqx n SER 239 N -0.51 -6.64 -4.83 1.36 7.64 -0.95 0.19 113.62 109.89 2wqx n SER 239 Ca 0.07 -0.65 -0.36 0.00 1.01 0.00 0.00 58.87 58.94 2wqx n SER 239 Cb 0.44 -4.93 -0.06 0.00 -1.01 0.00 0.00 64.21 58.64 2wqx n SER 239 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2wqx s GLN 240 N -4.39 4.15 -0.23 1.43 -1.52 -0.52 -2.49 119.66 116.09 2wqx s GLN 240 Ca 0.38 0.73 0.02 0.00 -1.95 0.00 0.00 55.36 54.54 2wqx s GLN 240 Cb -0.06 -2.86 0.04 0.00 -0.22 0.00 0.00 33.01 29.91 2wqx s GLN 240 CO 0.76 0.40 -0.15 -1.21 -0.25 0.00 0.00 175.29 174.85 2wqx s GLU 241 N -2.05 2.55 -0.05 2.91 2.02 -0.13 -0.42 118.70 123.53 2wqx s GLU 241 Ca 0.42 -1.14 -0.01 0.00 0.02 0.00 0.00 54.97 54.26 2wqx s GLU 241 Cb -0.16 -2.76 -0.04 0.00 0.10 0.00 0.00 34.13 31.27 2wqx s GLU 241 CO 0.20 -0.42 0.04 0.00 0.02 0.00 0.00 175.26 175.09 2wqx s ALA 242 N 1.18 3.42 -0.19 5.21 0.00 0.90 -4.21 121.76 128.07 2wqx s ALA 242 Ca -0.03 -0.83 0.01 0.00 0.00 0.00 0.00 51.96 51.10 2wqx s ALA 242 Cb -0.17 -1.53 0.04 0.00 0.00 0.00 0.00 23.12 21.45 2wqx s ALA 242 CO -0.08 0.63 -0.12 -1.17 0.00 0.00 0.00 175.76 175.01 2wqx s LEU 243 N -1.24 2.23 0.54 0.00 2.96 -1.26 -0.87 118.68 121.03 2wqx s LEU 243 Ca 0.17 -0.82 -0.17 0.00 -0.22 0.00 0.00 54.13 53.09 2wqx s LEU 243 Cb -0.12 -1.28 -0.06 0.00 0.50 0.00 0.00 46.19 45.23 2wqx s LEU 243 CO 0.07 -0.11 1.03 0.20 -1.32 0.00 0.00 176.35 176.22 2wqx s ASN 244 N 1.38 6.18 0.47 3.68 0.01 0.48 -4.96 114.94 122.19 2wqx s ASN 244 Ca 0.00 1.77 -0.23 0.00 -0.71 0.00 0.00 52.86 53.70 2wqx s ASN 244 Cb -0.15 -2.53 -0.07 0.00 0.41 0.00 0.00 41.25 38.90 2wqx s ASN 244 CO -0.09 -0.89 1.18 -0.54 -1.51 0.00 0.00 177.10 175.24 2wqx s LYS 245 N -3.83 3.67 0.52 -0.60 1.02 -1.26 -4.35 119.74 114.90 2wqx s LYS 245 Ca 0.63 1.80 -0.23 0.00 0.02 0.00 0.00 55.97 58.19 2wqx s LYS 245 Cb -0.14 -2.36 -0.06 0.00 -0.52 0.00 0.00 37.83 34.75 2wqx s LYS 245 CO 0.30 -0.63 1.34 -2.14 -0.92 0.00 0.00 175.35 173.31 2wqx s PRO 246 N -2.76 3.33 0.34 -1.68 0.02 -1.26 -4.66 135.00 128.33 2wqx s PRO 246 Ca 0.65 2.20 0.04 0.00 0.02 0.00 0.00 61.00 63.91 2wqx s PRO 246 Cb -0.29 -2.35 -0.06 0.00 0.02 0.00 0.00 34.50 31.82 2wqx s PRO 246 CO 0.35 -1.03 0.07 0.96 -0.33 0.00 0.00 177.00 177.02 2wqx s ILE 247 N -1.32 1.09 0.20 2.83 -4.36 -1.05 -4.99 121.20 113.60 2wqx s ILE 247 Ca 0.68 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.77 2wqx s ILE 247 Cb -0.39 -2.71 -0.08 0.00 1.25 0.00 0.00 42.46 40.53 2wqx s ILE 247 CO 0.47 0.00 0.98 0.20 0.24 0.00 0.00 174.94 176.84 2wqx s ASN 248 N -3.51 7.52 0.44 4.36 0.01 -1.26 -0.56 114.94 121.94 2wqx s ASN 248 Ca 0.34 1.96 -0.25 0.00 -0.71 0.00 0.00 52.86 54.20 2wqx s ASN 248 Cb 0.08 -2.61 -0.09 0.00 0.41 0.00 0.00 41.25 39.04 2wqx s ASN 248 CO 0.15 0.02 1.30 1.57 -1.51 0.00 0.00 177.10 178.63 2wqx n HIS 249 N 1.91 2.22 -4.03 2.20 -0.00 0.39 -4.73 115.22 