#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 0.11 -0.05 2.62 -4.23 -1.26 -4.66 115.64 108.17 2wqx s THR 37 Ca 0.00 -0.88 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 2wqx s THR 37 Cb 0.00 -1.07 -0.03 0.00 1.34 0.00 0.00 72.50 72.74 2wqx s THR 37 CO 0.00 -0.49 -0.02 0.27 -0.54 0.00 0.00 174.62 173.84 2wqx s ILE 38 N -3.04 4.08 -0.23 2.99 -4.36 -1.26 -5.05 121.20 114.32 2wqx s ILE 38 Ca -0.01 -0.44 0.02 0.00 -0.26 0.00 0.00 60.65 59.96 2wqx s ILE 38 Cb 0.01 -2.74 0.05 0.00 1.25 0.00 0.00 42.46 41.03 2wqx s ILE 38 CO -0.06 0.52 0.85 0.35 0.24 0.00 0.00 174.94 176.84 2wqx n THR 39 N 1.90 0.59 -3.89 8.37 -2.24 -1.26 -4.40 114.28 113.34 2wqx n THR 39 Ca -0.17 -0.79 -0.11 0.00 -2.27 0.00 0.00 64.05 60.71 2wqx n THR 39 Cb 0.53 0.73 -0.10 0.00 -2.10 0.00 0.00 70.33 69.39 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 -0.67 0.09 0.08 2.28 -7.23 -1.26 -5.11 120.40 108.58 2wqx s VAL 40 Ca 0.04 -0.73 -0.35 0.00 -1.81 0.00 0.00 61.98 59.13 2wqx s VAL 40 Cb 0.02 -0.40 -0.14 0.00 0.56 0.00 0.00 36.38 36.43 2wqx s VAL 40 CO 0.03 -0.40 1.60 -2.65 -0.31 0.00 0.00 175.10 173.37 2wqx n PRO 41 N 1.49 1.93 -4.24 4.82 -0.02 -1.26 -4.87 135.00 132.85 2wqx n PRO 41 Ca -0.23 0.70 -0.19 0.00 -2.02 0.00 0.00 63.50 61.77 2wqx n PRO 41 Cb 0.55 -2.46 -0.15 0.00 -0.02 0.00 0.00 33.50 31.42 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 1.53 0.57 0.18 3.45 2.01 0.04 -4.80 115.64 118.62 2wqx s THR 42 Ca 0.83 -0.24 -0.33 0.00 0.31 0.00 0.00 61.69 62.27 2wqx s THR 42 Cb -0.75 -0.53 -0.13 0.00 0.01 0.00 0.00 72.50 71.11 2wqx s THR 42 CO 0.43 0.19 1.66 -2.65 -0.69 0.00 0.00 174.62 173.57 2wqx n PRO 43 N 3.39 2.48 -0.33 4.92 -0.02 -1.26 -0.11 135.00 144.07 2wqx n PRO 43 Ca -0.19 0.89 0.07 0.00 -2.02 0.00 0.00 63.50 62.26 2wqx n PRO 43 Cb 0.54 -2.71 0.16 0.00 -0.02 0.00 0.00 33.50 31.48 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 3.77 0.07 0.00 4.25 2.04 -1.18 0.80 117.51 127.26 2wqx h ILE 44 Ca -0.44 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.42 2wqx h ILE 44 Cb 1.23 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2wqx h ILE 44 CO 0.92 0.00 0.00 0.50 0.00 0.00 0.00 178.15 179.58 2wqx h LYS 45 N 0.01 0.00 0.02 2.37 3.64 -1.03 -1.13 116.57 120.44 2wqx h LYS 45 Ca 0.48 0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.62 2wqx h LYS 45 Cb 0.80 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.59 2wqx h LYS 45 CO -0.94 0.00 -1.18 0.37 -2.27 0.00 0.00 179.45 175.43 2wqx h GLN 46 N 0.00 0.04 0.03 1.90 4.15 -1.11 -3.37 115.11 116.75 2wqx h GLN 46 Ca 0.00 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.29 2wqx h GLN 46 Cb 0.20 0.03 0.01 0.00 0.21 0.00 0.00 27.48 27.92 2wqx h GLN 46 CO 0.00 0.94 -0.26 0.82 -1.93 0.00 0.00 178.83 178.40 2wqx h ILE 47 N 0.01 1.65 -3.42 2.39 2.04 -1.13 -3.42 117.51 115.62 2wqx h ILE 47 Ca -0.08 -2.24 -0.77 0.00 1.00 0.00 0.00 64.86 62.76 2wqx h ILE 47 Cb 1.85 3.14 -0.25 0.00 -0.74 0.00 0.00 36.82 40.81 2wqx h ILE 47 CO 0.13 0.60 -0.09 -0.36 0.00 0.00 0.00 178.15 178.43 2wqx s PHE 48 N -2.59 3.48 0.40 1.37 0.08 -0.52 -3.86 117.98 116.34 2wqx s PHE 48 Ca -0.17 -1.64 0.12 0.00 0.12 0.00 0.00 56.93 55.37 2wqx s PHE 48 Cb -0.01 -3.79 0.83 0.00 -0.57 0.00 0.00 43.02 39.48 2wqx s PHE 48 CO 0.74 -1.00 1.91 0.66 -0.10 0.00 0.00 175.22 177.42 2wqx h SER 49 N 8.36 0.07 -3.15 1.36 4.64 -1.78 -3.39 113.55 119.67 2wqx h SER 49 Ca -0.12 -0.02 -0.57 0.00 -0.47 0.00 0.00 61.79 60.62 2wqx h SER 49 Cb 1.07 -0.02 -0.05 0.00 -0.31 0.00 0.00 62.40 63.10 2wqx h SER 49 CO 0.90 0.32 0.70 -0.62 -0.87 0.00 0.00 176.83 177.26 2wqx s ASP 50 N -6.94 7.15 0.36 4.97 -1.08 -1.26 -4.95 116.67 114.91 2wqx s ASP 50 Ca -0.04 1.50 0.09 0.00 -0.52 0.00 0.00 52.55 53.58 2wqx s ASP 50 Cb 0.15 -2.55 0.69 0.00 -1.46 0.00 0.00 42.92 39.76 2wqx s ASP 50 CO 0.72 -0.57 1.86 -0.78 0.52 0.00 0.00 175.17 176.91 2wqx h ASP 51 N 7.35 0.23 -0.44 -0.34 3.58 -1.94 0.31 116.42 125.18 2wqx h ASP 51 Ca -0.26 -0.06 -0.10 0.00 0.42 0.00 0.00 57.03 57.03 2wqx h ASP 51 Cb 1.11 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 42.08 2wqx h ASP 51 CO 0.92 0.45 -0.10 0.00 -2.88 0.00 0.00 179.24 177.63 2wqx h ALA 52 N 1.57 0.90 -0.32 -0.78 0.00 -1.89 -2.03 119.26 116.71 2wqx h ALA 52 Ca 0.04 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 2wqx h ALA 52 Cb 0.49 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2wqx h ALA 52 CO 0.03 0.64 -0.45 0.35 0.00 0.00 0.00 179.25 179.82 2wqx h PHE 53 N 0.81 1.01 -0.80 0.00 3.57 -1.55 -2.33 116.94 117.65 2wqx h PHE 53 Ca 0.13 -0.32 0.14 0.00 3.53 0.00 0.00 57.97 61.45 2wqx h PHE 53 Cb 0.62 -0.20 -0.09 0.00 2.79 0.00 0.00 35.95 39.06 2wqx h PHE 53 CO 0.04 1.12 0.38 0.00 -2.23 0.00 0.00 178.31 177.62 2wqx h ALA 54 N 0.83 1.16 -0.35 2.41 0.00 -0.33 -1.21 119.26 121.77 2wqx h ALA 54 Ca 0.04 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 2wqx h ALA 54 Cb 1.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 2wqx h ALA 54 CO 0.10 -0.12 0.04 0.93 0.00 0.00 0.00 179.25 180.20 2wqx h GLU 55 N 0.56 0.60 -0.51 0.00 4.39 -1.18 -1.40 114.58 117.04 2wqx h GLU 55 Ca 0.43 -0.17 0.10 0.00 0.34 0.00 0.00 59.36 60.06 2wqx h GLU 55 Cb 0.60 -0.06 -0.09 0.00 -0.10 0.00 0.00 28.75 29.09 2wqx h GLU 55 CO -0.36 0.69 -0.10 1.15 -1.16 0.00 0.00 179.01 179.23 2wqx h THR 56 N 0.43 0.51 -0.34 1.13 2.02 -1.01 -0.21 112.91 115.44 2wqx h THR 56 Ca 0.10 -0.01 -0.02 0.00 0.77 0.00 0.00 66.41 67.26 2wqx h THR 56 Cb 0.40 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2wqx h THR 56 CO 0.01 0.00 0.14 0.40 0.37 0.00 0.00 175.52 176.44 2wqx h ILE 57 N 0.02 1.18 -0.52 3.11 1.08 -0.95 -0.91 117.51 120.53 2wqx h ILE 57 Ca 0.25 -0.56 0.09 0.00 -0.39 0.00 0.00 64.86 64.24 2wqx h ILE 57 Cb 0.38 0.92 -0.07 0.00 -3.07 0.00 0.00 36.82 34.98 2wqx h ILE 57 CO -0.51 0.20 0.13 0.50 -0.69 0.00 0.00 178.15 177.79 2wqx h LYS 58 N 0.40 0.28 -0.51 2.37 3.64 -0.79 -0.65 116.57 121.31 2wqx h LYS 58 Ca 0.11 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.38 2wqx h LYS 58 Cb 0.18 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 2wqx h LYS 58 CO -0.01 0.18 -0.07 -0.44 -2.27 0.00 0.00 179.45 176.84 2wqx h ASP 59 N 0.28 0.95 -0.76 4.20 3.32 -0.97 0.43 116.42 123.86 2wqx h ASP 59 Ca 0.26 -0.34 0.03 0.00 0.02 0.00 0.00 57.03 57.00 2wqx h ASP 59 Cb 0.34 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.58 2wqx h ASP 59 CO -0.31 1.07 0.49 -1.13 -1.72 0.00 0.00 179.24 177.63 2wqx h ASN 60 N 0.81 0.80 -0.48 6.45 -0.73 -0.53 -1.91 115.58 120.00 2wqx h ASN 60 Ca 0.13 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.30 2wqx h ASN 60 Cb 0.62 -0.18 0.00 0.00 0.27 0.00 0.00 38.32 39.04 2wqx h ASN 60 CO 0.04 0.56 0.00 0.18 -0.37 0.00 0.00 177.43 177.84 2wqx n LEU 61 N -4.62 2.60 -1.60 0.34 4.77 -0.31 -4.92 117.00 113.27 2wqx n LEU 61 Ca 0.09 -1.29 -0.18 0.00 -0.03 0.00 0.00 56.01 54.59 2wqx n LEU 61 Cb 0.08 -0.32 -0.07 0.00 -2.33 0.00 0.00 43.42 40.78 2wqx n LEU 61 CO 0.34 0.65 -0.18 0.29 -1.33 0.00 0.00 177.39 177.15 2wqx n LYS 62 N 0.92 -1.43 -1.60 3.23 4.76 -0.58 -4.95 118.16 118.50 2wqx n LYS 62 Ca 0.16 1.05 -0.32 0.00 -2.87 0.00 0.00 58.31 56.34 2wqx n LYS 62 Cb 0.41 -5.42 0.06 0.00 -1.84 0.00 0.00 35.03 28.25 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 -3.66 2.66 0.10 1.97 -0.14 0.14 -4.97 119.74 115.85 2wqx s LYS 63 Ca 0.00 1.28 -0.12 0.00 -1.36 0.00 0.00 55.97 55.78 2wqx s LYS 63 Cb 0.00 -1.94 -0.16 0.00 -1.68 0.00 0.00 37.83 34.05 2wqx s LYS 63 CO 0.00 -1.34 1.28 0.87 -0.76 0.00 0.00 175.35 175.39 2wqx h LYS 64 N -0.36 0.71 -4.02 1.68 1.57 -1.92 -3.43 116.57 110.80 2wqx h LYS 64 Ca -0.46 -0.65 -0.11 0.00 -1.87 0.00 0.00 60.65 57.57 2wqx h LYS 64 Cb 1.24 0.16 -0.15 0.00 0.08 0.00 0.00 32.23 33.56 2wqx h LYS 64 CO 0.53 1.25 -0.54 0.45 -0.57 0.00 0.00 179.45 180.58 2wqx s SER 65 N -7.16 0.30 0.14 0.86 0.15 -1.26 -5.03 113.70 101.71 2wqx s SER 65 Ca -0.09 -0.81 0.22 0.00 0.70 0.00 0.00 55.95 55.97 2wqx s SER 65 Cb 0.08 0.26 0.87 0.00 -1.71 0.00 0.00 66.02 65.52 2wqx s SER 65 CO 0.90 -0.64 1.67 1.33 1.20 0.00 0.00 173.24 177.70 2wqx n VAL 66 N 0.11 0.76 1.13 4.45 0.24 -1.26 -2.01 118.33 121.75 2wqx n VAL 66 Ca -0.15 0.14 0.14 0.00 -2.04 0.00 0.00 64.34 62.43 2wqx n VAL 66 Cb 0.61 -0.96 0.58 0.00 -1.47 0.00 0.00 33.84 32.61 2wqx n VAL 66 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2wqx n THR 67 N -1.93 0.00 -2.08 3.34 -2.24 -1.26 -0.45 114.28 109.66 2wqx n THR 67 Ca 0.04 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.39 2wqx n THR 67 Cb 0.25 -0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.13 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 -2.85 6.73 0.27 3.42 1.01 -0.85 -4.64 116.67 119.76 2wqx s ASP 68 Ca 0.18 2.56 -0.29 0.00 0.71 0.00 0.00 52.55 55.70 2wqx s ASP 68 Cb 0.19 -2.61 -0.09 0.00 1.01 0.00 0.00 42.92 41.41 2wqx s ASP 68 CO 0.54 -0.66 1.20 0.00 0.21 0.00 0.00 175.17 176.46 2wqx s ALA 69 N 0.21 3.45 0.27 5.23 0.00 -1.26 -1.42 121.76 128.24 2wqx s ALA 69 Ca 0.60 1.04 0.08 0.00 0.00 0.00 0.00 51.96 53.68 2wqx s ALA 69 Cb -0.40 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.26 2wqx s ALA 69 CO 0.40 -0.38 -0.11 0.14 0.00 0.00 0.00 175.76 175.81 2wqx s VAL 70 N -0.83 1.92 0.32 0.00 -7.23 0.85 -4.79 120.40 110.63 2wqx s VAL 70 Ca 0.48 -2.21 0.09 0.00 -1.81 0.00 0.00 61.98 58.53 2wqx s VAL 70 Cb -0.35 -2.36 -0.05 0.00 0.56 0.00 0.00 36.38 34.19 2wqx s VAL 70 CO 0.44 -0.37 0.06 0.42 -0.31 0.00 0.00 175.10 175.33 2wqx s THR 71 N -2.84 3.07 0.31 5.32 -4.23 -1.26 -0.78 