#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wmx s ASP 8 N 0.00 6.20 -0.06 1.62 1.01 -1.26 -5.06 116.67 119.12 2wmx s ASP 8 Ca 0.00 0.24 0.06 0.00 0.71 0.00 0.00 52.55 53.55 2wmx s ASP 8 Cb 0.00 -2.08 -0.01 0.00 1.01 0.00 0.00 42.92 41.84 2wmx s ASP 8 CO 0.00 0.19 -0.24 0.26 0.21 0.00 0.00 175.17 175.59 2wmx s TRP 9 N 0.28 2.38 -0.12 4.23 0.52 -1.26 -1.00 118.94 123.96 2wmx s TRP 9 Ca 0.08 -0.75 -0.17 0.00 0.02 0.00 0.00 56.10 55.28 2wmx s TRP 9 Cb -0.11 -1.57 -0.04 0.00 -1.15 0.00 0.00 33.47 30.60 2wmx s TRP 9 CO -0.02 -0.24 0.44 -0.51 0.02 0.00 0.00 176.95 176.64 2wmx s ASP 10 N -0.07 6.64 -1.07 2.95 -0.00 0.25 -4.86 116.67 120.51 2wmx s ASP 10 Ca -0.06 0.76 -0.19 0.00 -0.00 0.00 0.00 52.55 53.06 2wmx s ASP 10 Cb -0.14 -2.27 0.10 0.00 -0.00 0.00 0.00 42.92 40.61 2wmx s ASP 10 CO 0.04 0.03 1.40 -0.76 -0.00 0.00 0.00 175.17 175.88 2wmx s LEU 11 N 0.53 4.29 0.10 1.23 1.43 -1.26 -0.87 118.68 124.12 2wmx s LEU 11 Ca 0.24 -2.05 -0.35 0.00 -1.03 0.00 0.00 54.13 50.94 2wmx s LEU 11 Cb -0.15 -2.49 -0.15 0.00 0.03 0.00 0.00 46.19 43.43 2wmx s LEU 11 CO 0.09 -1.19 1.57 0.58 0.23 0.00 0.00 176.35 177.63 2wmx h VAL 12 N 5.95 0.03 -3.24 -1.59 2.07 -1.55 -3.47 116.25 114.45 2wmx h VAL 12 Ca 0.25 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.75 2wmx h VAL 12 Cb 0.97 0.03 -0.11 0.00 -1.52 0.00 0.00 31.29 30.66 2wmx h VAL 12 CO 1.31 0.00 0.06 0.00 0.02 0.00 0.00 177.57 178.95 2wmx s GLN 13 N -5.84 1.31 0.02 1.57 -2.07 -1.24 -5.01 119.66 108.41 2wmx s GLN 13 Ca -0.17 -0.75 -0.25 0.00 -1.82 0.00 0.00 55.36 52.36 2wmx s GLN 13 Cb 0.06 0.53 -0.05 0.00 -1.09 0.00 0.00 33.01 32.46 2wmx s GLN 13 CO 0.61 -0.56 0.79 0.99 -1.32 0.00 0.00 175.29 175.80 2wmx s THR 14 N -3.83 4.79 -0.23 3.63 2.01 -1.26 -0.38 115.64 120.36 2wmx s THR 14 Ca 0.06 1.66 0.07 0.00 0.31 0.00 0.00 61.69 63.79 2wmx s THR 14 Cb -0.01 -4.13 -0.18 0.00 0.01 0.00 0.00 72.50 68.19 2wmx s THR 14 CO -0.06 0.32 -0.13 0.18 -0.69 0.00 0.00 174.62 174.24 2wmx n LEU 15 N 3.09 2.03 0.00 4.42 4.77 0.94 -4.89 117.00 127.36 2wmx n LEU 15 Ca -0.01 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 2wmx n LEU 15 Cb 0.50 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2wmx n LEU 15 CO 0.48 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.92 2wmx n GLY 16 N 2.17 -0.03 3.42 -0.72 0.00 -1.26 -5.00 105.19 103.77 2wmx n GLY 16 Ca -0.39 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.36 2wmx n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wmx s GLU 22 N 0.00 1.51 -0.05 1.61 -1.05 -1.10 -4.86 118.70 114.76 2wmx s GLU 22 Ca 0.00 -1.53 0.03 0.00 -0.15 0.00 0.00 54.97 53.32 2wmx s GLU 22 Cb 0.00 -1.81 0.01 0.00 -0.44 0.00 0.00 34.13 31.88 2wmx s GLU 22 CO 0.00 0.39 -0.14 0.08 0.95 0.00 0.00 175.26 176.54 2wmx s VAL 23 N -1.73 1.25 0.05 1.83 1.01 -1.26 0.11 120.40 121.66 2wmx s VAL 23 Ca 0.21 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.69 2wmx s VAL 23 Cb -0.08 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 2wmx s VAL 23 CO 0.10 0.37 -0.21 -1.10 0.00 0.00 0.00 175.10 174.26 2wmx s GLN 24 N 0.35 1.39 -0.02 2.72 -0.21 -0.38 -0.04 119.66 123.46 2wmx s GLN 24 Ca -0.09 -0.98 -0.30 0.00 0.02 0.00 0.00 55.36 54.01 2wmx s GLN 24 Cb -0.13 -1.53 -0.03 0.00 1.00 0.00 0.00 33.01 32.32 2wmx s GLN 24 CO 0.03 0.39 1.06 -1.17 -2.12 0.00 0.00 175.29 173.47 2wmx s LEU 25 N -1.27 4.32 -0.02 2.90 2.96 0.48 -0.85 118.68 127.21 2wmx s LEU 25 Ca 0.08 1.71 0.08 0.00 -0.22 0.00 0.00 54.13 55.78 2wmx s LEU 25 Cb -0.09 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 2wmx s LEU 25 CO 0.02 -0.39 -0.25 0.00 -1.32 0.00 0.00 176.35 174.41 2wmx s ALA 26 N 1.46 2.22 -0.08 5.97 0.00 0.19 -1.25 121.76 130.27 2wmx s ALA 26 Ca 0.53 -1.12 0.03 0.00 0.00 0.00 0.00 51.96 51.40 2wmx s ALA 26 Cb -0.22 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.32 2wmx s ALA 26 CO 0.25 0.53 -0.16 0.08 0.00 0.00 0.00 175.76 176.46 2wmx s VAL 27 N -0.64 1.48 0.13 0.00 1.01 -0.05 -0.16 120.40 122.16 2wmx s VAL 27 Ca 0.10 -0.67 -0.31 0.00 0.00 0.00 0.00 61.98 61.10 2wmx s VAL 27 Cb -0.10 -1.32 -0.09 0.00 0.00 0.00 0.00 36.38 34.87 2wmx s VAL 27 CO -0.01 0.43 1.50 0.21 0.00 0.00 0.00 175.10 177.24 2wmx s ASN 28 N 0.61 6.69 0.28 3.32 3.84 0.21 -0.59 114.94 129.32 2wmx s ASN 28 Ca -0.15 2.46 0.02 0.00 0.21 0.00 0.00 52.86 55.40 2wmx s ASN 28 Cb -0.16 -2.59 0.57 0.00 -0.55 0.00 0.00 41.25 38.52 2wmx s ASN 28 CO 0.05 -0.76 1.83 -0.09 -2.79 0.00 0.00 177.10 175.33 2wmx h ARG 29 N 7.01 0.93 0.00 0.43 2.43 -1.43 0.12 114.38 123.87 2wmx h ARG 29 Ca -0.42 -0.06 -0.26 0.00 -0.81 0.00 0.00 59.98 58.43 2wmx h ARG 29 Cb 1.20 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 30.51 2wmx h ARG 29 CO 0.90 0.62 -1.45 0.28 -1.51 0.00 0.00 179.97 178.80 2wmx n VAL 30 N -4.64 1.53 0.06 0.20 0.31 -1.26 -4.60 118.33 109.92 2wmx n VAL 30 Ca 0.19 -0.08 0.05 0.00 -0.01 0.00 0.00 64.34 64.50 2wmx n VAL 30 Cb 0.38 -2.03 -0.05 0.00 -0.91 0.00 0.00 33.84 31.22 2wmx n VAL 30 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2wmx n THR 31 N -4.41 0.89 -1.16 2.52 -2.24 -1.24 -4.96 114.28 103.67 2wmx n THR 31 Ca -0.35 -0.62 -0.06 0.00 -2.27 0.00 0.00 64.05 60.75 2wmx n THR 31 Cb 0.70 -0.52 -0.02 0.00 -2.10 0.00 0.00 70.33 68.38 2wmx n THR 31 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wmx n GLU 32 N -2.76 -0.91 -1.94 -0.78 1.02 0.40 -4.95 120.64 110.72 2wmx n GLU 32 Ca -0.06 0.58 -0.38 0.00 -0.02 0.00 0.00 57.16 57.28 2wmx n GLU 32 Cb 0.71 -4.46 0.02 0.00 -0.02 0.00 0.00 31.44 27.69 2wmx n GLU 32 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2wmx s GLU 33 N -2.00 3.43 -0.09 3.49 2.02 -1.26 -4.47 118.70 119.81 2wmx s GLU 33 Ca 0.00 2.11 -0.03 0.00 0.02 0.00 0.00 54.97 57.06 2wmx s GLU 33 Cb 0.00 -2.37 -0.04 0.00 0.10 0.00 0.00 34.13 31.83 2wmx s GLU 33 CO 0.00 -0.92 0.05 0.00 0.02 0.00 0.00 175.26 174.41 2wmx s ALA 34 N -1.36 3.49 0.23 5.21 0.00 -1.26 -0.62 121.76 127.46 2wmx s ALA 34 Ca 0.67 -0.75 -0.02 0.00 0.00 0.00 0.00 51.96 51.86 2wmx s ALA 34 Cb -0.37 -1.65 -0.03 0.00 0.00 0.00 0.00 23.12 21.07 2wmx s ALA 34 CO 0.45 0.60 0.22 0.14 0.00 0.00 0.00 175.76 177.17 2wmx s VAL 35 N -0.94 0.00 -0.05 0.00 -7.23 0.77 -4.37 120.40 108.57 2wmx s VAL 35 Ca 0.14 -1.88 0.04 0.00 -1.81 0.00 0.00 61.98 58.47 2wmx s VAL 35 Cb -0.12 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.34 2wmx s VAL 35 CO 0.03 0.00 -0.16 0.00 -0.31 0.00 0.00 175.10 174.66 2wmx s ALA 36 N -3.97 2.56 -0.18 1.32 0.00 0.14 0.56 121.76 122.18 2wmx s ALA 36 Ca 0.36 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.34 2wmx s ALA 36 Cb 0.05 -0.91 0.03 0.00 0.00 0.00 0.00 23.12 22.29 2wmx s ALA 36 CO 0.14 0.51 -0.13 0.08 0.00 0.00 0.00 175.76 176.36 2wmx s VAL 37 N -0.57 1.73 -0.28 0.00 1.01 -0.03 -0.22 120.40 122.04 2wmx s VAL 37 Ca 0.08 -0.91 -0.21 0.00 0.00 0.00 0.00 61.98 60.94 2wmx s VAL 37 Cb -0.11 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 2wmx s VAL 37 CO 0.01 0.32 0.66 -0.75 0.00 0.00 0.00 175.10 175.34 2wmx s LYS 38 N 1.39 4.01 -0.39 2.72 2.20 -0.41 -1.26 119.74 128.00 2wmx s LYS 38 Ca 0.02 0.48 -0.09 0.00 -0.36 0.00 0.00 55.97 56.01 2wmx s LYS 38 Cb -0.15 -3.69 0.05 0.00 -1.51 0.00 0.00 37.83 32.54 2wmx s LYS 38 CO -0.10 -0.51 0.22 0.42 -0.36 0.00 0.00 175.35 175.02 2wmx s ILE 39 N 2.62 4.30 -0.16 5.43 -1.09 0.12 -1.52 121.20 130.90 2wmx s ILE 39 Ca 0.27 -1.17 0.01 0.00 -2.23 0.00 0.00 60.65 57.53 2wmx s ILE 39 Cb -0.15 -3.52 0.02 0.00 -1.58 0.00 0.00 42.46 37.23 2wmx s ILE 39 CO 0.10 -0.36 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.60 2wmx s VAL 40 N 1.47 1.71 -0.11 2.92 1.01 -0.84 -2.71 120.40 123.86 2wmx s VAL 40 Ca 0.02 -0.72 -0.16 0.00 0.00 0.00 0.00 61.98 61.12 2wmx s VAL 40 Cb -0.21 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 2wmx s VAL 40 CO 0.04 0.48 0.39 1.51 0.00 0.00 0.00 175.10 177.52 2wmx s ASP 41 N 1.43 6.61 0.47 3.32 1.47 -1.26 -1.13 116.67 127.58 2wmx s ASP 41 Ca 0.05 0.72 0.02 0.00 1.18 0.00 0.00 52.55 54.52 2wmx s ASP 41 Cb -0.13 -2.24 0.01 0.00 -0.34 0.00 0.00 42.92 40.23 2wmx s ASP 41 CO -0.11 0.11 0.68 -0.04 0.68 0.00 0.00 175.17 176.49 2wmx s MET 42 N 0.19 2.85 0.00 2.11 -1.94 -1.26 -4.94 119.30 116.32 2wmx s MET 42 Ca 0.22 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.49 2wmx s MET 42 Cb -0.15 -2.57 0.00 0.00 2.01 0.00 0.00 34.83 34.12 2wmx s MET 42 CO 0.08 -0.41 0.00 -1.71 -0.01 0.00 0.00 175.02 172.98 2wmx n ASN 51 N -2.12 0.00 0.00 3.03 2.85 -1.26 -5.07 115.26 112.70 2wmx n ASN 51 Ca 0.04 0.00 -0.10 0.00 -0.11 0.00 0.00 54.58 54.41 2wmx n ASN 51 Cb 0.59 0.00 0.05 0.00 1.24 0.00 0.00 39.78 41.65 2wmx n ASN 51 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 2wmx h ILE 52 N 0.00 1.32 -0.56 -1.44 6.09 -1.99 -0.73 117.51 120.20 2wmx h ILE 52 Ca 0.00 -1.83 -0.07 0.00 -1.37 0.00 0.00 64.86 61.59 2wmx h ILE 52 Cb 0.00 1.80 -0.02 0.00 0.47 0.00 0.00 36.82 39.07 2wmx h ILE 52 CO 0.00 0.57 0.07 0.11 -3.07 0.00 0.00 178.15 175.83 2wmx h LYS 53 N 0.42 0.91 -0.16 2.19 1.57 -2.00 -2.20 116.57 117.30 2wmx h LYS 53 Ca 0.00 -0.23 -0.22 0.00 -1.87 0.00 0.00 60.65 58.34 2wmx h LYS 53 Cb 1.12 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 33.32 2wmx h LYS 53 CO 0.11 0.86 -0.76 -0.22 -0.57 0.00 0.00 179.45 178.87 2wmx h LYS 54 N 0.86 0.77 -0.79 3.15 3.64 -1.95 -1.28 116.57 120.97 2wmx h LYS 54 Ca 0.17 -0.62 0.11 0.00 -1.27 0.00 0.00 60.65 59.05 2wmx h LYS 54 Cb 0.40 0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 32.27 2wmx h LYS 54 CO 0.01 1.23 0.42 1.49 -2.27 0.00 0.00 179.45 180.33 2wmx h GLU 55 N 0.53 0.66 -0.09 1.90 4.81 -0.91 0.11 114.58 121.59 2wmx h GLU 55 Ca -0.05 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.05 2wmx h GLU 55 Cb 1.38 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2wmx h GLU 55 CO 0.15 0.44 -0.30 0.82 -0.73 0.00 0.00 179.01 179.40 2wmx h ILE 56 N 0.68 1.40 -0.31 2.32 2.04 -1.34 -1.18 117.51 121.13 2wmx h ILE 56 Ca 0.40 -1.64 0.07 0.00 1.00 0.00 0.00 64.86 64.69 2wmx h ILE 56 Cb 0.44 2.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.65 2wmx h ILE 56 CO -0.29 0.48 -0.17 0.00 0.00 0.00 0.00 178.15 178.17 2wmx h ILE 58 N -0.13 1.18 -0.81 0.00 2.04 -0.80 -2.69 117.51 116.30 2wmx h ILE 58 Ca 0.16 -0.54 0.17 0.00 1.00 0.00 0.00 64.86 65.65 2wmx h ILE 58 Cb 0.38 1.28 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 2wmx h ILE 58 CO -0.39 0.16 0.54 0.78 0.00 0.00 0.00 178.15 179.24 2wmx h ASN 59 N 0.05 0.37 0.36 1.72 2.35 -0.86 -0.57 115.58 119.00 2wmx h ASN 59 Ca 0.04 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.79 2wmx h ASN 59 Cb 0.22 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 2wmx h ASN 59 CO -0.00 0.17 -0.14 0.11 -1.65 0.00 0.00 177.43 175.92 2wmx h LYS 60 N 0.39 0.00 0.00 0.81 1.79 -0.81 -2.48 116.57 116.27 2wmx h LYS 60 Ca 0.41 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.88 2wmx h LYS 60 Cb 1.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.66 2wmx h LYS 60 CO -0.13 0.14 -0.29 -1.33 -1.08 0.00 0.00 179.45 176.76 2wmx n MET 61 N -3.75 0.25 -3.10 3.15 2.81 -0.23 -4.92 117.12 111.33 2wmx n MET 61 Ca -0.02 0.14 -0.41 0.00 -1.81 0.00 0.00 57.70 55.60 2wmx n MET 61 Cb 0.25 -1.72 -0.06 0.00 -0.71 0.00 0.00 33.22 30.98 2wmx n MET 61 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2wmx s LEU 62 N -4.23 4.07 -0.34 4.03 1.43 -0.94 -5.02 118.68 117.69 2wmx s LEU 62 Ca 0.09 0.68 -0.01 0.00 -1.03 0.00 0.00 54.13 53.86 2wmx s LEU 62 Cb 0.13 -2.86 0.13 0.00 0.03 0.00 0.00 46.19 43.62 2wmx s LEU 62 CO 0.65 -0.39 0.18 0.21 0.23 0.00 0.00 176.35 177.23 2wmx s ASN 63 N 1.49 3.24 -0.10 2.29 2.47 -1.26 -4.68 114.94 118.39 2wmx s ASN 63 Ca 0.26 -1.91 -0.20 0.00 0.42 0.00 0.00 52.86 51.43 2wmx s ASN 63 Cb -0.15 -0.45 0.05 0.00 -1.45 0.00 0.00 41.25 39.25 2wmx s ASN 63 CO 0.09 -0.35 0.49 -2.28 -3.72 0.00 0.00 177.10 171.32 2wmx s HIS 64 N 1.37 -0.46 -0.53 0.43 2.46 -1.26 -5.03 115.29 112.27 2wmx s HIS 64 Ca 0.15 0.94 0.21 0.00 0.47 0.00 0.00 55.06 56.83 2wmx s HIS 64 Cb -0.21 0.22 0.92 0.00 -0.13 0.00 0.00 32.58 33.38 2wmx s HIS 64 CO -0.12 -0.40 1.64 -0.85 -2.47 0.00 0.00 174.74 172.54 2wmx n GLU 65 N 1.81 0.15 -0.32 2.88 0.00 -1.26 -2.06 120.64 121.84 2wmx n GLU 65 Ca -0.18 0.44 0.08 0.00 0.00 0.00 0.00 57.16 57.50 2wmx n GLU 65 Cb 0.56 -1.82 0.21 0.00 0.00 0.00 0.00 31.44 30.40 2wmx n GLU 65 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2wmx n ASN 66 N -2.11 3.40 -4.09 -1.84 5.03 -1.26 -4.83 115.26 109.57 2wmx n ASN 66 Ca 0.02 -2.74 -0.23 0.00 0.87 0.00 0.00 54.58 52.50 2wmx n ASN 66 Cb 0.18 -0.43 -0.15 0.00 -1.02 0.00 0.00 39.78 38.35 2wmx n ASN 66 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2wmx s VAL 67 N -2.32 1.11 0.02 2.41 1.01 -0.87 -0.79 120.40 120.96 2wmx s VAL 67 Ca 0.35 -0.57 -0.33 0.00 0.00 0.00 0.00 61.98 61.42 2wmx s VAL 67 Cb 0.27 -0.94 -0.12 0.00 0.00 0.00 0.00 36.38 35.59 2wmx s VAL 67 CO 0.09 0.32 1.81 0.52 0.00 0.00 0.00 175.10 177.84 2wmx n VAL 68 N 2.96 0.42 -2.30 2.92 0.31 -0.03 -4.60 118.33 118.01 2wmx n VAL 68 Ca -0.16 -0.08 -0.41 0.00 -0.01 0.00 0.00 64.34 63.69 2wmx n VAL 68 Cb 0.54 -1.86 -0.03 0.00 -0.91 0.00 0.00 33.84 31.58 2wmx n VAL 68 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2wmx s LYS 69 N 3.11 4.48 -0.28 5.55 1.02 -1.26 -4.80 119.74 127.56 2wmx s LYS 69 Ca 0.87 2.00 -0.11 0.00 0.02 0.00 0.00 55.97 58.75 2wmx s LYS 69 Cb -0.64 -3.15 -0.05 0.00 -0.52 0.00 0.00 37.83 33.47 2wmx s LYS 69 CO 0.45 -0.03 0.18 0.12 -0.92 0.00 0.00 175.35 175.15 2wmx s PHE 70 N -0.84 3.22 -0.18 3.18 5.36 -1.26 0.19 117.98 127.65 2wmx s PHE 70 Ca 0.49 0.11 -0.14 0.00 -0.96 0.00 0.00 56.93 56.43 2wmx s PHE 70 Cb -0.35 -2.37 -0.22 0.00 -0.34 0.00 0.00 43.02 39.74 2wmx s PHE 70 CO 0.44 -0.15 0.23 0.66 -1.46 0.00 0.00 175.22 174.94 2wmx n TYR 71 N 5.00 1.03 -3.41 10.12 4.01 0.23 -5.00 117.16 129.14 2wmx n TYR 71 Ca -0.14 0.32 0.00 0.00 -0.16 0.00 0.00 57.90 57.92 2wmx n TYR 71 Cb 0.52 -1.12 0.00 0.00 -0.31 0.00 0.00 39.34 38.43 2wmx n TYR 71 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wmx n GLY 72 N 1.70 -0.99 3.38 2.72 0.00 -1.15 -4.98 105.19 105.87 2wmx n GLY 72 Ca -0.34 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 44.63 2wmx n GLY 72 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2wmx s HIS 73 N -3.00 -0.41 -0.06 1.61 -3.43 -1.26 -0.14 115.29 108.61 2wmx s HIS 73 Ca 0.00 0.52 0.01 0.00 -0.80 0.00 0.00 55.06 54.79 2wmx s HIS 73 Cb 0.00 0.30 0.02 0.00 -1.43 0.00 0.00 32.58 31.48 2wmx s HIS 73 CO 0.00 -0.59 -0.05 1.03 -2.00 0.00 0.00 174.74 173.13 2wmx s ARG 74 N -2.09 0.94 -1.08 -0.38 0.52 -0.57 -4.97 118.95 111.31 2wmx s ARG 74 Ca -0.07 -0.11 -0.13 0.00 -0.52 0.00 0.00 55.73 54.89 2wmx s ARG 74 Cb -0.01 -0.98 0.20 0.00 0.52 0.00 0.00 34.95 34.68 2wmx s ARG 74 CO 0.01 -0.12 1.20 1.03 0.02 0.00 0.00 175.30 177.44 2wmx s ARG 75 N 1.13 3.97 -0.10 3.54 3.00 -1.26 -1.99 118.95 127.24 2wmx s ARG 75 Ca -0.08 -2.59 -0.17 0.00 0.00 0.00 0.00 55.73 52.89 2wmx s ARG 75 Cb -0.14 -4.81 -0.14 0.00 0.00 0.00 0.00 34.95 29.86 2wmx s ARG 75 CO -0.01 -1.56 0.57 0.93 0.00 0.00 0.00 175.30 175.23 2wmx h GLU 76 N 7.41 -0.08 -3.68 3.54 5.08 -1.98 -3.50 114.58 121.37 2wmx h GLU 76 Ca 0.22 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2wmx h GLU 76 Cb 0.92 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.19 2wmx h GLU 76 CO 1.09 0.40 -0.59 1.51 -1.00 0.00 0.00 179.01 180.43 2wmx n ILE 79 N -4.78 -3.48 -4.56 3.13 3.06 -1.26 -5.08 119.36 106.39 2wmx n ILE 79 Ca -0.06 1.61 -0.22 0.00 -2.50 0.00 0.00 62.75 61.58 2wmx n ILE 79 Cb 0.25 -2.10 -0.14 0.00 0.54 0.00 0.00 39.64 38.20 2wmx n ILE 79 CO 0.00 0.00 0.00 -1.58 -2.50 0.00 0.00 176.55 172.47 2wmx s GLN 80 N -1.85 1.14 -0.18 9.51 2.00 -0.29 -4.98 119.66 125.01 2wmx s GLN 80 Ca 0.00 -0.69 0.00 0.00 -2.00 0.00 0.00 55.36 52.67 2wmx s GLN 80 Cb 0.00 -1.15 0.01 0.00 0.80 0.00 0.00 33.01 32.67 2wmx s GLN 80 CO 0.00 0.30 -0.18 0.71 -0.50 0.00 0.00 175.29 175.62 2wmx s TYR 81 N -0.62 2.79 -0.18 1.67 1.51 -0.84 -1.98 117.35 119.71 2wmx s TYR 81 Ca 0.05 -1.50 -0.05 0.00 -1.01 0.00 0.00 57.07 54.56 2wmx s TYR 81 Cb -0.07 -1.93 -0.03 0.00 -0.11 0.00 0.00 41.96 39.82 2wmx s TYR 81 CO 0.01 -0.74 -0.01 -0.51 -1.11 0.00 0.00 175.55 173.18 2wmx s LEU 82 N 1.25 3.29 -0.44 -1.29 1.02 -0.57 -1.52 118.68 120.42 2wmx s LEU 82 Ca 0.04 -0.16 -0.16 0.00 0.02 0.00 0.00 54.13 53.87 2wmx s LEU 82 Cb -0.13 -1.82 0.04 0.00 0.02 0.00 0.00 46.19 44.29 2wmx s LEU 82 CO -0.10 0.11 0.40 -0.36 0.02 0.00 0.00 176.35 176.41 2wmx s PHE 83 N 0.73 3.20 0.11 0.29 0.08 0.80 -1.29 117.98 121.90 2wmx s PHE 83 Ca -0.00 -0.62 0.09 0.00 0.12 0.00 0.00 56.93 56.52 2wmx s PHE 83 Cb -0.14 -2.93 -0.04 0.00 -0.57 0.00 0.00 43.02 39.34 2wmx s PHE 83 CO 0.02 -0.72 -0.23 -0.51 -0.10 0.00 0.00 175.22 173.68 2wmx s LEU 84 N 1.89 2.30 0.31 -0.37 1.43 0.69 0.74 118.68 125.67 2wmx s LEU 84 Ca 0.08 -0.70 -0.28 0.00 -1.03 0.00 0.00 54.13 52.19 2wmx s LEU 84 Cb -0.20 -0.99 -0.13 0.00 0.03 0.00 0.00 46.19 44.90 2wmx s LEU 84 CO 0.10 0.10 1.20 1.21 0.23 0.00 0.00 176.35 179.19 