#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdk n ASN 3 N 0.00 0.00 -0.45 1.61 6.94 -1.26 -5.09 115.26 117.01 2wdk n ASN 3 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 2wdk n ASN 3 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2wdk n ASN 3 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2wdk n LYS 4 N -0.37 0.00 -1.34 -3.83 5.02 -1.26 -4.73 118.16 111.65 2wdk n LYS 4 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.93 2wdk n LYS 4 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.08 2wdk n LYS 4 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2wdk n ILE 5 N 0.01 2.31 -1.12 -0.18 -6.64 -1.26 -4.79 119.36 107.70 2wdk n ILE 5 Ca 0.00 -0.41 -0.41 0.00 -1.77 0.00 0.00 62.75 60.16 2wdk n ILE 5 Cb 0.00 -0.88 -0.04 0.00 -1.44 0.00 0.00 39.64 37.27 2wdk n ILE 5 CO 0.00 0.00 0.00 1.57 -1.77 0.00 0.00 176.55 176.35 2wdk n HIS 6 N -2.32 0.06 0.50 4.28 -0.00 -1.26 -4.86 115.22 111.63 2wdk n HIS 6 Ca 0.11 0.78 0.13 0.00 -0.00 0.00 0.00 57.72 58.74 2wdk n HIS 6 Cb 0.49 -1.56 0.35 0.00 -0.00 0.00 0.00 29.99 29.27 2wdk n HIS 6 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2wdk h PRO 7 N 1.55 0.00 0.00 1.57 0.13 -1.94 -3.09 132.00 130.22 2wdk h PRO 7 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2wdk h PRO 7 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2wdk h PRO 7 CO 0.47 0.00 -0.14 0.82 -0.23 0.00 0.00 178.00 178.92 2wdk h ILE 8 N 0.00 0.00 0.00 -3.56 1.08 -1.90 -3.16 117.51 109.96 2wdk h ILE 8 Ca 0.00 -0.67 0.00 0.00 -0.39 0.00 0.00 64.86 63.80 2wdk h ILE 8 Cb 0.79 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.54 2wdk h ILE 8 CO 0.00 0.00 0.24 1.23 -0.69 0.00 0.00 178.15 178.93 2wdk h GLY 9 N -0.67 0.00 0.39 5.37 0.00 -1.96 1.67 103.07 107.87 2wdk h GLY 9 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2wdk h GLY 9 CO 0.00 0.00 -0.07 -2.75 0.00 0.00 0.00 176.54 173.72 2wdk h PHE 10 N 0.00 -0.18 -0.05 5.60 3.57 -1.67 -3.32 116.94 120.89 2wdk h PHE 10 Ca 0.00 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2wdk h PHE 10 Cb 0.48 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.28 2wdk h PHE 10 CO 0.00 0.28 -0.05 0.00 -2.23 0.00 0.00 178.31 176.31 2wdk h ARG 11 N -0.81 0.12 0.00 1.11 2.47 -0.72 -3.40 114.38 113.16 2wdk h ARG 11 Ca -0.02 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.64 2wdk h ARG 11 Cb 0.54 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.86 2wdk h ARG 11 CO 0.03 0.57 0.00 -0.11 0.56 0.00 0.00 179.97 181.03 2wdk n LEU 12 N -4.75 0.00 -0.17 3.04 -0.00 0.54 0.12 117.00 115.78 2wdk n LEU 12 Ca -0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 55.92 2wdk n LEU 12 Cb 0.29 0.00 0.07 0.00 -0.00 0.00 0.00 43.42 43.77 2wdk n LEU 12 CO 0.35 0.00 0.83 1.23 -0.00 0.00 0.00 177.39 179.80 2wdk h GLY 13 N 0.00 0.52 0.00 -3.96 0.00 -1.80 -3.38 103.07 94.45 2wdk h GLY 13 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2wdk h GLY 13 CO 0.00 -0.17 0.00 4.51 0.00 0.00 0.00 176.54 180.88 2wdk n ILE 14 N -5.27 0.00 0.00 2.60 3.06 0.32 -4.94 119.36 115.14 2wdk n ILE 14 Ca 0.06 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.31 2wdk n ILE 14 Cb 0.29 -0.39 0.00 0.00 0.54 0.00 0.00 39.64 40.08 2wdk n ILE 14 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 2wdk n THR 15 N -0.19 0.00 -0.77 9.51 -1.04 -1.21 -4.74 114.28 115.83 2wdk n THR 15 Ca 0.00 0.35 -0.33 0.00 -2.04 0.00 0.00 64.05 62.04 2wdk n THR 15 Cb 0.00 -0.91 0.13 0.00 -1.82 0.00 0.00 70.33 67.72 2wdk n THR 15 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2wdk n ARG 16 N 0.00 -0.34 -4.62 -2.82 3.00 -1.26 -4.92 116.66 105.70 2wdk n ARG 16 Ca 0.00 -0.05 -0.30 0.00 -0.00 0.00 0.00 57.85 57.50 2wdk n ARG 16 Cb 0.00 -1.93 -0.14 0.00 0.00 0.00 0.00 32.46 30.39 2wdk n ARG 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2wdk s ASP 17 N -2.11 3.31 -0.19 6.15 -0.00 -1.26 -4.56 116.67 118.01 2wdk s ASP 17 Ca 0.58 -0.65 -0.34 0.00 -0.00 0.00 0.00 52.55 52.13 2wdk s ASP 17 Cb -0.21 -0.29 -0.11 0.00 -0.00 0.00 0.00 42.92 42.31 2wdk s ASP 17 CO 0.66 0.22 1.98 0.79 -0.00 0.00 0.00 175.17 178.82 2wdk n TRP 18 N 1.31 2.09 -0.30 4.23 5.03 -1.26 -4.76 117.44 123.77 2wdk n TRP 18 Ca -0.17 0.11 0.00 0.00 3.03 0.00 0.00 57.50 60.46 2wdk n TRP 18 Cb 0.52 -2.62 0.00 0.00 -1.03 0.00 0.00 31.31 28.19 2wdk n TRP 18 CO 0.00 0.00 0.00 -1.91 -0.03 0.00 0.00 177.69 175.75 2wdk n GLU 19 N 7.12 0.69 0.00 -0.99 2.13 -1.26 -2.96 120.64 125.37 2wdk n GLU 19 Ca 0.28 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.10 2wdk n GLU 19 Cb 0.28 -1.16 0.00 0.00 0.27 0.00 0.00 31.44 30.83 2wdk n GLU 19 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2wdk n SER 20 N 1.62 0.00 -4.64 4.31 2.88 -1.26 -4.06 113.62 112.47 2wdk n SER 20 Ca 0.00 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.15 2wdk n SER 20 Cb 0.34 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.73 2wdk n SER 20 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wdk s ARG 21 N 0.00 4.13 0.14 -1.46 1.70 -0.82 -4.92 118.95 117.72 2wdk s ARG 21 Ca 0.00 0.35 -0.22 0.00 -0.47 0.00 0.00 55.73 55.39 2wdk s ARG 21 Cb 0.00 -3.60 0.08 0.00 -0.57 0.00 0.00 34.95 30.86 2wdk s ARG 21 CO 0.00 -0.23 1.05 -2.67 -1.08 0.00 0.00 175.30 172.36 2wdk n TRP 22 N 5.11 -1.13 -4.63 5.89 4.27 -1.26 -3.92 117.44 121.76 2wdk n TRP 22 Ca -0.05 -1.12 -0.30 0.00 -3.89 0.00 0.00 57.50 52.15 2wdk n TRP 22 Cb 0.50 0.54 -0.09 0.00 -1.36 0.00 0.00 31.31 30.90 2wdk n TRP 22 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 2wdk s TYR 23 N -2.20 2.22 0.00 -2.67 5.04 -1.26 -5.04 117.35 113.43 2wdk s TYR 23 Ca 0.24 -0.79 0.00 0.00 -2.44 0.00 0.00 57.07 54.07 2wdk s TYR 23 Cb -0.02 -1.72 0.00 0.00 0.35 0.00 0.00 41.96 40.56 2wdk s TYR 23 CO 0.04 0.31 0.00 0.00 -1.34 0.00 0.00 175.55 174.56 2wdk n ALA 24 N -1.14 0.00 -1.44 3.97 0.00 -1.26 -4.95 120.51 115.69 2wdk n ALA 24 Ca -0.11 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.23 2wdk n ALA 24 Cb 0.67 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.21 2wdk n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdk n GLY 25 N -0.57 -1.29 0.00 0.00 0.00 -1.22 -4.92 105.19 97.19 2wdk n GLY 25 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2wdk n GLY 25 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wdk n LYS 26 N -2.31 0.00 -0.43 1.61 2.85 -1.26 -3.06 118.16 115.56 2wdk n LYS 26 Ca 0.08 0.41 0.36 0.00 -1.05 0.00 0.00 58.31 58.11 2wdk n LYS 26 Cb 0.27 -1.32 0.61 0.00 -0.65 0.00 0.00 35.03 33.93 2wdk n LYS 26 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2wdk n LYS 27 N -1.61 -0.03 -4.02 -1.58 5.02 -1.26 -3.47 118.16 111.20 2wdk n LYS 27 Ca 0.00 1.12 -0.32 0.00 -2.02 0.00 0.00 58.31 57.09 2wdk n LYS 27 Cb 0.00 -2.21 -0.15 0.00 -0.02 0.00 0.00 35.03 32.65 2wdk n LYS 27 