115.64 115.22 2wqx s THR 71 Ca 0.28 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 2wqx s THR 71 Cb 0.01 -2.89 0.27 0.00 1.34 0.00 0.00 72.50 71.23 2wqx s THR 71 CO 0.12 -0.25 1.94 -0.61 -0.54 0.00 0.00 174.62 175.28 2wqx h GLN 72 N 1.72 1.00 -0.95 3.99 5.75 -1.90 -1.51 115.11 123.21 2wqx h GLN 72 Ca -0.44 -0.06 0.06 0.00 -0.15 0.00 0.00 58.65 58.07 2wqx h GLN 72 Cb 1.25 -0.23 -0.06 0.00 1.07 0.00 0.00 27.48 29.51 2wqx h GLN 72 CO 0.63 0.66 0.61 -0.91 -2.65 0.00 0.00 178.83 177.17 2wqx h ASN 73 N 1.03 0.97 -0.31 -0.69 2.35 -1.95 0.15 115.58 117.13 2wqx h ASN 73 Ca 0.34 0.01 -0.18 0.00 -0.55 0.00 0.00 56.30 55.92 2wqx h ASN 73 Cb 0.07 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.24 2wqx h ASN 73 CO -0.11 0.62 -0.51 -0.33 -1.65 0.00 0.00 177.43 175.46 2wqx h GLU 74 N 1.11 0.89 -0.50 0.81 5.08 -1.77 -2.77 114.58 117.44 2wqx h GLU 74 Ca 0.41 -0.55 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 2wqx h GLU 74 Cb 0.16 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2wqx h GLU 74 CO -0.17 1.19 0.15 -0.07 -1.00 0.00 0.00 179.01 179.10 2wqx h LEU 75 N 0.69 0.69 -2.04 1.33 3.38 -0.62 -1.53 115.31 117.21 2wqx h LEU 75 Ca 0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 2wqx h LEU 75 Cb 1.12 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2wqx h LEU 75 CO 0.12 0.66 -0.09 0.78 0.09 0.00 0.00 178.44 180.00 2wqx h ASN 76 N 0.73 0.00 0.78 -0.43 2.35 -0.61 -2.32 115.58 116.07 2wqx h ASN 76 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2wqx h ASN 76 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.60 2wqx h ASN 76 CO -0.01 0.09 0.00 -1.54 -1.65 0.00 0.00 177.43 174.32 2wqx n SER 77 N -3.66 0.00 -4.63 5.81 3.41 -0.58 -4.57 113.62 109.40 2wqx n SER 77 Ca -0.02 0.27 -0.43 0.00 -0.26 0.00 0.00 58.87 58.43 2wqx n SER 77 Cb 0.21 -0.42 -0.02 0.00 -0.26 0.00 0.00 64.21 63.72 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 -2.84 4.39 -0.12 -1.33 1.01 -0.88 -4.84 121.20 116.60 2wqx s ILE 78 Ca 0.18 1.58 0.20 0.00 0.00 0.00 0.00 60.65 62.61 2wqx s ILE 78 Cb 0.18 -4.37 -0.28 0.00 0.01 0.00 0.00 42.46 38.00 2wqx s ILE 78 CO 0.47 -0.54 0.31 -0.67 0.00 0.00 0.00 174.94 174.51 2wqx n ASP 79 N 7.15 0.07 -3.78 3.58 2.03 -1.26 -2.55 116.55 121.79 2wqx n ASP 79 Ca 0.13 0.03 -0.13 0.00 0.52 0.00 0.00 54.79 55.34 2wqx n ASP 79 Cb 0.47 1.36 -0.12 0.00 -0.72 0.00 0.00 41.12 42.11 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 -2.97 0.26 -0.12 -0.67 0.74 -1.26 -0.08 119.66 115.55 2wqx s GLN 80 Ca -0.09 0.36 0.00 0.00 0.05 0.00 0.00 55.36 55.69 2wqx s GLN 80 Cb 0.10 0.08 0.02 0.00 1.10 0.00 0.00 33.01 34.31 2wqx s GLN 80 CO 0.86 -0.06 -0.10 0.42 -0.55 0.00 0.00 175.29 175.86 2wqx s ILE 81 N 0.35 1.20 -0.41 -2.34 1.01 -0.78 -5.02 121.20 115.21 2wqx s ILE 81 Ca -0.02 -0.41 -0.06 0.00 0.00 0.00 0.00 60.65 60.17 2wqx s ILE 81 Cb -0.03 -1.17 0.10 0.00 0.01 0.00 0.00 42.46 41.36 2wqx s ILE 81 CO -0.01 0.39 0.23 -0.63 0.00 0.00 0.00 174.94 174.92 2wqx s ILE 82 N 1.54 3.69 -0.36 2.92 1.01 -1.26 -1.03 121.20 127.70 2wqx s ILE 82 Ca 0.03 -1.76 0.13 0.00 0.00 0.00 0.00 60.65 59.05 2wqx s ILE 82 Cb -0.13 -3.39 0.37 0.00 0.01 0.00 0.00 42.46 39.32 2wqx s ILE 82 CO -0.08 -0.60 0.78 0.00 0.00 0.00 0.00 174.94 175.05 2wqx n ALA 83 N 4.74 2.17 -1.78 9.38 0.00 0.64 -4.98 120.51 130.68 2wqx n ALA 83 Ca -0.07 -3.29 -0.36 0.00 0.00 0.00 0.00 53.44 49.73 2wqx n ALA 83 Cb 0.42 -0.94 -0.03 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 -2.51 6.55 -1.35 0.00 0.01 -1.14 -4.08 114.94 112.41 2wqx s ASN 84 Ca 0.37 2.10 -0.05 0.00 -0.71 0.00 0.00 52.86 54.57 2wqx s ASN 84 Cb 0.37 -2.59 0.02 0.00 0.41 0.00 0.00 41.25 39.46 2wqx s ASN 84 CO -0.06 -0.64 0.89 0.59 -1.51 0.00 0.00 177.10 176.37 2wqx n ASN 85 N -0.28 -2.99 -0.03 -1.22 3.02 0.41 -4.88 115.26 109.28 2wqx n ASN 85 Ca 0.06 -0.74 0.02 0.00 -0.03 0.00 0.00 54.58 53.90 2wqx n ASN 85 Cb 0.49 -4.34 0.03 0.00 -0.61 0.00 0.00 39.78 35.36 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 -3.01 1.78 -3.69 6.41 7.64 -1.25 -5.01 113.62 116.49 2wqx n SER 86 Ca -0.17 -2.13 -0.27 0.00 1.01 0.00 0.00 58.87 57.31 2wqx n SER 86 Cb 0.62 -0.10 0.04 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 -0.63 -5.23 -4.71 6.43 2.03 -1.26 -4.85 116.55 108.33 2wqx n ASP 87 Ca 0.04 -0.63 -0.40 0.00 0.52 0.00 0.00 54.79 54.32 2wqx n ASP 87 Cb 0.38 -4.18 -0.05 0.00 -0.72 0.00 0.00 41.12 36.56 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 -3.25 5.02 -0.34 5.18 1.01 -1.26 -4.75 121.20 122.81 2wqx s ILE 88 Ca 0.58 1.47 0.14 0.00 0.00 0.00 0.00 60.65 62.84 2wqx s ILE 88 Cb -0.28 -4.06 -0.18 0.00 0.01 0.00 0.00 42.46 37.95 2wqx s ILE 88 CO 0.72 0.22 0.44 1.17 0.00 0.00 0.00 174.94 177.49 2wqx n LYS 89 N 3.99 1.55 -3.65 2.79 3.00 -1.26 -0.08 118.16 124.51 2wqx n LYS 89 Ca -0.00 -0.06 -0.08 0.00 -0.00 0.00 0.00 58.31 58.17 2wqx n LYS 89 Cb 0.51 -1.22 -0.07 0.00 0.00 0.00 0.00 35.03 34.24 2wqx n LYS 89 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2wqx s SER 90 N -2.89 -0.89 -0.41 3.14 0.15 -1.26 -4.44 113.70 107.10 2wqx s SER 90 Ca 0.00 1.45 0.06 0.00 0.70 0.00 0.00 55.95 58.16 2wqx s SER 90 Cb 0.10 1.33 0.66 0.00 -1.71 0.00 0.00 66.02 66.39 2wqx s SER 90 CO 0.56 -0.24 1.84 1.33 1.20 0.00 0.00 173.24 177.94 2wqx n VAL 91 N 4.21 3.07 -1.71 4.45 0.24 -1.26 -4.35 118.33 122.98 2wqx n VAL 91 Ca -0.20 -1.98 -0.43 0.00 -2.04 0.00 0.00 64.34 59.68 2wqx n VAL 91 Cb 0.58 -0.43 -0.02 0.00 -1.47 0.00 0.00 33.84 32.50 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 -0.98 2.42 0.00 7.34 -0.06 -1.26 -1.41 117.38 123.43 2wqx n GLN 92 Ca 0.53 0.86 0.00 0.00 -2.00 0.00 0.00 57.00 56.40 2wqx n GLN 92 Cb 1.54 -2.61 0.00 0.00 -4.06 0.00 0.00 30.24 25.12 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 2.43 2.80 0.28 1.69 0.00 -1.25 -3.57 105.19 107.57 2wqx n GLY 93 Ca 0.11 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.32 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 0.00 -0.19 -0.61 2.10 -1.55 -2.30 117.51 114.95 2wqx h ILE 94 Ca 0.00 -0.18 0.06 0.00 1.08 0.00 0.00 64.86 65.82 2wqx h ILE 94 Cb 0.00 1.08 -0.01 0.00 -1.09 0.00 0.00 36.82 36.81 2wqx h ILE 94 CO 0.00 0.00 0.20 1.56 -1.08 0.00 0.00 178.15 178.83 2wqx h GLN 95 N 0.00 0.00 -0.65 2.19 7.50 -1.80 -1.96 115.11 120.40 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 0.19 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.72 2wqx h GLN 95 CO 0.00 0.00 0.00 0.66 -1.50 0.00 0.00 178.83 177.99 2wqx n TYR 96 N -3.88 0.74 -3.54 2.96 4.01 -0.87 -4.46 117.16 112.12 2wqx n TYR 96 Ca 0.02 -0.28 -0.32 0.00 -0.16 0.00 0.00 57.90 57.16 2wqx n TYR 96 Cb 0.33 -0.18 -0.07 0.00 -0.31 0.00 0.00 39.34 39.10 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 0.33 4.10 0.27 7.72 4.32 -0.74 -4.54 117.00 128.46 2wqx n LEU 97 Ca 0.12 -5.27 0.18 0.00 -0.02 0.00 0.00 56.01 51.01 2wqx n LEU 97 Cb 0.53 -0.90 0.76 0.00 -1.62 0.00 0.00 43.42 42.18 2wqx n LEU 97 CO 0.12 1.79 1.01 1.55 -1.22 0.00 0.00 177.39 180.64 2wqx h PRO 98 N 5.16 0.00 -0.20 3.23 0.13 -1.83 -2.79 132.00 135.70 2wqx h PRO 98 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2wqx h PRO 98 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 2wqx h PRO 98 CO 0.88 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.74 2wqx n ASN 99 N -2.99 2.95 -4.70 1.44 3.02 -1.26 -4.39 115.26 109.34 2wqx n ASN 99 Ca 0.00 -1.93 -0.42 0.00 -0.03 0.00 0.00 54.58 52.20 2wqx n ASN 99 Cb 0.25 -0.12 -0.03 0.00 -0.61 0.00 0.00 39.78 39.27 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 -1.76 2.59 -0.29 2.41 0.11 -1.05 -4.45 120.40 117.97 2wqx s VAL 100 Ca 0.34 0.26 0.11 0.00 -2.93 0.00 0.00 61.98 59.76 2wqx s VAL 100 Cb 0.21 -3.17 -0.14 0.00 -1.53 0.00 0.00 36.38 31.76 2wqx s VAL 100 CO 0.31 0.01 0.36 0.35 -3.33 0.00 0.00 175.10 172.79 2wqx n THR 101 N 4.39 0.00 -3.68 5.04 -2.24 0.88 -3.11 114.28 115.56 2wqx n THR 101 Ca 0.16 -0.25 -0.18 0.00 -2.27 0.00 0.00 64.05 61.51 2wqx n THR 101 Cb 0.38 0.67 -0.17 0.00 -2.10 0.00 0.00 70.33 69.12 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 -2.33 -0.02 -0.17 -0.78 1.02 -1.06 0.50 119.74 116.90 2wqx s LYS 102 Ca 0.01 0.43 0.01 0.00 0.02 0.00 0.00 55.97 56.43 2wqx s LYS 102 Cb 0.08 -0.38 0.03 0.00 -0.52 0.00 0.00 37.83 37.04 2wqx s LYS 102 CO 0.44 -0.30 -0.12 -0.51 -0.92 0.00 0.00 175.35 173.94 2wqx s LEU 103 N 2.05 1.99 -0.58 3.17 1.43 -0.46 -1.86 118.68 124.44 2wqx s LEU 103 Ca 0.02 -0.69 -0.09 0.00 -1.03 0.00 0.00 54.13 52.35 2wqx s LEU 103 Cb -0.12 -1.21 0.15 0.00 0.03 0.00 0.00 46.19 45.03 2wqx s LEU 103 CO -0.04 -0.10 0.45 -0.36 0.23 0.00 0.00 176.35 176.53 2wqx s PHE 104 N 1.44 3.48 -0.23 0.29 2.99 -0.20 -0.96 117.98 124.79 2wqx s PHE 104 Ca 0.02 -2.09 0.11 0.00 0.00 0.00 0.00 56.93 54.97 2wqx s PHE 104 Cb -0.14 -3.49 0.44 0.00 0.00 0.00 0.00 43.02 39.82 2wqx s PHE 104 CO -0.10 -0.96 1.20 1.28 -0.00 0.00 0.00 175.22 176.64 2wqx n LEU 105 N 4.40 3.49 -4.77 -0.37 4.77 0.45 -0.26 117.00 124.70 2wqx n LEU 105 Ca -0.00 -4.11 -0.37 0.00 -0.03 0.00 0.00 56.01 51.51 2wqx n LEU 105 Cb 0.41 -0.37 -0.01 0.00 -2.33 0.00 0.00 43.42 41.13 2wqx n LEU 105 CO 0.39 1.63 0.81 0.20 -1.33 0.00 0.00 177.39 179.09 2wqx s ASN 106 N -3.35 6.14 -0.65 -1.43 0.01 -1.08 -3.87 114.94 110.72 2wqx s ASN 106 Ca 0.43 2.25 -0.02 0.00 -0.71 0.00 0.00 52.86 54.81 2wqx s ASN 106 Cb 0.39 -2.60 0.00 0.00 0.41 0.00 0.00 41.25 39.45 2wqx s ASN 106 CO -0.03 -0.94 0.31 0.61 -1.51 0.00 0.00 177.10 175.54 2wqx n GLY 107 N 0.37 0.20 0.00 0.66 0.00 -0.24 -0.45 105.19 