113.19 2wqx n HIS 249 Ca -0.00 0.48 -0.11 0.00 -0.00 0.00 0.00 57.72 58.08 2wqx n HIS 249 Cb 0.47 -2.39 -0.11 0.00 -0.00 0.00 0.00 29.99 27.96 2wqx n HIS 249 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 2wqx s GLN 250 N -2.33 0.42 0.34 1.57 -1.52 -1.26 -4.98 119.66 111.91 2wqx s GLN 250 Ca 0.62 -0.67 0.06 0.00 -1.95 0.00 0.00 55.36 53.42 2wqx s GLN 250 Cb -0.49 -0.12 0.60 0.00 -0.22 0.00 0.00 33.01 32.78 2wqx s GLN 250 CO 0.57 0.01 1.83 0.66 -0.25 0.00 0.00 175.29 178.11 2wqx h SER 251 N 4.63 0.38 -4.04 5.90 4.64 -1.91 -3.32 113.55 119.82 2wqx h SER 251 Ca -0.34 -0.09 -0.67 0.00 -0.47 0.00 0.00 61.79 60.22 2wqx h SER 251 Cb 1.21 -0.10 -0.38 0.00 -0.31 0.00 0.00 62.40 62.82 2wqx h SER 251 CO 0.41 0.55 -0.54 0.20 -0.87 0.00 0.00 176.83 176.58 2wqx s ASN 252 N -6.81 4.86 0.01 4.97 0.01 -1.26 0.12 114.94 116.84 2wqx s ASN 252 Ca -0.06 -2.66 -0.14 0.00 -0.71 0.00 0.00 52.86 49.28 2wqx s ASN 252 Cb 0.15 -1.74 -0.06 0.00 0.41 0.00 0.00 41.25 40.01 2wqx s ASN 252 CO 0.76 -0.35 0.41 -0.22 -1.51 0.00 0.00 177.10 176.19 2wqx s LEU 253 N 0.21 4.46 -0.07 0.60 2.96 -0.21 -4.95 118.68 121.68 2wqx s LEU 253 Ca 0.15 0.95 -0.00 0.00 -0.22 0.00 0.00 54.13 55.00 2wqx s LEU 253 Cb -0.22 -2.65 0.03 0.00 0.50 0.00 0.00 46.19 43.84 2wqx s LEU 253 CO -0.03 0.30 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.59 2wqx s VAL 254 N -1.13 0.51 -0.07 1.68 1.01 -1.26 -1.84 120.40 119.31 2wqx s VAL 254 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.23 2wqx s VAL 254 Cb -0.16 -0.61 0.02 0.00 0.00 0.00 0.00 36.38 35.63 2wqx s VAL 254 CO 0.14 0.27 -0.05 -0.69 0.00 0.00 0.00 175.10 174.77 2wqx s VAL 255 N 1.62 0.68 0.15 2.92 1.01 0.31 -4.98 120.40 122.11 2wqx s VAL 255 Ca 0.00 -0.13 -0.31 0.00 0.00 0.00 0.00 61.98 61.54 2wqx s VAL 255 Cb -0.13 -0.73 -0.11 0.00 0.00 0.00 0.00 36.38 35.42 2wqx s VAL 255 CO -0.04 0.29 1.76 -2.84 0.00 0.00 0.00 175.10 174.26 2wqx s PRO 256 N 1.39 4.14 0.26 2.72 0.02 -1.26 -0.64 135.00 141.63 2wqx s PRO 256 Ca -0.03 2.56 -0.30 0.00 0.02 0.00 0.00 61.00 63.25 2wqx s PRO 256 Cb -0.13 -3.38 -0.10 0.00 0.02 0.00 0.00 34.50 30.90 2wqx s PRO 256 CO -0.03 -0.78 1.45 1.21 -0.33 0.00 0.00 177.00 178.52 2wqx s ASN 257 N 2.04 6.63 0.00 2.53 3.84 -0.23 -4.88 114.94 124.87 2wqx s ASN 257 Ca 0.77 2.70 0.00 0.00 0.21 0.00 0.00 52.86 56.54 2wqx s ASN 257 Cb -0.46 -2.63 0.00 0.00 -0.55 0.00 0.00 41.25 37.61 2wqx s ASN 257 CO 0.34 -0.72 0.64 0.35 -2.79 0.00 0.00 177.10 174.92 2wqx n THR 258 N 2.27 0.29 -2.99 -5.21 -2.24 -1.26 -4.98 114.28 100.17 2wqx n THR 258 Ca 0.07 -0.64 -0.41 0.00 -2.27 0.00 0.00 64.05 60.80 2wqx n THR 258 Cb 0.40 0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 69.44 2wqx n THR 258 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2wqx s VAL 259 N -0.29 4.97 -0.04 2.28 1.01 -1.26 -4.66 120.40 122.40 2wqx s VAL 259 Ca 0.00 1.48 0.02 