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2wdk s GLN 28 N -5.06 1.93 0.00 1.97 -1.52 -1.17 -4.68 119.66 111.12 2wdk s GLN 28 Ca -0.07 -1.59 0.00 0.00 -1.95 0.00 0.00 55.36 51.76 2wdk s GLN 28 Cb 0.28 -3.08 0.00 0.00 -0.22 0.00 0.00 33.01 29.98 2wdk s GLN 28 CO 0.73 -0.75 0.00 0.98 -0.25 0.00 0.00 175.29 176.00 2wdk n TYR 29 N 4.38 0.00 -0.40 0.91 -0.00 -1.23 -3.38 117.16 117.44 2wdk n TYR 29 Ca -0.06 0.00 0.35 0.00 -0.00 0.00 0.00 57.90 58.19 2wdk n TYR 29 Cb 0.42 0.00 0.69 0.00 -0.00 0.00 0.00 39.34 40.45 2wdk n TYR 29 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.86 176.77 2wdk h ARG 30 N 0.00 0.11 0.10 2.98 9.65 -1.83 0.18 114.38 125.56 2wdk h ARG 30 Ca 0.00 -0.01 -0.34 0.00 -1.10 0.00 0.00 59.98 58.53 2wdk h ARG 30 Cb 0.00 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 2wdk h ARG 30 CO 0.00 0.07 -1.86 0.72 2.80 0.00 0.00 179.97 181.70 2wdk n HIS 31 N -4.34 1.19 0.20 2.20 8.25 -1.26 -2.81 115.22 118.65 2wdk n HIS 31 Ca 0.30 0.30 0.02 0.00 -0.26 0.00 0.00 57.72 58.08 2wdk n HIS 31 Cb 1.30 -1.15 0.11 0.00 1.12 0.00 0.00 29.99 31.37 2wdk n HIS 31 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2wdk n LEU 32 N -3.68 0.00 -0.09 2.41 4.77 0.44 -0.66 117.00 120.18 2wdk n LEU 32 Ca -0.32 0.25 -0.20 0.00 -0.03 0.00 0.00 56.01 55.71 2wdk n LEU 32 Cb 0.97 -0.25 -0.07 0.00 -2.33 0.00 0.00 43.42 41.75 2wdk n LEU 32 CO 0.38 -0.22 -1.13 -0.11 -1.33 0.00 0.00 177.39 174.98 2wdk n LEU 33 N -1.25 1.32 -0.31 2.23 7.94 -0.06 -3.57 117.00 123.29 2wdk n LEU 33 Ca 0.02 0.23 0.08 0.00 -1.11 0.00 0.00 56.01 55.23 2wdk n LEU 33 Cb 0.03 -0.55 0.28 0.00 0.53 0.00 0.00 43.42 43.71 2wdk n LEU 33 CO 0.03 0.37 1.23 0.25 -1.11 0.00 0.00 177.39 178.17 2wdk h LEU 34 N -0.67 0.84 -0.24 -1.96 6.46 -1.30 0.21 115.31 118.64 2wdk h LEU 34 Ca -0.47 0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.29 2wdk h LEU 34 Cb 1.40 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 41.19 2wdk h LEU 34 CO -0.28 0.47 0.01 -0.08 -0.62 0.00 0.00 178.44 177.94 2wdk h GLU 35 N 0.91 0.41 -0.75 1.25 4.81 -1.12 -2.62 114.58 117.47 2wdk h GLU 35 Ca 0.45 -0.12 0.13 0.00 -0.13 0.00 0.00 59.36 59.69 2wdk h GLU 35 Cb 0.47 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.76 2wdk h GLU 35 CO -0.21 0.57 0.49 -0.44 -0.73 0.00 0.00 179.01 178.70 2wdk h ASP 36 N 0.19 0.46 0.45 1.04 3.45 -0.77 -1.82 116.42 119.42 2wdk h ASP 36 Ca 0.07 0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.53 2wdk h ASP 36 Cb 0.38 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 2wdk h ASP 36 CO 0.01 0.25 -0.22 1.56 -1.57 0.00 0.00 179.24 179.27 2wdk h GLN 37 N 0.50 -0.59 0.00 3.56 1.08 -0.53 -2.90 115.11 116.23 2wdk h GLN 37 Ca 0.36 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.60 2wdk h GLN 37 Cb 0.71 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.27 2wdk h GLN 37 CO -0.12 -0.39 0.25 2.89 -0.95 0.00 0.00 178.83 180.50 2wdk n ARG 38 N -4.65 0.09 0.25 1.46 1.85 -1.02 0.15 116.66 114.80 2wdk n ARG 38 Ca -0.08 0.57 -0.11 0.00 -1.00 0.00 0.00 57.85 57.24 2wdk n ARG 38 Cb 0.24 -2.05 -0.05 0.00 -1.05 0.00 0.00 32.46 29.55 2wdk n ARG 38 CO 0.00 0.00 0.00 0.82 -0.01 0.00 0.00 177.63 178.44 2wdk h ILE 39 N 0.00 0.00 -0.01 8.89 2.04 -1.14 -2.52 117.51 124.77 2wdk h ILE 39 Ca 0.00 -0.48 -0.13 0.00 1.00 0.00 0.00 64.86 65.25 2wdk h ILE 39 Cb 0.49 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 2wdk h ILE 39 CO 0.00 0.00 -0.60 0.03 0.00 0.00 0.00 178.15 177.58 2wdk h ARG 40 N -1.19 0.02 -0.07 2.37 3.08 -0.50 -1.52 114.38 116.57 2wdk h ARG 40 Ca -0.07 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.00 2wdk h ARG 40 Cb 0.54 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.53 2wdk h ARG 40 CO 0.12 0.62 -0.37 0.78 -1.07 0.00 0.00 179.97 180.04 2wdk h GLY 41 N 1.78 -0.62 0.66 0.04 0.00 0.13 -0.36 103.07 104.71 2wdk h GLY 41 Ca -0.01 0.46 -0.03 0.00 0.00 0.00 0.00 47.33 47.75 2wdk h GLY 41 CO 0.08 -0.23 -0.32 -2.00 0.00 0.00 0.00 176.54 174.07 2wdk h LEU 42 N -0.49 -0.75 -0.61 3.11 5.85 -1.39 -3.27 115.31 117.76 2wdk h LEU 42 Ca 0.07 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.87 2wdk h LEU 42 Cb 0.60 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.75 2wdk h LEU 42 CO -0.34 -0.45 -0.36 0.18 -0.34 0.00 0.00 178.44 177.13 2wdk n LEU 43 N -4.89 -0.64 0.04 2.25 4.77 -0.58 0.67 117.00 118.62 2wdk n LEU 43 Ca -0.11 1.39 0.02 0.00 -0.03 0.00 0.00 56.01 57.28 2wdk n LEU 43 Cb 0.35 -0.30 0.11 0.00 -2.33 0.00 0.00 43.42 41.25 2wdk n LEU 43 CO 0.27 -1.04 0.57 -0.62 -1.33 0.00 0.00 177.39 175.24 2wdk n GLU 44 N -4.39 0.03 0.00 3.23 1.02 -0.16 -2.88 120.64 117.49 2wdk n GLU 44 Ca 0.01 0.46 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 2wdk n GLU 44 Cb 0.16 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 2wdk n GLU 44 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2wdk n LYS 45 N -1.58 0.00 -0.62 3.49 5.02 0.21 -3.62 118.16 121.07 2wdk n LYS 45 Ca -0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.13 2wdk n LYS 45 Cb 0.10 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.07 2wdk n LYS 45 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2wdk n GLU 46 N 0.00 1.64 0.00 1.97 4.71 -1.17 -1.02 120.64 126.77 2wdk n GLU 46 Ca 0.00 -1.12 0.00 0.00 -0.01 0.00 0.00 57.16 56.03 2wdk n GLU 46 Cb 0.00 -2.22 0.00 0.00 -1.01 0.00 0.00 31.44 28.21 2wdk n GLU 46 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 2wdk n LEU 47 N 3.83 0.00 -0.13 -4.62 7.94 -1.14 -4.94 117.00 117.94 2wdk n LEU 47 Ca 0.35 -0.09 -0.03 0.00 -1.11 0.00 0.00 56.01 55.13 2wdk n LEU 47 Cb 0.22 0.00 0.18 0.00 0.53 0.00 0.00 43.42 44.35 2wdk n LEU 47 CO 0.54 0.22 0.97 0.22 -1.11 0.00 0.00 177.39 178.23 2wdk h TYR 48 N 0.00 0.87 -0.58 1.96 3.20 -1.14 -2.97 116.97 118.31 2wdk h TYR 48 Ca 0.00 -0.08 0.10 0.00 3.14 0.00 0.00 58.73 61.88 2wdk h TYR 48 Cb 0.27 -0.25 -0.11 0.00 1.54 0.00 0.00 36.73 38.17 2wdk h TYR 48 CO 0.00 0.73 -0.38 0.77 -1.64 0.00 0.00 178.16 177.65 2wdk h SER 49 N 0.81 -1.30 0.23 -2.11 0.02 -1.91 0.47 113.55 109.75 2wdk h SER 49 Ca 0.18 0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 61.31 2wdk h SER 49 Cb 0.31 0.62 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 2wdk h SER 49 CO 0.00 -0.32 -0.23 0.00 -1.14 0.00 0.00 176.83 175.14 2wdk h ALA 50 N 0.83 1.62 -2.99 3.77 0.00 -1.77 -3.47 119.26 117.25 2wdk h ALA 50 Ca 0.21 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wdk h ALA 50 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2wdk h ALA 50 CO -0.68 0.28 0.00 0.41 0.00 0.00 0.00 179.25 179.27 2wdk n GLY 51 N -0.88 0.91 3.72 0.00 0.00 0.16 -4.21 105.19 104.90 2wdk n GLY 51 Ca -0.02 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.29 2wdk n GLY 51 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2wdk n LEU 52 N -1.49 3.96 -0.96 0.99 -0.00 -1.25 -4.74 117.00 113.51 2wdk n LEU 52 Ca 0.00 1.11 0.07 0.00 -0.00 0.00 0.00 56.01 57.19 2wdk n LEU 52 Cb 0.50 -1.55 0.25 0.00 -0.00 0.00 0.00 43.42 42.62 2wdk n LEU 52 CO 0.00 0.04 0.72 0.00 -0.00 0.00 0.00 177.39 178.15 2wdk n ALA 53 N 2.86 3.20 0.00 1.47 0.00 -0.63 -4.92 120.51 122.50 2wdk n ALA 53 Ca 0.12 -2.41 0.00 0.00 0.00 0.00 0.00 53.44 51.15 2wdk n ALA 53 Cb 0.35 -0.74 0.00 0.00 0.00 0.00 0.00 19.45 19.06 2wdk n ALA 53 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2wdk n ARG 54 N -0.58 0.00 -2.88 0.00 0.63 -1.26 -4.89 116.66 107.67 2wdk n ARG 54 Ca 0.23 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 57.04 2wdk n ARG 54 Cb 0.93 0.00 0.03 0.00 0.45 0.00 0.00 32.46 33.87 2wdk n ARG 54 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2wdk n VAL 55 N -0.51 -0.14 -1.29 5.15 0.31 -1.26 -3.14 118.33 117.45 2wdk n VAL 55 Ca 0.00 -2.40 -0.36 0.00 -0.01 0.00 0.00 64.34 61.56 2wdk n VAL 55 Cb 0.00 0.67 0.07 0.00 -0.91 0.00 0.00 33.84 33.67 2wdk n VAL 55 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2wdk n ASP 56 N 0.93 -1.01 -3.67 4.52 2.03 -0.88 -4.75 116.55 113.72 2wdk n ASP 56 Ca 0.12 0.61 -0.11 0.00 0.52 0.00 0.00 54.79 55.94 2wdk n ASP 56 Cb 0.64 -1.23 -0.11 0.00 -0.72 0.00 0.00 41.12 39.70 2wdk n ASP 56 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2wdk s ILE 57 N -1.89 -0.43 0.21 5.18 1.01 -1.26 -1.68 121.20 122.35 2wdk s ILE 57 Ca 0.67 0.20 0.11 0.00 0.00 0.00 0.00 60.65 61.62 2wdk s ILE 57 Cb -0.36 -0.55 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 2wdk s ILE 57 CO 0.57 0.08 -0.23 -1.61 0.00 0.00 0.00 174.94 173.76 2wdk s GLU 58 N 2.26 1.52 0.24 2.79 2.02 -1.26 -1.94 118.70 124.33 2wdk s GLU 58 Ca -0.02 -1.56 -0.20 0.00 0.02 0.00 0.00 54.97 53.21 2wdk s GLU 58 Cb -0.11 -1.77 0.03 0.00 0.10 0.00 0.00 34.13 32.37 2wdk s GLU 58 CO -0.11 0.37 0.64 1.03 0.02 0.00 0.00 175.26 177.21 2wdk s ARG 59 N -2.85 1.62 0.00 1.61 0.52 -1.25 -2.09 118.95 116.50 2wdk s ARG 59 Ca 0.22 -0.92 0.00 0.00 -0.52 0.00 0.00 55.73 54.51 2wdk s ARG 59 Cb -0.07 0.58 0.00 0.00 0.52 0.00 0.00 34.95 35.97 2wdk s ARG 59 CO 0.10 -0.72 0.00 0.00 0.02 0.00 0.00 175.30 174.70 2wdk n ALA 60 N -0.42 0.23 0.00 2.13 0.00 -1.26 -4.57 120.51 116.62 2wdk n ALA 60 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2wdk n ALA 60 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 2wdk n ALA 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wdk n ALA 61 N -0.64 0.00 0.00 0.00 0.00 -1.26 -4.98 120.51 113.63 2wdk n ALA 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2wdk n ALA 61 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2wdk n ALA 61 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2wdk n ASP 62 N 0.00 0.00 -4.74 0.00 9.92 -1.26 -4.93 116.55 115.54 2wdk n ASP 62 Ca 0.00 0.00 -0.40 0.00 -0.53 0.00 0.00 54.79 53.86 2wdk n ASP 62 Cb 0.00 0.00 0.01 0.00 -0.64 0.00 0.00 41.12 40.49 2wdk n ASP 62 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 2wdk n ASN 63 N 1.23 3.14 -3.60 -2.24 6.94 -1.26 -3.17 115.26 116.29 2wdk n ASN 63 Ca 0.00 1.13 -0.22 0.00 -0.02 0.00 0.00 54.58 55.47 2wdk n ASN 63 Cb 0.00 -1.57 -0.16 0.00 -2.36 0.00 0.00 39.78 35.69 2wdk n ASN 63 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2wdk s VAL 64 N -1.18 -0.18 0.10 3.53 1.01 -1.25 -4.32 120.40 118.11 2wdk s VAL 64 Ca 0.60 0.00 -0.25 0.00 0.00 0.00 0.00 61.98 62.34 2wdk s VAL 64 Cb -0.47 -0.50 -0.10 0.00 0.00 0.00 0.00 36.38 35.30 2wdk s VAL 64 CO 0.58 -0.14 1.68 0.00 0.00 0.00 0.00 175.10 177.23 2wdk h ALA 65 N 8.39 -0.24 -6.70 5.51 0.00 -1.62 -1.97 119.26 122.64 2wdk h ALA 65 Ca -0.15 -0.02 -0.54 0.00 0.00 0.00 0.00 54.91 54.20 2wdk h ALA 65 Cb 1.14 0.22 -0.12 0.00 0.00 0.00 0.00 17.79 19.04 2wdk h ALA 65 CO 0.25 -0.66 -0.91 0.28 0.00 0.00 0.00 179.25 178.21 2wdk n VAL 66 N -5.27 -2.25 -2.69 0.00 0.31 -1.21 -3.84 118.33 103.38 2wdk n VAL 66 Ca -0.07 -0.45 -0.43 0.00 -0.01 0.00 0.00 64.34 63.38 2wdk n VAL 66 Cb 0.19 -2.06 -0.03 0.00 -0.91 0.00 0.00 33.84 31.03 2wdk n VAL 66 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2wdk s THR 67 N -4.02 4.34 -0.09 2.52 2.01 -0.67 -3.48 115.64 116.25 2wdk s THR 67 Ca 0.08 1.14 -0.18 0.00 0.31 0.00 0.00 61.69 63.04 2wdk s THR 67 Cb -0.04 -4.51 -0.05 0.00 0.01 0.00 0.00 72.50 67.91 2wdk s THR 67 CO 0.93 -0.87 0.47 -0.69 -0.69 0.00 0.00 174.62 173.77 2wdk s VAL 68 N 4.09 5.15 -0.11 3.82 1.01 -1.16 -2.07 120.40 131.14 2wdk s VAL 68 Ca 0.44 0.94 -0.02 0.00 0.00 0.00 0.00 61.98 63.34 2wdk s VAL 68 Cb -0.09 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2wdk s VAL 68 CO 0.27 0.37 -0.05 -1.00 0.00 0.00 0.00 175.10 174.70 2wdk s HIS 69 N 0.32 3.00 0.00 5.22 3.76 -1.19 -0.15 115.29 126.25 2wdk s HIS 69 Ca 0.25 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 55.03 2wdk s HIS 69 Cb -0.15 -1.84 0.00 0.00 1.11 0.00 0.00 32.58 31.69 2wdk s HIS 69 CO 0.11 0.15 0.00 0.28 -0.85 0.00 0.00 174.74 174.43 2wdk n VAL 70 N 2.89 0.00 -1.65 -0.90 0.31 -0.24 -1.60 118.33 117.14 2wdk n VAL 70 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 2wdk n VAL 70 Cb 0.53 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.46 2wdk n VAL 70 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wdk n ALA 71 N -3.00 0.37 -2.81 3.52 0.00 -1.26 0.20 120.51 117.53 2wdk n ALA 71 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2wdk n ALA 71 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 2wdk n ALA 71 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wdk n LYS 72 N 0.00 1.27 0.00 0.00 4.81 -1.26 -4.84 118.16 118.15 2wdk n LYS 72 Ca 0.00 -3.40 0.07 0.00 -0.87 0.00 0.00 58.31 54.11 2wdk n LYS 72 Cb 0.30 -1.46 0.35 0.00 0.02 0.00 0.00 35.03 34.24 2wdk n LYS 72 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2wdk n PRO 73 N 0.01 0.16 0.00 1.64 -0.04 -1.26 -3.11 135.00 132.40 2wdk n PRO 73 Ca 0.16 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.79 2wdk n PRO 73 Cb 0.75 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.71 2wdk n PRO 73 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wdk n GLY 74 N -0.08 -0.18 0.00 0.55 0.00 -1.26 -0.78 105.19 103.44 2wdk n GLY 74 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2wdk n GLY 74 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wdk n VAL 75 N -0.41 0.00 0.00 1.61 0.31 -1.18 -4.73 118.33 113.93 2wdk n VAL 75 Ca 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2wdk n VAL 75 Cb 0.01 0.20 0.00 0.00 -0.91 0.00 0.00 33.84 33.13 2wdk n VAL 75 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 2wdk n VAL 76 N -0.30 0.00 0.27 2.52 0.24 0.04 -3.54 118.33 117.57 2wdk n VAL 76 Ca 0.00 1.21 0.12 0.00 -2.04 0.00 0.00 64.34 63.63 2wdk n VAL 76 Cb 0.00 -2.19 0.76 0.00 -1.47 0.00 0.00 33.84 30.94 2wdk n VAL 76 