2wmx n GLU 85 N 1.07 1.81 -3.47 1.70 2.13 0.13 -0.69 120.64 123.32 2wmx n GLU 85 Ca -0.19 0.64 -0.37 0.00 0.66 0.00 0.00 57.16 57.89 2wmx n GLU 85 Cb 0.53 -2.15 -0.06 0.00 0.27 0.00 0.00 31.44 30.03 2wmx n GLU 85 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 2wmx s TYR 86 N -0.95 3.57 -0.37 4.31 5.04 -1.26 -4.46 117.35 123.22 2wmx s TYR 86 Ca 0.58 0.81 -0.00 0.00 -2.44 0.00 0.00 57.07 56.02 2wmx s TYR 86 Cb -0.63 -2.37 0.10 0.00 0.35 0.00 0.00 41.96 39.40 2wmx s TYR 86 CO 0.60 0.36 0.12 0.00 -1.34 0.00 0.00 175.55 175.30 2wmx n SER 88 N 4.47 0.01 0.15 0.00 3.41 -1.23 -2.38 113.62 118.06 2wmx n SER 88 Ca -0.01 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 2wmx n SER 88 Cb 0.42 -0.51 0.23 0.00 -0.26 0.00 0.00 64.21 64.10 2wmx n SER 88 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2wmx h GLY 89 N 2.74 0.00 0.00 5.00 0.00 0.14 -3.47 103.07 107.48 2wmx h GLY 89 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wmx h GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2wmx n GLY 90 N 0.07 -1.73 3.95 4.60 0.00 -1.00 -4.72 105.19 106.37 2wmx n GLY 90 Ca -0.01 -1.67 -0.23 0.00 0.00 0.00 0.00 46.02 44.10 2wmx n GLY 90 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wmx s GLU 91 N 0.00 3.47 0.34 1.61 -1.05 -1.26 -0.81 118.70 121.00 2wmx s GLU 91 Ca 0.00 -0.51 0.14 0.00 -0.15 0.00 0.00 54.97 54.45 2wmx s GLU 91 Cb 0.00 -2.77 0.61 0.00 -0.44 0.00 0.00 34.13 31.53 2wmx s GLU 91 CO 0.00 0.29 1.74 1.25 0.95 0.00 0.00 175.26 179.49 2wmx h LEU 92 N 1.04 0.00 -1.99 1.83 5.85 -0.85 -2.88 115.31 118.31 2wmx h LEU 92 Ca -0.51 0.00 0.12 0.00 0.84 0.00 0.00 57.88 58.33 2wmx h LEU 92 Cb 1.22 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 2wmx h LEU 92 CO 0.62 0.45 0.29 -0.26 -0.34 0.00 0.00 178.44 179.21 2wmx h PHE 93 N 0.00 0.01 -0.12 1.25 0.05 -1.83 0.30 116.94 116.60 2wmx h PHE 93 Ca -0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 2wmx h PHE 93 Cb 0.85 -0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.80 2wmx h PHE 93 CO 0.00 0.00 0.00 -0.25 -0.18 0.00 0.00 178.31 177.88 2wmx n ASP 94 N -4.42 0.77 -0.49 2.17 10.43 -1.09 -2.35 116.55 121.57 2wmx n ASP 94 Ca 0.07 -1.79 0.06 0.00 2.57 0.00 0.00 54.79 55.69 2wmx n ASP 94 Cb 0.48 -0.08 0.06 0.00 1.84 0.00 0.00 41.12 43.43 2wmx n ASP 94 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2wmx n ARG 95 N -0.17 0.86 -3.73 -1.24 5.12 0.10 -4.90 116.66 112.69 2wmx n ARG 95 Ca 0.09 -1.29 -0.38 0.00 -1.93 0.00 0.00 57.85 54.35 2wmx n ARG 95 Cb 0.15 -1.23 -0.12 0.00 -1.16 0.00 0.00 32.46 30.10 2wmx n ARG 95 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2wmx s ILE 96 N -0.98 4.15 -0.06 0.55 1.01 -0.99 -4.69 121.20 120.17 2wmx s ILE 96 Ca 0.15 -0.59 -0.30 0.00 0.00 0.00 0.00 60.65 59.91 2wmx s ILE 96 Cb 0.10 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 2wmx s ILE 96 CO 0.15 0.10 1.42 -0.70 0.00 0.00 0.00 174.94 175.90 2wmx s GLU 97 N 1.54 4.25 0.31 2.79 2.56 -0.11 -4.87 118.70 125.16 2wmx s GLU 97 Ca 0.03 1.92 -0.29 0.00 0.00 0.00 0.00 54.97 56.63 2wmx s GLU 97 Cb -0.17 -3.73 -0.13 0.00 2.00 0.00 0.00 34.13 32.10 2wmx s GLU 97 CO 0.03 -0.68 1.30 -2.30 -0.56 0.00 0.00 175.26 173.06 2wmx n PRO 98 N 6.17 2.04 -0.09 4.30 -0.02 -1.26 -0.14 135.00 146.00 2wmx n PRO 98 Ca 0.14 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 2wmx n PRO 98 Cb 0.44 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 2wmx n PRO 98 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2wmx n ASP 99 N 1.21 0.00 -0.05 2.55 2.03 -0.29 -4.61 116.55 117.39 2wmx n ASP 99 Ca 0.07 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.27 2wmx n ASP 99 Cb 0.34 -1.23 -0.04 0.00 -0.72 0.00 0.00 41.12 39.48 2wmx n ASP 99 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2wmx n ILE 100 N -2.00 0.78 0.00 5.18 5.41 -0.64 -4.65 119.36 123.45 2wmx n ILE 100 Ca 0.00 -0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.68 2wmx n ILE 100 Cb 0.00 -1.71 0.00 0.00 -0.71 0.00 0.00 39.64 37.22 2wmx n ILE 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wmx n GLY 101 N 2.35 0.68 3.52 7.39 0.00 0.80 -3.89 105.19 116.04 2wmx n GLY 101 Ca -0.19 -1.40 -0.09 0.00 0.00 0.00 0.00 46.02 44.33 2wmx n GLY 101 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2wmx s MET 102 N 0.00 1.39 0.31 1.61 0.23 -0.27 -0.93 119.30 121.64 2wmx s MET 102 Ca 0.00 -0.96 -0.30 0.00 -1.03 0.00 0.00 55.69 53.40 2wmx s MET 102 Cb 0.00 0.50 -0.11 0.00 -1.53 0.00 0.00 34.83 33.68 2wmx s MET 102 CO 0.00 -0.58 1.57 -2.30 -2.03 0.00 0.00 175.02 171.68 2wmx n PRO 103 N -0.33 2.69 -0.34 3.16 -0.02 -1.26 -4.79 135.00 134.11 2wmx n PRO 103 Ca -0.08 0.95 0.15 0.00 -2.02 0.00 0.00 63.50 62.50 2wmx n PRO 103 Cb 0.62 -2.72 0.36 0.00 -0.02 0.00 0.00 33.50 31.74 2wmx n PRO 103 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2wmx h GLU 104 N 4.34 0.67 -0.52 -0.52 4.81 -1.98 -0.62 114.58 120.76 2wmx h GLU 104 Ca -0.48 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 58.72 2wmx h GLU 104 Cb 1.23 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.43 2wmx h GLU 104 CO 0.76 0.44 0.35 -1.35 -0.73 0.00 0.00 179.01 178.48 2wmx h PRO 105 N 0.69 0.67 -0.05 0.92 0.11 -1.90 -1.65 132.00 130.79 2wmx h PRO 105 Ca 0.57 -0.04 -0.25 0.00 0.11 0.00 0.00 66.00 66.39 2wmx h PRO 105 Cb 0.99 -0.15 0.02 0.00 0.11 0.00 0.00 31.00 31.96 2wmx h PRO 105 CO -0.35 0.44 -0.95 -0.44 -0.21 0.00 0.00 178.00 176.49 2wmx h ASP 106 N 0.69 0.87 -0.50 -2.05 3.45 -1.49 -2.74 116.42 114.65 2wmx h ASP 106 Ca 0.19 -0.65 0.08 0.00 0.43 0.00 0.00 57.03 57.08 2wmx h ASP 106 Cb -0.05 -0.26 -0.07 0.00 -0.56 0.00 0.00 39.33 38.39 2wmx h ASP 106 CO -0.04 1.45 0.13 0.00 -1.57 0.00 0.00 179.24 179.21 2wmx h ALA 107 N 0.51 0.58 -0.09 3.45 0.00 -1.17 -1.24 119.26 121.29 2wmx h ALA 107 Ca -0.10 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2wmx h ALA 107 Cb 1.59 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 2wmx h ALA 107 CO 0.19 -0.28 0.03 0.37 0.00 0.00 0.00 179.25 179.56 2wmx h GLN 108 N 0.28 0.15 -0.33 0.00 4.15 -1.32 -0.50 115.11 117.54 2wmx h GLN 108 Ca 0.25 -0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.68 2wmx h GLN 108 Cb 0.31 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.94 2wmx h GLN 108 CO -0.30 0.31 0.07 -0.09 -1.93 0.00 0.00 178.83 176.89 2wmx h ARG 109 N -0.04 0.19 -0.70 1.69 2.43 -1.33 0.38 114.38 117.00 2wmx h ARG 109 Ca 0.03 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.16 2wmx h ARG 109 Cb 0.22 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 2wmx h ARG 109 CO -0.00 0.12 0.34 0.74 -1.51 0.00 0.00 179.97 179.66 2wmx h PHE 110 N 0.19 1.01 -0.69 2.20 0.04 -1.08 -1.67 116.94 116.95 2wmx h PHE 110 Ca 0.16 -0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.81 2wmx h PHE 110 Cb 0.17 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 37.98 2wmx h PHE 110 CO -0.18 0.75 0.15 0.35 -0.60 0.00 0.00 178.31 178.78 2wmx h PHE 111 N 0.98 1.16 -0.47 -0.55 3.57 -0.56 0.27 116.94 121.33 2wmx h PHE 111 Ca 0.24 -0.14 0.06 0.00 3.53 0.00 0.00 57.97 61.66 2wmx h PHE 111 Cb 0.12 -0.33 -0.05 0.00 2.79 0.00 0.00 35.95 38.48 2wmx h PHE 111 CO 0.01 0.95 0.16 0.45 -2.23 0.00 0.00 178.31 177.64 2wmx h HIS 112 N 1.04 0.28 -0.17 0.41 3.86 0.18 0.25 115.15 120.99 2wmx h HIS 112 Ca 0.21 0.02 -0.15 0.00 -1.16 0.00 0.00 60.37 59.30 2wmx h HIS 112 Cb 0.38 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 2wmx h HIS 112 CO 0.03 0.09 -0.53 1.96 0.86 0.00 0.00 177.93 180.34 2wmx h GLN 113 N 0.33 0.50 -0.46 2.45 4.20 -0.99 -1.07 115.11 120.07 2wmx h GLN 113 Ca 0.22 -0.30 -0.06 0.00 0.06 0.00 0.00 58.65 58.57 2wmx h GLN 113 Cb 0.23 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 2wmx h GLN 113 CO -0.23 0.90 0.03 1.25 -0.67 0.00 0.00 178.83 180.11 2wmx h LEU 114 N 0.39 0.70 -0.23 1.46 5.85 -0.11 -1.15 115.31 122.23 2wmx h LEU 114 Ca 0.01 -0.15 -0.20 0.00 0.84 0.00 0.00 57.88 58.38 2wmx h LEU 114 Cb 1.05 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 41.90 2wmx h LEU 114 CO 0.10 0.75 -0.65 0.24 -0.34 0.00 0.00 178.44 178.54 2wmx h MET 115 N 0.70 0.84 -0.26 1.25 2.86 -0.70 -1.33 114.93 118.30 2wmx h MET 115 Ca 0.14 -0.60 0.04 0.00 -2.06 0.00 0.00 59.70 57.22 2wmx h MET 115 Cb 0.39 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.11 2wmx h MET 115 CO 0.01 1.22 0.01 0.00 1.06 0.00 0.00 176.91 179.21 2wmx h ALA 116 N 0.62 0.23 -0.31 6.32 0.00 -0.96 0.21 119.26 125.38 2wmx h ALA 116 Ca -0.02 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2wmx h ALA 116 Cb 