105.73 2wqx n GLY 107 Ca 0.08 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.13 1.73 -1.36 1.61 3.02 -1.24 -3.19 115.26 115.70 2wqx n ASN 108 Ca -0.04 -0.37 -0.06 0.00 -0.03 0.00 0.00 54.58 54.08 2wqx n ASN 108 Cb 0.55 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.83 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 -0.05 2.30 -2.59 3.52 5.02 0.89 -4.36 118.16 122.89 2wqx n LYS 109 Ca 0.00 -3.57 -0.40 0.00 -2.02 0.00 0.00 58.31 52.31 2wqx n LYS 109 Cb 0.00 -1.77 -0.05 0.00 -0.02 0.00 0.00 35.03 33.19 2wqx n LYS 109 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wqx s LEU 110 N -3.19 4.56 -0.05 -0.35 1.43 -1.20 -4.53 118.68 115.34 2wqx s LEU 110 Ca 0.42 2.09 0.04 0.00 -1.03 0.00 0.00 54.13 55.65 2wqx s LEU 110 Cb 0.38 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.93 2wqx s LEU 110 CO -0.03 -0.07 0.00 0.35 0.23 0.00 0.00 176.35 176.83 2wqx n THR 111 N 1.73 0.36 -4.10 5.49 -2.24 -1.26 -0.95 114.28 113.31 2wqx n THR 111 Ca -0.00 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.25 2wqx n THR 111 Cb 0.46 -0.84 -0.16 0.00 -2.10 0.00 0.00 70.33 67.70 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 -3.84 3.48 -0.09 3.42 2.15 -1.26 -4.22 116.67 116.30 2wqx s ASP 112 Ca -0.04 -0.83 0.14 0.00 0.43 0.00 0.00 52.55 52.25 2wqx s ASP 112 Cb 0.02 -1.50 0.45 0.00 -0.30 0.00 0.00 42.92 41.58 2wqx s ASP 112 CO 0.20 -0.05 1.37 2.30 -0.17 0.00 0.00 175.17 178.82 2wqx n ILE 113 N 4.58 1.66 -0.11 4.11 -5.35 -1.26 -4.61 119.36 118.38 2wqx n ILE 113 Ca -0.19 -1.40 0.16 0.00 -0.27 0.00 0.00 62.75 61.04 2wqx n ILE 113 Cb 0.48 0.13 0.55 0.00 -1.74 0.00 0.00 39.64 39.06 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 2.15 0.31 0.00 6.28 1.57 -1.93 0.49 116.57 125.44 2wqx h LYS 114 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2wqx h LYS 114 Cb 1.12 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2wqx h LYS 114 CO 0.12 0.20 0.00 -2.30 -0.57 0.00 0.00 179.45 176.91 2wqx n PRO 115 N -4.45 0.05 0.00 3.15 -0.02 -1.26 -1.54 135.00 130.93 2wqx n PRO 115 Ca 0.12 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 62.25 2wqx n PRO 115 Cb 0.51 -1.66 0.32 0.00 -0.02 0.00 0.00 33.50 32.65 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 -1.78 0.75 -0.11 2.45 4.77 0.17 -3.94 117.00 119.31 2wqx n LEU 116 Ca -0.00 -0.13 0.10 0.00 -0.03 0.00 0.00 56.01 55.95 2wqx n LEU 116 Cb 0.04 -0.19 0.45 0.00 -2.33 0.00 0.00 43.42 41.38 2wqx n LEU 116 CO 0.05 0.16 1.19 0.00 -1.33 0.00 0.00 177.39 177.46 2wqx h ALA 117 N 3.34 1.89 -0.37 -1.18 0.00 -1.38 -2.29 119.26 119.27 2wqx h ALA 117 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wqx h ALA 117 Cb 0.50 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2wqx h ALA 117 CO 0.00 -0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.33 2wqx n ASN 118 N -4.48 3.97 -4.25 0.00 3.02 -1.26 -4.57 115.26 107.68 2wqx n ASN 118 Ca 0.10 -2.68 -0.43 0.00 -0.03 0.00 0.00 54.58 51.54 2wqx n ASN 118 Cb 0.31 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 38.99 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 0.08 5.71 0.24 3.41 4.77 -0.87 -4.80 117.00 125.54 2wqx n LEU 119 Ca 0.20 -4.26 0.16 0.00 -0.03 0.00 0.00 56.01 52.08 2wqx n LEU 119 Cb 0.81 -1.64 0.66 0.00 -2.33 0.00 0.00 43.42 40.92 2wqx n LEU 119 CO 0.16 0.73 0.96 0.11 -1.33 0.00 0.00 177.39 178.03 2wqx h LYS 120 N 6.80 0.00 -0.01 3.23 1.57 -1.87 -1.43 116.57 124.85 2wqx h LYS 120 Ca 0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.20 2wqx h LYS 120 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.09 2wqx h LYS 120 CO 1.51 0.00 -0.04 0.09 -0.57 0.00 0.00 179.45 180.44 2wqx n ASN 121 N -2.82 1.30 -4.67 0.86 3.02 -1.26 -4.27 115.26 107.42 2wqx n ASN 121 Ca 0.01 -1.35 -0.51 0.00 -0.03 0.00 0.00 54.58 52.69 2wqx n ASN 121 Cb 0.26 0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.39 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 -0.05 2.76 -0.03 3.41 4.77 -0.54 -4.38 117.00 122.93 2wqx n LEU 122 Ca 0.18 1.05 -0.04 0.00 -0.03 0.00 0.00 56.01 57.17 2wqx n LEU 122 Cb 0.33 -1.28 -0.03 0.00 -2.33 0.00 0.00 43.42 40.11 2wqx n LEU 122 CO 0.18 -0.38 -0.69 0.61 -1.33 0.00 0.00 177.39 175.77 2wqx n GLY 123 N 3.81 -0.14 3.10 -0.72 0.00 0.18 -2.57 105.19 108.85 2wqx n GLY 123 Ca 0.22 -0.06 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.13 1.78 -0.14 1.61 0.51 -0.64 -0.39 118.94 119.55 2wqx s TRP 124 Ca -0.07 -0.63 -0.03 0.00 -2.12 0.00 0.00 56.10 53.25 2wqx s TRP 124 Cb 0.02 -1.24 0.05 0.00 -0.81 0.00 0.00 33.47 31.49 2wqx s TRP 124 CO 0.17 -0.27 0.05 -1.17 -0.51 0.00 0.00 176.95 175.22 2wqx s LEU 125 N 0.40 0.60 -0.32 2.99 2.96 -0.48 -1.35 118.68 123.48 2wqx s LEU 125 Ca -0.12 -0.45 -0.02 0.00 -0.22 0.00 0.00 54.13 53.32 2wqx s LEU 125 Cb -0.15 -0.37 0.06 0.00 0.50 0.00 0.00 46.19 46.23 2wqx s LEU 125 CO 0.04 -0.29 0.03 -0.36 -1.32 0.00 0.00 176.35 174.45 2wqx s PHE 126 N 2.03 3.34 -0.19 5.38 0.08 -0.13 -1.16 117.98 127.32 2wqx s PHE 126 Ca 0.02 -2.02 0.13 0.00 0.12 0.00 0.00 56.93 55.18 2wqx s PHE 126 Cb -0.15 -2.31 0.42 0.00 -0.57 0.00 0.00 43.02 40.42 2wqx s PHE 126 CO -0.07 -0.84 1.21 1.28 -0.10 0.00 0.00 175.22 176.70 2wqx n LEU 127 N 4.60 2.63 -4.76 -0.37 4.77 1.00 -0.41 117.00 124.45 2wqx n LEU 127 Ca -0.11 -3.72 -0.39 0.00 -0.03 0.00 0.00 56.01 51.76 2wqx n LEU 127 Cb 0.43 -0.45 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 2wqx n LEU 127 CO 0.27 1.34 1.01 -1.81 -1.33 0.00 0.00 177.39 176.87 2wqx s ASP 128 N -3.12 5.78 -1.17 -1.43 1.01 -1.22 -3.41 116.67 113.12 2wqx s ASP 128 Ca 0.38 2.80 -0.06 0.00 0.71 0.00 0.00 52.55 56.38 2wqx s ASP 128 Cb 0.37 -2.64 0.01 0.00 1.01 0.00 0.00 42.92 41.67 2wqx s ASP 128 CO -0.07 -1.23 1.01 -0.62 0.21 0.00 0.00 175.17 174.47 2wqx n GLU 129 N -0.40 -6.80 -0.85 8.23 -0.58 -0.03 -1.08 120.64 119.13 2wqx n GLU 129 Ca 0.06 0.73 0.00 0.00 -0.42 0.00 0.00 57.16 57.54 2wqx n GLU 129 Cb 0.43 -5.47 0.00 0.00 -0.57 0.00 0.00 31.44 25.83 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 -2.55 1.64 -2.14 1.62 3.02 -1.22 -3.66 115.26 111.98 2wqx n ASN 130 Ca -0.04 -0.47 -0.21 0.00 -0.03 0.00 0.00 54.58 53.83 2wqx n ASN 130 Cb 0.57 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.76 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 -0.08 3.37 -2.62 3.52 5.02 -0.12 -4.10 118.16 123.14 2wqx n LYS 131 Ca 0.00 -4.10 -0.42 0.00 -2.02 0.00 0.00 58.31 51.77 2wqx n LYS 131 Cb 0.00 -2.19 -0.03 0.00 -0.02 0.00 0.00 35.03 32.79 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 -4.53 4.01 -0.21 -0.18 1.01 -1.13 -4.41 120.40 114.96 2wqx s VAL 132 Ca 0.48 0.63 0.15 0.00 0.00 0.00 0.00 61.98 63.24 2wqx s VAL 132 Cb 0.40 -4.75 -0.24 0.00 0.00 0.00 0.00 36.38 31.80 2wqx s VAL 132 CO 0.02 -1.45 0.04 0.29 0.00 0.00 0.00 175.10 174.01 2wqx n LYS 133 N 8.50 0.68 -3.08 2.72 5.02 -1.26 -4.75 118.16 125.99 2wqx n LYS 133 Ca 0.06 0.03 -0.41 0.00 -2.02 0.00 0.00 58.31 55.96 2wqx n LYS 133 Cb 0.49 -1.53 -0.06 0.00 -0.02 0.00 0.00 35.03 33.91 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 -5.69 6.53 0.00 4.39 -1.08 -1.26 -4.84 116.67 114.72 2wqx s ASP 134 Ca -0.14 0.47 0.24 0.00 -0.52 0.00 0.00 52.55 52.60 2wqx s ASP 134 Cb 0.07 -2.34 0.36 0.00 -1.46 0.00 0.00 42.92 39.54 2wqx s ASP 134 CO 0.79 -0.50 1.36 0.18 0.52 0.00 0.00 175.17 177.52 2wqx n LEU 135 N 5.94 3.15 0.24 -1.34 4.77 -1.26 -4.52 117.00 123.98 2wqx n LEU 135 Ca -0.00 -1.22 0.11 0.00 -0.03 0.00 0.00 56.01 54.86 2wqx n LEU 135 Cb 0.49 -0.13 0.58 0.00 -2.33 0.00 0.00 43.42 42.03 2wqx n LEU 135 CO 0.47 0.61 0.87 0.77 -1.33 0.00 0.00 177.39 178.78 2wqx h SER 136 N 4.45 0.00 0.71 -1.43 4.64 -1.92 -2.06 113.55 117.94 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 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2wqx h SER 136 CO 0.00 0.19 0.00 -1.20 -0.87 0.00 0.00 176.83 174.95 2wqx n SER 137 N -3.52 0.19 0.05 4.97 7.64 -1.26 -2.41 113.62 119.27 2wqx n SER 137 Ca -0.01 0.54 0.14 0.00 1.01 0.00 0.00 58.87 60.54 2wqx n SER 137 Cb 0.34 -0.58 0.53 0.00 -1.01 0.00 0.00 64.21 63.49 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 -1.70 0.35 -0.33 -3.43 4.77 -0.77 -4.05 117.00 111.85 2wqx n LEU 138 Ca 0.04 0.53 0.15 0.00 -0.03 0.00 0.00 56.01 56.70 2wqx n LEU 138 Cb 0.23 -0.42 0.34 0.00 -2.33 0.00 0.00 43.42 41.24 2wqx n LEU 138 CO 0.18 -0.08 1.11 0.50 -1.33 0.00 0.00 177.39 177.77 2wqx h LYS 139 N 0.00 0.50 -0.69 3.23 3.64 -1.67 -1.11 116.57 120.47 2wqx h LYS 139 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2wqx h LYS 139 Cb 0.60 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 2wqx h LYS 139 CO 0.00 0.33 0.00 -0.25 -2.27 0.00 0.00 179.45 177.26 2wqx n ASP 140 N -4.95 4.00 -3.57 4.20 8.00 -1.26 -4.67 116.55 118.30 2wqx n ASP 140 Ca 0.24 -2.07 -0.41 0.00 0.71 0.00 0.00 54.79 53.27 2wqx n ASP 140 Cb 0.69 -0.48 -0.01 0.00 -0.02 0.00 0.00 41.12 41.30 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 1.48 7.74 0.00 0.64 4.77 -0.42 -4.76 117.00 126.45 2wqx n LEU 141 Ca 0.24 -4.61 0.06 0.00 -0.03 0.00 0.00 56.01 51.66 2wqx n LEU 141 Cb 0.65 -1.47 0.32 0.00 -2.33 0.00 0.00 43.42 40.58 2wqx n LEU 141 CO 0.17 1.78 0.65 0.29 -1.33 0.00 0.00 177.39 178.96 2wqx n LYS 142 N 3.23 0.19 -0.20 3.23 4.76 -1.26 -1.40 118.16 126.71 2wqx n LYS 142 Ca 0.59 0.16 0.12 0.00 -2.87 0.00 0.00 58.31 56.31 2wqx n LYS 142 Cb 0.29 -1.50 0.22 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 -1.28 2.51 -2.19 1.97 5.02 -1.26 -4.89 118.16 118.04 2wqx n LYS 143 Ca 0.06 -2.31 -0.43 0.00 -2.02 