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2wdk h ILE 77 N 0.00 0.72 0.00 1.34 2.04 -1.91 -3.19 117.51 116.52 2wdk h ILE 77 Ca 0.00 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.65 2wdk h ILE 77 Cb 0.00 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 2wdk h ILE 77 CO 0.00 0.05 0.00 0.61 0.00 0.00 0.00 178.15 178.81 2wdk n GLY 78 N -1.18 -1.57 3.60 5.37 0.00 -1.23 0.02 105.19 110.20 2wdk n GLY 78 Ca -0.03 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 44.02 2wdk n GLY 78 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdk s ARG 79 N 0.00 3.36 0.00 1.61 0.52 -1.26 -4.11 118.95 119.07 2wdk s ARG 79 Ca 0.00 1.36 0.00 0.00 -0.52 0.00 0.00 55.73 56.57 2wdk s ARG 79 Cb 0.00 -4.18 0.00 0.00 0.52 0.00 0.00 34.95 31.29 2wdk s ARG 79 CO 0.00 -1.83 0.00 0.41 0.02 0.00 0.00 175.30 173.90 2wdk n GLY 80 N 5.38 0.61 0.00 -3.53 0.00 -1.26 -2.83 105.19 103.57 2wdk n GLY 80 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2wdk n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdk n GLY 81 N 0.00 -0.19 0.00 -0.02 0.00 -1.26 -5.05 105.19 98.67 2wdk n GLY 81 Ca 0.00 0.06 -0.00 0.00 0.00 0.00 0.00 46.02 46.08 2wdk n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wdk n GLU 82 N 0.00 2.10 -0.01 1.61 1.02 -1.13 -4.55 120.64 119.69 2wdk n GLU 82 Ca 0.00 -0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 57.05 2wdk n GLU 82 Cb 0.00 -1.04 -0.07 0.00 -0.02 0.00 0.00 31.44 30.32 2wdk n GLU 82 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 2wdk h ARG 83 N 0.00 -0.09 -0.20 3.49 9.65 -0.68 -2.80 114.38 123.75 2wdk h ARG 83 Ca -0.02 0.01 0.06 0.00 -1.10 0.00 0.00 59.98 58.92 2wdk h ARG 83 Cb 0.63 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.23 2wdk h ARG 83 CO 0.00 0.36 0.27 0.97 2.80 0.00 0.00 179.97 184.37 2wdk h ILE 84 N -0.96 0.33 0.20 1.20 2.10 -0.46 -1.69 117.51 118.23 2wdk h ILE 84 Ca -0.01 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.92 2wdk h ILE 84 Cb 0.50 0.77 0.00 0.00 -1.09 0.00 0.00 36.82 37.00 2wdk h ILE 84 CO 0.02 0.00 -0.10 -0.09 -1.08 0.00 0.00 178.15 176.90 2wdk h ARG 85 N 0.00 -0.26 0.00 2.19 9.65 -1.79 -1.24 114.38 122.94 2wdk h ARG 85 Ca 0.09 0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 2wdk h ARG 85 Cb 0.63 0.06 0.00 0.00 -1.39 0.00 0.00 29.97 29.27 2wdk h ARG 85 CO -0.00 -0.17 0.28 -0.39 2.80 0.00 0.00 179.97 182.48 2wdk h VAL 86 N -0.47 0.00 0.09 0.20 -1.51 -1.14 0.14 116.25 113.56 2wdk h VAL 86 Ca -0.03 0.00 -0.28 0.00 -1.23 0.00 0.00 66.70 65.16 2wdk h VAL 86 Cb 0.20 0.45 -0.01 0.00 -2.13 0.00 0.00 31.29 29.80 2wdk h VAL 86 CO 0.04 0.00 -1.48 -0.07 -1.23 0.00 0.00 177.57 174.83 2wdk h LEU 87 N 0.00 0.30 -2.06 4.19 3.38 -1.29 -2.27 115.31 117.56 2wdk h LEU 87 Ca 0.00 -0.81 0.11 0.00 0.09 0.00 0.00 57.88 57.27 2wdk h LEU 87 Cb 0.55 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2wdk h LEU 87 CO 0.00 1.63 0.35 0.03 0.09 0.00 0.00 178.44 180.54 2wdk h ARG 88 N -0.38 0.00 0.00 1.13 3.08 0.25 -1.63 114.38 116.83 2wdk h ARG 88 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2wdk h ARG 88 Cb 1.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.76 2wdk h ARG 88 CO 0.01 0.00 0.00 -1.91 -1.07 0.00 0.00 179.97 177.00 2wdk n GLU 89 N -3.95 0.00 -0.24 0.04 4.07 -0.60 -3.36 120.64 116.60 2wdk n GLU 89 Ca 0.06 0.26 0.09 0.00 -0.06 0.00 0.00 57.16 57.51 2wdk n GLU 89 Cb 0.52 -1.15 0.18 0.00 -0.06 0.00 0.00 31.44 30.93 2wdk n GLU 89 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2wdk n GLU 90 N -1.29 -0.06 0.00 5.31 -0.58 -0.68 -0.12 120.64 123.22 2wdk n GLU 90 Ca 0.00 1.05 0.00 0.00 -0.42 0.00 0.00 57.16 57.79 2wdk n GLU 90 Cb 0.00 -1.64 0.00 0.00 -0.57 0.00 0.00 31.44 29.23 2wdk n GLU 90 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2wdk n LEU 91 N -4.98 0.00 0.34 -4.62 4.77 -0.79 -2.04 117.00 109.68 2wdk n LEU 91 Ca 0.15 0.85 0.22 0.00 -0.03 0.00 0.00 56.01 57.20 2wdk n LEU 91 Cb 0.49 -0.35 1.17 0.00 -2.33 0.00 0.00 43.42 42.40 2wdk n LEU 91 CO -0.06 -0.35 1.18 0.00 -1.33 0.00 0.00 177.39 176.83 2wdk h ALA 92 N -1.83 1.06 0.00 -1.18 0.00 -1.41 0.19 119.26 116.10 2wdk h ALA 92 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wdk h ALA 92 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2wdk h ALA 92 CO 0.00 -0.04 -0.01 -0.22 0.00 0.00 0.00 179.25 178.98 2wdk h LYS 93 N 0.00 0.00 -0.02 0.00 3.64 0.08 -1.05 116.57 119.22 2wdk h LYS 93 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wdk h LYS 93 Cb 0.08 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2wdk h LYS 93 CO -0.00 0.01 0.00 1.47 -2.27 0.00 0.00 179.45 178.66 2wdk n LEU 94 N -3.18 1.43 -3.88 5.20 -0.00 0.62 -4.98 117.00 112.21 2wdk n LEU 94 Ca -0.02 -1.22 -0.22 0.00 -0.00 0.00 0.00 56.01 54.54 2wdk n LEU 94 Cb 0.13 -0.01 -0.17 0.00 -0.00 0.00 0.00 43.42 43.38 2wdk n LEU 94 CO 0.23 0.34 -0.41 -0.89 -0.00 0.00 0.00 177.39 176.65 2wdk s THR 95 N -0.38 0.64 0.00 1.47 2.01 -0.40 -5.00 115.64 113.97 2wdk s THR 95 Ca 0.03 -0.12 -0.04 0.00 0.31 0.00 0.00 61.69 61.87 2wdk s THR 95 Cb 0.02 -0.68 -0.17 0.00 0.01 0.00 0.00 72.50 71.68 2wdk s THR 95 CO 0.03 0.27 2.96 0.61 -0.69 0.00 0.00 174.62 177.81 2wdk n GLY 96 N 4.43 2.75 3.18 4.40 0.00 -1.26 -4.51 105.19 114.17 2wdk n GLY 96 Ca -0.18 -0.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.96 2wdk n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wdk s LYS 97 N 0.75 1.04 0.61 1.61 1.02 -1.26 -5.11 119.74 118.40 2wdk s LYS 97 Ca 0.43 -1.50 -0.18 0.00 0.02 0.00 0.00 55.97 54.74 2wdk s LYS 97 Cb 0.20 0.26 -0.03 0.00 -0.52 0.00 0.00 37.83 37.74 2wdk s LYS 97 CO 0.00 -0.32 1.17 -0.80 -0.92 0.00 0.00 175.35 174.49 2wdk s ASN 98 N -3.09 5.18 -0.53 2.83 0.01 -1.19 -4.70 114.94 113.46 2wdk s ASN 98 Ca 0.29 2.27 0.05 0.00 -0.71 0.00 0.00 52.86 54.76 2wdk s ASN 98 Cb 0.07 -2.59 0.18 0.00 0.41 0.00 0.00 41.25 39.33 2wdk s ASN 98 CO 0.06 -1.59 0.44 1.33 -1.51 0.00 0.00 177.10 175.83 2wdk n VAL 99 N -1.79 0.06 -2.29 1.60 0.24 -1.26 -4.17 118.33 110.71 2wdk n VAL 99 Ca 0.13 -4.10 -0.41 0.00 -2.04 0.00 0.00 64.34 57.91 2wdk n VAL 99 Cb 0.50 -1.90 -0.03 0.00 -1.47 0.00 0.00 33.84 30.95 2wdk n VAL 99 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2wdk s ALA 100 N -0.78 3.48 -0.11 2.33 0.00 -0.74 -4.97 121.76 120.97 2wdk s ALA 100 Ca 0.31 1.04 -0.03 0.00 0.00 0.00 0.00 51.96 53.27 2wdk s ALA 100 Cb 0.03 -3.44 0.05 0.00 0.00 0.00 0.00 23.12 19.76 2wdk s ALA 100 CO -0.17 -0.45 0.07 -1.17 0.00 0.00 0.00 175.76 174.04 2wdk s LEU 101 N -0.32 0.35 0.53 0.00 0.20 -1.25 -3.86 118.68 114.32 2wdk s LEU 101 Ca 0.54 -0.31 0.06 0.00 0.69 0.00 0.00 54.13 55.11 2wdk s LEU 101 Cb -0.35 -0.25 0.03 0.00 -0.43 0.00 0.00 46.19 45.20 2wdk s LEU 101 CO 0.38 -0.29 0.41 0.20 -0.29 0.00 0.00 176.35 176.76 2wdk s ASN 102 N 2.11 4.67 -0.01 3.68 0.01 -1.23 -5.03 114.94 119.15 2wdk s ASN 102 Ca 0.03 -1.19 -0.12 0.00 -0.71 0.00 0.00 52.86 50.87 2wdk s ASN 102 Cb -0.14 0.31 0.02 0.00 0.41 0.00 0.00 41.25 41.84 2wdk s ASN 102 CO -0.06 -1.06 0.26 -0.69 -1.51 0.00 0.00 177.10 174.03 2wdk s VAL 103 N -2.74 0.07 0.22 1.60 1.01 -1.26 -2.96 120.40 116.33 2wdk s VAL 103 Ca 0.36 -0.55 -0.03 0.00 0.00 0.00 0.00 61.98 61.77 2wdk s VAL 103 Cb -0.02 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 2wdk s VAL 103 CO 0.22 -0.30 0.20 -1.10 0.00 0.00 0.00 175.10 174.12 2wdk s GLN 104 N -1.38 1.30 0.01 2.72 -1.52 0.79 -4.90 119.66 116.68 2wdk s GLN 104 Ca -0.14 -1.59 0.01 0.00 -1.95 0.00 0.00 55.36 51.70 2wdk s GLN 104 Cb -0.06 0.31 -0.01 0.00 -0.22 0.00 0.00 33.01 33.04 2wdk s GLN 104 CO 0.03 -0.46 -0.05 -2.00 -0.25 0.00 0.00 175.29 172.57 2wdk s GLU 105 N -4.08 0.35 -0.22 2.91 2.12 -1.25 -1.08 118.70 117.46 2wdk s GLU 105 Ca 0.36 -0.26 -0.23 0.00 0.36 0.00 0.00 54.97 55.20 2wdk s GLU 105 Cb 0.05 -0.29 -0.02 0.00 0.26 0.00 0.00 34.13 34.14 2wdk s GLU 105 CO 0.12 0.07 0.74 0.08 -0.54 0.00 0.00 175.26 175.73 2wdk s VAL 106 N -0.37 4.93 0.38 3.70 1.01 0.54 -4.88 120.40 125.70 2wdk s VAL 106 Ca -0.01 1.39 0.37 0.00 0.00 0.00 0.00 61.98 63.73 2wdk s VAL 106 Cb -0.03 -4.04 0.37 0.00 0.00 0.00 0.00 36.38 32.68 2wdk s VAL 106 CO -0.00 0.02 2.14 1.56 0.00 0.00 0.00 175.10 178.81 2wdk h GLN 107 N 7.60 0.00 -1.75 2.72 7.50 -1.98 -3.32 115.11 125.88 2wdk h GLN 107 Ca -0.27 0.00 -0.31 0.00 0.50 0.00 0.00 58.65 58.56 2wdk h GLN 107 Cb 1.12 0.00 -0.28 0.00 0.05 0.00 0.00 27.48 28.37 2wdk h GLN 107 CO 0.82 0.00 -0.65 1.21 -1.50 0.00 0.00 178.83 178.71 2wdk s ASN 108 N -4.77 0.55 0.66 1.46 3.84 -1.26 -5.01 114.94 110.41 2wdk s ASN 108 Ca -0.04 -1.53 0.16 0.00 0.21 0.00 0.00 52.86 51.66 2wdk s ASN 108 Cb 0.11 0.84 0.83 0.00 -0.55 0.00 0.00 41.25 42.48 2wdk s ASN 108 CO 0.34 -0.23 1.46 -0.65 -2.79 0.00 0.00 177.10 175.24 2wdk h PRO 109 N 6.86 0.00 0.39 0.43 0.11 -1.95 -0.78 132.00 137.06 2wdk h PRO 109 Ca 0.06 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 2wdk h PRO 109 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2wdk h PRO 109 CO 0.18 0.00 -0.19 -0.91 -0.21 0.00 0.00 178.00 176.87 2wdk h ASN 110 N 0.00 -0.44 0.00 -2.05 2.35 -1.94 -3.20 115.58 110.30 2wdk h ASN 110 Ca 0.02 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2wdk h ASN 110 Cb 1.38 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.87 2wdk h ASN 110 CO -0.00 -0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.96 2wdk n LEU 111 N -5.12 0.00 -3.93 1.61 4.77 -0.30 -3.90 117.00 110.13 2wdk n LEU 111 Ca -0.07 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.62 2wdk n LEU 111 Cb 0.22 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.18 2wdk n LEU 111 CO 0.17 0.00 -0.11 -0.55 -1.33 0.00 0.00 177.39 175.57 2wdk s SER 112 N -0.92 4.56 0.20 -1.43 0.15 -1.21 -4.95 113.70 110.10 2wdk s SER 112 Ca 0.00 -3.41 -0.22 0.00 0.70 0.00 0.00 55.95 53.02 2wdk s SER 112 Cb 0.00 -1.64 0.13 0.00 -1.71 0.00 0.00 66.02 62.80 2wdk s SER 112 CO 0.00 -0.16 1.55 0.00 1.20 0.00 0.00 173.24 175.83 2wdk h ALA 113 N 5.98 -0.09 -1.00 5.45 0.00 -1.83 0.25 119.26 128.01 2wdk h ALA 113 Ca 0.02 0.22 0.29 0.00 0.00 0.00 0.00 54.91 55.44 2wdk h ALA 113 Cb 0.83 1.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.70 2wdk h ALA 113 CO 0.70 -0.75 1.05 -1.35 0.00 0.00 0.00 179.25 178.91 2wdk h PRO 114 N -0.02 0.00 0.00 0.00 0.11 -1.87 0.44 132.00 130.66 2wdk h PRO 114 Ca 0.28 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.33 2wdk h PRO 114 Cb 0.54 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 2wdk h PRO 114 CO -0.95 0.00 -0.46 -0.07 -0.21 0.00 0.00 178.00 176.30 2wdk h LEU 115 N 0.00 0.00 -1.14 2.35 3.38 -0.84 -3.19 115.31 115.86 2wdk h LEU 115 Ca 0.48 -0.30 0.44 0.00 0.09 0.00 0.00 57.88 58.59 2wdk h LEU 115 Cb 2.57 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 43.16 2wdk h LEU 115 CO -0.01 0.91 0.68 0.52 0.09 0.00 0.00 178.44 180.63 2wdk n VAL 116 N -4.62 -0.33 0.00 1.22 0.31 0.13 0.85 118.33 115.89 2wdk n VAL 116 Ca -0.12 1.88 0.00 0.00 -0.01 0.00 0.00 64.34 66.09 2wdk n VAL 116 Cb 0.33 -3.06 0.00 0.00 -0.91 0.00 0.00 33.84 30.20 2wdk n VAL 116 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wdk n ALA 117 N -2.39 -0.45 -0.22 3.52 0.00 0.14 -1.67 120.51 119.44 2wdk n ALA 117 Ca 0.38 0.00 0.31 0.00 0.00 0.00 0.00 53.44 54.13 2wdk n ALA 117 Cb 1.38 0.00 0.73 0.00 0.00 0.00 0.00 19.45 21.56 2wdk n ALA 117 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2wdk h GLN 118 N 0.00 0.00 0.16 0.00 4.20 -0.64 0.41 115.11 119.24 2wdk h GLN 118 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wdk h GLN 118 Cb 0.00 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2wdk h GLN 118 CO 0.00 0.00 -0.16 -0.09 -0.67 0.00 0.00 178.83 177.91 2wdk h ARG 119 N 0.00 -0.34 -0.17 1.46 2.43 0.85 -1.61 114.38 117.00 2wdk h ARG 119 Ca 0.47 0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.58 2wdk h ARG 119 Cb 1.99 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 31.62 2wdk h ARG 119 CO -0.00 -0.23 -0.22 0.28 -1.51 0.00 0.00 179.97 178.28 2wdk h VAL 120 N -0.36 1.35 -1.10 0.20 2.07 0.60 -3.03 116.25 115.98 2wdk h VAL 120 Ca 0.00 -1.43 0.31 0.00 0.82 0.00 0.00 66.70 66.41 2wdk h VAL 120 Cb 0.34 1.89 -0.12 0.00 -1.52 0.00 0.00 31.29 31.88 2wdk h VAL 120 CO -0.05 0.43 0.69 0.00 0.02 0.00 0.00 177.57 178.66 2wdk h ALA 121 N 0.60 2.25 0.21 1.67 0.00 -0.61 -0.10 119.26 123.28 2wdk h ALA 121 Ca 0.02 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2wdk h ALA 121 Cb 0.78 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2wdk h ALA 121 CO 0.05 -0.76 -0.11 0.93 0.00 0.00 0.00 179.25 179.37 2wdk h GLU 122 N 0.33 -0.28 -0.88 0.00 5.08 -1.17 -1.84 114.58 115.81 2wdk h GLU 122 Ca 0.68 0.02 0.17 0.00 -1.00 0.00 0.00 59.36 59.22 2wdk h GLU 122 Cb 1.76 0.06 -0.16 0.00 0.50 0.00 0.00 28.75 30.91 2wdk h GLU 122 CO -0.40 -0.19 -0.27 1.96 -1.00 0.00 0.00 179.01 179.11 2wdk h GLN 123 N -0.29 -0.02 0.82 2.33 4.20 -1.07 -1.35 115.11 119.73 2wdk h GLN 123 Ca -0.03 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 2wdk h GLN 123 Cb 0.23 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 2wdk h GLN 123 CO 0.04 -0.01 -0.48 0.82 -0.67 0.00 0.00 178.83 178.53 2wdk h ILE 124 N -0.02 0.00 0.00 2.54 2.04 -1.12 -0.72 117.51 120.24 2wdk h ILE 124 Ca 0.39 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.25 2wdk h ILE 124 Cb 0.63 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 2wdk h ILE 124 CO -0.90 0.00 0.04 -0.62 0.00 0.00 0.00 178.15 176.66 2wdk n GLU 125 N -5.50 0.00 -2.51 2.37 1.02 -0.60 -1.12 120.64 114.29 2wdk n GLU 125 Ca -0.15 0.12 -0.22 0.00 -0.02 0.00 0.00 57.16 56.89 2wdk n GLU 125 Cb 0.50 -1.54 0.01 0.00 -0.02 0.00 0.00 31.44 30.39 