1.27 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 2wmx h ALA 116 CO 0.14 -0.41 0.07 0.78 0.00 0.00 0.00 179.25 179.83 2wmx h GLY 117 N 0.09 0.36 1.04 0.00 0.00 -1.16 -2.15 103.07 101.25 2wmx h GLY 117 Ca 0.12 -0.03 -0.13 0.00 0.00 0.00 0.00 47.33 47.29 2wmx h GLY 117 CO -0.20 -0.01 -0.29 -2.08 0.00 0.00 0.00 176.54 173.97 2wmx h VAL 118 N 0.19 1.29 -0.51 4.60 2.07 -0.92 -2.34 116.25 120.62 2wmx h VAL 118 Ca 0.14 -1.45 0.07 0.00 0.82 0.00 0.00 66.70 66.29 2wmx h VAL 118 Cb 0.15 1.43 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 2wmx h VAL 118 CO -0.18 0.48 0.18 0.58 0.02 0.00 0.00 177.57 178.65 2wmx h VAL 119 N 0.60 0.81 0.45 2.57 2.07 -0.49 -0.82 116.25 121.44 2wmx h VAL 119 Ca 0.06 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2wmx h VAL 119 Cb 0.86 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2wmx h VAL 119 CO 0.07 0.06 -0.39 0.22 0.02 0.00 0.00 177.57 177.56 2wmx h TYR 120 N 0.35 -1.05 -0.07 1.57 3.20 -1.22 0.11 116.97 119.86 2wmx h TYR 120 Ca 0.25 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.16 2wmx h TYR 120 Cb 0.27 0.40 -0.05 0.00 1.54 0.00 0.00 36.73 38.89 2wmx h TYR 120 CO -0.17 -0.55 -0.29 -0.07 -1.64 0.00 0.00 178.16 175.44 2wmx h LEU 121 N -0.84 -0.88 -1.79 2.82 3.38 -1.17 -0.30 115.31 116.54 2wmx h LEU 121 Ca -0.04 0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.07 2wmx h LEU 121 Cb 0.73 0.37 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2wmx h LEU 121 CO -0.03 -0.34 0.18 0.45 0.09 0.00 0.00 178.44 178.78 2wmx h HIS 122 N -0.40 0.27 -0.74 1.13 3.86 -1.10 -0.16 115.15 118.02 2wmx h HIS 122 Ca 0.08 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.32 2wmx h HIS 122 Cb 0.52 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.86 2wmx h HIS 122 CO -0.35 0.16 0.49 0.78 0.86 0.00 0.00 177.93 179.87 2wmx h GLY 123 N 0.29 1.03 -3.30 2.45 0.00 0.96 -1.27 103.07 103.23 2wmx h GLY 123 Ca 0.11 -0.37 -0.32 0.00 0.00 0.00 0.00 47.33 46.75 2wmx h GLY 123 CO -0.02 0.34 0.33 0.29 0.00 0.00 0.00 176.54 177.48 2wmx n ILE 124 N -4.44 2.92 -1.74 2.60 -5.35 -0.68 -4.95 119.36 107.72 2wmx n ILE 124 Ca 0.09 -2.02 -0.10 0.00 -0.27 0.00 0.00 62.75 60.45 2wmx n ILE 124 Cb 0.08 -0.39 -0.02 0.00 -1.74 0.00 0.00 39.64 37.57 2wmx n ILE 124 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wmx n GLY 125 N -0.79 0.55 3.43 3.28 0.00 -0.48 -4.93 105.19 106.24 2wmx n GLY 125 Ca 0.46 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 2wmx n GLY 125 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wmx s ILE 126 N -2.43 3.17 -0.12 -0.61 1.01 -0.16 -0.49 121.20 121.59 2wmx s ILE 126 Ca 0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 60.65 60.00 2wmx s ILE 126 Cb 0.00 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 40.15 2wmx s ILE 126 CO 0.00 0.55 -0.12 0.28 0.00 0.00 0.00 174.94 175.66 2wmx s THR 127 N -0.12 3.20 0.04 2.92 -1.32 -0.01 -3.20 115.64 117.16 2wmx s THR 127 Ca -0.01 -0.62 -0.21 0.00 -1.21 0.00 0.00 61.69 59.64 2wmx s THR 127 Cb -0.14 -2.34 -0.14 0.00 -1.51 0.00 0.00 72.50 68.37 2wmx s THR 127 CO 0.03 0.53 1.38 -0.74 -2.21 0.00 0.00 174.62 173.61 2wmx h HIS 128 N 6.43 0.34 0.00 9.09 2.76 -1.91 -1.73 115.15 130.13 2wmx h HIS 128 Ca -0.31 -0.09 0.00 0.00 -2.20 0.00 0.00 60.37 57.77 2wmx h HIS 128 Cb 1.20 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 30.08 2wmx h HIS 128 CO 0.51 0.64 0.00 0.54 -1.30 0.00 0.00 177.93 178.32 2wmx n ARG 129 N -4.65 0.00 -2.72 5.26 1.74 -1.26 -3.09 116.66 111.94 2wmx n ARG 129 Ca -0.06 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 56.97 2wmx n ARG 129 Cb 0.31 -2.48 0.06 0.00 -1.02 0.00 0.00 32.46 29.33 2wmx n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2wmx n ASP 130 N 0.00 0.49 -4.65 0.55 4.64 -1.26 -3.47 116.55 112.85 2wmx n ASP 130 Ca 0.00 -2.42 -0.43 0.00 -1.38 0.00 0.00 54.79 50.56 2wmx n ASP 130 Cb 0.00 -0.08 -0.02 0.00 -1.04 0.00 0.00 41.12 39.98 2wmx n ASP 130 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2wmx s ILE 131 N -2.28 4.04 0.15 5.18 1.01 -1.26 -4.83 121.20 123.20 2wmx s ILE 131 Ca 0.24 1.23 -0.23 0.00 0.00 0.00 0.00 60.65 61.89 2wmx s ILE 131 Cb 0.41 -3.87 0.07 0.00 0.01 0.00 0.00 42.46 39.08 2wmx s ILE 131 CO -0.03 -0.19 0.63 -1.59 0.00 0.00 0.00 174.94 173.76 2wmx s LYS 132 N 3.87 1.26 0.57 2.79 -2.85 -1.26 -4.76 119.74 119.35 2wmx s LYS 132 Ca 0.61 -0.47 0.26 0.00 -1.00 0.00 0.00 55.97 55.37 2wmx s LYS 132 Cb -0.24 0.57 1.64 0.00 -2.06 0.00 0.00 37.83 37.74 2wmx s LYS 132 CO 0.21 -0.55 2.20 -1.35 0.10 0.00 0.00 175.35 175.95 2wmx h PRO 133 N 2.00 0.00 0.00 1.78 0.11 -1.93 0.12 132.00 134.08 2wmx h PRO 133 Ca -0.33 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 2wmx h PRO 133 Cb 1.30 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 2wmx h PRO 133 CO 0.37 0.00 -0.02 0.93 -0.21 0.00 0.00 178.00 179.07 2wmx h GLU 134 N 0.00 0.00 -0.26 1.05 3.07 -1.96 -2.70 114.58 113.78 2wmx h GLU 134 Ca 0.02 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.88 2wmx h GLU 134 Cb 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.02 2wmx h GLU 134 CO -0.00 0.02 0.00 0.09 -1.40 0.00 0.00 179.01 177.72 2wmx n ASN 135 N -3.30 3.24 -4.17 1.42 3.02 0.40 -4.86 115.26 111.02 2wmx n ASN 135 Ca -0.02 -2.53 -0.35 0.00 -0.03 0.00 0.00 54.58 51.65 2wmx n ASN 135 Cb 0.15 -0.37 -0.13 0.00 -0.61 0.00 0.00 39.78 38.82 2wmx n ASN 135 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2wmx s LEU 136 N -1.95 4.13 0.33 3.41 1.43 -1.03 -1.47 118.68 123.54 2wmx s LEU 136 Ca 0.30 -1.39 0.07 0.00 -1.03 0.00 0.00 54.13 52.08 2wmx s LEU 136 Cb 0.22 -1.74 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 2wmx s LEU 136 CO 0.11 -0.31 0.37 -0.76 0.23 0.00 0.00 176.35 175.99 2wmx s LEU 137 N 1.24 3.79 -0.04 1.79 1.43 -0.32 -0.74 118.68 125.82 2wmx s LEU 137 Ca -0.03 -0.34 0.05 0.00 -1.03 0.00 0.00 54.13 52.78 2wmx s LEU 137 Cb -0.20 -2.47 -0.01 0.00 0.03 0.00 0.00 46.19 43.55 2wmx s LEU 137 CO -0.01 -0.37 -0.20 -0.76 0.23 0.00 0.00 176.35 175.24 2wmx s LEU 138 N -4.07 1.98 0.00 1.79 1.43 0.01 0.27 118.68 120.08 2wmx s LEU 138 Ca 0.42 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 2wmx s LEU 138 Cb -0.08 -1.10 0.00 0.00 0.03 0.00 0.00 46.19 45.05 2wmx s LEU 138 CO 0.29 0.19 0.00 -0.90 0.23 0.00 0.00 176.35 176.16 2wmx n ASP 139 N 3.01 0.00 0.20 2.29 3.85 -0.39 0.64 116.55 126.16 2wmx n ASP 139 Ca -0.17 -0.48 0.06 0.00 -0.71 0.00 0.00 54.79 53.48 2wmx n ASP 139 Cb 0.53 0.00 0.42 0.00 -1.35 0.00 0.00 41.12 40.72 2wmx n ASP 139 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.20 177.24 2wmx h GLU 140 N 0.00 0.00 -0.62 0.11 9.09 -1.91 -1.95 114.58 119.30 2wmx h GLU 140 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2wmx h GLU 140 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2wmx h GLU 140 CO 0.00 0.33 0.00 0.54 0.05 0.00 0.00 179.01 179.93 2wmx n ARG 141 N -3.75 3.03 -2.16 1.06 1.74 -1.26 -4.90 116.66 110.41 2wmx n ARG 141 Ca -0.01 -2.04 -0.16 0.00 -0.77 0.00 0.00 57.85 54.87 2wmx n ARG 141 Cb 0.42 -1.75 -0.02 0.00 -1.02 0.00 0.00 32.46 30.09 2wmx n ARG 141 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2wmx n ASP 142 N 0.69 -4.89 -4.73 0.55 8.00 -0.73 -4.99 116.55 110.46 2wmx n ASP 142 Ca 0.18 0.06 -0.41 0.00 0.71 0.00 0.00 54.79 55.33 2wmx n ASP 142 Cb 0.70 -3.97 -0.04 0.00 -0.02 0.00 0.00 41.12 37.79 2wmx n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2wmx s ASN 143 N -2.36 7.39 0.17 -2.24 0.01 -1.26 -4.75 114.94 111.90 2wmx s ASN 143 Ca 0.00 1.86 -0.30 0.00 -0.71 0.00 0.00 52.86 53.71 2wmx s ASN 143 Cb 0.00 -2.59 -0.07 0.00 0.41 0.00 0.00 41.25 39.00 2wmx s ASN 143 CO 0.00 -0.17 1.02 -0.22 -1.51 0.00 0.00 177.10 176.22 2wmx s LEU 144 N 0.17 4.53 -0.10 0.60 0.20 -1.26 -1.26 118.68 121.56 2wmx s LEU 144 Ca 0.49 1.96 0.00 0.00 0.69 0.00 0.00 54.13 57.27 2wmx s LEU 144 Cb -0.25 -3.60 0.02 0.00 -0.43 0.00 0.00 46.19 41.93 2wmx s LEU 144 CO 0.31 -0.09 -0.08 -0.54 -0.29 0.00 0.00 176.35 175.66 2wmx s LYS 145 N -0.43 1.48 0.21 1.98 -0.14 0.14 -4.41 119.74 118.58 2wmx s LYS 145 Ca 0.47 -0.26 -0.30 0.00 -1.36 0.00 0.00 55.97 54.51 2wmx s LYS 145 Cb -0.27 -1.47 -0.09 0.00 -1.68 0.00 0.00 37.83 34.33 2wmx s LYS 145 CO 0.33 -0.19 1.25 0.42 -0.76 0.00 0.00 175.35 176.40 2wmx s ILE 146 N 1.43 3.32 0.03 2.17 1.01 0.03 -1.18 121.20 128.02 2wmx s ILE 146 Ca -0.01 1.14 0.01 0.00 0.00 0.00 0.00 60.65 61.79 2wmx s ILE 146 Cb -0.13 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 2wmx s ILE 146 CO -0.05 0.19 -0.05 -0.55 0.00 0.00 