0.00 0.00 0.00 0.00 61.98 63.47 2wqx s VAL 259 Cb 0.00 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 32.33 2wqx s VAL 259 CO 0.00 0.12 -0.07 -0.54 0.00 0.00 0.00 175.10 174.62 2wqx s LYS 260 N 1.64 0.95 1.11 2.72 1.02 0.97 -0.15 119.74 127.99 2wqx s LYS 260 Ca 0.36 -0.19 -0.19 0.00 0.02 0.00 0.00 55.97 55.97 2wqx s LYS 260 Cb -0.17 -0.90 0.26 0.00 -0.52 0.00 0.00 37.83 36.51 2wqx s LYS 260 CO 0.14 -0.01 1.26 1.21 -0.92 0.00 0.00 175.35 177.02 2wqx s ASN 261 N 0.65 1.81 0.50 2.83 3.84 0.41 -1.37 114.94 123.61 2wqx s ASN 261 Ca -0.10 0.29 0.18 0.00 0.21 0.00 0.00 52.86 53.45 2wqx s ASN 261 Cb -0.13 -0.31 1.24 0.00 -0.55 0.00 0.00 41.25 41.51 2wqx s ASN 261 CO 0.01 -3.54 2.09 0.71 -2.79 0.00 0.00 177.10 173.57 2wqx h THR 262 N -2.20 0.95 -0.01 -5.21 1.35 -1.89 0.45 112.91 106.36 2wqx h THR 262 Ca -0.43 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 2wqx h THR 262 Cb 1.24 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.85 2wqx h THR 262 CO 0.30 0.09 -0.00 -0.90 -0.25 0.00 0.00 175.52 174.76 2wqx n ASP 263 N -4.26 0.84 0.00 5.36 5.75 -1.26 -4.32 116.55 118.66 2wqx n ASP 263 Ca -0.03 -1.27 0.00 0.00 -0.01 0.00 0.00 54.79 53.48 2wqx n ASP 263 Cb 0.17 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 2wqx n ASP 263 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wqx n GLY 264 N 1.10 2.34 3.74 6.12 0.00 0.15 -5.04 105.19 113.60 2wqx n GLY 264 Ca 0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2wqx n GLY 264 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wqx s SER 265 N -1.82 4.90 0.14 1.61 1.04 -1.26 -4.49 113.70 113.81 2wqx s SER 265 Ca 0.00 2.50 -0.30 0.00 0.48 0.00 0.00 55.95 58.63 2wqx s SER 265 Cb 0.00 -2.61 -0.07 0.00 0.10 0.00 0.00 66.02 63.45 2wqx s SER 265 CO 0.00 -1.80 1.01 -0.76 0.98 0.00 0.00 173.24 172.67 2wqx s LEU 266 N -4.23 4.51 -0.26 2.42 1.43 -1.26 -0.45 118.68 120.85 2wqx s LEU 266 Ca 0.80 1.90 -0.26 0.00 -1.03 0.00 0.00 54.13 55.54 2wqx s LEU 266 Cb -0.34 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.29 2wqx s LEU 266 CO 0.36 -0.10 0.88 -0.69 0.23 0.00 0.00 176.35 177.03 2wqx s VAL 267 N -0.15 4.77 0.23 -1.59 1.01 0.79 -4.88 120.40 120.58 2wqx s VAL 267 Ca 0.47 1.61 -0.32 0.00 0.00 0.00 0.00 61.98 63.75 2wqx s VAL 267 Cb -0.25 -4.18 -0.12 0.00 0.00 0.00 0.00 36.38 31.82 2wqx s VAL 267 CO 0.32 -0.15 1.66 0.41 0.00 0.00 0.00 175.10 177.33 2wqx n THR 268 N 5.36 0.33 -1.63 3.92 -1.04 -1.26 -4.83 114.28 115.12 2wqx n THR 268 Ca 0.07 -0.08 -0.32 0.00 -2.04 0.00 0.00 64.05 61.68 2wqx n THR 268 Cb 0.47 -1.90 0.06 0.00 -1.82 0.00 0.00 70.33 67.14 2wqx n THR 268 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2wqx s PRO 269 N 0.59 2.72 -0.22 -2.82 0.02 -1.26 -4.56 135.00 129.48 2wqx s PRO 269 Ca 0.72 1.26 0.08 0.00 0.02 0.00 0.00 61.00 63.07 2wqx s PRO 269 Cb -0.53 -1.95 -0.18 0.00 0.02 0.00 0.00 