2wdk n GLU 125 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2wdk n ARG 126 N -1.05 2.89 -2.90 3.49 1.74 -0.30 -4.94 116.66 115.59 2wdk n ARG 126 Ca 0.00 -4.20 -0.10 0.00 -0.77 0.00 0.00 57.85 52.78 2wdk n ARG 126 Cb 0.04 -2.01 0.00 0.00 -1.02 0.00 0.00 32.46 29.47 2wdk n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2wdk n ARG 127 N -0.39 -0.61 -4.46 5.56 3.00 -0.27 -4.90 116.66 114.59 2wdk n ARG 127 Ca 0.32 0.31 -0.25 0.00 -0.01 0.00 0.00 57.85 58.22 2wdk n ARG 127 Cb 0.71 -0.84 -0.10 0.00 0.00 0.00 0.00 32.46 32.23 2wdk n ARG 127 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 2wdk s PHE 128 N -2.20 2.39 -0.35 -1.55 0.40 -1.09 -5.03 117.98 110.55 2wdk s PHE 128 Ca 0.01 -0.38 -0.28 0.00 -0.60 0.00 0.00 56.93 55.69 2wdk s PHE 128 Cb -0.00 -1.18 -0.03 0.00 0.51 0.00 0.00 43.02 42.32 2wdk s PHE 128 CO 0.35 0.65 2.00 0.00 0.70 0.00 0.00 175.22 178.91 2wdk s ALA 129 N -2.52 2.59 0.20 5.36 0.00 -1.26 -4.83 121.76 121.30 2wdk s ALA 129 Ca 0.31 0.27 -0.02 0.00 0.00 0.00 0.00 51.96 52.53 2wdk s ALA 129 Cb -0.02 -4.11 0.16 0.00 0.00 0.00 0.00 23.12 19.15 2wdk s ALA 129 CO 0.16 -3.05 1.53 0.28 0.00 0.00 0.00 175.76 174.68 2wdk h VAL 130 N 7.02 1.32 -0.77 0.00 2.07 -1.97 1.11 116.25 125.04 2wdk h VAL 130 Ca -0.34 -1.77 -0.06 0.00 0.82 0.00 0.00 66.70 65.36 2wdk h VAL 130 Cb 1.20 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.70 2wdk h VAL 130 CO 1.05 0.55 0.26 -0.09 0.02 0.00 0.00 177.57 179.35 2wdk h ARG 131 N 0.40 1.18 0.40 1.57 9.65 -2.01 -2.36 114.38 123.21 2wdk h ARG 131 Ca 0.01 -0.24 -0.02 0.00 -1.10 0.00 0.00 59.98 58.63 2wdk h ARG 131 Cb 1.05 -0.18 0.00 0.00 -1.39 0.00 0.00 29.97 29.46 2wdk h ARG 131 CO 0.10 0.99 -0.19 -0.09 2.80 0.00 0.00 179.97 183.57 2wdk h ARG 132 N 1.13 -0.52 -0.71 0.20 2.43 -1.89 -3.10 114.38 111.92 2wdk h ARG 132 Ca 0.25 0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.57 2wdk h ARG 132 Cb 0.28 0.12 -0.12 0.00 -0.42 0.00 0.00 29.97 29.83 2wdk h ARG 132 CO -0.01 -0.34 -0.26 0.00 -1.51 0.00 0.00 179.97 177.85 2wdk n ALA 133 N -2.74 -0.03 0.29 2.80 0.00 0.38 -0.19 120.51 121.02 2wdk n ALA 133 Ca -0.07 0.73 -0.12 0.00 0.00 0.00 0.00 53.44 53.98 2wdk n ALA 133 Cb 0.22 -0.35 -0.06 0.00 0.00 0.00 0.00 19.45 19.26 2wdk n ALA 133 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2wdk h ILE 134 N 0.00 0.00 0.00 0.00 1.08 -1.55 0.99 117.51 118.04 2wdk h ILE 134 Ca 0.27 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2wdk h ILE 134 Cb 0.45 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.20 2wdk h ILE 134 CO -0.71 0.00 0.34 0.11 -0.69 0.00 0.00 178.15 177.20 2wdk h LYS 135 N -1.04 0.00 0.00 2.37 1.79 -1.24 -1.06 116.57 117.39 2wdk h LYS 135 Ca -0.08 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.11 2wdk h LYS 135 Cb 0.59 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.20 2wdk h LYS 135 CO 0.13 0.00 -1.55 0.94 -1.08 0.00 0.00 179.45 177.89 2wdk n GLN 136 N -2.42 0.57 0.08 3.15 7.27 0.73 -3.24 117.38 123.52 2wdk n GLN 136 Ca -0.01 0.49 0.08 0.00 0.07 0.00 0.00 57.00 57.64 2wdk n GLN 136 Cb 0.37 -1.68 0.39 0.00 2.41 0.00 0.00 30.24 31.73 2wdk n GLN 136 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2wdk n ALA 137 N -3.64 1.40 -0.06 1.69 0.00 0.33 -2.09 120.51 118.13 2wdk n ALA 137 Ca -0.37 0.07 -0.10 0.00 0.00 0.00 0.00 53.44 53.04 2wdk n ALA 137 Cb 0.71 -1.27 -0.15 0.00 0.00 0.00 0.00 19.45 18.75 2wdk n ALA 137 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wdk n VAL 138 N -1.94 1.50 1.19 0.00 0.31 -0.50 -2.88 118.33 116.01 2wdk n VAL 138 Ca 0.01 -0.82 0.01 0.00 -0.01 0.00 0.00 64.34 63.53 2wdk n VAL 138 Cb 0.13 -0.77 0.05 0.00 -0.91 0.00 0.00 33.84 32.34 2wdk n VAL 138 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2wdk n GLN 139 N -2.91 1.36 0.00 5.55 -0.06 -0.89 -2.64 117.38 117.80 2wdk n GLN 139 Ca -0.25 -0.37 -0.02 0.00 -2.00 0.00 0.00 57.00 54.36 2wdk n GLN 139 Cb 1.10 -1.36 -0.01 0.00 -4.06 0.00 0.00 30.24 25.92 2wdk n GLN 139 CO 0.00 0.00 0.00 -2.13 -0.20 0.00 0.00 177.06 174.73 2wdk n ARG 140 N -0.06 0.13 0.15 3.69 0.63 -1.15 -3.84 116.66 116.20 2wdk n ARG 140 Ca 0.03 0.05 0.19 0.00 -0.92 0.00 0.00 57.85 57.20 2wdk n ARG 140 Cb 0.24 -0.62 0.78 0.00 0.45 0.00 0.00 32.46 33.30 2wdk n ARG 140 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2wdk h VAL 141 N -0.24 0.36 0.12 5.15 2.07 -1.56 0.24 116.25 122.40 2wdk h VAL 141 Ca 0.00 0.00 -0.33 0.00 0.82 0.00 0.00 66.70 67.19 2wdk h VAL 141 Cb 0.24 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 2wdk h VAL 141 CO 0.00 0.00 -1.78 0.24 0.02 0.00 0.00 177.57 176.05 2wdk h MET 142 N 0.00 0.26 -0.78 1.57 2.86 -1.77 -3.36 114.93 113.71 2wdk h MET 142 Ca 0.14 -0.44 0.15 0.00 -2.06 0.00 0.00 59.70 57.49 2wdk h MET 142 Cb 0.87 0.16 -0.10 0.00 0.06 0.00 0.00 31.60 32.59 2wdk h MET 142 CO -0.00 1.21 0.32 1.49 1.06 0.00 0.00 176.91 180.99 2wdk h GLU 143 N -0.10 0.44 -2.14 1.72 4.81 -0.72 -1.32 114.58 117.27 2wdk h GLU 143 Ca -0.38 -0.03 -0.46 0.00 -0.13 0.00 0.00 59.36 58.36 2wdk h GLU 143 Cb 1.92 -0.10 -0.13 0.00 0.63 0.00 0.00 28.75 31.07 2wdk h GLU 143 CO 0.07 0.29 0.65 -1.13 -0.73 0.00 0.00 179.01 178.16 2wdk n SER 144 N -5.00 6.49 -2.59 1.04 3.41 -0.12 -4.87 113.62 111.98 2wdk n SER 144 Ca 0.15 -2.98 -0.02 0.00 -0.26 0.00 0.00 58.87 55.77 2wdk n SER 144 Cb 0.44 -1.32 -0.01 0.00 -0.26 0.00 0.00 64.21 63.06 2wdk n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wdk n GLY 145 N 1.55 -2.50 3.31 5.00 0.00 -0.51 -4.88 105.19 107.18 2wdk n GLY 145 Ca 0.51 0.53 -0.13 0.00 0.00 0.00 0.00 46.02 46.92 2wdk n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdk s ALA 146 N -0.29 -1.04 0.24 4.61 0.00 -1.17 -4.92 121.76 119.20 2wdk s ALA 146 Ca -0.08 1.05 -0.04 0.00 0.00 0.00 0.00 51.96 52.89 2wdk s ALA 146 Cb 0.01 -0.52 0.27 0.00 0.00 0.00 0.00 23.12 22.87 2wdk s ALA 146 CO 0.22 -0.22 1.75 0.87 0.00 0.00 0.00 175.76 178.38 2wdk h LYS 147 N 5.06 0.91 -2.15 0.00 1.79 -1.71 -3.47 116.57 117.00 2wdk h LYS 147 Ca -0.27 -0.23 0.08 0.00 -2.18 0.00 0.00 60.65 58.04 2wdk h LYS 147 Cb 1.18 -0.11 -0.17 0.00 -1.58 0.00 0.00 32.23 31.54 2wdk h LYS 147 CO 0.27 0.86 0.45 0.20 -1.08 0.00 0.00 179.45 180.16 2wdk s GLY 148 N -3.63 -0.44 -0.12 3.86 0.00 -1.07 -2.18 107.32 103.73 2wdk s GLY 148 Ca -0.10 1.23 -0.10 0.00 0.00 0.00 0.00 44.72 45.75 2wdk s GLY 148 CO 0.82 0.54 0.31 0.00 0.00 0.00 0.00 173.10 174.77 2wdk s ALA 149 N -2.53 -0.77 -0.10 3.20 0.00 -0.26 0.67 121.76 121.97 2wdk s ALA 149 Ca 0.02 0.93 -0.09 0.00 0.00 0.00 0.00 51.96 52.82 2wdk s ALA 149 Cb -0.01 -0.55 0.03 0.00 0.00 0.00 0.00 23.12 22.60 2wdk s ALA 149 CO -0.05 -0.16 0.27 0.21 0.00 0.00 0.00 175.76 176.03 2wdk s LYS 150 N 0.33 0.29 0.01 0.00 2.20 0.12 -0.68 119.74 122.02 2wdk s LYS 150 Ca -0.01 0.41 -0.06 0.00 -0.36 0.00 0.00 55.97 55.94 