0.00 174.94 174.49 2wmx s SER 147 N 0.08 0.51 -0.06 3.58 0.15 -0.54 -0.85 113.70 116.56 2wmx s SER 147 Ca 0.53 -0.56 -0.00 0.00 0.70 0.00 0.00 55.95 56.62 2wmx s SER 147 Cb -0.35 0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.04 2wmx s SER 147 CO 0.39 -0.28 0.01 -0.67 1.20 0.00 0.00 173.24 173.88 2wmx n ASP 148 N 1.43 -3.10 -1.82 5.45 4.64 -1.26 -4.81 116.55 117.08 2wmx n ASP 148 Ca -0.23 0.25 0.02 0.00 -1.38 0.00 0.00 54.79 53.45 2wmx n ASP 148 Cb 0.55 -1.79 0.34 0.00 -1.04 0.00 0.00 41.12 39.18 2wmx n ASP 148 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 2wmx n PHE 149 N 0.09 2.03 -0.10 -0.67 3.01 -1.26 -4.47 117.46 116.10 2wmx n PHE 149 Ca 0.00 -0.82 0.16 0.00 1.01 0.00 0.00 57.45 57.80 2wmx n PHE 149 Cb 0.01 -0.54 0.55 0.00 -0.01 0.00 0.00 39.48 39.49 2wmx n PHE 149 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2wmx h GLY 150 N 3.68 0.48 -1.48 1.37 0.00 -1.90 -1.64 103.07 103.58 2wmx h GLY 150 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2wmx h GLY 150 CO 0.54 0.05 -0.03 1.04 0.00 0.00 0.00 176.54 178.14 2wmx n LEU 151 N -4.45 2.52 -4.78 3.11 4.77 -1.26 -4.82 117.00 112.09 2wmx n LEU 151 Ca 0.12 -0.98 -0.33 0.00 -0.03 0.00 0.00 56.01 54.79 2wmx n LEU 151 Cb 0.51 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.64 2wmx n LEU 151 CO 0.34 0.44 0.73 0.00 -1.33 0.00 0.00 177.39 177.57 2wmx s ALA 152 N -1.63 2.51 0.15 -1.18 0.00 -0.62 -4.68 121.76 116.31 2wmx s ALA 152 Ca 0.22 0.47 -0.12 0.00 0.00 0.00 0.00 51.96 52.53 2wmx s ALA 152 Cb 0.16 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.99 2wmx s ALA 152 CO 0.26 -1.24 0.34 -0.08 0.00 0.00 0.00 175.76 175.04 2wmx s THR 153 N -2.45 0.07 0.04 0.00 -1.32 -0.65 -4.96 115.64 106.37 2wmx s THR 153 Ca 0.65 -1.09 -0.24 0.00 -1.21 0.00 0.00 61.69 59.80 2wmx s THR 153 Cb -0.19 -1.59 -0.05 0.00 -1.51 0.00 0.00 72.50 69.15 2wmx s THR 153 CO 0.43 -0.32 0.73 -0.69 -2.21 0.00 0.00 174.62 172.56 2wmx s VAL 154 N -3.90 4.76 0.00 5.08 1.01 -1.26 -0.83 120.40 125.26 2wmx s VAL 154 Ca 0.11 1.56 0.00 0.00 0.00 0.00 0.00 61.98 63.65 2wmx s VAL 154 Cb 0.02 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.32 2wmx s VAL 154 CO -0.04 0.37 0.00 2.22 0.00 0.00 0.00 175.10 177.65 2wmx n PHE 155 N 2.80 0.00 -4.04 5.22 -1.74 0.36 -4.90 117.46 115.16 2wmx n PHE 155 Ca -0.03 0.00 -0.20 0.00 -0.56 0.00 0.00 57.45 56.65 2wmx n PHE 155 Cb 0.50 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.34 2wmx n PHE 155 CO 0.00 0.00 0.00 0.50 -0.56 0.00 0.00 176.76 176.70 2wmx s ARG 156 N -0.84 0.72 -0.05 3.97 3.52 -1.14 -0.42 118.95 124.71 2wmx s ARG 156 Ca 0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 55.73 55.54 2wmx s ARG 156 Cb 0.00 -0.84 0.03 0.00 -1.56 0.00 0.00 34.95 32.58 2wmx s ARG 156 CO 0.00 -0.14 0.11 -0.47 -0.81 0.00 0.00 175.30 173.99 2wmx s TYR 157 N 1.18 -0.11 -1.60 5.12 5.04 -0.28 -4.52 117.35 122.17 2wmx s TYR 157 Ca -0.07 0.34 -0.16 0.00 -2.44 0.00 0.00 57.07 54.74 2wmx s TYR 157 Cb -0.14 -0.06 0.12 0.00 0.35 0.00 0.00 41.96 42.23 2wmx s TYR 157 CO -0.01 -0.11 0.91 0.09 -1.34 0.00 0.00 175.55 175.08 2wmx n ASN 158 N 3.73 -4.19 -1.70 4.32 3.02 -1.26 -0.86 115.26 118.32 2wmx n ASN 158 Ca -0.21 -0.87 -0.18 0.00 -0.03 0.00 0.00 54.58 53.29 2wmx n ASN 158 Cb 0.55 -3.42 -0.05 0.00 -0.61 0.00 0.00 39.78 36.24 2wmx n ASN 158 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2wmx n ASN 159 N -2.76 -5.22 -4.16 6.41 3.02 -1.26 -4.98 115.26 106.31 2wmx n ASN 159 Ca 0.05 0.23 -0.32 0.00 -0.03 0.00 0.00 54.58 54.51 2wmx n ASN 159 Cb 0.51 -4.30 -0.17 0.00 -0.61 0.00 0.00 39.78 35.22 2wmx n ASN 159 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2wmx s ARG 160 N -4.17 2.95 -0.02 3.52 6.06 -0.04 -5.11 118.95 122.14 2wmx s ARG 160 Ca 0.00 -0.83 -0.18 0.00 -2.50 0.00 0.00 55.73 52.22 2wmx s ARG 160 Cb 0.00 -2.38 -0.05 0.00 0.06 0.00 0.00 34.95 32.57 2wmx s ARG 160 CO 0.00 -0.01 0.51 -2.00 -2.50 0.00 0.00 175.30 171.30 2wmx s GLU 161 N 0.81 4.20 -0.18 5.12 2.12 -1.26 -1.13 118.70 128.38 2wmx s GLU 161 Ca -0.08 0.57 -0.04 0.00 0.36 0.00 0.00 54.97 55.79 2wmx s GLU 161 Cb -0.16 -3.32 -0.02 0.00 0.26 0.00 0.00 34.13 30.90 2wmx s GLU 161 CO -0.01 0.44 -0.03 -0.98 -0.54 0.00 0.00 175.26 174.14 2wmx s ARG 162 N -0.36 3.56 0.60 4.30 1.04 0.44 -4.99 118.95 123.53 2wmx s ARG 162 Ca 0.27 -0.56 -0.17 0.00 -1.04 0.00 0.00 55.73 54.23 2wmx s ARG 162 Cb -0.17 -2.97 -0.03 0.00 -2.04 0.00 0.00 34.95 29.74 2wmx s ARG 162 CO 0.15 0.06 1.12 -0.51 -0.04 0.00 0.00 175.30 176.08 2wmx s LEU 163 N 0.84 3.58 0.36 -1.89 1.43 -1.26 -4.75 118.68 116.99 2wmx s LEU 163 Ca -0.01 2.10 0.02 0.00 -1.03 0.00 0.00 54.13 55.22 2wmx s LEU 163 Cb -0.14 -4.57 -0.02 0.00 0.03 0.00 0.00 46.19 41.49 2wmx s LEU 163 CO 0.02 -1.42 0.54 -0.76 0.23 0.00 0.00 176.35 174.95 2wmx s LEU 164 N -4.31 3.94 0.00 1.79 1.43 0.17 -4.85 118.68 116.85 2wmx s LEU 164 Ca 0.70 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 2wmx s LEU 164 Cb -0.22 -3.07 0.00 0.00 0.03 0.00 0.00 46.19 42.92 2wmx s LEU 164 CO 0.34 -0.41 0.00 -0.46 0.23 0.00 0.00 176.35 176.05 2wmx n ASN 165 N -1.79 0.00 -4.81 2.29 0.23 -1.26 -1.68 115.26 108.24 2wmx n ASN 165 Ca -0.03 -0.57 -0.38 0.00 -0.53 0.00 0.00 54.58 53.08 2wmx n ASN 165 Cb 0.57 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.21 2wmx n ASN 165 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2wmx s LYS 166 N 0.00 4.05 -0.50 -3.83 1.02 -1.26 -4.91 119.74 114.31 2wmx s LYS 166 Ca 0.00 0.51 -0.24 0.00 0.02 0.00 0.00 55.97 56.26 2wmx s LYS 166 Cb 0.00 -3.25 0.04 0.00 -0.52 0.00 0.00 37.83 34.09 2wmx s LYS 166 CO 0.00 0.61 0.88 -1.64 -0.92 0.00 0.00 175.35 174.28 2wmx s MET 167 N -0.88 3.38 0.38 1.68 -1.94 -1.26 -5.02 119.30 115.65 2wmx s MET 167 Ca 0.25 -0.16 0.08 0.00 -1.71 0.00 0.00 55.69 54.15 2wmx s MET 167 Cb -0.17 -4.00 -0.07 0.00 2.01 0.00 0.00 34.83 32.59 2wmx s MET 167 CO 0.15 -1.32 -0.02 0.00 -0.01 0.00 0.00 175.02 173.81 2wmx n GLY 169 N -0.89 -0.55 2.67 0.00 0.00 -1.23 -4.97 105.19 100.22 2wmx n GLY 169 Ca -0.05 -2.01 -0.20 0.00 0.00 0.00 0.00 46.02 43.76 2wmx n GLY 169 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wmx s THR 170 N 0.00 -0.09 0.29 2.61 2.01 -1.26 -5.05 115.64 114.15 2wmx s THR 170 Ca 0.00 0.39 -0.01 0.00 0.31 0.00 0.00 61.69 62.38 2wmx s THR 170 Cb 0.00 -0.19 0.39 0.00 0.01 0.00 0.00 72.50 72.71 2wmx s THR 170 CO 0.00 0.16 1.59 -0.07 -0.69 0.00 0.00 174.62 175.61 2wmx h LEU 171 N 8.43 -0.49 -1.44 4.42 3.38 -1.93 -0.17 115.31 127.51 2wmx h LEU 171 Ca -0.12 0.26 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 2wmx h LEU 171 Cb 1.12 0.47 -0.01 0.00 0.09 0.00 0.00 40.66 42.33 2wmx h LEU 171 CO 0.16 -0.31 -0.28 -0.65 0.09 0.00 0.00 178.44 177.46 2wmx h PRO 172 N 0.03 0.00 -0.00 1.13 0.11 -1.73 -2.92 132.00 128.62 2wmx h PRO 172 Ca 0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.65 2wmx h PRO 172 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2wmx h PRO 172 CO -0.87 0.28 -0.45 0.66 -0.21 0.00 0.00 178.00 177.40 2wmx n TYR 173 N -3.89 0.00 -2.80 0.65 4.01 -0.12 -4.84 117.16 110.17 2wmx n TYR 173 Ca -0.02 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.35 2wmx n TYR 173 Cb 0.36 -0.21 -0.06 0.00 -0.31 0.00 0.00 39.34 39.11 2wmx n TYR 173 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2wmx s VAL 174 N -2.88 4.22 0.51 -0.72 0.11 -0.96 -3.65 120.40 117.04 2wmx s VAL 174 Ca 0.14 1.81 -0.20 0.00 -2.93 0.00 0.00 61.98 60.81 2wmx s VAL 174 Cb 0.18 -4.03 -0.07 0.00 -1.53 0.00 0.00 36.38 30.92 2wmx s VAL 174 CO 0.66 0.19 1.09 0.00 -3.33 0.00 0.00 175.10 173.71 2wmx s ALA 175 N -1.56 2.79 0.28 1.54 0.00 -1.26 -4.54 121.76 119.02 2wmx s ALA 175 Ca 0.48 0.73 -0.00 0.00 0.00 0.00 0.00 51.96 53.17 2wmx s ALA 175 Cb -0.19 -3.31 0.48 0.00 0.00 0.00 0.00 23.12 20.10 2wmx s ALA 175 CO 0.24 -0.55 1.88 -1.00 0.00 0.00 0.00 175.76 176.34 2wmx h PRO 176 N 1.41 1.06 0.00 0.00 0.13 -1.88 -2.84 132.00 129.88 2wmx h PRO 176 Ca -0.50 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.55 2wmx h PRO 176 Cb 1.24 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 2wmx h PRO 176 CO 0.58 0.70 -0.08 1.05 -0.23 0.00 0.00 178.00 180.02 2wmx h GLU 177 N 1.09 0.00 0.00 0.86 9.09 -1.92 0.22 114.58 123.93 2wmx h GLU 177 Ca 0.43 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.81 2wmx h GLU 177 Cb 0.26 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.35 2wmx h GLU 177 CO -0.18 0.08 -0.17 1.25 0.05 0.00 0.00 179.01 180.04 2wmx h LEU 178 N 0.00 0.00 0.00 3.06 6.46 -1.79 0.63 