0.00 0.00 58.31 53.62 2wqx n LYS 143 Cb 0.10 -1.51 -0.02 0.00 -0.02 0.00 0.00 35.03 33.58 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 -1.42 4.26 -0.11 -0.35 2.96 -0.49 -4.29 118.68 119.24 2wqx s LEU 144 Ca 0.39 2.00 0.13 0.00 -0.22 0.00 0.00 54.13 56.43 2wqx s LEU 144 Cb 0.23 -3.54 -0.19 0.00 0.50 0.00 0.00 46.19 43.19 2wqx s LEU 144 CO 0.31 -0.85 0.13 0.29 -1.32 0.00 0.00 176.35 174.91 2wqx n LYS 145 N 6.90 1.35 -4.11 1.98 4.76 0.47 -4.10 118.16 125.40 2wqx n LYS 145 Ca 0.16 -0.04 -0.24 0.00 -2.87 0.00 0.00 58.31 55.32 2wqx n LYS 145 Cb 0.44 -1.36 -0.17 0.00 -1.84 0.00 0.00 35.03 32.09 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 -4.48 1.63 -0.03 4.39 0.15 -0.77 -1.42 113.70 113.18 2wqx s SER 146 Ca -0.07 -0.21 0.02 0.00 0.70 0.00 0.00 55.95 56.39 2wqx s SER 146 Cb 0.06 -0.66 0.00 0.00 -1.71 0.00 0.00 66.02 63.72 2wqx s SER 146 CO 0.60 -0.08 -0.09 -0.22 1.20 0.00 0.00 173.24 174.65 2wqx s LEU 147 N 1.29 1.76 -0.08 3.45 2.96 0.07 -1.39 118.68 126.74 2wqx s LEU 147 Ca -0.04 -0.20 -0.00 0.00 -0.22 0.00 0.00 54.13 53.67 2wqx s LEU 147 Cb -0.14 -0.58 0.03 0.00 0.50 0.00 0.00 46.19 46.00 2wqx s LEU 147 CO -0.03 0.06 -0.04 -0.55 -1.32 0.00 0.00 176.35 174.48 2wqx s SER 148 N 0.26 1.71 -0.23 3.68 0.15 -0.31 -1.87 113.70 117.10 2wqx s SER 148 Ca -0.04 -0.18 0.19 0.00 0.70 0.00 0.00 55.95 56.62 2wqx s SER 148 Cb -0.09 -0.60 0.48 0.00 -1.71 0.00 0.00 66.02 64.10 2wqx s SER 148 CO 0.01 -0.14 1.14 0.18 1.20 0.00 0.00 173.24 175.63 2wqx n LEU 149 N 4.85 2.35 -4.76 3.45 4.77 0.48 -0.00 117.00 128.14 2wqx n LEU 149 Ca -0.12 -3.34 -0.38 0.00 -0.03 0.00 0.00 56.01 52.14 2wqx n LEU 149 Cb 0.50 0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.77 2wqx n LEU 149 CO 0.15 1.23 0.93 -1.61 -1.33 0.00 0.00 177.39 176.77 2wqx s GLU 150 N -3.22 3.48 -1.30 3.23 2.02 -1.22 -3.64 118.70 118.05 2wqx s GLU 150 Ca 0.34 2.07 -0.08 0.00 0.02 0.00 0.00 54.97 57.32 2wqx s GLU 150 Cb 0.35 -2.39 -0.00 0.00 0.10 0.00 0.00 34.13 32.20 2wqx s GLU 150 CO -0.04 -0.86 0.57 1.58 0.02 0.00 0.00 175.26 176.52 2wqx n HIS 151 N -0.66 -1.74 0.04 1.61 -0.00 -0.65 -0.85 115.22 112.97 2wqx n HIS 151 Ca 0.08 0.64 0.04 0.00 0.46 0.00 0.00 57.72 58.94 2wqx n HIS 151 Cb 0.46 -3.67 0.08 0.00 -0.12 0.00 0.00 29.99 26.74 2wqx n HIS 151 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 2wqx n ASN 152 N -2.86 2.28 -1.38 0.26 3.02 -1.24 -3.77 115.26 111.56 2wqx n ASN 152 Ca -0.23 -1.75 -0.13 0.00 -0.03 0.00 0.00 54.58 52.44 2wqx n ASN 152 Cb 0.65 -0.10 -0.02 0.00 -0.61 0.00 0.00 39.78 39.70 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 0.30 0.27 3.72 7.41 0.00 -1.26 -4.14 105.19 111.48 2wqx n GLY 153 Ca 0.07 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.62 4.58 -0.00 -0.61 1.01 -1.26 -4.65 121.20 117.65 2wqx s ILE 154 Ca 0.00 1.97 0.00 0.00 0.00 0.00 0.00 60.65 62.62 2wqx s ILE 154 Cb 0.00 -4.26 -0.00 0.00 0.01 0.00 0.00 42.46 38.21 2wqx s ILE 154 CO 0.00 0.22 0.00 -1.54 0.00 0.00 0.00 174.94 173.62 2wqx n SER 155 N 3.40 4.98 -4.38 3.58 3.41 -1.26 0.11 113.62 123.47 2wqx n SER 155 Ca 0.05 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.28 2wqx n SER 155 Cb 0.50 0.52 -0.12 0.00 -0.26 0.00 0.00 64.21 64.84 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 -2.98 5.37 -0.07 4.04 -1.08 -1.26 -4.45 116.67 116.24 2wqx s ASP 156 Ca -0.00 -0.71 0.13 0.00 -0.52 0.00 0.00 52.55 51.44 2wqx s ASP 156 Cb 0.00 -1.94 0.37 0.00 -1.46 0.00 0.00 42.92 39.89 2wqx s ASP 156 CO 0.00 -0.23 1.30 2.30 0.52 0.00 0.00 175.17 179.06 2wqx n ILE 157 N 4.92 1.52 0.25 4.11 -5.35 -1.26 -4.73 119.36 118.83 2wqx n ILE 157 Ca -0.14 -1.38 0.10 0.00 -0.27 0.00 0.00 62.75 61.06 2wqx n ILE 157 Cb 0.48 0.19 0.70 0.00 -1.74 0.00 0.00 39.64 39.26 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 1.75 0.00 0.28 7.28 2.35 -1.92 -0.35 115.58 124.97 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 1.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.37 2wqx h ASN 158 CO 0.09 0.00 0.00 1.23 -1.65 0.00 0.00 177.43 177.10 2wqx h GLY 159 N 0.00 0.00 2.00 2.83 0.00 -1.90 -1.99 103.07 104.01 2wqx h GLY 159 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2wqx h GLY 159 CO -0.00 0.00 0.00 1.41 0.00 0.00 0.00 176.54 177.95 2wqx h LEU 160 N 0.00 0.00 -1.93 3.11 3.38 -1.38 -3.07 115.31 115.42 2wqx h LEU 160 Ca 0.00 0.00 0.17 0.00 0.09 0.00 0.00 57.88 58.14 2wqx h LEU 160 Cb 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2wqx h LEU 160 CO 0.00 0.00 0.55 1.62 0.09 0.00 0.00 178.44 180.70 2wqx h VAL 161 N 0.00 0.41 -0.02 1.22 3.04 -1.55 0.20 116.25 119.55 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 0.47 0.58 0.00 0.00 -2.01 0.00 0.00 31.29 30.33 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 -3.87 0.03 -2.81 3.17 8.25 -1.16 -4.10 115.22 114.73 2wqx n HIS 162 Ca 0.12 -0.01 -0.26 0.00 -0.26 0.00 0.00 57.72 57.31 2wqx n HIS 162 Cb 0.78 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.87 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 -0.65 4.18 0.09 2.41 4.77 0.70 -4.85 117.00 123.65 2wqx n LEU 163 Ca 0.16 -5.42 0.09 0.00 -0.03 0.00 0.00 56.01 50.80 2wqx n LEU 163 Cb 0.11 -0.40 0.39 0.00 -2.33 0.00 0.00 43.42 41.20 2wqx n LEU 163 CO 0.12 2.29 0.77 -0.81 -1.33 0.00 0.00 177.39 178.42 2wqx n PRO 164 N -0.28 0.11 0.00 3.23 -0.04 -1.26 -1.96 135.00 134.80 2wqx n PRO 164 Ca 0.32 0.44 0.14 0.00 -0.04 0.00 0.00 63.50 64.35 2wqx n PRO 164 Cb 0.51 -1.74 0.53 0.00 -0.04 0.00 0.00 33.50 32.75 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 -1.95 0.21 -1.68 0.54 0.00 -1.26 -4.23 117.38 109.02 2wqx n GLN 165 Ca 0.01 -0.06 -0.44 0.00 0.00 0.00 0.00 57.00 56.51 2wqx n GLN 165 Cb 0.14 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 28.86 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 -1.34 3.26 -0.03 2.61 4.77 -0.83 -4.81 117.00 120.63 2wqx n LEU 166 Ca 0.09 1.15 -0.01 0.00 -0.03 0.00 0.00 56.01 57.21 2wqx n LEU 166 Cb 0.32 -1.45 -0.08 0.00 -2.33 0.00 0.00 43.42 39.88 2wqx n LEU 166 CO 0.28 -0.44 -0.73 -0.62 -1.33 0.00 0.00 177.39 174.55 2wqx n GLU 167 N 1.89 1.60 -3.95 3.23 1.02 -0.51 -2.41 120.64 121.50 2wqx n GLU 167 Ca 0.11 -0.04 -0.19 0.00 -0.02 0.00 0.00 57.16 57.02 2wqx n GLU 167 Cb 0.32 -1.24 -0.17 0.00 -0.02 0.00 0.00 31.44 30.34 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 -3.75 0.81 -0.17 1.62 0.01 -0.60 -1.00 113.70 110.62 2wqx s SER 168 Ca -0.04 -0.06 -0.04 0.00 1.31 0.00 0.00 55.95 57.12 2wqx s SER 168 Cb 0.04 -0.32 0.08 0.00 0.21 0.00 0.00 66.02 66.03 2wqx s SER 168 CO 0.40 -0.11 0.26 -0.22 0.41 0.00 0.00 173.24 173.98 2wqx s LEU 169 N 1.22 -0.27 -0.30 2.44 2.96 -0.07 -0.75 118.68 123.90 2wqx s LEU 169 Ca -0.07 0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 54.08 2wqx s LEU 169 Cb -0.13 0.64 0.03 0.00 0.50 0.00 0.00 46.19 47.22 2wqx s LEU 169 CO -0.02 -0.28 0.04 -0.31 -1.32 0.00 0.00 176.35 174.46 2wqx s TYR 170 N 2.40 3.18 -0.09 5.38 2.02 -0.78 -1.37 117.35 128.09 2wqx s TYR 170 Ca 0.04 -1.42 0.14 0.00 -0.37 0.00 0.00 57.07 55.46 2wqx s TYR 170 Cb -0.14 -2.18 0.28 0.00 -0.40 0.00 0.00 41.96 39.52 2wqx s TYR 170 CO -0.10 -0.70 1.13 1.28 -1.57 0.00 0.00 175.55 175.59 2wqx n LEU 171 N 4.75 1.62 -4.53 -1.29 4.77 0.76 -0.38 117.00 122.69 2wqx n LEU 171 Ca -0.14 -2.59 -0.41 0.00 -0.03 0.00 0.00 56.01 52.84 2wqx n LEU 171 Cb 0.46 -0.27 0.01 0.00 -2.33 0.00 0.00 43.42 41.29 2wqx n LEU 171 CO 0.29 0.73 0.34 0.61 -1.33 0.00 0.00 177.39 178.03 2wqx n GLY 172 N -0.66 -0.83 3.47 -0.72 0.00 -1.14 -3.73 105.19 101.58 2wqx n GLY 172 Ca 0.11 0.08 -0.18 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 0.77 -2.55 0.00 1.61 4.13 0.26 -1.64 115.26 117.84 2wqx n ASN 173 Ca 0.11 -0.68 0.00 0.00 1.68 0.00 0.00 54.58 55.69 2wqx n ASN 173 Cb 0.40 -4.89 0.00 0.00 -1.54 0.00 0.00 39.78 33.75 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 -3.12 1.41 -2.17 6.41 3.02 -1.04 -2.29 115.26 117.49 2wqx n ASN 174 Ca -0.26 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.09 2wqx n ASN 174 Cb 0.66 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.86 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 3.30 -3.16 3.52 4.76 0.30 -4.43 118.16 122.46 2wqx n LYS 175 Ca 0.00 -4.08 -0.39 0.00 -2.87 0.00 0.00 58.31 50.97 2wqx n LYS 175 Cb 0.00 -2.17 -0.06 0.00 -1.84 0.00 0.00 35.03 30.97 2wqx n LYS 175 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2wqx s ILE 176 N -4.51 4.84 -0.06 -0.18 1.01 -1.16 -4.36 121.20 116.77 2wqx s ILE 176 Ca 0.47 1.34 0.03 0.00 0.00 0.00 0.00 60.65 62.49 2wqx s ILE 176 Cb 0.40 -3.97 -0.06 0.00 0.01 0.00 0.00 42.46 38.83 2wqx s ILE 176 CO 0.02 0.42 -0.02 0.35 0.00 0.00 0.00 174.94 175.70 2wqx n THR 177 N 2.63 0.40 -3.61 2.92 -2.24 -1.26 -0.74 114.28 112.37 2wqx n THR 177 Ca -0.06 -0.20 -0.40 0.00 -2.27 0.00 0.00 64.05 61.12 2wqx n THR 177 Cb 0.51 -0.80 -0.10 0.00 -2.10 0.00 0.00 70.33 67.84 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 -4.21 5.62 -0.34 3.42 2.15 -1.26 -4.45 116.67 117.60 2wqx s ASP 178 Ca -0.06 -1.55 0.08 0.00 0.43 0.00 0.00 52.55 51.45 2wqx s ASP 178 Cb 0.02 -1.98 0.61 0.00 -0.30 0.00 0.00 42.92 41.27 2wqx s ASP 178 CO 0.20 -0.55 1.67 2.30 -0.17 0.00 0.00 175.17 178.63 2wqx n ILE 179 N 4.90 2.82 -0.24 4.11 -5.35 -1.26 -4.69 119.36 119.64 2wqx n ILE 179 Ca -0.10 -2.19 0.05 0.00 -0.27 0.00 0.00 62.75 60.24 2wqx n ILE 179 Cb 0.43 -0.37 0.17 0.00 -1.74 0.00 0.00 39.64 38.13 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 1.38 0.58 0.00 7.28 2.02 -1.92 -1.95 112.91 120.30 2wqx h THR 180 Ca 0.35 -0.11 -0.00 0.00 0.77 0.00 0.00 66.41 67.41 2wqx h THR 180 Cb 2.17 0.23 -0.00 0.00 -1.74 0.00 0.00 68.15 68.81 2wqx h THR 180 CO 0.68 0.06 -0.02 1.62 0.37 0.00 0.00 175.52 178.22 2wqx h VAL 181 N 0.32 0.77 0.00 3.16 3.04 -1.92 -2.71 116.25 118.91 2wqx h VAL 181 Ca 0.40 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 66.01 2wqx h VAL 181 Cb 0.64 1.