2wdk s LYS 150 Cb -0.03 0.10 -0.00 0.00 -1.51 0.00 0.00 37.83 36.38 2wdk s LYS 150 CO -0.01 -0.06 0.10 0.08 -0.36 0.00 0.00 175.35 175.10 2wdk s VAL 151 N 0.36 0.10 -0.09 4.02 1.01 -0.12 0.76 120.40 126.45 2wdk s VAL 151 Ca -0.02 -0.83 -0.13 0.00 0.00 0.00 0.00 61.98 61.01 2wdk s VAL 151 Cb -0.03 -0.53 0.03 0.00 0.00 0.00 0.00 36.38 35.85 2wdk s VAL 151 CO -0.01 -0.45 0.32 0.27 0.00 0.00 0.00 175.10 175.22 2wdk s ILE 152 N -1.72 0.02 0.06 2.22 -4.36 -0.56 -2.47 121.20 114.40 2wdk s ILE 152 Ca -0.12 -0.17 0.07 0.00 -0.26 0.00 0.00 60.65 60.17 2wdk s ILE 152 Cb -0.06 -0.52 -0.04 0.00 1.25 0.00 0.00 42.46 43.10 2wdk s ILE 152 CO -0.00 -0.09 -0.15 -0.69 0.24 0.00 0.00 174.94 174.25 2wdk s VAL 153 N -0.34 3.05 0.00 8.37 1.01 -0.46 -1.37 120.40 130.66 2wdk s VAL 153 Ca -0.05 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 60.74 2wdk s VAL 153 Cb -0.03 -2.34 0.00 0.00 0.00 0.00 0.00 36.38 34.01 2wdk s VAL 153 CO 0.02 0.26 0.00 -1.54 0.00 0.00 0.00 175.10 173.84 2wdk n SER 154 N 1.26 0.00 -4.96 3.32 3.41 -0.10 -0.97 113.62 115.58 2wdk n SER 154 Ca -0.15 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.23 2wdk n SER 154 Cb 0.52 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.52 2wdk n SER 154 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2wdk s GLY 155 N 0.00 1.79 -0.92 5.00 0.00 -1.06 -3.63 107.32 108.50 2wdk s GLY 155 Ca 0.00 -1.23 0.00 0.00 0.00 0.00 0.00 44.72 43.49 2wdk s GLY 155 CO 0.00 -0.91 0.00 0.54 0.00 0.00 0.00 173.10 172.73 2wdk n ARG 156 N -2.50 -0.68 -1.51 2.90 1.74 -1.26 -4.64 116.66 110.70 2wdk n ARG 156 Ca 0.08 0.70 -0.44 0.00 -0.77 0.00 0.00 57.85 57.42 2wdk n ARG 156 Cb 0.60 -4.63 -0.06 0.00 -1.02 0.00 0.00 32.46 27.35 2wdk n ARG 156 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 2wdk n ILE 157 N -3.16 0.13 -1.22 0.55 5.41 -1.26 -0.31 119.36 119.49 2wdk n ILE 157 Ca -0.10 -0.43 0.00 0.00 1.00 0.00 0.00 62.75 63.22 2wdk n ILE 157 Cb 0.40 -2.06 0.00 0.00 -0.71 0.00 0.00 39.64 37.27 2wdk n ILE 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2wdk n GLY 158 N 6.22 1.01 4.38 7.39 0.00 -1.26 -3.89 105.19 119.03 2wdk n GLY 158 Ca 0.40 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2wdk n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdk n GLY 159 N -0.98 0.13 3.53 -0.02 0.00 0.58 -4.89 105.19 103.54 2wdk n GLY 159 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2wdk n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdk n ALA 160 N 0.97 -1.00 -0.13 4.61 0.00 -1.25 -4.87 120.51 118.83 2wdk n ALA 160 Ca 0.00 0.36 -0.11 0.00 0.00 0.00 0.00 53.44 53.69 2wdk n ALA 160 Cb 0.00 -1.89 -0.02 0.00 0.00 0.00 0.00 19.45 17.54 2wdk n ALA 160 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2wdk h GLU 161 N 1.58 0.78 -5.98 0.00 4.57 -1.93 -3.37 114.58 110.22 2wdk h GLU 161 Ca -0.37 -0.31 -0.54 0.00 -1.18 0.00 0.00 59.36 56.96 2wdk h GLU 161 Cb 1.37 -0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 29.84 2wdk h GLU 161 CO 0.58 0.93 1.41 -1.14 -1.18 0.00 0.00 179.01 179.61 2wdk s GLN 162 N -4.74 3.40 0.23 1.92 2.00 -1.26 -4.92 119.66 116.28 2wdk s GLN 162 Ca -0.12 -1.06 -0.31 0.00 -2.00 0.00 0.00 55.36 51.87 2wdk s GLN 162 Cb 0.10 -5.32 -0.11 0.00 0.80 0.00 0.00 33.01 28.48 2wdk s GLN 162 CO 0.82 -2.50 1.65 0.00 -0.50 0.00 0.00 175.29 174.77 2wdk s ALA 163 N 6.09 3.85 0.00 1.58 0.00 -1.26 -4.67 121.76 127.36 2wdk s ALA 163 Ca 0.52 1.54 0.00 0.00 0.00 0.00 0.00 51.96 54.03 2wdk s ALA 163 Cb -0.01 -3.67 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2wdk s ALA 163 CO -0.05 -0.91 0.00 0.54 0.00 0.00 0.00 175.76 175.33 2wdk n ARG 164 N 3.44 1.60 -3.60 0.00 1.74 -1.26 -4.74 116.66 113.84 2wdk n ARG 164 Ca 0.13 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.18 2wdk n ARG 164 Cb 0.36 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.75 2wdk n ARG 164 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2wdk s THR 165 N 3.56 -0.25 -0.39 0.55 -1.32 -1.24 -2.56 115.64 113.99 2wdk s THR 165 Ca 0.00 0.00 -0.10 0.00 -1.21 0.00 0.00 61.69 60.38 2wdk s THR 165 Cb 0.00 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.04 2wdk s THR 165 CO 0.00 0.00 0.22 -0.70 -2.21 0.00 0.00 174.62 171.93 2wdk s GLU 166 N 1.88 2.71 0.50 7.08 2.56 -0.15 -4.96 118.70 128.33 2wdk s GLU 166 Ca -0.08 -1.26 -0.06 0.00 0.00 0.00 0.00 54.97 53.58 2wdk s GLU 166 Cb -0.06 -3.72 -0.03 0.00 2.00 0.00 0.00 34.13 32.32 2wdk s GLU 166 CO -0.18 -0.81 0.82 -0.46 -0.56 0.00 0.00 175.26 174.08 2wdk s TRP 167 N 1.48 3.54 0.00 5.30 -0.00 -1.26 -1.35 118.94 126.66 2wdk s TRP 167 Ca 0.02 0.85 0.00 0.00 -0.00 0.00 0.00 56.10 56.96 2wdk s TRP 167 Cb -0.21 -2.38 0.00 0.00 -0.00 0.00 0.00 33.47 30.88 2wdk s TRP 167 CO 0.04 -0.37 0.00 0.00 -0.00 0.00 0.00 176.95 176.63 2wdk n ALA 168 N -2.34 0.00 -3.64 5.86 0.00 -1.03 -4.96 120.51 114.40 2wdk n ALA 168 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 2wdk n ALA 168 Cb 0.55 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.97 2wdk n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wdk s ALA 169 N -0.42 -2.12 0.29 0.00 0.00 -1.26 -0.95 121.76 117.29 2wdk s ALA 169 Ca 0.00 1.86 0.03 0.00 0.00 0.00 0.00 51.96 53.85 2wdk s ALA 169 Cb 0.00 -1.18 -0.04 0.00 0.00 0.00 0.00 23.12 21.91 2wdk s ALA 169 CO 0.00 -0.32 0.17 -1.14 0.00 0.00 0.00 175.76 174.47 2wdk s GLN 170 N -1.31 1.54 1.98 0.00 0.74 0.15 -4.99 119.66 117.78 2wdk s GLN 170 Ca 0.09 -1.87 0.00 0.00 0.05 0.00 0.00 55.36 53.62 2wdk s GLN 170 Cb -0.01 0.03 0.00 0.00 1.10 0.00 0.00 33.01 34.13 2wdk s GLN 170 CO -0.06 -0.47 0.00 0.41 -0.55 0.00 0.00 175.29 174.62 2wdk n GLY 171 N -0.53 -0.92 3.87 2.59 0.00 -1.26 -1.10 105.19 107.84 2wdk n GLY 171 Ca 0.02 -1.14 -0.35 0.00 0.00 0.00 0.00 46.02 44.55 2wdk n GLY 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdk s ARG 172 N 0.00 3.38 -0.43 1.61 0.52 -0.93 -4.75 118.95 118.35 2wdk s ARG 172 Ca 0.00 -0.24 0.07 0.00 -0.52 0.00 0.00 55.73 55.04 2wdk s ARG 172 Cb 0.00 -3.11 0.23 0.00 0.52 0.00 0.00 34.95 32.59 2wdk s ARG 172 CO 0.00 0.73 0.62 0.28 0.02 0.00 0.00 175.30 176.95 2wdk n VAL 173 N 1.59 -0.51 -2.53 3.52 0.31 -1.26 -3.24 118.33 116.21 2wdk n VAL 173 Ca -0.16 -2.92 -0.41 0.00 -0.01 0.00 0.00 64.34 60.84 2wdk n VAL 173 Cb 0.54 -0.64 -0.03 0.00 -0.91 0.00 0.00 33.84 32.80 2wdk n VAL 173 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2wdk s PRO 174 N -0.27 3.35 0.07 5.55 0.04 -1.26 -4.82 135.00 137.66 2wdk s PRO 174 Ca 0.33 -0.64 0.21 0.00 0.04 0.00 0.00 61.00 60.95 2wdk s PRO 174 Cb 0.15 -4.76 0.87 0.00 0.04 0.00 0.00 34.50 30.80 2wdk s PRO 174 CO -0.16 -2.22 1.66 1.28 0.04 0.00 0.00 177.00 177.60 2wdk n LEU 175 N 9.33 0.20 -0.91 -3.56 4.77 -1.26 -2.62 117.00 122.96 2wdk n LEU 175 Ca 0.18 0.54 0.12 0.00 -0.03 0.00 0.00 56.01 56.82 2wdk n LEU 