115.31 123.67 2wmx h LEU 178 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2wmx h LEU 178 Cb 0.16 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.09 2wmx h LEU 178 CO 0.01 0.17 -0.94 0.18 -0.62 0.00 0.00 178.44 177.24 2wmx n LEU 179 N -3.55 0.64 0.00 2.25 4.77 0.04 -4.50 117.00 116.65 2wmx n LEU 179 Ca -0.01 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2wmx n LEU 179 Cb 0.31 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2wmx n LEU 179 CO 0.31 -0.01 0.14 2.29 -1.33 0.00 0.00 177.39 178.79 2wmx n LYS 180 N -2.08 0.98 -4.76 3.23 2.85 -1.04 -5.04 118.16 112.29 2wmx n LYS 180 Ca 0.02 -0.27 -0.26 0.00 -1.05 0.00 0.00 58.31 56.74 2wmx n LYS 180 Cb 0.45 -0.74 -0.15 0.00 -0.65 0.00 0.00 35.03 33.95 2wmx n LYS 180 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2wmx s ARG 181 N -0.22 1.51 0.10 -1.58 1.81 0.19 -5.03 118.95 115.73 2wmx s ARG 181 Ca 0.00 -0.91 -0.15 0.00 -1.72 0.00 0.00 55.73 52.95 2wmx s ARG 181 Cb 0.00 -1.58 -0.08 0.00 -0.45 0.00 0.00 34.95 32.84 2wmx s ARG 181 CO 0.00 0.41 1.44 -0.09 -0.68 0.00 0.00 175.30 176.38 2wmx h ARG 182 N 5.05 0.70 -5.22 3.54 2.43 -1.93 -3.44 114.38 115.50 2wmx h ARG 182 Ca -0.42 -0.35 -0.38 0.00 -0.81 0.00 0.00 59.98 58.02 2wmx h ARG 182 Cb 1.15 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.51 2wmx h ARG 182 CO 0.45 0.96 -0.76 -1.21 -1.51 0.00 0.00 179.97 177.90 2wmx s GLU 183 N -4.43 0.88 0.04 0.20 2.02 -1.26 -4.33 118.70 111.82 2wmx s GLU 183 Ca -0.12 -1.10 -0.27 0.00 0.02 0.00 0.00 54.97 53.50 2wmx s GLU 183 Cb 0.09 -0.74 0.07 0.00 0.10 0.00 0.00 34.13 33.64 2wmx s GLU 183 CO 0.82 0.14 0.62 -0.59 0.02 0.00 0.00 175.26 176.28 2wmx s PHE 184 N -1.90 -0.57 0.43 1.61 -0.12 -0.68 -4.95 117.98 111.80 2wmx s PHE 184 Ca 0.03 0.73 -0.24 0.00 -0.05 0.00 0.00 56.93 57.40 2wmx s PHE 184 Cb -0.06 0.45 -0.08 0.00 -0.63 0.00 0.00 43.02 42.69 2wmx s PHE 184 CO 0.02 -0.70 1.17 -1.01 -0.05 0.00 0.00 175.22 174.65 2wmx s HIS 185 N -2.30 2.98 0.03 3.49 3.76 -1.26 -0.66 115.29 121.32 2wmx s HIS 185 Ca -0.06 1.54 -0.20 0.00 -0.15 0.00 0.00 55.06 56.20 2wmx s HIS 185 Cb -0.00 -3.38 -0.17 0.00 1.11 0.00 0.00 32.58 30.13 2wmx s HIS 185 CO -0.00 -1.40 1.24 0.00 -0.85 0.00 0.00 174.74 173.73 2wmx h ALA 186 N 2.35 0.18 0.11 -1.40 0.00 -1.96 -3.36 119.26 115.18 2wmx h ALA 186 Ca -0.49 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 53.99 2wmx h ALA 186 Cb 1.24 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2wmx h ALA 186 CO 0.61 0.21 -0.05 0.93 0.00 0.00 0.00 179.25 180.95 2wmx h GLU 187 N -0.04 -0.14 0.00 0.00 5.08 -1.98 -1.50 114.58 115.99 2wmx h GLU 187 Ca -0.01 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wmx h GLU 187 Cb 0.92 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2wmx h GLU 187 CO 0.07 -0.08 0.00 -1.35 -1.00 0.00 0.00 179.01 176.64 2wmx h PRO 188 N -0.16 0.00 -0.17 2.33 0.11 -1.91 -1.90 132.00 130.30 2wmx h PRO 188 Ca -0.01 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.99 2wmx h PRO 188 Cb 0.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.23 2wmx h PRO 188 CO 0.02 0.00 -0.30 0.28 -0.21 0.00 0.00 178.00 177.79 2wmx h VAL 189 N 0.00 1.35 0.00 3.15 2.07 -1.42 -1.84 116.25 119.55 2wmx h VAL 189 Ca 0.00 -1.54 -0.03 0.00 0.82 0.00 0.00 66.70 65.96 2wmx h VAL 189 Cb 0.06 1.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.75 2wmx h VAL 189 CO 0.00 0.47 -0.13 0.44 0.02 0.00 0.00 177.57 178.36 2wmx h ASP 190 N 0.15 0.00 -0.04 0.57 3.32 -1.23 -2.66 116.42 116.53 2wmx h ASP 190 Ca 0.01 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 2wmx h ASP 190 Cb 0.89 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.44 2wmx h ASP 190 CO 0.07 0.13 -0.33 0.58 -1.72 0.00 0.00 179.24 177.97 2wmx h VAL 191 N 0.00 1.46 -0.24 -1.35 2.07 -1.20 -2.24 116.25 114.75 2wmx h VAL 191 Ca -0.00 -1.82 0.06 0.00 0.82 0.00 0.00 66.70 65.76 2wmx h VAL 191 Cb 0.25 2.48 -0.07 0.00 -1.52 0.00 0.00 31.29 32.43 2wmx h VAL 191 CO 0.02 0.51 -0.31 -0.25 0.02 0.00 0.00 177.57 177.56 2wmx h TRP 192 N -0.25 -0.85 -0.42 1.57 2.91 -1.24 -1.52 115.95 116.15 2wmx h TRP 192 Ca -0.03 0.05 0.01 0.00 1.13 0.00 0.00 58.89 60.05 2wmx h TRP 192 Cb 1.01 0.41 -0.02 0.00 -0.51 0.00 0.00 29.16 30.05 2wmx h TRP 192 CO 0.14 -0.38 0.28 0.66 -1.03 0.00 0.00 178.44 178.11 2wmx h SER 193 N -0.32 0.44 -0.76 2.65 4.64 -1.47 0.08 113.55 118.81 2wmx h SER 193 Ca 0.13 -0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.39 2wmx h SER 193 Cb 0.53 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.48 2wmx h SER 193 CO -0.42 0.32 0.30 0.00 -0.87 0.00 0.00 176.83 176.15 2wmx h GLY 195 N 1.14 -0.04 0.31 0.00 0.00 -0.03 0.40 103.07 104.84 2wmx h GLY 195 Ca 0.25 0.01 0.16 0.00 0.00 0.00 0.00 47.33 47.76 2wmx h GLY 195 CO -0.02 -0.01 0.61 -2.22 0.00 0.00 0.00 176.54 174.90 2wmx h ILE 196 N -0.13 0.79 -0.47 2.60 1.08 -1.18 0.50 117.51 120.71 2wmx h ILE 196 Ca -0.00 -0.27 -0.11 0.00 -0.39 0.00 0.00 64.86 64.08 2wmx h ILE 196 Cb 0.12 -0.08 -0.02 0.00 -3.07 0.00 0.00 36.82 33.78 2wmx h ILE 196 CO 0.01 0.15 -0.15 0.58 -0.69 0.00 0.00 178.15 178.04 2wmx h VAL 197 N 0.80 1.27 -0.67 1.67 2.07 -0.61 -0.78 116.25 119.99 2wmx h VAL 197 Ca 0.53 -1.27 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 2wmx h VAL 197 Cb 0.77 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 2wmx h VAL 197 CO -0.30 0.44 0.23 0.25 0.02 0.00 0.00 177.57 178.21 2wmx h LEU 198 N 0.79 0.96 -0.52 2.57 5.85 0.38 -0.90 115.31 124.44 2wmx h LEU 198 Ca 0.12 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.67 2wmx h LEU 198 Cb 0.68 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 2wmx h LEU 198 CO 0.05 0.90 0.32 0.74 -0.34 0.00 0.00 178.44 180.11 2wmx h THR 199 N 0.97 1.06 -0.38 1.05 2.02 -0.75 -1.90 112.91 114.98 2wmx h THR 199 Ca 0.22 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 2wmx h THR 199 Cb 0.27 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 2wmx h THR 199 CO -0.01 0.11 0.08 0.00 0.37 0.00 0.00 175.52 176.07 2wmx h ALA 200 N 1.23 1.43 -0.01 6.16 0.00 -0.48 -2.19 119.26 125.40 2wmx h ALA 200 Ca 0.21 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2wmx h ALA 200 Cb 0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2wmx h ALA 200 CO -0.09 0.41 -0.62 0.52 0.00 0.00 0.00 179.25 179.47 2wmx h MET 201 N 0.55 0.03 -0.02 0.00 2.07 -0.43 -0.39 114.93 116.74 2wmx h MET 201 Ca 0.13 -0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.74 2wmx h MET 201 Cb 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.96 2wmx h MET 201 CO -0.00 0.64 -0.39 1.28 1.07 0.00 0.00 176.91 179.51 2wmx n LEU 202 N -3.81 1.96 0.00 1.22 4.77 -0.82 -1.11 117.00 119.21 2wmx n LEU 202 Ca -0.01 -0.78 0.00 0.00 -0.03 0.00 0.00 56.01 55.19 2wmx n LEU 202 Cb 0.62 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 2wmx n LEU 202 CO 0.42 0.36 -0.00 0.00 -1.33 0.00 0.00 177.39 176.85 2wmx n ALA 203 N 0.05 0.06 -1.16 -1.18 0.00 -0.85 -4.69 120.51 112.75 2wmx n ALA 203 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.47 2wmx n ALA 203 Cb 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.86 2wmx n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wmx n GLY 204 N 0.04 0.64 3.16 0.00 0.00 -0.16 -3.41 105.19 105.46 2wmx n GLY 204 Ca 0.00 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 2wmx n GLY 204 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wmx s GLU 205 N -2.08 0.71 0.05 1.61 -1.05 -1.26 -1.14 118.70 115.54 2wmx s GLU 205 Ca 0.00 -0.90 -0.20 0.00 -0.15 0.00 0.00 54.97 53.71 2wmx s GLU 205 Cb 0.00 0.28 -0.06 0.00 -0.44 0.00 0.00 34.13 33.91 2wmx s GLU 205 CO 0.00 -0.20 0.60 -0.51 0.95 0.00 0.00 175.26 176.10 2wmx s LEU 206 N -2.56 4.48 0.36 1.83 1.43 -1.26 -4.02 118.68 118.94 2wmx s LEU 206 Ca 0.01 1.25 0.17 0.00 -1.03 0.00 0.00 54.13 54.53 2wmx s LEU 206 Cb 0.03 -2.94 0.67 0.00 0.03 0.00 0.00 46.19 43.98 2wmx s LEU 206 CO -0.08 0.19 1.74 1.55 0.23 0.00 0.00 176.35 179.98 2wmx h PRO 207 N 5.01 0.00 -3.15 1.29 0.13 -1.92 -3.47 132.00 129.89 2wmx h PRO 207 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 2wmx h PRO 207 Cb 1.21 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.23 2wmx h PRO 207 CO 0.66 0.40 0.12 1.67 -0.23 0.00 0.00 178.00 180.62 2wmx s TRP 208 N -3.69 -0.31 0.18 1.56 -2.14 -1.26 -4.67 118.94 108.61 2wmx s TRP 208 Ca -0.01 0.01 0.03 0.00 2.66 0.00 0.00 56.10 58.79 2wmx s TRP 208 Cb 0.12 0.49 0.06 0.00 -3.10 0.00 0.00 33.47 31.03 2wmx s TRP 208 CO 0.70 -0.91 1.42 -0.44 -2.66 0.00 0.00 176.95 175.06 2wmx h ASP 209 N 2.11 