34.50 31.85 2wqx s PRO 269 CO 0.38 -1.29 -0.10 -1.91 -0.33 0.00 0.00 177.00 173.75 2wqx n GLU 270 N -2.76 0.74 -3.78 5.54 2.13 0.51 -4.94 120.64 118.09 2wqx n GLU 270 Ca 0.09 0.08 -0.16 0.00 0.66 0.00 0.00 57.16 57.84 2wqx n GLU 270 Cb 0.53 -1.48 -0.16 0.00 0.27 0.00 0.00 31.44 30.60 2wqx n GLU 270 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2wqx s ILE 271 N -2.47 -0.04 -0.09 6.31 1.01 -1.02 -4.98 121.20 119.93 2wqx s ILE 271 Ca -0.23 0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.65 2wqx s ILE 271 Cb 0.07 -0.11 -0.02 0.00 0.01 0.00 0.00 42.46 42.41 2wqx s ILE 271 CO 0.63 0.10 -0.12 -0.63 0.00 0.00 0.00 174.94 174.92 2wqx s ILE 272 N 1.17 3.19 0.94 2.92 1.01 -1.26 -0.11 121.20 129.06 2wqx s ILE 272 Ca -0.08 -0.65 -0.12 0.00 0.00 0.00 0.00 60.65 59.81 2wqx s ILE 272 Cb -0.13 -2.30 0.16 0.00 0.01 0.00 0.00 42.46 40.20 2wqx s ILE 272 CO -0.03 0.56 1.09 -0.94 0.00 0.00 0.00 174.94 175.62 2wqx s SER 273 N -0.27 3.06 -1.58 3.58 1.04 -0.39 -4.00 113.70 115.14 2wqx s SER 273 Ca 0.02 1.45 -0.06 0.00 0.48 0.00 0.00 55.95 57.84 2wqx s SER 273 Cb -0.13 -2.12 0.05 0.00 0.10 0.00 0.00 66.02 63.92 2wqx s SER 273 CO 0.03 -2.89 0.28 0.47 0.98 0.00 0.00 173.24 172.11 2wqx n ASP 274 N -4.05 -0.25 -2.24 7.02 8.00 -1.26 -1.27 116.55 122.50 2wqx n ASP 274 Ca 0.06 -1.18 -0.17 0.00 0.71 0.00 0.00 54.79 54.22 2wqx n ASP 274 Cb 0.55 -2.09 -0.02 0.00 -0.02 0.00 0.00 41.12 39.55 2wqx n ASP 274 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2wqx n ASP 275 N -2.82 -4.86 -4.71 -2.24 2.03 -1.26 -4.76 116.55 97.94 2wqx n ASP 275 Ca -0.21 0.15 -0.29 0.00 0.52 0.00 0.00 54.79 54.95 2wqx n ASP 275 Cb 0.64 -4.13 0.15 0.00 -0.72 0.00 0.00 41.12 37.06 2wqx n ASP 275 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2wqx s GLY 276 N -2.11 1.59 0.32 0.27 0.00 -0.39 -4.82 107.32 102.17 2wqx s GLY 276 Ca 0.00 -0.25 0.05 0.00 0.00 0.00 0.00 44.72 44.52 2wqx s GLY 276 CO 0.00 0.30 0.22 0.51 0.00 0.00 0.00 173.10 174.13 2wqx s ASP 277 N -3.50 1.66 -0.04 1.64 1.47 -0.28 -4.75 116.67 112.87 2wqx s ASP 277 Ca 0.64 -1.67 0.03 0.00 1.18 0.00 0.00 52.55 52.73 2wqx s ASP 277 Cb -0.18 0.50 0.00 0.00 -0.34 0.00 0.00 42.92 42.91 2wqx s ASP 277 CO 0.57 -0.99 -0.13 -0.47 0.68 0.00 0.00 175.17 174.83 2wqx s TYR 278 N -3.52 1.36 -0.33 2.11 5.04 -1.26 -1.29 117.35 119.46 2wqx s TYR 278 Ca 0.37 -0.40 -0.01 0.00 -2.44 0.00 0.00 57.07 54.59 2wqx s TYR 278 Cb 0.03 -0.95 0.11 0.00 0.35 0.00 0.00 41.96 41.51 2wqx s TYR 278 CO 0.22 -0.16 0.15 -2.00 -1.34 0.00 0.00 175.55 172.42 2wqx s GLU 279 N 0.23 0.60 -0.00 4.97 2.12 0.70 -5.01 118.70 122.30 2wqx s GLU 279 Ca -0.06 -1.10 -0.37 0.00 0.36 0.00 0.00 54.97 53.81 2wqx s GLU 279 Cb -0.11 -1.64 -0.16 0.00 0.26 0.00 0.00 34.13 32.48 2wqx s GLU 279 CO 0.02 -1.07 1.50 1.17 -0.54 0.00 0.00 175.26 176.34 2wqx n LYS 280 N 4.61 1.34 -0.45 4.30 4.81 -1.26 -0.62 118.16 130.89 2wqx n LYS 280 Ca 0.01 0.49 0.11 0.00 -0.87 0.00 0.00 58.31 58.05 2wqx n LYS 280 Cb 0.40 -2.17 0.33 0.00 0.02 0.00 0.00 35.03 33.61 2wqx n LYS 280 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2wqx n PRO 281 N 3.60 3.00 -4.48 1.64 -0.04 -1.26 -5.11 135.00 132.35 2wqx n PRO 281 Ca 0.20 -2.67 -0.33 0.00 -0.04 0.00 0.00 63.50 60.66 2wqx n PRO 281 Cb 0.19 -1.67 -0.10 0.00 -0.04 0.00 0.00 33.50 31.88 2wqx n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2wqx s ASN 282 N -0.96 4.67 0.00 3.54 0.02 0.21 -1.06 114.94 121.35 2wqx s ASN 282 Ca 0.49 -0.10 -0.09 0.00 -1.02 0.00 0.00 52.86 52.13 2wqx s ASN 282 Cb 0.28 -1.12 -0.05 0.00 0.02 0.00 0.00 41.25 40.37 2wqx s ASN 282 CO 0.30 0.30 0.31 -0.69 0.02 0.00 0.00 177.10 177.34 2wqx s VAL 283 N -0.96 5.22 -0.00 1.60 1.01 0.19 -0.21 120.40 127.24 2wqx s VAL 283 Ca 0.16 0.41 0.01 0.00 0.00 0.00 0.00 61.98 62.56 2wqx s VAL 283 Cb -0.11 -3.59 -0.00 0.00 0.00 0.00 0.00 36.38 32.67 2wqx s VAL 283 CO 0.06 0.44 -0.05 -0.54 0.00 0.00 0.00 175.10 175.02 2wqx s LYS 284 N -1.50 0.39 -0.01 2.72 1.02 -0.41 -0.53 119.74 121.42 2wqx s LYS 284 Ca 0.26 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.08 2wqx s LYS 284 Cb -0.14 -0.38 0.01 0.00 -0.52 0.00 0.00 37.83 36.80 2wqx s LYS 284 CO 0.14 0.10 -0.01 -1.58 -0.92 0.00 0.00 175.35 173.08 2wqx s TRP 285 N -0.10 0.17 -0.45 3.18 0.51 -0.76 -1.13 118.94 120.36 2wqx s TRP 285 Ca 0.02 0.00 -0.21 0.00 -2.12 0.00 0.00 56.10 53.79 2wqx s TRP 285 Cb -0.02 -0.19 0.03 0.00 -0.81 0.00 0.00 33.47 32.48 2wqx s TRP 285 CO -0.00 -0.05 0.69 -1.58 -0.51 0.00 0.00 176.95 175.50 2wqx s HIS 286 N 0.38 3.03 -0.75 -1.98 5.65 -1.26 -1.04 115.29 119.33 2wqx s HIS 286 Ca -0.03 -0.04 0.04 0.00 0.25 0.00 0.00 55.06 55.27 2wqx s HIS 286 Cb -0.06 -3.48 0.26 0.00 -1.18 0.00 0.00 32.58 28.13 2wqx s HIS 286 CO -0.01 -0.94 0.90 1.28 -0.65 0.00 0.00 174.74 175.32 2wqx n LEU 287 N 6.43 4.32 0.08 8.88 4.77 0.31 -4.95 117.00 136.85 2wqx n LEU 287 Ca -0.01 -5.38 0.20 0.00 -0.03 0.00 0.00 56.01 50.79 2wqx n LEU 287 Cb 0.48 -0.82 0.75 0.00 -2.33 0.00 0.00 43.42 41.50 2wqx n LEU 287 CO 0.55 1.95 1.18 1.55 -1.33 0.00 0.00 177.39 181.30 2wqx h PRO 288 N 4.55 0.00 -6.26 3.23 0.13 -1.91 -3.37 132.00 128.37 2wqx h PRO 288 Ca 0.20 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.75 2wqx h PRO 288 Cb 0.66 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 31.68 2wqx h PRO 288 CO 0.94 0.00 -0.67 -1.21 -0.23 0.00 0.00 178.00 176.83 2wqx s GLU 289 N -4.69 2.19 0.34 0.86 8.01 -1.26 -4.99 118.70 119.16 2wqx s GLU 289 Ca -0.04 -1.41 -0.29 0.00 0.01 0.00 0.00 54.97 53.24 2wqx s GLU 289 Cb 0.16 -2.13 -0.12 0.00 -4.31 0.00 0.00 34.13 27.73 2wqx s GLU 289 CO 0.58 0.38 1.42 0.34 0.01 0.00 0.00 175.26 177.99 2wqx n PHE 290 N -0.64 2.63 -4.01 1.61 7.35 -1.26 -5.01 117.46 118.12 2wqx n PHE 290 Ca -0.07 0.46 -0.08 0.00 -0.76 0.00 0.00 57.45 56.99 2wqx n PHE 290 Cb 0.58 -2.49 -0.11 0.00 0.35 0.00 0.00 39.48 37.82 2wqx n PHE 290 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 2wqx s THR 291 N -0.85 0.15 -2.42 -2.13 -1.32 -1.26 -5.07 115.64 102.73 2wqx s THR 291 Ca 0.57 -1.24 0.28 0.00 -1.21 0.00 0.00 61.69 60.10 2wqx s THR 291 Cb -0.53 -0.75 0.59 0.00 -1.51 0.00 0.00 72.50 70.30 2wqx s THR 291 CO 0.60 -0.68 1.80 -0.46 -2.21 0.00 0.00 174.62 173.67 2wqx n ASN 292 N 1.02 1.31 -3.61 8.08 0.23 -1.26 -4.64 115.26 116.38 2wqx n ASN 292 Ca -0.20 -1.43 -0.09 0.00 -0.53 0.00 0.00 54.58 52.34 2wqx n ASN 292 Cb 0.57 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.22 2wqx n ASN 292 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 2wqx s GLU 293 N -2.01 0.47 0.36 -3.83 2.12 -1.26 -0.99 118.70 113.56 2wqx s GLU 293 Ca 0.39 0.31 0.05 0.00 0.36 0.00 0.00 54.97 56.08 2wqx s GLU 293 Cb 0.21 0.22 -0.07 0.00 0.26 0.00 0.00 34.13 34.76 2wqx s GLU 293 CO 0.34 -0.11 0.04 0.14 -0.54 0.00 0.00 175.26 175.14 2wqx s VAL 294 N -0.45 1.41 0.28 3.70 -7.23 -0.99 -4.94 120.40 112.18 2wqx s VAL 294 Ca 0.02 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.05 2wqx s VAL 294 Cb -0.03 -2.82 0.01 0.00 0.56 0.00 0.00 36.38 34.10 2wqx s VAL 294 CO -0.04 0.00 0.57 -0.94 -0.31 0.00 0.00 175.10 174.38 2wqx s SER 295 N -3.58 -0.04 0.09 4.85 1.04 -1.26 -0.38 113.70 114.43 2wqx s SER 295 Ca 0.34 -0.92 -0.14 0.00 0.48 0.00 0.00 55.95 55.71 2wqx s SER 295 Cb 0.09 0.66 0.03 0.00 0.10 0.00 0.00 66.02 66.89 2wqx s SER 295 CO 0.16 -1.27 0.34 0.72 0.98 0.00 0.00 173.24 174.18 2wqx s PHE 296 N -3.73 -0.13 -0.00 5.02 -0.12 -0.66 -1.26 117.98 117.10 2wqx s PHE 296 Ca 0.19 -0.13 0.08 0.00 -0.05 0.00 0.00 56.93 57.02 2wqx s PHE 296 Cb -0.03 0.16 -0.02 0.00 -0.63 0.00 0.00 43.02 42.50 2wqx s PHE 296 CO 0.10 -0.61 -0.25 0.42 -0.05 0.00 0.00 175.22 174.82 2wqx s ILE 297 N -3.36 2.13 0.11 -4.49 1.01 0.84 -0.64 121.20 116.81 2wqx s ILE 297 Ca 0.00 -1.17 0.04 0.00 0.00 0.00 0.00 60.65 59.53 2wqx s ILE 297 Cb 0.02 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.68 2wqx s ILE 297 CO -0.09 0.52 -0.11 0.72 0.00 0.00 0.00 174.94 175.98 2wqx s PHE 298 N -0.67 1.18 -0.21 3.97 -0.12 -0.44 -0.36 117.98 121.32 2wqx s PHE 298 Ca 0.11 -0.65 -0.15 0.00 -0.05 0.00 0.00 56.93 56.19 2wqx s PHE 298 Cb -0.10 -0.63 0.06 0.00 -0.63 0.00 0.00 43.02 41.72 2wqx s PHE 298 CO 0.00 0.05 0.53 -0.47 -0.05 0.00 0.00 175.22 175.28 2wqx s TYR 299 N -2.55 -0.71 -0.09 3.49 5.04 -1.26 -1.79 117.35 119.48 2wqx s TYR 299 Ca 0.09 1.56 -0.03 0.00 -2.44 0.00 0.00 57.07 56.24 2wqx s TYR 299 Cb -0.02 0.33 0.05 0.00 0.35 0.00 0.00 41.96 42.67 2wqx s TYR 299 CO 0.01 -0.36 0.16 -1.14 -1.34 0.00 0.00 175.55 172.87 2wqx s GLN 300 N 1.00 0.04 0.07 4.97 2.00 0.13 -4.92 119.66 122.94 2wqx s GLN 300 Ca -0.06 0.53 -0.31 0.00 -2.00 0.00 0.00 55.36 