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.97 2wqx h VAL 181 CO -0.46 0.02 0.00 0.18 -1.01 0.00 0.00 177.57 176.30 2wqx n LEU 182 N -4.15 0.31 0.26 3.16 4.77 -0.73 -1.51 117.00 119.10 2wqx n LEU 182 Ca -0.03 0.62 0.15 0.00 -0.03 0.00 0.00 56.01 56.72 2wqx n LEU 182 Cb 0.11 -0.63 0.64 0.00 -2.33 0.00 0.00 43.42 41.21 2wqx n LEU 182 CO 0.31 -0.62 0.94 0.77 -1.33 0.00 0.00 177.39 177.46 2wqx h SER 183 N 0.00 0.00 1.23 -1.43 4.64 -1.49 -1.67 113.55 114.84 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 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2wqx h SER 183 CO 0.00 0.08 -0.03 0.54 -0.87 0.00 0.00 176.83 176.56 2wqx n ARG 184 N -3.24 0.14 -2.62 4.77 5.12 -0.57 -4.43 116.66 115.84 2wqx n ARG 184 Ca 0.00 0.11 -0.42 0.00 -1.93 0.00 0.00 57.85 55.62 2wqx n ARG 184 Cb 0.33 -1.66 0.01 0.00 -1.16 0.00 0.00 32.46 29.98 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 -1.91 7.08 -0.05 0.55 4.32 -0.63 -4.64 117.00 121.72 2wqx n LEU 185 Ca 0.06 -5.17 0.13 0.00 -0.02 0.00 0.00 56.01 51.01 2wqx n LEU 185 Cb 0.39 -1.27 0.73 0.00 -1.62 0.00 0.00 43.42 41.65 2wqx n LEU 185 CO 0.29 1.86 0.97 0.35 -1.22 0.00 0.00 177.39 179.64 2wqx n THR 186 N 1.07 0.01 1.05 -5.08 -2.24 -1.26 -2.55 114.28 105.28 2wqx n THR 186 Ca 0.41 -0.03 0.12 0.00 -2.27 0.00 0.00 64.05 62.28 2wqx n THR 186 Cb 0.29 -0.31 0.09 0.00 -2.10 0.00 0.00 70.33 68.30 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 -0.78 1.43 -1.68 -0.78 4.76 -1.26 -4.59 118.16 115.26 2wqx n LYS 187 Ca 0.19 -1.14 -0.45 0.00 -2.87 0.00 0.00 58.31 54.04 2wqx n LYS 187 Cb 0.12 -1.48 -0.04 0.00 -1.84 0.00 0.00 35.03 31.79 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 0.22 3.62 -0.00 -0.35 4.77 -1.01 -4.38 117.00 119.86 2wqx n LEU 188 Ca 0.11 1.01 0.06 0.00 -0.03 0.00 0.00 56.01 57.16 2wqx n LEU 188 Cb 0.48 -1.46 -0.08 0.00 -2.33 0.00 0.00 43.42 40.02 2wqx n LEU 188 CO 0.25 -0.02 -0.33 -0.90 -1.33 0.00 0.00 177.39 175.06 2wqx n ASP 189 N 5.36 1.37 -3.81 -1.43 5.68 -0.17 -2.90 116.55 120.65 2wqx n ASP 189 Ca 0.19 -0.40 -0.23 0.00 -0.50 0.00 0.00 54.79 53.85 2wqx n ASP 189 Cb 0.33 1.28 -0.17 0.00 -1.14 0.00 0.00 41.12 41.41 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 -2.49 0.51 -0.08 2.12 2.01 -0.87 -1.03 115.64 115.83 2wqx s THR 190 Ca 0.00 0.02 -0.03 0.00 0.31 0.00 0.00 61.69 61.99 2wqx s THR 190 Cb 0.08 -0.63 0.04 0.00 0.01 0.00 0.00 72.50 72.01 2wqx s THR 190 CO 0.50 0.28 0.16 -0.22 -0.69 0.00 0.00 174.62 174.65 2wqx s LEU 191 N 1.81 0.32 -0.15 4.42 2.96 -0.59 -0.89 118.68 126.57 2wqx s LEU 191 Ca 0.03 0.34 0.02 0.00 -0.22 0.00 0.00 54.13 54.30 2wqx s LEU 191 Cb -0.12 0.35 0.01 0.00 0.50 0.00 0.00 46.19 46.93 2wqx s LEU 191 CO -0.05 -0.19 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.03 2wqx s SER 192 N 1.71 3.01 -0.08 3.68 0.15 -0.47 -1.57 113.70 120.14 2wqx s SER 192 Ca -0.03 -0.59 0.11 0.00 0.70 0.00 0.00 55.95 56.14 2wqx s SER 192 Cb -0.12 -1.40 0.19 0.00 -1.71 0.00 0.00 66.02 62.99 2wqx s SER 192 CO -0.06 0.04 1.09 0.18 1.20 0.00 0.00 173.24 175.70 2wqx n LEU 193 N 4.27 1.34 -4.70 3.45 4.77 0.34 -0.17 117.00 126.30 2wqx n LEU 193 Ca -0.20 -2.23 -0.36 0.00 -0.03 0.00 0.00 56.01 53.18 2wqx n LEU 193 Cb 0.51 -0.24 0.08 0.00 -2.33 0.00 0.00 43.42 41.44 2wqx n LEU 193 CO 0.26 0.56 0.80 -1.84 -1.33 0.00 0.00 177.39 175.84 2wqx n GLU 194 N -0.72 0.88 -3.48 3.23 0.28 -0.89 -3.60 120.64 116.34 2wqx n GLU 194 Ca 0.09 0.36 -0.20 0.00 -0.16 0.00 0.00 57.16 57.25 2wqx n GLU 194 Cb 0.70 -2.44 0.06 0.00 1.43 0.00 0.00 31.44 31.18 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 -1.95 -4.37 0.00 -1.84 2.03 -0.22 -0.57 116.55 109.62 2wqx n ASP 195 Ca 0.15 -0.79 0.00 0.00 0.52 0.00 0.00 54.79 54.67 2wqx n ASP 195 Cb 0.48 -4.54 0.00 0.00 -0.72 0.00 0.00 41.12 36.35 2wqx n ASP 195 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2wqx n ASN 196 N -3.05 0.47 -2.56 1.67 3.02 -1.14 -2.48 115.26 111.18 2wqx n ASN 196 Ca -0.16 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.29 2wqx n ASN 196 Cb 0.64 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.84 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 2.30 -3.23 3.52 6.02 0.08 -4.34 117.38 121.73 2wqx n GLN 197 Ca 0.00 -3.73 -0.39 0.00 -0.01 0.00 0.00 57.00 52.87 2wqx n GLN 197 Cb 0.00 -1.79 -0.06 0.00 1.02 0.00 0.00 30.24 29.41 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 -4.06 5.13 -0.19 5.09 1.01 -1.21 -4.41 121.20 122.56 2wqx s ILE 198 Ca 0.35 1.08 -0.12 0.00 0.00 0.00 0.00 60.65 61.96 2wqx s ILE 198 Cb 0.37 -3.88 -0.08 0.00 0.01 0.00 0.00 42.46 38.88 2wqx s ILE 198 CO -0.02 0.27 -0.29 -1.14 0.00 0.00 0.00 174.94 173.77 2wqx n ARG 199 N 3.95 0.46 -2.99 2.79 0.63 -1.25 -0.63 116.66 119.61 2wqx n ARG 199 Ca -0.05 0.20 -0.43 0.00 -0.92 0.00 0.00 57.85 56.65 2wqx n ARG 199 Cb 0.51 -1.28 -0.06 0.00 0.45 0.00 0.00 32.46 32.09 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 -2.51 3.34 0.00 -0.14 3.52 -1.26 -4.64 118.95 117.26 2wqx s ARG 200 Ca -0.29 -0.25 0.18 0.00 -0.13 0.00 0.00 55.73 55.24 2wqx s ARG 200 Cb 0.09 -3.97 0.31 0.00 -1.56 0.00 0.00 34.95 29.82 2wqx s ARG 200 CO 0.38 -1.15 1.23 0.44 -0.81 0.00 0.00 175.30 175.39 2wqx n ILE 201 N 6.04 0.46 -0.33 4.11 -5.35 -1.26 -4.63 119.36 118.39 2wqx n ILE 201 Ca 0.01 -0.73 0.19 0.00 -0.27 0.00 0.00 62.75 61.94 2wqx n ILE 201 Cb 0.48 0.98 0.39 0.00 -1.74 0.00 0.00 39.64 39.75 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 3.46 0.43 0.00 7.28 2.07 -1.92 -1.16 116.25 126.42 2wqx h VAL 202 Ca 0.00 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2wqx h VAL 202 Cb 0.81 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2wqx h VAL 202 CO 0.00 0.08 0.12 -2.65 0.02 0.00 0.00 177.57 175.13 2wqx n PRO 203 N -5.00 0.10 0.00 1.57 -0.02 -1.26 -1.45 135.00 128.95 2wqx n PRO 203 Ca 0.27 0.59 0.13 0.00 -2.02 0.00 0.00 63.50 62.47 2wqx n PRO 203 Cb 0.81 -1.96 0.42 0.00 -0.02 0.00 0.00 33.50 32.74 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 -2.08 0.65 0.12 2.45 4.77 -0.44 -3.37 117.00 119.10 2wqx n LEU 204 Ca -0.01 -0.06 0.04 0.00 -0.03 0.00 0.00 56.01 55.95 2wqx n LEU 204 Cb 0.14 -0.21 0.44 0.00 -2.33 0.00 0.00 43.42 41.46 2wqx n LEU 204 CO 0.07 0.13 0.97 0.00 -1.33 0.00 0.00 177.39 177.23 2wqx h ALA 205 N 3.41 1.62 -0.15 -1.18 0.00 -1.34 -2.49 119.26 119.13 2wqx h ALA 205 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2wqx h ALA 205 Cb 0.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2wqx h ALA 205 CO 0.00 0.28 0.00 0.54 0.00 0.00 0.00 179.25 180.07 2wqx n ARG 206 N -4.35 2.22 -1.32 0.00 5.12 -1.26 -4.68 116.66 112.38 2wqx n ARG 206 Ca -0.00 -1.97 -0.38 0.00 -1.93 0.00 0.00 57.85 53.57 2wqx n ARG 206 Cb 0.20 -1.45 -0.02 0.00 -1.16 0.00 0.00 32.46 30.03 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 1.31 7.43 0.00 0.55 4.32 -0.94 -4.73 117.00 124.95 2wqx n LEU 207 Ca 0.15 -4.00 0.04 0.00 -0.02 0.00 0.00 56.01 52.18 2wqx n LEU 207 Cb 0.57 -1.49 0.18 0.00 -1.62 0.00 0.00 43.42 41.06 2wqx n LEU 207 CO 0.14 1.46 0.63 0.41 -1.22 0.00 0.00 177.39 178.82 2wqx n THR 208 N 4.22 1.42 1.08 -5.08 -1.04 -1.26 -2.01 114.28 111.60 2wqx n THR 208 Ca 0.65 0.36 0.14 0.00 -2.04 0.00 0.00 64.05 63.16 2wqx n THR 208 Cb 0.27 -1.21 0.60 0.00 -1.82 0.00 0.00 70.33 68.17 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 -1.51 0.09 -1.75 -2.82 5.02 -1.26 -4.34 118.16 111.59 2wqx n LYS 209 Ca 0.02 -0.01 -0.42 0.00 -2.02 0.00 0.00 58.31 55.88 2wqx n LYS 209 Cb 0.10 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 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 -2.92 4.39 -0.05 -0.35 1.43 -0.85 -4.31 118.68 116.01 2wqx s LEU 210 Ca 0.16 2.75 0.02 0.00 -1.03 0.00 0.00 54.13 56.03 2wqx s LEU 210 Cb 0.19 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.79 2wqx s LEU 210 CO 0.54 -0.97 -0.02 0.00 0.23 0.00 0.00 176.35 176.12 2wqx n GLN 211 N 5.14 1.69 -4.19 1.70 6.02 -0.19 -3.48 117.38 124.07 2wqx n GLN 211 Ca 0.17 0.01 -0.30 0.00 -0.01 0.00 0.00 57.00 56.87 2wqx n GLN 211 Cb 0.38 -1.10 -0.16 0.00 1.02 0.00 0.00 30.24 30.37 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 -4.02 2.70 -0.07 1.08 -0.87 -0.93 0.15 114.94 112.99 2wqx s ASN 212 Ca -0.05 -0.50 -0.02 0.00 -1.57 0.00 0.00 52.86 50.73 2wqx s ASN 212 Cb 0.02 -1.20 0.03 0.00 -0.02 0.00 0.00 41.25 40.07 2wqx s ASN 212 CO 0.14 -0.02 0.03 -0.22 -2.57 0.00 0.00 177.10 174.46 2wqx s LEU 213 N 1.29 0.41 -0.33 0.60 2.96 -0.13 -1.54 118.68 121.94 2wqx s LEU 213 Ca 0.01 -0.07 -0.05 0.00 -0.22 0.00 0.00 54.13 53.80 2wqx s LEU 213 Cb -0.14 -0.31 0.05 0.00 0.50 0.00 0.00 46.19 46.29 2wqx s LEU 213 CO -0.08 -0.23 0.07 -0.31 -1.32 0.00 0.00 176.35 174.48 2wqx s TYR 214 N 2.06 3.27 -0.01 5.38 2.02 -0.61 -2.08 117.35 127.39 2wqx s TYR 214 Ca 0.05 -1.63 0.01 0.00 -0.37 0.00 0.00 57.07 55.12 2wqx s TYR 214 Cb -0.13 -2.27 0.01 0.00 -0.40 0.00 0.00 41.96 39.18 2wqx s TYR 214 CO -0.05 -0.77 0.86 1.28 -1.57 0.00 0.00 175.55 175.30 2wqx n LEU 215 N 4.73 1.37 -4.67 -1.29 4.77 -0.14 -0.50 117.00 121.27 2wqx n LEU 215 Ca -0.12 -1.43 -0.33 0.00 -0.03 0.00 0.00 56.01 54.09 2wqx n LEU 215 Cb 0.44 -0.02 0.13 0.00 -2.33 0.00 0.00 43.42 41.64 2wqx n LEU 215 CO 0.30 0.35 0.70 -1.54 -1.33 0.00 0.00 177.39 175.87 2wqx n SER 216 N -0.38 0.77 -3.46 -1.43 3.41 -1.11 -3.85 113.62 107.57 2wqx n SER 216 Ca 0.01 0.56 -0.22 0.00 -0.26 0.00 0.00 58.87 58.96 2wqx n SER 216 Cb 0.36 -1.48 0.08 0.00 -0.26 0.00 0.00 64.21 62.90 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 -3.23 -7.48 0.00 4.33 5.02 0.23 -1.06 118.16 115.97 2wqx n LYS 217 Ca 0.13 0.80 0.00 0.00 -2.02 0.00 0.00 58.31 57.22 2wqx n LYS 217 Cb 0.51 -5.76 0.00 0.00 -0.02 0.00 0.00 35.03 29.76 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 -2.89 0.31 -2.52 4.39 3.02 -1.25 -2.90 115.26 113.42 2wqx n ASN 218 Ca -0.04 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.31 2wqx n ASN 218 Cb 0.58 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 2.59 -3.88 3.10 8.25 0.19 -1.21 115.22 124.25 2wqx n HIS 219 Ca 0.00 -2.92 -0.35 0.00 -0.26 0.00 0.00 57.72 54.19 2wqx n HIS 219 Cb 0.00 -0.20 -0.09 0.00 1.12 0.00 0.00 29.99 30.82 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 -4.66 5.00 -0.08 1.59 1.01 -1.24 -3.93 121.20 118.90 2wqx s ILE 220 Ca 0.41 0.04 0.01 0.00 0.00 0.00 0.00 60.65 61.11 2wqx s ILE 220 Cb 0.42 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.62 2wqx s ILE 220 CO -0.10 0.44 0.39 -1.54 0.00 0.00 0.00 174.94 174.13 2wqx n SER 221 N 3.67 0.78 -3.69 3.58 3.41 -1.26 -4.79 113.62 115.31 2wqx n SER 221 Ca -0.16 -0.89 -0.23 0.00 -0.26 0.00 0.00 58.87 57.33 2wqx n SER 221 Cb 0.52 0.28 -0.17 0.00 -0.26 0.00 0.00 64.21 64.58 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 -0.35 1.79 0.00 4.04 2.15 -1.26 -0.38 116.67 122.66 2wqx s ASP 222 Ca 0.01 -0.25 0.26 0.00 0.43 0.00 0.00 52.55 52.99 2wqx s ASP 222 Cb 0.01 -0.31 0.57 0.00 -0.30 0.00 0.00 42.92 42.89 2wqx s ASP 222 CO 0.02 -0.27 1.47 0.18 -0.17 0.00 0.00 175.17 176.40 2wqx n LEU 223 N 5.22 2.28 -0.29 -1.34 4.77 -0.28 -4.48 117.00 122.88 2wqx n LEU 223 Ca -0.06 -0.76 0.10 0.00 -0.03 0.00 0.00 56.01 55.26 2wqx n LEU 223 Cb 0.49 -0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.84 2wqx n LEU 223 CO 0.09 0.38 1.01 0.03 -1.33 0.00 0.00 177.39 177.57 2wqx h ARG 224 N 3.54 0.36 -0.30 3.23 3.08 -1.76 0.13 114.38 122.67 2wqx h ARG 224 Ca 0.00 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.11 2wqx h ARG 224 Cb 0.76 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 2wqx h ARG 224 CO 0.00 0.24 0.38 0.00 -1.07 0.00 0.00 179.97 179.52 2wqx h ALA 225 N 1.67 1.92 -0.01 0.04 0.00 -1.89 -2.14 119.26 118.84 2wqx h ALA 225 Ca 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.40 2wqx h ALA 225 Cb 0.91 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2wqx h ALA 225 CO -0.51 -0.54 -0.26 1.28 0.00 0.00 0.00 179.25 179.22 2wqx n LEU 226 N -3.58 1.22 0.25 0.00 4.77 0.44 -3.77 117.00 116.33 2wqx n LEU 226 Ca 0.05 -0.36 0.09 0.00 -0.03 0.00 0.00 56.01 55.77 2wqx n LEU 226 Cb 0.53 -0.09 0.66 0.00 -2.33 0.00 0.00 43.42 42.18 2wqx n LEU 226 CO 0.25 0.23 1.00 0.08 -1.33 0.00 0.00 177.39 177.61 2wqx h ARG 227 N 1.50 0.00 -0.04 3.23 0.11 -1.44 -2.70 114.38 115.04 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 0.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.63 2wqx h ARG 227 CO 0.00 0.10 0.00 0.41 0.10 0.00 0.00 179.97 180.58 2wqx n GLY 228 N -1.11 -0.21 2.65 0.08 0.00 -1.26 -4.71 105.19 100.64 2wqx n GLY 228 Ca -0.03 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.09 7.39 0.00 0.99 4.77 -1.02 -4.71 117.00 124.34 2wqx n LEU 229 Ca 0.19 -4.52 0.10 0.00 -0.03 0.00 0.00 56.01 51.75 2wqx n LEU 229 Cb 0.28 -1.51 0.52 0.00 -2.33 0.00 0.00 43.42 40.38 2wqx n LEU 229 CO 0.16 1.58 0.83 2.29 -1.33 0.00 0.00 177.39 180.92 2wqx n LYS 230 N 3.92 0.27 -0.52 3.23 2.85 -1.26 -2.66 118.16 123.98 2wqx n LYS 230 Ca 0.55 0.09 0.10 0.00 -1.05 0.00 0.00 58.31 58.00 2wqx n LYS 230 Cb 0.32 -1.50 0.34 0.00 -0.65 0.00 0.00 35.03 33.54 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 -1.31 4.44 -4.73 -5.58 3.02 -1.26 -4.17 115.26 105.68 2wqx n ASN 231 Ca 0.09 -2.27 -0.42 0.00 -0.03 0.00 0.00 54.58 51.95 2wqx n ASN 231 Cb 0.17 -0.54 -0.03 0.00 -0.61 0.00 0.00 39.78 38.78 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 -1.52 4.37 -0.18 3.41 1.43 -1.09 -4.34 118.68 120.76 2wqx s LEU 232 Ca 0.50 2.64 0.09 0.00 -1.03 0.00 0.00 54.13 56.33 2wqx s LEU 232 Cb 0.30 -3.60 -0.17 0.00 0.03 0.00 0.00 46.19 42.74 2wqx s LEU 232 CO 0.28 -0.79 -0.05 0.47 0.23 0.00 0.00 176.35 176.48 2wqx n ASP 233 N 3.48 1.58 -3.74 2.29 8.00 0.12 -0.21 116.55 128.06 2wqx n ASP 233 Ca 0.12 -0.05 -0.20 0.00 0.71 0.00 0.00 54.79 55.37 2wqx n ASP 233 Cb 0.39 0.35 -0.17 0.00 -0.02 0.00 0.00 41.12 41.67 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 0.12 -0.04 2.53 1.01 -0.41 -4.47 120.40 116.73 2wqx s VAL 234 Ca -0.17 0.24 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 2wqx s VAL 234 Cb 0.06 -0.30 0.03 0.00 0.00 0.00 0.00 36.38 36.18 2wqx s VAL 234 CO 0.59 0.19 0.08 -0.22 0.00 0.00 0.00 175.10 175.74 2wqx s LEU 235 N 1.78 0.73 -0.07 3.92 2.96 -1.26 -0.95 118.68 125.79 2wqx s LEU 235 Ca 0.01 0.15 0.03 0.00 -0.22 0.00 0.00 54.13 54.10 2wqx s LEU 235 Cb -0.12 0.09 0.00 0.00 0.50 0.00 0.00 46.19 46.66 2wqx s LEU 235 CO -0.03 -0.16 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.05 2wqx s GLU 236 N 1.37 2.08 -0.02 1.98 2.02 -0.88 -4.42 118.70 120.83 2wqx s GLU 236 Ca -0.06 -0.60 0.08 0.00 0.02 0.00 0.00 54.97 54.41 2wqx s GLU 236 Cb -0.12 -1.69 0.15 0.00 0.10 0.00 0.00 34.13 32.56 2wqx s GLU 236 CO -0.04 0.14 1.06 1.28 0.02 0.00 0.00 175.26 177.72 2wqx n LEU 237 N 3.51 0.54 -4.76 1.80 4.77 -1.26 -0.97 117.00 120.63 2wqx n LEU 237 Ca -0.20 -1.52 -0.38 0.00 -0.03 0.00 0.00 56.01 53.87 2wqx n LEU 237 Cb 0.52 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2wqx n LEU 237 CO 0.26 0.39 0.96 -0.36 -1.33 0.00 0.00 177.39 177.31 2wqx s PHE 238 N -0.35 2.52 -0.89 -1.77 0.08 -1.21 -3.67 117.98 112.68 2wqx s PHE 238 Ca 0.12 1.40 -0.05 0.00 0.12 0.00 0.00 56.93 58.53 2wqx s PHE 238 Cb 0.13 -3.71 -0.02 0.00 -0.57 0.00 0.00 43.02 38.85 2wqx s PHE 238 CO -0.04 -2.48 0.77 0.43 -0.10 0.00 0.00 175.22 173.80 2wqx n SER 239 N -0.61 -6.89 -4.84 1.36 7.64 -1.04 0.75 113.62 109.99 2wqx n SER 239 Ca 0.08 -0.47 -0.35 0.00 1.01 0.00 0.00 58.87 59.14 2wqx n SER 239 Cb 0.45 -4.72 -0.06 0.00 -1.01 0.00 0.00 64.21 58.87 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 -3.98 3.98 -0.19 1.43 -1.52 -0.59 -2.06 119.66 116.74 2wqx s GLN 240 Ca 0.20 0.49 -0.00 0.00 -1.95 0.00 0.00 55.36 54.10 2wqx s GLN 240 Cb -0.04 -2.94 0.01 0.00 -0.22 0.00 0.00 33.01 29.82 2wqx s GLN 240 CO 0.77 0.48 -0.16 -1.21 -0.25 0.00 0.00 175.29 174.93 2wqx s GLU 241 N -1.94 3.10 -0.04 2.91 2.02 -0.35 -0.93 118.70 123.46 2wqx s GLU 241 Ca 0.38 -0.77 0.01 0.00 0.02 0.00 0.00 54.97 54.60 2wqx s GLU 241 Cb -0.15 -2.69 -0.03 0.00 0.10 0.00 0.00 34.13 31.36 2wqx s GLU 241 CO 0.19 -0.21 -0.02 0.00 0.02 0.00 0.00 175.26 175.24 2wqx s ALA 242 N 1.34 3.18 -0.21 5.21 0.00 0.87 -4.00 121.76 128.14 2wqx s ALA 242 Ca 0.05 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 51.13 2wqx s ALA 242 Cb -0.13 -1.33 0.04 0.00 0.00 0.00 0.00 23.12 21.70 2wqx s ALA 242 CO -0.10 0.61 -0.14 -1.17 0.00 0.00 0.00 175.76 174.95 2wqx s LEU 243 N -1.16 2.59 0.56 0.00 2.96 -1.26 -0.55 118.68 121.82 2wqx s LEU 243 Ca 0.16 -0.95 -0.17 0.00 -0.22 0.00 0.00 54.13 52.95 2wqx s LEU 243 Cb -0.11 -1.43 -0.05 0.00 0.50 0.00 0.00 46.19 45.09 2wqx s LEU 243 CO 0.05 -0.10 1.05 0.20 -1.32 0.00 0.00 176.35 176.23 2wqx s ASN 244 N 1.26 5.99 0.48 3.68 0.01 0.62 -4.96 114.94 122.02 2wqx s ASN 244 Ca -0.01 1.84 -0.22 0.00 -0.71 0.00 0.00 52.86 53.76 2wqx s ASN 244 Cb -0.16 -2.54 -0.07 0.00 0.41 0.00 0.00 41.25 38.89 2wqx s ASN 244 CO -0.09 -1.02 1.15 -0.54 -1.51 0.00 0.00 177.10 175.08 2wqx s LYS 245 N -3.83 3.69 0.40 -0.60 1.02 -1.26 -4.36 119.74 114.80 2wqx s LYS 245 Ca 0.64 1.71 -0.27 0.00 0.02 0.00 0.00 55.97 58.08 2wqx s LYS 245 Cb -0.16 -2.31 -0.09 0.00 -0.52 0.00 0.00 37.83 34.74 2wqx s LYS 245 CO 0.32 -0.59 1.40 -2.14 -0.92 0.00 0.00 175.35 173.41 2wqx s PRO 246 N -2.84 3.97 0.38 -1.68 0.02 -1.26 -4.70 135.00 128.90 2wqx s PRO 246 Ca 0.65 2.37 0.05 0.00 0.02 0.00 0.00 61.00 64.10 2wqx s PRO 246 Cb -0.27 -2.83 -0.07 0.00 0.02 0.00 0.00 34.50 31.35 2wqx s PRO 246 CO 0.32 -0.57 0.03 0.96 -0.33 0.00 0.00 177.00 177.41 2wqx s ILE 247 N -1.18 1.60 0.27 2.83 -4.36 -1.11 -4.96 121.20 114.29 2wqx s ILE 247 Ca 0.56 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.65 2wqx s ILE 247 Cb -0.43 -2.86 -0.09 0.00 1.25 0.00 0.00 42.46 40.33 2wqx s ILE 247 CO 0.56 0.00 1.06 0.20 0.24 0.00 0.00 174.94 177.00 2wqx s ASN 248 N -3.63 7.36 0.48 4.36 0.01 -1.26 -0.04 114.94 122.21 2wqx s ASN 248 Ca 0.34 2.19 -0.24 0.00 -0.71 0.00 0.00 52.86 54.44 2wqx s ASN 248 Cb 0.09 -2.62 -0.07 0.00 0.41 0.00 0.00 41.25 39.06 2wqx s ASN 248 CO 0.16 -0.08 1.35 -2.28 -1.51 0.00 0.00 177.10 174.74 2wqx s HIS 249 N -1.12 2.51 0.02 2.20 5.65 0.61 -4.71 115.29 120.46 2wqx s HIS 249 Ca 0.44 1.36 0.01 0.00 0.25 0.00 0.00 55.06 57.12 2wqx s HIS 249 Cb -0.30 -3.77 -0.02 0.00 -1.18 0.00 0.00 32.58 27.31 2wqx s HIS 249 CO 0.39 -2.60 -0.04 -0.65 -0.65 0.00 0.00 174.74 171.18 2wqx s GLN 250 N -2.60 0.36 0.40 2.88 -1.52 -1.26 -4.98 119.66 112.93 2wqx s GLN 250 Ca 0.64 -0.54 0.10 0.00 -1.95 0.00 0.00 55.36 53.62 2wqx s GLN 250 Cb -0.40 -0.09 0.82 0.00 -0.22 0.00 0.00 33.01 33.11 2wqx s GLN 250 CO 0.49 0.01 1.93 0.66 -0.25 0.00 0.00 175.29 