0.27 -4.52 -2.66 3.32 -1.92 -3.42 116.42 109.59 2wmx h ASP 209 Ca -0.30 -0.20 0.01 0.00 0.02 0.00 0.00 57.03 56.56 2wmx h ASP 209 Cb 1.28 -0.08 -0.21 0.00 0.22 0.00 0.00 39.33 40.54 2wmx h ASP 209 CO 0.37 0.96 0.37 0.00 -1.72 0.00 0.00 179.24 179.22 2wmx s GLN 210 N -3.36 0.81 -1.51 3.56 -2.07 -1.26 -2.49 119.66 113.35 2wmx s GLN 210 Ca -0.03 0.21 -0.11 0.00 -1.82 0.00 0.00 55.36 53.61 2wmx s GLN 210 Cb 0.11 0.38 -0.07 0.00 -1.09 0.00 0.00 33.01 32.34 2wmx s GLN 210 CO 0.82 -0.25 2.73 -0.35 -1.32 0.00 0.00 175.29 176.92 2wmx n PRO 211 N 0.84 3.34 -4.29 9.60 -0.04 -1.26 -4.77 135.00 138.42 2wmx n PRO 211 Ca -0.14 -2.18 -0.19 0.00 -0.04 0.00 0.00 63.50 60.95 2wmx n PRO 211 Cb 0.57 -2.85 -0.11 0.00 -0.04 0.00 0.00 33.50 31.08 2wmx n PRO 211 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2wmx s SER 212 N 2.54 2.30 0.38 3.54 1.04 -1.26 -4.52 113.70 117.72 2wmx s SER 212 Ca 0.63 -0.91 0.11 0.00 0.48 0.00 0.00 55.95 56.26 2wmx s SER 212 Cb 0.16 -0.10 0.75 0.00 0.10 0.00 0.00 66.02 66.93 2wmx s SER 212 CO -0.06 -0.15 1.86 0.44 0.98 0.00 0.00 173.24 176.31 2wmx h ASP 213 N 3.09 0.08 0.16 7.02 5.19 -1.96 0.90 116.42 130.90 2wmx h ASP 213 Ca -0.39 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 55.99 2wmx h ASP 213 Cb 1.20 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.69 2wmx h ASP 213 CO 0.55 0.38 0.00 -1.54 -3.12 0.00 0.00 179.24 175.51 2wmx n SER 214 N -4.17 0.00 -4.54 6.45 3.41 -1.26 -4.50 113.62 109.02 2wmx n SER 214 Ca -0.02 0.42 -0.41 0.00 -0.26 0.00 0.00 58.87 58.60 2wmx n SER 214 Cb 0.36 -0.44 -0.09 0.00 -0.26 0.00 0.00 64.21 63.78 2wmx n SER 214 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wmx h GLN 216 N 8.51 0.12 -0.56 0.00 5.75 -1.84 -0.71 115.11 126.39 2wmx h GLN 216 Ca -0.28 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.19 2wmx h GLN 216 Cb 1.13 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.63 2wmx h GLN 216 CO 0.74 0.08 0.26 0.93 -2.65 0.00 0.00 178.83 178.19 2wmx h GLU 217 N 0.12 0.79 -0.05 1.69 3.07 -1.93 -1.07 114.58 117.20 2wmx h GLU 217 Ca 0.20 -0.10 -0.25 0.00 -0.50 0.00 0.00 59.36 58.71 2wmx h GLU 217 Cb 0.29 -0.15 0.02 0.00 -0.84 0.00 0.00 28.75 28.06 2wmx h GLU 217 CO -0.33 0.62 -0.95 -0.92 -1.40 0.00 0.00 179.01 176.03 2wmx h TYR 218 N 0.79 1.06 -0.88 4.33 3.20 -1.67 -2.46 116.97 121.34 2wmx h TYR 218 Ca 0.20 -0.54 0.09 0.00 3.14 0.00 0.00 58.73 61.62 2wmx h TYR 218 Cb 0.09 -0.14 -0.07 0.00 1.54 0.00 0.00 36.73 38.16 2wmx h TYR 218 CO 0.01 1.37 0.53 0.77 -1.64 0.00 0.00 178.16 179.20 2wmx h SER 219 N 0.45 0.79 -0.28 -2.11 0.02 -0.71 -1.72 113.55 109.98 2wmx h SER 219 Ca -0.10 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 2wmx h SER 219 Cb 1.60 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 64.00 2wmx h SER 219 CO 0.19 0.47 0.11 0.44 -1.14 0.00 0.00 176.83 176.90 2wmx h ASP 220 N 0.91 0.39 -0.66 3.07 3.45 -1.11 -2.13 116.42 120.33 2wmx h ASP 220 Ca 0.41 -0.16 0.04 0.00 0.43 0.00 0.00 57.03 57.75 2wmx h ASP 220 Cb 0.31 -0.10 -0.05 0.00 -0.56 0.00 0.00 39.33 38.93 2wmx h ASP 220 CO -0.22 0.44 0.39 -0.25 -1.57 0.00 0.00 179.24 178.03 2wmx h TRP 221 N 0.30 0.72 0.00 4.55 2.91 -1.25 -0.83 115.95 122.35 2wmx h TRP 221 Ca 0.09 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.14 2wmx h TRP 221 Cb 0.18 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 28.60 2wmx h TRP 221 CO -0.01 0.38 0.00 0.87 -1.03 0.00 0.00 178.44 178.65 2wmx h LYS 222 N 0.74 0.00 -0.54 2.65 1.57 -0.93 -0.28 116.57 119.78 2wmx h LYS 222 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2wmx h LYS 222 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2wmx h LYS 222 CO -0.14 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.13 2wmx n GLU 223 N -2.58 2.65 -1.44 3.15 1.02 -0.38 -4.97 120.64 118.09 2wmx n GLU 223 Ca -0.00 -2.37 -0.12 0.00 -0.02 0.00 0.00 57.16 54.65 2wmx n GLU 223 Cb 0.15 -1.46 -0.05 0.00 -0.02 0.00 0.00 31.44 30.07 2wmx n GLU 223 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2wmx n LYS 224 N 1.26 -0.85 -1.33 3.49 4.76 -0.12 -4.90 118.16 120.47 2wmx n LYS 224 Ca 0.19 0.89 -0.40 0.00 -2.87 0.00 0.00 58.31 56.12 2wmx n LYS 224 Cb 0.55 -4.92 -0.03 0.00 -1.84 0.00 0.00 35.03 28.79 2wmx n LYS 224 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2wmx n LYS 225 N -2.60 2.26 0.00 1.97 5.02 -0.85 -4.64 118.16 119.32 2wmx n LYS 225 Ca -0.12 -2.11 0.15 0.00 -2.02 0.00 0.00 58.31 54.20 2wmx n LYS 225 Cb 0.42 -2.99 0.75 0.00 -0.02 0.00 0.00 35.03 33.18 2wmx n LYS 225 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2wmx n THR 226 N 5.25 0.02 1.14 -0.18 -2.24 -1.26 -2.60 114.28 114.41 2wmx n THR 226 Ca 0.52 0.01 0.11 0.00 -2.27 0.00 0.00 64.05 62.42 2wmx n THR 226 Cb 0.35 -0.52 0.59 0.00 -2.10 0.00 0.00 70.33 68.65 2wmx n THR 226 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wmx n TYR 227 N -1.28 0.00 -3.06 4.78 0.18 -1.26 -1.87 117.16 114.65 2wmx n TYR 227 Ca 0.14 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.68 2wmx n TYR 227 Cb 0.24 -0.22 0.00 0.00 -0.38 0.00 0.00 39.34 38.97 2wmx n TYR 227 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2wmx s LEU 228 N -2.45 3.76 0.58 -3.48 1.43 -1.07 -4.65 118.68 112.80 2wmx s LEU 228 Ca 0.24 0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 53.61 2wmx s LEU 228 Cb 0.15 -3.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 2wmx s LEU 228 CO 0.32 -0.55 1.16 0.20 0.23 0.00 0.00 176.35 177.72 2wmx s ASN 229 N -4.14 5.40 0.00 2.29 0.01 -1.26 -1.19 114.94 116.05 2wmx s ASN 229 Ca 0.45 2.26 0.29 0.00 -0.71 0.00 0.00 52.86 55.16 2wmx s ASN 229 Cb -0.10 -2.59 1.31 0.00 0.41 0.00 0.00 41.25 40.29 2wmx s ASN 229 CO 0.38 -1.44 1.96 -0.81 -1.51 0.00 0.00 177.10 175.68 2wmx n PRO 230 N -1.55 0.12 0.04 -0.60 -0.04 -1.26 -4.86 135.00 126.85 2wmx n PRO 230 Ca 0.12 -0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.55 2wmx n PRO 230 Cb 0.50 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.68 2wmx n PRO 230 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2wmx h TRP 231 N 0.00 0.48 -0.92 0.54 4.06 -1.59 -2.50 115.95 116.03 2wmx h TRP 231 Ca 0.00 -0.10 0.18 0.00 2.06 0.00 0.00 58.89 61.02 2wmx h TRP 231 Cb 0.44 -0.12 -0.08 0.00 -1.00 0.00 0.00 29.16 28.41 2wmx h TRP 231 CO 0.00 0.67 0.59 -0.22 -3.56 0.00 0.00 178.44 175.92 2wmx h LYS 232 N 0.37 0.57 -0.00 0.49 3.64 -0.40 -1.21 116.57 120.03 2wmx h LYS 232 Ca 0.05 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2wmx h LYS 232 Cb 0.68 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 2wmx h LYS 232 CO 0.05 0.37 -0.00 1.63 -2.27 0.00 0.00 179.45 179.23 2wmx n LYS 233 N -4.58 0.81 -4.31 1.90 5.02 -0.94 -4.83 118.16 111.23 2wmx n LYS 233 Ca 0.19 -0.01 -0.34 0.00 -2.02 0.00 0.00 58.31 56.13 2wmx n LYS 233 Cb 0.59 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.98 2wmx n LYS 233 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wmx s ILE 234 N -2.20 4.00 0.87 -0.18 1.01 -0.46 -4.87 121.20 119.37 2wmx s ILE 234 Ca 0.41 -0.32 -0.12 0.00 0.00 0.00 0.00 60.65 60.63 2wmx s ILE 234 Cb 0.21 -2.77 0.11 0.00 0.01 0.00 0.00 42.46 40.03 2wmx s ILE 234 CO 0.40 0.48 1.13 -0.67 0.00 0.00 0.00 174.94 176.28 2wmx n ASP 235 N 3.63 0.51 0.19 3.58 -0.08 -1.26 -4.76 116.55 118.36 2wmx n ASP 235 Ca -0.17 0.49 0.06 0.00 -1.51 0.00 0.00 54.79 53.66 2wmx n ASP 235 Cb 0.52 -1.48 0.54 0.00 2.34 0.00 0.00 41.12 43.05 2wmx n ASP 235 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2wmx h SER 236 N -1.41 0.11 0.04 1.67 4.64 -1.98 -2.06 113.55 114.56 2wmx h SER 236 Ca -0.45 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2wmx h SER 236 Cb 1.28 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2wmx h SER 236 CO 0.43 0.14 -0.02 0.00 -0.87 0.00 0.00 176.83 176.51 2wmx h ALA 237 N 1.87 -0.06 -0.28 5.18 0.00 -2.00 -1.76 119.26 122.21 2wmx h ALA 237 Ca 0.03 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 2wmx h ALA 237 Cb 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2wmx h ALA 237 CO 0.00 -0.17 0.17 -1.35 0.00 0.00 0.00 179.25 177.90 2wmx h PRO 238 N -0.78 0.38 -0.07 0.00 0.11 -1.93 -2.74 132.00 126.97 2wmx h PRO 238 Ca -0.01 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.94 2wmx h PRO 238 Cb 0.66 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.67 2wmx h PRO 238 CO 0.01 0.27 -0.56 1.25 -0.21 0.00 0.00 178.00 178.77 2wmx h LEU 239 N 0.39 0.24 -0.94 2.35 5.85 -1.32 -1.38 115.31 120.50 2wmx h LEU 239 Ca 0.10 -0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.60 2wmx h LEU 239 