53.53 2wqx s GLN 300 Cb -0.06 -0.35 -0.06 0.00 0.80 0.00 0.00 33.01 33.34 2wqx s GLN 300 CO -0.09 -0.33 1.29 -1.25 -0.50 0.00 0.00 175.29 174.41 2wqx s PRO 301 N 2.29 4.37 0.12 1.67 0.04 -1.26 -1.64 135.00 140.58 2wqx s PRO 301 Ca 0.03 1.89 0.10 0.00 0.04 0.00 0.00 61.00 63.07 2wqx s PRO 301 Cb -0.12 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.03 2wqx s PRO 301 CO -0.06 -0.37 -0.25 0.14 0.04 0.00 0.00 177.00 176.50 2wqx s VAL 302 N 1.29 2.09 -0.13 -0.36 -7.23 0.28 -4.95 120.40 111.38 2wqx s VAL 302 Ca 0.61 -1.67 0.02 0.00 -1.81 0.00 0.00 61.98 59.13 2wqx s VAL 302 Cb -0.32 -1.85 0.01 0.00 0.56 0.00 0.00 36.38 34.78 2wqx s VAL 302 CO 0.29 0.06 -0.19 -0.89 -0.31 0.00 0.00 175.10 174.06 2wqx s THR 303 N -1.07 1.82 -0.06 5.32 2.01 -1.26 -0.91 115.64 121.49 2wqx s THR 303 Ca 0.12 -0.83 0.01 0.00 0.31 0.00 0.00 61.69 61.29 2wqx s THR 303 Cb -0.10 -1.64 0.02 0.00 0.01 0.00 0.00 72.50 70.79 2wqx s THR 303 CO 0.05 0.50 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.79 2wqx s ILE 304 N 0.95 0.77 0.00 1.82 1.01 -0.01 -5.00 121.20 120.74 2wqx s ILE 304 Ca -0.05 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.36 2wqx s ILE 304 Cb -0.15 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 41.55 2wqx s ILE 304 CO -0.03 0.29 0.00 0.61 0.00 0.00 0.00 174.94 175.81 2wqx n GLY 305 N 4.22 2.63 1.26 6.18 0.00 -1.26 -0.41 105.19 117.82 2wqx n GLY 305 Ca -0.21 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.65 2wqx n GLY 305 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wqx n LYS 306 N 13.19 2.70 -4.30 1.61 5.02 0.38 -4.94 118.16 131.81 2wqx n LYS 306 Ca 0.00 -2.56 -0.32 0.00 -2.02 0.00 0.00 58.31 53.41 2wqx n LYS 306 Cb 0.00 -1.54 -0.09 0.00 -0.02 0.00 0.00 35.03 33.38 2wqx n LYS 306 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wqx s ALA 307 N -1.07 3.20 -0.05 7.82 0.00 0.45 -4.78 121.76 127.33 2wqx s ALA 307 Ca 0.45 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.47 2wqx s ALA 307 Cb 0.24 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 2wqx s ALA 307 CO 0.32 0.65 -0.25 0.21 0.00 0.00 0.00 175.76 176.68 2wqx s LYS 308 N -1.66 2.49 0.13 0.00 2.20 -1.26 -0.83 119.74 120.81 2wqx s LYS 308 Ca 0.20 -0.91 -0.04 0.00 -0.36 0.00 0.00 55.97 54.87 2wqx s LYS 308 Cb -0.11 -2.14 -0.03 0.00 -1.51 0.00 0.00 37.83 34.04 2wqx s LYS 308 CO 0.11 0.40 0.12 0.00 -0.36 0.00 0.00 175.35 175.62 2wqx s ALA 309 N -0.22 0.54 -0.37 3.13 0.00 -0.09 -4.60 121.76 120.16 2wqx s ALA 309 Ca -0.02 -1.25 -0.08 0.00 0.00 0.00 0.00 51.96 50.62 2wqx s ALA 309 Cb -0.13 0.80 0.05 0.00 0.00 0.00 0.00 23.12 23.84 2wqx s ALA 309 CO 0.03 -0.52 0.16 1.03 0.00 0.00 0.00 175.76 176.46 2wqx s ARG 310 N -4.01 2.62 -0.30 0.00 0.52 -1.26 -0.56 118.95 115.96 2wqx s ARG 310 Ca 0.20 -1.26 -0.21 0.00 -0.52 0.00 0.00 55.73 53.94 2wqx s ARG 310 Cb 0.06 -3.58 -0.01 0.00 0.52 