178.13 2wqx h SER 251 N 4.93 0.19 -4.16 5.90 4.64 -1.92 -3.30 113.55 119.84 2wqx h SER 251 Ca -0.32 -0.04 -0.67 0.00 -0.47 0.00 0.00 61.79 60.30 2wqx h SER 251 Cb 1.21 -0.05 -0.38 0.00 -0.31 0.00 0.00 62.40 62.86 2wqx h SER 251 CO 0.43 0.35 -0.54 0.20 -0.87 0.00 0.00 176.83 176.41 2wqx s ASN 252 N -6.89 4.76 0.04 4.97 0.01 -1.26 -0.03 114.94 116.54 2wqx s ASN 252 Ca -0.05 -2.80 -0.14 0.00 -0.71 0.00 0.00 52.86 49.16 2wqx s ASN 252 Cb 0.15 -1.73 -0.06 0.00 0.41 0.00 0.00 41.25 40.03 2wqx s ASN 252 CO 0.73 -0.32 0.43 -0.22 -1.51 0.00 0.00 177.10 176.21 2wqx s LEU 253 N 0.01 4.43 -0.06 0.60 2.96 0.03 -4.94 118.68 121.72 2wqx s LEU 253 Ca 0.16 0.95 0.00 0.00 -0.22 0.00 0.00 54.13 55.02 2wqx s LEU 253 Cb -0.23 -2.76 0.02 0.00 0.50 0.00 0.00 46.19 43.72 2wqx s LEU 253 CO -0.02 0.26 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.55 2wqx s VAL 254 N -1.20 0.53 -0.08 1.68 1.01 -1.26 -2.00 120.40 119.09 2wqx s VAL 254 Ca 0.28 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 62.18 2wqx s VAL 254 Cb -0.16 -0.59 0.03 0.00 0.00 0.00 0.00 36.38 35.65 2wqx s VAL 254 CO 0.15 0.25 -0.03 -0.69 0.00 0.00 0.00 175.10 174.78 2wqx s VAL 255 N 1.28 0.61 0.21 2.92 1.01 0.28 -4.99 120.40 121.72 2wqx s VAL 255 Ca -0.05 -0.06 -0.32 0.00 0.00 0.00 0.00 61.98 61.55 2wqx s VAL 255 Cb -0.14 -0.70 -0.11 0.00 0.00 0.00 0.00 36.38 35.43 2wqx s VAL 255 CO -0.02 0.29 1.66 -2.84 0.00 0.00 0.00 175.10 174.19 2wqx s PRO 256 N 1.64 4.15 0.19 2.72 0.02 -1.26 -0.83 135.00 141.62 2wqx s PRO 256 Ca 0.01 2.54 -0.31 0.00 0.02 0.00 0.00 61.00 63.26 2wqx s PRO 256 Cb -0.13 -3.09 -0.09 0.00 0.02 0.00 0.00 34.50 31.21 2wqx s PRO 256 CO -0.05 -0.70 1.42 1.21 -0.33 0.00 0.00 177.00 178.55 2wqx s ASN 257 N 1.08 6.75 0.00 2.53 2.47 -0.08 -4.86 114.94 122.83 2wqx s ASN 257 Ca 0.72 2.50 0.03 0.00 0.42 0.00 0.00 52.86 56.53 2wqx s ASN 257 Cb -0.48 -2.61 0.05 0.00 -1.45 0.00 0.00 41.25 36.77 2wqx s ASN 257 CO 0.34 -0.67 0.83 0.35 -3.72 0.00 0.00 177.10 174.23 2wqx n THR 258 N 3.11 0.49 -2.95 -5.21 -2.24 -1.26 -4.97 114.28 101.25 2wqx n THR 258 Ca 0.09 -0.75 -0.41 0.00 -2.27 0.00 0.00 64.05 60.71 2wqx n THR 258 Cb 0.41 0.78 -0.05 0.00 -2.10 0.00 0.00 70.33 69.38 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 -0.62 4.87 -0.04 2.28 1.01 -1.26 -4.65 120.40 121.99 2wqx s VAL 259 Ca 0.05 1.42 0.03 0.00 0.00 0.00 0.00 61.98 63.49 2wqx s VAL 259 Cb 0.03 -4.07 0.00 0.00 0.00 0.00 0.00 36.38 32.34 2wqx s VAL 259 CO 0.04 -0.06 -0.14 -0.54 0.00 0.00 0.00 175.10 174.40 2wqx s LYS 260 N 2.76 1.56 0.98 2.72 1.02 0.49 0.19 119.74 129.46 2wqx s LYS 260 Ca 0.32 -0.49 -0.17 0.00 0.02 0.00 0.00 55.97 55.65 2wqx s LYS 260 Cb -0.15 -1.36 0.23 0.00 -0.52 0.00 0.00 37.83 36.03 2wqx s LYS 260 CO 0.08 0.17 1.13 -1.71 -0.92 0.00 0.00 175.35 174.10 2wqx n ASN 261 N 3.31 -0.73 0.21 2.83 2.85 0.19 -1.12 115.26 122.81 2wqx n ASN 261 Ca -0.19 -1.31 0.06 0.00 -0.11 0.00 0.00 54.58 53.03 2wqx n ASN 261 Cb 0.53 -0.92 0.47 0.00 1.24 0.00 0.00 39.78 41.10 2wqx n ASN 261 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 2wqx h THR 262 N -2.07 1.05 -0.01 -0.44 1.35 -1.89 0.18 112.91 111.09 2wqx h THR 262 Ca -0.39 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 64.49 2wqx h THR 262 Cb 1.11 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 2wqx h THR 262 CO 0.26 0.27 -0.01 -0.90 -0.25 0.00 0.00 175.52 174.89 2wqx n ASP 263 N -4.00 0.52 0.00 5.36 5.75 -1.26 -4.35 116.55 118.57 2wqx n ASP 263 Ca -0.02 -1.09 0.00 0.00 -0.01 0.00 0.00 54.79 53.67 2wqx n ASP 263 Cb 0.34 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 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 1.09 2.31 3.73 6.12 0.00 0.65 -5.05 105.19 114.04 2wqx n GLY 264 Ca 0.21 0.00 -0.37 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 -2.08 4.55 0.04 1.61 1.04 -1.26 -4.54 113.70 113.06 2wqx s SER 265 Ca 0.00 2.59 -0.29 0.00 0.48 0.00 0.00 55.95 58.73 2wqx s SER 265 Cb 0.00 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 2wqx s SER 265 CO 0.00 -2.04 0.92 -0.76 0.98 0.00 0.00 173.24 172.34 2wqx s LEU 266 N -4.46 4.42 -0.22 2.42 1.43 -1.26 -0.63 118.68 120.37 2wqx s LEU 266 Ca 0.82 1.63 -0.28 0.00 -1.03 0.00 0.00 54.13 55.27 2wqx s LEU 266 Cb -0.36 -3.49 0.01 0.00 0.03 0.00 0.00 46.19 42.37 2wqx s LEU 266 CO 0.40 -0.15 1.00 -0.69 0.23 0.00 0.00 176.35 177.14 2wqx s VAL 267 N 0.51 4.72 0.29 -1.59 1.01 0.13 -4.91 120.40 120.56 2wqx s VAL 267 Ca 0.47 1.94 -0.30 0.00 0.00 0.00 0.00 61.98 64.09 2wqx s VAL 267 Cb -0.21 -4.27 -0.11 0.00 0.00 0.00 0.00 36.38 31.78 2wqx s VAL 267 CO 0.27 -0.15 1.57 -0.89 0.00 0.00 0.00 175.10 175.91 2wqx s THR 268 N 3.04 2.13 0.58 3.92 2.01 -1.26 -4.81 115.64 121.26 2wqx s THR 268 Ca 0.43 0.11 -0.14 0.00 0.31 0.00 0.00 61.69 62.39 2wqx s THR 268 Cb -0.15 -3.07 -0.05 0.00 0.01 0.00 0.00 72.50 69.24 2wqx s THR 268 CO 0.07 0.02 1.02 -2.84 -0.69 0.00 0.00 174.62 172.20 2wqx s PRO 269 N -0.52 3.60 -0.26 4.92 0.02 -1.26 -4.56 135.00 136.94 2wqx s PRO 269 Ca 0.63 0.95 0.01 0.00 0.02 0.00 0.00 61.00 62.61 2wqx s PRO 269 Cb -0.47 -2.08 -0.17 0.00 0.02 0.00 0.00 34.50 31.80 2wqx s PRO 269 CO 0.48 -0.56 -0.23 -1.91 -0.33 0.00 0.00 177.00 174.44 2wqx n GLU 270 N -2.17 0.64 -4.28 5.54 2.13 0.17 -4.93 120.64 117.73 2wqx n GLU 270 Ca 0.07 0.15 -0.20 0.00 0.66 0.00 0.00 57.16 57.84 2wqx n GLU 270 Cb 0.54 -1.51 -0.16 0.00 0.27 0.00 0.00 31.44 30.58 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 -2.51 0.68 -0.10 6.31 1.01 -0.98 -4.99 121.20 120.62 2wqx s ILE 271 Ca -0.35 -0.24 0.01 0.00 0.00 0.00 0.00 60.65 60.08 2wqx s ILE 271 Cb 0.09 -0.65 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 2wqx s ILE 271 CO 0.59 0.24 -0.12 -0.63 0.00 0.00 0.00 174.94 175.02 2wqx s ILE 272 N 0.66 3.24 1.06 2.92 1.01 -1.26 -0.22 121.20 128.60 2wqx s ILE 272 Ca -0.10 -0.62 -0.12 0.00 0.00 0.00 0.00 60.65 59.81 2wqx s ILE 272 Cb -0.13 -2.33 0.22 0.00 0.01 0.00 0.00 42.46 40.23 2wqx s ILE 272 CO 0.01 0.55 1.07 -0.94 0.00 0.00 0.00 174.94 175.63 2wqx s SER 273 N -0.16 1.87 -1.48 3.58 1.04 0.62 -4.09 113.70 115.07 2wqx s SER 273 Ca 0.00 1.70 -0.03 0.00 0.48 0.00 0.00 55.95 58.10 2wqx s SER 273 Cb -0.13 -2.35 0.00 0.00 0.10 0.00 0.00 66.02 63.64 2wqx s SER 273 CO 0.03 -3.67 0.16 0.47 0.98 0.00 0.00 173.24 171.21 2wqx n ASP 274 N -4.58 0.21 -2.45 7.02 8.00 -1.26 -0.85 116.55 122.64 2wqx n ASP 274 Ca 0.06 -1.21 -0.12 0.00 0.71 0.00 0.00 54.79 54.23 2wqx n ASP 274 Cb 0.54 -2.00 -0.01 0.00 -0.02 0.00 0.00 41.12 39.63 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 -2.86 -3.79 -4.74 -2.24 2.03 -1.26 -4.75 116.55 98.94 2wqx n ASP 275 Ca -0.31 0.20 -0.29 0.00 0.52 0.00 0.00 54.79 54.92 2wqx n ASP 275 Cb 0.69 -3.23 0.15 0.00 -0.72 0.00 0.00 41.12 38.01 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 -2.03 1.57 0.34 0.27 0.00 -0.03 -4.82 107.32 102.62 2wqx s GLY 276 Ca 0.00 -0.43 0.06 0.00 0.00 0.00 0.00 44.72 44.34 2wqx s GLY 276 CO 0.00 0.14 0.22 0.51 0.00 0.00 0.00 173.10 173.98 2wqx s ASP 277 N -3.77 1.84 -0.06 1.64 1.47 -0.16 -4.77 116.67 112.86 2wqx s ASP 277 Ca 0.64 -1.70 0.03 0.00 1.18 0.00 0.00 52.55 52.71 2wqx s ASP 277 Cb -0.16 0.52 0.01 0.00 -0.34 0.00 0.00 42.92 42.94 2wqx s ASP 277 CO 0.55 -1.00 -0.15 -0.47 0.68 0.00 0.00 175.17 174.78 2wqx s TYR 278 N -3.45 1.62 -0.32 2.11 5.04 -1.26 -0.87 117.35 120.22 2wqx s TYR 278 Ca 0.36 -0.55 -0.02 0.00 -2.44 0.00 0.00 57.07 54.42 2wqx s TYR 278 Cb 0.03 -1.14 0.11 0.00 0.35 0.00 0.00 41.96 41.31 2wqx s TYR 278 CO 0.22 -0.24 0.15 -2.00 -1.34 0.00 0.00 175.55 172.34 2wqx s GLU 279 N 0.38 0.55 -0.00 4.97 2.12 0.79 -5.01 118.70 122.50 2wqx s GLU 279 Ca -0.11 -1.02 -0.37 0.00 0.36 0.00 0.00 54.97 53.83 2wqx s GLU 279 Cb -0.14 -1.58 -0.16 0.00 0.26 0.00 0.00 34.13 32.51 2wqx s GLU 279 CO 0.04 -1.06 1.47 1.17 -0.54 0.00 0.00 175.26 176.33 2wqx n LYS 280 N 4.70 1.24 -0.49 4.30 4.81 -1.26 -0.61 118.16 130.84 2wqx n LYS 280 Ca 0.00 0.45 0.10 0.00 -0.87 0.00 0.00 58.31 58.00 2wqx n LYS 280 Cb 0.40 -2.12 0.33 0.00 0.02 0.00 0.00 35.03 33.67 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 3.40 3.19 -4.69 1.64 -0.04 -1.26 -5.10 135.00 132.14 2wqx n PRO 281 Ca 0.20 -2.69 -0.34 0.00 -0.04 0.00 0.00 63.50 60.64 2wqx n PRO 281 Cb 0.18 -1.73 -0.12 0.00 -0.04 0.00 0.00 33.50 31.80 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 -0.93 4.49 0.02 3.54 0.02 0.22 -0.90 114.94 121.39 2wqx s ASN 282 Ca 0.49 -0.07 -0.12 0.00 -1.02 0.00 0.00 52.86 52.13 2wqx s ASN 282 Cb 0.29 -1.13 -0.06 0.00 0.02 0.00 0.00 41.25 40.38 2wqx s ASN 282 CO 0.28 0.35 0.39 -0.69 0.02 0.00 0.00 177.10 177.44 2wqx s VAL 283 N -0.72 5.09 0.00 1.60 1.01 -0.01 -0.15 120.40 127.22 2wqx s VAL 283 Ca 0.11 0.64 0.01 0.00 0.00 0.00 0.00 61.98 62.75 2wqx s VAL 283 Cb -0.11 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 2wqx s VAL 283 CO 0.01 0.47 -0.05 -0.54 0.00 0.00 0.00 175.10 174.99 2wqx s LYS 284 N -1.40 0.39 -0.04 2.72 1.02 -0.05 -0.55 119.74 121.83 2wqx s LYS 284 Ca 0.27 -0.27 -0.02 0.00 0.02 0.00 0.00 55.97 55.96 2wqx s LYS 284 Cb -0.15 -0.33 0.02 0.00 -0.52 0.00 0.00 37.83 36.84 2wqx s LYS 284 CO 0.15 0.09 0.09 -1.58 -0.92 0.00 0.00 175.35 173.17 2wqx s TRP 285 N -0.35 -0.09 -0.44 3.18 0.51 -0.85 -0.99 118.94 119.91 2wqx s TRP 285 Ca -0.01 0.26 -0.21 0.00 -2.12 0.00 0.00 56.10 54.02 2wqx s TRP 285 Cb -0.03 -0.04 0.02 0.00 -0.81 0.00 0.00 33.47 32.61 2wqx s TRP 285 CO -0.00 -0.08 0.69 -1.58 -0.51 0.00 0.00 176.95 175.47 2wqx s HIS 286 N 0.45 3.05 -0.78 -1.98 5.65 -1.26 -0.79 115.29 