Cb -0.01 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2wmx h LEU 239 CO -0.02 0.75 -0.26 0.00 -0.34 0.00 0.00 178.44 178.57 2wmx h ALA 240 N 1.26 1.10 -0.24 1.25 0.00 -1.01 0.71 119.26 122.33 2wmx h ALA 240 Ca -0.00 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 2wmx h ALA 240 Cb 1.03 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2wmx h ALA 240 CO 0.08 0.56 -0.28 1.25 0.00 0.00 0.00 179.25 180.86 2wmx h LEU 241 N 0.41 0.65 -1.34 0.00 5.85 -1.38 -2.76 115.31 116.73 2wmx h LEU 241 Ca 0.06 -0.49 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 2wmx h LEU 241 Cb 0.68 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2wmx h LEU 241 CO 0.05 1.01 0.30 -0.07 -0.34 0.00 0.00 178.44 179.40 2wmx h LEU 242 N 0.31 0.67 -1.97 2.25 3.38 -0.97 0.44 115.31 119.41 2wmx h LEU 242 Ca 0.03 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.97 2wmx h LEU 242 Cb 0.85 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 2wmx h LEU 242 CO 0.07 0.54 0.06 0.45 0.09 0.00 0.00 178.44 179.64 2wmx h HIS 243 N 0.76 0.04 0.00 1.13 3.86 -0.67 -0.69 115.15 119.58 2wmx h HIS 243 Ca 0.20 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 59.19 2wmx h HIS 243 Cb 0.02 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 28.44 2wmx h HIS 243 CO 0.00 0.02 -1.18 0.87 0.86 0.00 0.00 177.93 178.51 2wmx h LYS 244 N 0.04 0.00 0.06 2.45 1.57 -0.69 -3.39 116.57 116.61 2wmx h LYS 244 Ca 0.04 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.68 2wmx h LYS 244 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2wmx h LYS 244 CO -0.00 0.71 -0.67 0.82 -0.57 0.00 0.00 179.45 179.74 2wmx h ILE 245 N 0.00 1.45 -0.52 1.86 2.04 -0.93 -1.93 117.51 119.48 2wmx h ILE 245 Ca -0.10 -2.38 -0.39 0.00 1.00 0.00 0.00 64.86 62.99 2wmx h ILE 245 Cb 1.77 3.04 -0.11 0.00 -0.74 0.00 0.00 36.82 40.77 2wmx h ILE 245 CO 0.10 0.61 0.41 0.18 0.00 0.00 0.00 178.15 179.45 2wmx n LEU 246 N -4.33 6.18 -4.65 1.44 4.77 -0.29 -4.67 117.00 115.45 2wmx n LEU 246 Ca -0.17 -3.74 -0.38 0.00 -0.03 0.00 0.00 56.01 51.69 2wmx n LEU 246 Cb 0.68 -1.35 -0.08 0.00 -2.33 0.00 0.00 43.42 40.34 2wmx n LEU 246 CO 0.37 1.76 0.03 -0.69 -1.33 0.00 0.00 177.39 177.53 2wmx s VAL 247 N -0.40 5.23 0.23 4.08 1.01 -1.26 -4.95 120.40 124.33 2wmx s VAL 247 Ca 0.63 0.56 -0.08 0.00 0.00 0.00 0.00 61.98 63.10 2wmx s VAL 247 Cb 0.33 -3.67 0.21 0.00 0.00 0.00 0.00 36.38 33.25 2wmx s VAL 247 CO -0.10 0.25 1.89 -0.08 0.00 0.00 0.00 175.10 177.06 2wmx h GLU 248 N 7.57 1.20 -6.47 2.72 4.81 -1.96 -3.38 114.58 119.07 2wmx h GLU 248 Ca -0.36 -0.10 -0.56 0.00 -0.13 0.00 0.00 59.36 58.22 2wmx h GLU 248 Cb 1.16 -0.26 -0.05 0.00 0.63 0.00 0.00 28.75 30.23 2wmx h GLU 248 CO 0.69 0.83 1.09 1.21 -0.73 0.00 0.00 179.01 182.10 2wmx s ASN 249 N -6.09 6.22 0.62 1.04 3.84 -1.26 -4.62 114.94 114.69 2wmx s ASN 249 Ca -0.13 0.63 0.34 0.00 0.21 0.00 0.00 52.86 53.91 2wmx s ASN 249 Cb 0.17 -2.54 1.84 0.00 -0.55 0.00 0.00 41.25 40.16 2wmx s ASN 249 CO 0.81 -1.57 2.03 1.55 -2.79 0.00 0.00 177.10 177.13 2wmx h PRO 250 N 11.02 0.00 0.00 0.43 0.13 -1.96 0.77 132.00 142.39 2wmx h PRO 250 Ca -0.27 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.72 2wmx h PRO 250 Cb 1.10 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 2wmx h PRO 250 CO 1.12 0.00 -1.10 0.77 -0.23 0.00 0.00 178.00 178.56 2wmx h SER 251 N 0.00 0.00 0.74 1.44 0.02 -1.92 -3.29 113.55 110.53 2wmx h SER 251 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wmx h SER 251 Cb 0.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.91 2wmx h SER 251 CO 0.00 0.53 -1.21 0.00 -1.14 0.00 0.00 176.83 175.01 2wmx n ALA 252 N -2.33 2.66 -1.64 3.77 0.00 0.05 -4.94 120.51 118.08 2wmx n ALA 252 Ca -0.05 -0.31 -0.44 0.00 0.00 0.00 0.00 53.44 52.64 2wmx n ALA 252 Cb 0.79 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 19.20 2wmx n ALA 252 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2wmx n ARG 253 N -2.52 1.71 -1.68 0.00 0.63 0.02 -4.90 116.66 109.92 2wmx n ARG 253 Ca -0.01 0.60 -0.38 0.00 -0.92 0.00 0.00 57.85 57.14 2wmx n ARG 253 Cb 0.54 -2.11 0.05 0.00 0.45 0.00 0.00 32.46 31.39 2wmx n ARG 253 CO 0.00 0.00 0.00 1.51 -2.51 0.00 0.00 177.63 176.63 2wmx n ILE 254 N 0.76 3.91 -3.89 5.15 3.06 -0.72 -5.01 119.36 122.61 2wmx n ILE 254 Ca 0.09 -0.50 -0.21 0.00 -2.50 0.00 0.00 62.75 59.63 2wmx n ILE 254 Cb 0.32 -1.40 -0.02 0.00 0.54 0.00 0.00 39.64 39.08 2wmx n ILE 254 CO 0.00 0.00 0.00 0.42 -2.50 0.00 0.00 176.55 174.47 2wmx s THR 255 N -1.39 4.99 0.18 9.51 -4.23 -1.26 -4.93 115.64 118.51 2wmx s THR 255 Ca 0.75 -1.02 -0.14 0.00 -1.18 0.00 0.00 61.69 60.10 2wmx s THR 255 Cb -0.42 -3.75 0.09 0.00 1.34 0.00 0.00 72.50 69.76 2wmx s THR 255 CO 0.47 -0.30 1.71 0.40 -0.54 0.00 0.00 174.62 176.37 2wmx h ILE 256 N 1.14 0.74 -0.74 2.99 2.04 -1.98 -0.32 117.51 121.38 2wmx h ILE 256 Ca -0.51 -0.07 0.13 0.00 1.00 0.00 0.00 64.86 65.41 2wmx h ILE 256 Cb 1.24 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 37.79 2wmx h ILE 256 CO 0.59 0.04 0.49 -0.65 0.00 0.00 0.00 178.15 178.62 2wmx h PRO 257 N 0.20 0.49 0.00 2.37 0.11 -1.99 -0.84 132.00 132.34 2wmx h PRO 257 Ca 0.22 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 66.15 2wmx h PRO 257 Cb 0.29 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 2wmx h PRO 257 CO -0.31 0.32 -0.73 -0.44 -0.21 0.00 0.00 178.00 176.64 2wmx h ASP 258 N 0.50 0.00 -0.86 -2.05 3.45 -1.59 -3.00 116.42 112.88 2wmx h ASP 258 Ca 0.36 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.79 2wmx h ASP 258 Cb 0.69 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.42 2wmx h ASP 258 CO -0.12 0.73 0.44 0.40 -1.57 0.00 0.00 179.24 179.11 2wmx h ILE 259 N 0.00 1.26 0.00 0.35 2.04 0.20 -1.90 117.51 119.46 2wmx h ILE 259 Ca -0.01 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.16 2wmx h ILE 259 Cb 1.34 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.54 2wmx h ILE 259 CO 0.09 0.30 0.00 0.29 0.00 0.00 0.00 178.15 178.84 2wmx n LYS 260 N -4.32 0.05 0.00 2.37 5.02 -0.51 -1.43 118.16 119.34 2wmx n LYS 260 Ca 0.09 0.47 0.06 0.00 -2.02 0.00 0.00 58.31 56.92 2wmx n LYS 260 Cb 0.12 -1.63 -0.02 0.00 -0.02 0.00 0.00 35.03 33.48 2wmx n LYS 260 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2wmx n LYS 261 N -1.73 2.12 -1.78 1.97 5.02 -0.74 -4.83 118.16 118.19 2wmx n LYS 261 Ca 0.01 -0.54 -0.40 0.00 -2.02 0.00 0.00 58.31 55.36 2wmx n LYS 261 Cb 0.06 -1.16 0.02 0.00 -0.02 0.00 0.00 35.03 33.93 2wmx n LYS 261 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2wmx s ASP 262 N -1.76 5.85 0.17 4.39 -1.08 -0.52 -4.88 116.67 118.84 2wmx s ASP 262 Ca 0.09 2.94 -0.17 0.00 -0.52 0.00 0.00 52.55 54.90 2wmx s ASP 262 Cb 0.10 -2.66 0.10 0.00 -1.46 0.00 0.00 42.92 39.00 2wmx s ASP 262 CO 0.37 -1.20 1.67 -0.09 0.52 0.00 0.00 175.17 176.45 2wmx h ARG 263 N 2.31 0.02 -0.46 4.34 2.43 -1.94 -2.11 114.38 118.98 2wmx h ARG 263 Ca -0.51 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.54 2wmx h ARG 263 Cb 1.27 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 2wmx h ARG 263 CO 0.61 0.01 -0.18 2.35 -1.51 0.00 0.00 179.97 181.25 2wmx h TRP 264 N 0.02 1.06 -0.98 2.20 7.01 -1.92 -1.22 115.95 122.12 2wmx h TRP 264 Ca 0.19 -0.25 0.19 0.00 2.11 0.00 0.00 58.89 61.13 2wmx h TRP 264 Cb 0.29 -0.25 -0.09 0.00 -2.10 0.00 0.00 29.16 27.01 2wmx h TRP 264 CO -0.34 1.05 0.61 -0.92 -2.79 0.00 0.00 178.44 176.06 2wmx h TYR 265 N 0.77 0.93 -0.63 2.65 5.03 -1.78 -2.40 116.97 121.54 2wmx h TYR 265 Ca 0.11 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.45 2wmx h TYR 265 Cb 0.75 -0.28 0.00 0.00 1.55 0.00 0.00 36.73 38.75 2wmx h TYR 265 CO 0.05 0.23 0.00 0.09 -1.32 0.00 0.00 178.16 177.21 2wmx n ASN 266 N -4.68 3.71 -4.67 -2.11 3.02 -0.82 -4.95 115.26 104.77 2wmx n ASN 266 Ca 0.22 -1.99 -0.43 0.00 -0.03 0.00 0.00 54.58 52.35 2wmx n ASN 266 Cb 0.59 -0.42 -0.02 0.00 -0.61 0.00 0.00 39.78 39.32 2wmx n ASN 266 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2wmx s LYS 267 N -1.03 4.30 0.16 3.52 2.20 -0.51 -5.01 119.74 123.38 2wmx s LYS 267 Ca 0.43 1.36 -0.32 0.00 -0.36 0.00 0.00 55.97 57.09 2wmx s LYS 267 Cb 0.23 -3.61 -0.11 0.00 -1.51 0.00 0.00 37.83 32.82 2wmx s LYS 267 CO 0.30 -0.54 1.70 -2.14 -0.36 0.00 0.00 175.35 174.30 2wmx s PRO 268 N 2.87 4.16 0.00 4.03 0.02 -1.26 -5.03 135.00 139.79 2wmx s PRO 268 Ca 0.45 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.98 2wmx s PRO 268 Cb -0.16 -3.26 0.00 0.00 0.02 0.00 0.00 34.50 31.10 2wmx s PRO 268 CO 0.09 -0.73 0.00 1.28 -0.33 0.00 0.00 177.00 177.31