0.00 0.00 34.95 31.94 2wqx s ARG 310 CO -0.00 -0.76 0.65 0.12 0.02 0.00 0.00 175.30 175.33 2wqx s PHE 311 N 1.42 3.21 0.04 -0.53 5.36 -0.65 -3.32 117.98 123.50 2wqx s PHE 311 Ca 0.00 0.62 -0.21 0.00 -0.96 0.00 0.00 56.93 56.39 2wqx s PHE 311 Cb -0.20 -3.02 0.04 0.00 -0.34 0.00 0.00 43.02 39.50 2wqx s PHE 311 CO 0.03 -0.48 0.47 -3.38 -1.46 0.00 0.00 175.22 170.40 2wqx s HIS 312 N 2.66 -0.36 -1.86 10.12 -3.43 -1.24 0.17 115.29 121.35 2wqx s HIS 312 Ca 0.26 0.39 0.00 0.00 -0.80 0.00 0.00 55.06 54.91 2wqx s HIS 312 Cb -0.15 0.28 0.00 0.00 -1.43 0.00 0.00 32.58 31.29 2wqx s HIS 312 CO 0.12 -0.60 0.00 0.41 -2.00 0.00 0.00 174.74 172.66 2wqx n GLY 313 N 0.50 -1.29 3.19 -1.38 0.00 -0.74 -1.43 105.19 104.04 2wqx n GLY 313 Ca -0.19 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 44.74 2wqx n GLY 313 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wqx s ARG 314 N -0.75 0.89 -0.17 1.61 1.70 0.44 -1.33 118.95 121.34 2wqx s ARG 314 Ca 0.00 -1.24 0.01 0.00 -0.47 0.00 0.00 55.73 54.02 2wqx s ARG 314 Cb 0.00 -0.52 0.01 0.00 -0.57 0.00 0.00 34.95 33.87 2wqx s ARG 314 CO 0.00 0.07 -0.17 0.08 -1.08 0.00 0.00 175.30 174.19 2wqx s VAL 315 N -2.77 2.35 -0.17 4.99 1.01 0.19 -0.07 120.40 125.93 2wqx s VAL 315 Ca 0.09 -0.86 -0.07 0.00 0.00 0.00 0.00 61.98 61.14 2wqx s VAL 315 Cb -0.01 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 2wqx s VAL 315 CO -0.00 0.52 0.05 -0.89 0.00 0.00 0.00 175.10 174.78 2wqx s THR 316 N 1.11 4.73 -0.45 3.92 2.01 -0.05 -1.65 115.64 125.26 2wqx s THR 316 Ca 0.00 -0.06 0.01 0.00 0.31 0.00 0.00 61.69 61.95 2wqx s THR 316 Cb -0.14 -3.11 0.12 0.00 0.01 0.00 0.00 72.50 69.38 2wqx s THR 316 CO -0.07 0.49 0.21 -1.58 -0.69 0.00 0.00 174.62 172.98 2wqx s GLN 317 N 0.16 1.93 0.59 4.92 2.00 0.49 -0.38 119.66 129.38 2wqx s GLN 317 Ca 0.04 -2.12 -0.17 0.00 -2.00 0.00 0.00 55.36 51.11 2wqx s GLN 317 Cb -0.12 -3.44 -0.03 0.00 0.80 0.00 0.00 33.01 30.21 2wqx s GLN 317 CO 0.01 -1.06 1.11 -2.14 -0.50 0.00 0.00 175.29 172.71 2wqx s PRO 318 N 0.57 3.15 0.02 1.67 0.02 -1.26 -2.34 135.00 136.83 2wqx s PRO 318 Ca 0.12 1.46 0.07 0.00 0.02 0.00 0.00 61.00 62.67 2wqx s PRO 318 Cb -0.22 -1.99 -0.02 0.00 0.02 0.00 0.00 34.50 32.29 2wqx s PRO 318 CO -0.04 -0.98 -0.20 -0.51 -0.33 0.00 0.00 177.00 174.93 2wqx s LEU 319 N -4.30 2.12 -0.07 -5.54 1.43 -0.16 -2.53 118.68 109.64 2wqx s LEU 319 Ca 0.69 -0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.35 2wqx s LEU 319 Cb -0.21 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.98 2wqx s LEU 319 CO 0.34 0.19 -0.10 -0.75 0.23 0.00 0.00 176.35 176.26 2wqx s LYS 320 N -0.91 2.71 0.00 1.70 2.20 0.27 -4.64 119.74 121.07 2wqx s LYS 320 Ca 0.08 -0.61 0.32 0.00 -0.36 0.00 0.00 55.97 55.39 2wqx s LYS 320 Cb -0.08 -2.51 1.89 0.00 -1.51 0.00 0.00 37.83 35.61 2wqx s LYS 320 CO 0.01 0.61 2.22 0.39 -0.36 0.00 0.00 175.35 178.22