119.63 2wqx s HIS 286 Ca -0.03 0.03 0.03 0.00 0.25 0.00 0.00 55.06 55.33 2wqx s HIS 286 Cb -0.05 -3.44 0.24 0.00 -1.18 0.00 0.00 32.58 28.15 2wqx s HIS 286 CO -0.02 -0.90 0.82 1.28 -0.65 0.00 0.00 174.74 175.27 2wqx n LEU 287 N 6.40 4.12 0.34 8.88 4.77 0.96 -4.96 117.00 137.51 2wqx n LEU 287 Ca -0.00 -5.29 0.23 0.00 -0.03 0.00 0.00 56.01 50.91 2wqx n LEU 287 Cb 0.48 -0.88 1.20 0.00 -2.33 0.00 0.00 43.42 41.89 2wqx n LEU 287 CO 0.55 1.83 1.18 1.55 -1.33 0.00 0.00 177.39 181.17 2wqx h PRO 288 N 5.03 0.00 -6.34 3.23 0.13 -1.91 -3.37 132.00 128.77 2wqx h PRO 288 Ca 0.18 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.70 2wqx h PRO 288 Cb 0.71 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.69 2wqx h PRO 288 CO 0.89 0.00 -0.75 -1.21 -0.23 0.00 0.00 178.00 176.71 2wqx s GLU 289 N -4.14 1.82 0.38 0.86 8.01 -1.26 -5.01 118.70 119.35 2wqx s GLU 289 Ca -0.05 -1.57 -0.26 0.00 0.01 0.00 0.00 54.97 53.10 2wqx s GLU 289 Cb 0.13 -1.92 -0.11 0.00 -4.31 0.00 0.00 34.13 27.91 2wqx s GLU 289 CO 0.42 0.37 1.16 0.34 0.01 0.00 0.00 175.26 177.56 2wqx n PHE 290 N -0.37 1.78 -3.91 1.61 7.35 -1.26 -5.00 117.46 117.66 2wqx n PHE 290 Ca -0.08 0.56 -0.10 0.00 -0.76 0.00 0.00 57.45 57.07 2wqx n PHE 290 Cb 0.58 -2.33 -0.10 0.00 0.35 0.00 0.00 39.48 37.98 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 -1.17 0.11 -2.05 -2.13 -1.32 -1.26 -5.06 115.64 102.76 2wqx s THR 291 Ca 0.59 -0.89 0.30 0.00 -1.21 0.00 0.00 61.69 60.49 2wqx s THR 291 Cb -0.57 -0.57 0.66 0.00 -1.51 0.00 0.00 72.50 70.51 2wqx s THR 291 CO 0.59 -0.49 1.97 -0.46 -2.21 0.00 0.00 174.62 174.02 2wqx n ASN 292 N 1.22 0.60 -3.61 8.08 0.23 -1.26 -4.60 115.26 115.93 2wqx n ASN 292 Ca -0.22 -1.02 -0.09 0.00 -0.53 0.00 0.00 54.58 52.72 2wqx n ASN 292 Cb 0.56 -0.02 -0.06 0.00 -2.08 0.00 0.00 39.78 38.18 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 -2.14 0.51 0.36 -3.83 2.12 -1.26 -0.79 118.70 113.66 2wqx s GLU 293 Ca 0.39 0.33 0.03 0.00 0.36 0.00 0.00 54.97 56.08 2wqx s GLU 293 Cb 0.21 0.25 -0.05 0.00 0.26 0.00 0.00 34.13 34.80 2wqx s GLU 293 CO 0.39 -0.12 0.08 0.14 -0.54 0.00 0.00 175.26 175.22 2wqx s VAL 294 N -0.49 0.94 0.23 3.70 -7.23 -0.86 -4.95 120.40 111.75 2wqx s VAL 294 Ca 0.01 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 57.96 2wqx s VAL 294 Cb -0.03 -2.60 0.04 0.00 0.56 0.00 0.00 36.38 34.35 2wqx s VAL 294 CO -0.03 0.00 0.68 -0.94 -0.31 0.00 0.00 175.10 174.50 2wqx s SER 295 N -3.53 -0.37 0.07 4.85 1.04 -1.26 -0.60 113.70 113.90 2wqx s SER 295 Ca 0.31 -0.38 -0.12 0.00 0.48 0.00 0.00 55.95 56.24 2wqx s SER 295 Cb 0.06 0.68 0.01 0.00 0.10 0.00 0.00 66.02 66.87 2wqx s SER 295 CO 0.15 -1.20 0.26 0.72 0.98 0.00 0.00 173.24 174.15 2wqx s PHE 296 N -3.85 -0.00 -0.01 5.02 -0.12 -0.80 -0.28 117.98 117.94 2wqx s PHE 296 Ca 0.07 -0.28 0.07 0.00 -0.05 0.00 0.00 56.93 56.74 2wqx s PHE 296 Cb -0.04 0.05 -0.02 0.00 -0.63 0.00 0.00 43.02 42.37 2wqx s PHE 296 CO -0.00 -0.54 -0.21 0.42 -0.05 0.00 0.00 175.22 174.83 2wqx s ILE 297 N -3.24 2.49 0.05 -4.49 1.01 0.69 -0.41 121.20 117.30 2wqx s ILE 297 Ca -0.00 -1.04 0.04 0.00 0.00 0.00 0.00 60.65 59.65 2wqx s ILE 297 Cb 0.02 -1.95 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 2wqx s ILE 297 CO -0.08 0.52 -0.11 0.72 0.00 0.00 0.00 174.94 175.99 2wqx s PHE 298 N -0.72 0.98 -0.12 3.97 -0.12 -0.33 0.46 117.98 122.09 2wqx s PHE 298 Ca 0.11 -0.42 -0.08 0.00 -0.05 0.00 0.00 56.93 56.49 2wqx s PHE 298 Cb -0.10 -0.57 0.04 0.00 -0.63 0.00 0.00 43.02 41.75 2wqx s PHE 298 CO 0.01 0.00 0.30 -0.47 -0.05 0.00 0.00 175.22 175.01 2wqx s TYR 299 N -1.12 -0.39 -0.06 3.49 5.04 -1.26 -1.55 117.35 121.50 2wqx s TYR 299 Ca -0.03 0.90 -0.03 0.00 -2.44 0.00 0.00 57.07 55.47 2wqx s TYR 299 Cb -0.09 0.12 0.04 0.00 0.35 0.00 0.00 41.96 42.38 2wqx s TYR 299 CO 0.01 -0.22 0.12 -1.14 -1.34 0.00 0.00 175.55 172.97 2wqx s GLN 300 N 0.81 -0.01 0.09 4.97 2.00 0.16 -4.92 119.66 122.76 2wqx s GLN 300 Ca -0.05 0.46 -0.31 0.00 -2.00 0.00 0.00 55.36 53.46 2wqx s GLN 300 Cb -0.06 -0.35 -0.07 0.00 0.80 0.00 0.00 33.01 33.33 2wqx s GLN 300 CO -0.05 -0.30 1.27 -1.25 -0.50 0.00 0.00 175.29 174.46 2wqx s PRO 301 N 2.09 4.39 0.10 1.67 0.04 -1.26 -1.51 135.00 140.51 2wqx s PRO 301 Ca 0.02 1.88 0.10 0.00 0.04 0.00 0.00 61.00 63.04 2wqx s PRO 301 Cb -0.12 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.08 2wqx s PRO 301 CO -0.05 -0.31 -0.24 0.14 0.04 0.00 0.00 177.00 176.58 2wqx s VAL 302 N 1.03 2.40 -0.15 -0.36 -7.23 0.62 -4.95 120.40 111.76 2wqx s VAL 302 Ca 0.61 -1.56 0.02 0.00 -1.81 0.00 0.00 61.98 59.24 2wqx s VAL 302 Cb -0.32 -2.04 0.01 0.00 0.56 0.00 0.00 36.38 34.59 2wqx s VAL 302 CO 0.30 0.19 -0.19 -0.89 -0.31 0.00 0.00 175.10 174.19 2wqx s THR 303 N -1.00 2.29 -0.06 5.32 2.01 -1.26 -0.92 115.64 122.02 2wqx s THR 303 Ca 0.14 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.27 2wqx s THR 303 Cb -0.10 -1.94 0.01 0.00 0.01 0.00 0.00 72.50 70.48 2wqx s THR 303 CO 0.06 0.54 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.76 2wqx s ILE 304 N 0.83 1.18 0.00 1.82 1.01 -0.53 -5.00 121.20 120.51 2wqx s ILE 304 Ca -0.06 -0.52 0.00 0.00 0.00 0.00 0.00 60.65 60.07 2wqx s ILE 304 Cb -0.15 -1.07 0.00 0.00 0.01 0.00 0.00 42.46 41.25 2wqx s ILE 304 CO -0.02 0.36 0.00 0.61 0.00 0.00 0.00 174.94 175.90 2wqx n GLY 305 N 3.71 3.95 1.24 6.18 0.00 -1.26 -0.24 105.19 118.77 2wqx n GLY 305 Ca -0.22 0.01 0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 13.98 2.79 -4.12 1.61 5.02 0.70 -4.94 118.16 133.21 2wqx n LYS 306 Ca 0.00 -2.57 -0.30 0.00 -2.02 0.00 0.00 58.31 53.42 2wqx n LYS 306 Cb 0.00 -1.53 -0.08 0.00 -0.02 0.00 0.00 35.03 33.40 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 -1.03 3.35 -0.03 7.82 0.00 0.67 -4.79 121.76 127.75 2wqx s ALA 307 Ca 0.45 -1.08 0.06 0.00 0.00 0.00 0.00 51.96 51.38 2wqx s ALA 307 Cb 0.23 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.09 2wqx s ALA 307 CO 0.30 0.71 -0.22 0.21 0.00 0.00 0.00 175.76 176.76 2wqx s LYS 308 N -2.28 1.95 0.10 0.00 2.20 -1.26 -1.46 119.74 118.99 2wqx s LYS 308 Ca 0.26 -0.78 -0.04 0.00 -0.36 0.00 0.00 55.97 55.05 2wqx s LYS 308 Cb -0.12 -1.79 -0.03 0.00 -1.51 0.00 0.00 37.83 34.39 2wqx s LYS 308 CO 0.19 0.41 0.10 0.00 -0.36 0.00 0.00 175.35 175.69 2wqx s ALA 309 N -0.34 0.35 -0.38 3.13 0.00 -0.09 -4.60 121.76 119.83 2wqx s ALA 309 Ca 0.04 -1.09 -0.09 0.00 0.00 0.00 0.00 51.96 50.81 2wqx s ALA 309 Cb -0.10 0.59 0.05 0.00 0.00 0.00 0.00 23.12 23.65 2wqx s ALA 309 CO 0.01 -0.48 0.20 1.03 0.00 0.00 0.00 175.76 176.51 2wqx s ARG 310 N -3.95 2.71 -0.27 0.00 0.52 -1.26 -0.27 118.95 116.42 2wqx s ARG 310 Ca 0.13 -1.21 -0.19 0.00 -0.52 0.00 0.00 55.73 53.93 2wqx s ARG 310 Cb 0.06 -3.68 -0.02 0.00 0.52 0.00 0.00 34.95 31.83 2wqx s ARG 310 CO -0.05 -0.77 0.58 0.12 0.02 0.00 0.00 175.30 175.20 2wqx s PHE 311 N 1.48 3.26 0.05 -0.53 5.36 -0.57 -3.32 117.98 123.72 2wqx s PHE 311 Ca 0.01 0.68 -0.21 0.00 -0.96 0.00 0.00 56.93 56.45 2wqx s PHE 311 Cb -0.20 -2.82 0.05 0.00 -0.34 0.00 0.00 43.02 39.71 2wqx s PHE 311 CO 0.04 -0.34 0.49 -3.38 -1.46 0.00 0.00 175.22 170.57 2wqx s HIS 312 N 2.43 -0.38 -1.69 10.12 -3.43 -1.24 0.38 115.29 121.49 2wqx s HIS 312 Ca 0.24 0.37 0.00 0.00 -0.80 0.00 0.00 55.06 54.87 2wqx s HIS 312 Cb -0.15 0.31 0.00 0.00 -1.43 0.00 0.00 32.58 31.31 2wqx s HIS 312 CO 0.09 -0.64 0.00 0.41 -2.00 0.00 0.00 174.74 172.61 2wqx n GLY 313 N 0.37 -1.26 3.25 -1.38 0.00 -0.60 -1.54 105.19 104.03 2wqx n GLY 313 Ca -0.18 -0.94 -0.14 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.68 1.05 -0.15 1.61 1.70 -0.11 -1.19 118.95 121.19 2wqx s ARG 314 Ca 0.00 -1.45 0.02 0.00 -0.47 0.00 0.00 55.73 53.83 2wqx s ARG 314 Cb 0.00 -0.58 0.01 0.00 -0.57 0.00 0.00 34.95 33.81 2wqx s ARG 314 CO 0.00 0.06 -0.20 0.08 -1.08 0.00 0.00 175.30 174.15 2wqx s VAL 315 N -3.36 2.18 -0.17 4.99 1.01 0.45 -0.09 120.40 125.40 2wqx s VAL 315 Ca 0.17 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 61.15 2wqx s VAL 315 Cb 0.03 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 2wqx s VAL 315 CO 0.00 0.54 0.07 -0.89 0.00 0.00 0.00 175.10 174.83 2wqx s THR 316 N 0.91 4.91 -0.49 3.92 2.01 0.29 -1.90 115.64 125.28 2wqx s THR 316 Ca -0.04 0.00 0.01 0.00 0.31 0.00 0.00 61.69 61.97 2wqx s THR 316 Cb -0.15 -3.19 0.13 0.00 0.01 0.00 0.00 72.50 69.30 2wqx s THR 316 CO -0.04 0.49 0.26 -1.58 -0.69 0.00 0.00 174.62 173.07 2wqx s GLN 317 N 0.06 2.05 0.61 4.92 2.00 0.24 -0.28 119.66 129.25 2wqx s GLN 317 Ca 0.06 -2.30 -0.18 0.00 -2.00 0.00 0.00 55.36 50.94 2wqx s GLN 317 Cb -0.12 -3.46 -0.03 0.00 0.80 0.00 0.00 33.01 30.20 2wqx s GLN 317 CO 0.01 -1.09 1.16 -2.14 -0.50 0.00 0.00 175.29 172.73 2wqx s PRO 318 N 0.28 2.96 -0.01 1.67 0.02 -1.26 -2.03 135.00 136.63 2wqx s PRO 318 Ca 0.14 1.67 0.06 0.00 0.02 0.00 0.00 61.00 62.89 2wqx s PRO 318 Cb -0.22 -1.95 -0.02 0.00 0.02 0.00 0.00 34.50 32.33 2wqx s PRO 318 CO -0.03 -1.18 -0.20 -0.51 -0.33 0.00 0.00 177.00 174.76 2wqx s LEU 319 N -4.27 2.05 -0.05 -5.54 1.43 0.03 -2.74 118.68 109.59 2wqx s LEU 319 Ca 0.74 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 2wqx s LEU 319 Cb -0.26 -0.99 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 2wqx s LEU 319 CO 0.34 0.23 -0.02 -0.75 0.23 0.00 0.00 176.35 176.38 2wqx s LYS 320 N -0.55 2.83 0.00 1.70 2.20 0.95 -4.65 119.74 122.22 2wqx s LYS 320 Ca 0.07 -0.53 0.32 0.00 -0.36 0.00 0.00 55.97 55.48 2wqx s LYS 320 Cb -0.08 -2.68 1.89 0.00 -1.51 0.00 0.00 37.83 35.46 2wqx s LYS 320 CO -0.00 0.66 2.22 0.39 -0.36 0.00 0.00 175.35 178.26