175 Cb 0.50 -0.50 0.26 0.00 -2.33 0.00 0.00 43.42 41.35 2wdk n LEU 175 CO 0.68 -0.23 0.72 1.41 -1.33 0.00 0.00 177.39 178.64 2wdk n HIS 176 N -1.71 0.28 -3.86 -1.77 8.25 -1.26 -4.88 115.22 110.27 2wdk n HIS 176 Ca 0.04 -0.14 -0.35 0.00 -0.26 0.00 0.00 57.72 57.01 2wdk n HIS 176 Cb 0.25 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.28 2wdk n HIS 176 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2wdk s THR 177 N -1.72 5.24 0.02 1.59 2.01 -1.08 -5.00 115.64 116.70 2wdk s THR 177 Ca 0.35 0.12 -0.19 0.00 0.31 0.00 0.00 61.69 62.28 2wdk s THR 177 Cb 0.21 -3.35 -0.22 0.00 0.01 0.00 0.00 72.50 69.15 2wdk s THR 177 CO 0.30 0.50 1.13 -0.07 -0.69 0.00 0.00 174.62 175.79 2wdk h LEU 178 N 6.19 0.59 -4.03 4.42 -0.00 -1.89 -3.29 115.31 117.29 2wdk h LEU 178 Ca -0.44 -0.74 -0.13 0.00 -0.00 0.00 0.00 57.88 56.57 2wdk h LEU 178 Cb 1.18 -0.18 -0.05 0.00 -0.00 0.00 0.00 40.66 41.61 2wdk h LEU 178 CO 0.69 1.25 -0.19 -2.11 -0.00 0.00 0.00 178.44 178.08 2wdk n ARG 179 N -4.18 1.50 -0.09 1.13 1.85 -1.26 -4.09 116.66 111.52 2wdk n ARG 179 Ca -0.10 -0.68 -0.19 0.00 -1.00 0.00 0.00 57.85 55.88 2wdk n ARG 179 Cb 0.68 -1.78 -0.06 0.00 -1.05 0.00 0.00 32.46 30.25 2wdk n ARG 179 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2wdk n ALA 180 N 2.43 1.67 -2.88 2.89 0.00 -1.24 -3.92 120.51 119.46 2wdk n ALA 180 Ca 0.29 -0.76 -0.09 0.00 0.00 0.00 0.00 53.44 52.89 2wdk n ALA 180 Cb 0.69 0.21 0.01 0.00 0.00 0.00 0.00 19.45 20.37 2wdk n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wdk n ASN 181 N -3.95 -7.86 -4.05 0.00 5.15 -1.26 -4.21 115.26 99.09 2wdk n ASN 181 Ca -0.34 0.50 -0.32 0.00 -0.60 0.00 0.00 54.58 53.83 2wdk n ASN 181 Cb 0.70 -5.25 -0.15 0.00 -0.53 0.00 0.00 39.78 34.55 2wdk n ASN 181 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2wdk s ILE 182 N -2.57 2.02 0.20 -1.44 1.01 -1.26 -2.75 121.20 116.42 2wdk s ILE 182 Ca 0.25 -1.48 -0.32 0.00 0.00 0.00 0.00 60.65 59.10 2wdk s ILE 182 Cb -0.07 -2.14 -0.12 0.00 0.01 0.00 0.00 42.46 40.15 2wdk s ILE 182 CO 0.77 0.01 1.74 -0.62 0.00 0.00 0.00 174.94 176.84 2wdk s ASP 183 N 1.18 6.38 -0.11 3.58 3.68 -0.77 -4.68 116.67 125.93 2wdk s ASP 183 Ca -0.07 2.86 0.04 0.00 2.13 0.00 0.00 52.55 57.51 2wdk s ASP 183 Cb -0.19 -2.60 0.00 0.00 -1.45 0.00 0.00 42.92 38.68 2wdk s ASP 183 CO -0.06 -0.98 -0.24 -0.47 0.13 0.00 0.00 175.17 173.56 2wdk s TYR 184 N 1.34 2.58 0.06 -5.34 5.04 -1.25 -1.40 117.35 118.36 2wdk s TYR 184 Ca 0.75 -1.08 0.03 0.00 -2.44 0.00 0.00 57.07 54.33 2wdk s TYR 184 Cb -0.49 -1.72 -0.03 0.00 0.35 0.00 0.00 41.96 40.06 2wdk s TYR 184 CO 0.32 -0.44 -0.10 0.20 -1.34 0.00 0.00 175.55 174.19 2wdk s GLY 185 N 0.40 0.66 -0.18 8.97 0.00 -0.72 -4.41 107.32 112.05 2wdk s GLY 185 Ca -0.17 -0.91 -0.04 0.00 0.00 0.00 0.00 44.72 43.60 2wdk s GLY 185 CO 0.08 -0.96 0.17 -0.12 0.00 0.00 0.00 173.10 172.27 2wdk s PHE 186 N -1.57 -0.11 0.18 1.90 5.36 -1.26 -1.09 117.98 121.40 2wdk s PHE 186 Ca -0.05 0.10 0.08 0.00 -0.96 0.00 0.00 56.93 56.10 2wdk s PHE 186 Cb -0.09 -0.46 -0.04 0.00 -0.34 0.00 0.00 43.02 42.10 2wdk s PHE 186 CO 0.01 -0.53 -0.03 0.00 -1.46 0.00 0.00 175.22 173.21 2wdk s ALA 187 N 2.26 3.13 0.03 11.12 0.00 -1.13 -4.95 121.76 132.22 2wdk s ALA 187 Ca 0.05 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.59 2wdk s ALA 187 Cb -0.15 -0.90 0.00 0.00 0.00 0.00 0.00 23.12 22.06 2wdk s ALA 187 CO -0.10 0.46 0.00 1.28 0.00 0.00 0.00 175.76 177.39 2wdk n LEU 188 N -0.15 0.00 0.00 0.00 7.99 -1.26 -1.31 117.00 122.27 2wdk n LEU 188 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.90 2wdk n LEU 188 Cb 0.56 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.87 2wdk n LEU 188 CO 0.38 0.00 0.00 0.00 -1.51 0.00 0.00 177.39 176.26 2wdk n ALA 189 N -3.00 0.00 -2.86 -1.18 0.00 -1.26 -4.65 120.51 107.56 2wdk n ALA 189 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2wdk n ALA 189 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2wdk n ALA 189 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wdk n ARG 190 N -0.04 2.42 0.00 0.00 1.74 -1.26 -3.01 116.66 116.50 2wdk n ARG 190 Ca 0.00 -4.18 0.00 0.00 -0.77 0.00 0.00 57.85 52.90 2wdk n ARG 190 Cb 0.00 -1.97 0.00 0.00 -1.02 0.00 0.00 32.46 29.47 2wdk n ARG 190 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2wdk n THR 191 N -0.14 0.00 -0.05 0.55 -2.24 -1.17 -4.94 114.28 106.29 2wdk n THR 191 Ca 0.28 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.89 2wdk n THR 191 Cb 0.58 -0.37 -0.13 0.00 -2.10 0.00 0.00 70.33 68.31 2wdk n THR 191 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2wdk h THR 192 N -1.67 1.48 0.00 4.28 2.02 -1.98 -3.32 112.91 113.72 2wdk h THR 192 Ca 0.00 -2.36 0.00 0.00 0.77 0.00 0.00 66.41 64.82 2wdk h THR 192 Cb 0.00 3.05 0.00 0.00 -1.74 0.00 0.00 68.15 69.46 2wdk h THR 192 CO 0.00 0.58 0.00 0.00 0.37 0.00 0.00 175.52 176.47 2wdk n TYR 193 N -4.41 0.66 -0.03 3.16 0.18 -1.26 -4.94 117.16 110.52 2wdk n TYR 193 Ca -0.17 0.33 0.00 0.00 1.88 0.00 0.00 57.90 59.94 2wdk n TYR 193 Cb 0.63 -1.03 0.00 0.00 -0.38 0.00 0.00 39.34 38.57 2wdk n TYR 193 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2wdk n GLY 194 N -1.08 0.90 3.90 -7.48 0.00 -1.25 -5.01 105.19 95.17 2wdk n GLY 194 Ca -0.01 -1.92 -0.28 0.00 0.00 0.00 0.00 46.02 43.81 2wdk n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wdk s VAL 195 N -1.28 3.58 0.00 1.61 1.01 -1.26 -3.06 120.40 120.99 2wdk s VAL 195 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2wdk s VAL 195 Cb 0.00 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 32.92 2wdk s VAL 195 CO 0.00 -0.53 0.00 0.18 0.00 0.00 0.00 175.10 174.75 2wdk n LEU 196 N -2.77 0.00 -3.52 3.92 7.99 -1.16 -4.78 117.00 116.67 2wdk n LEU 196 Ca 0.06 0.00 -0.00 0.00 -0.01 0.00 0.00 56.01 56.05 2wdk n LEU 196 Cb 0.57 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 43.83 2wdk n LEU 196 CO 0.55 0.00 0.60 -0.83 -1.51 0.00 0.00 177.39 176.20 2wdk s GLY 197 N -0.23 -0.18 -0.05 -0.72 0.00 -1.26 -4.54 107.32 100.34 2wdk s GLY 197 Ca 0.00 3.00 0.05 0.00 0.00 0.00 0.00 44.72 47.77 2wdk s GLY 197 CO 0.00 2.95 -0.19 0.14 0.00 0.00 0.00 173.10 176.00 2wdk s VAL 198 N 2.03 2.65 -0.08 1.40 1.01 -0.43 -0.92 120.40 126.07 2wdk s VAL 198 Ca -0.06 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.07 2wdk s VAL 198 Cb -0.06 -2.01 0.02 0.00 0.00 0.00 0.00 36.38 34.33 2wdk s VAL 198 CO -0.17 0.58 -0.10 -0.54 0.00 0.00 0.00 175.10 174.87 2wdk s LYS 199 N -0.48 1.59 -0.09 2.72 1.02 -0.47 -2.82 119.74 121.22 2wdk s LYS 199 Ca 0.06 -0.34 0.04 0.00 0.02 0.00 0.00 55.97 55.75 2wdk s LYS 199 Cb -0.12 -1.44 -0.01 0.00 -0.52 0.00 0.00 37.83 35.75 2wdk s LYS 199 CO 0.01 -0.08 -0.23 0.00 -0.92 0.00 0.00 175.35 174.13 2wdk s ALA 200 N 1.05 2.23 -0.12 5.17 0.00 -0.25 -1.50 121.76 128.35 2wdk s ALA 200 Ca -0.07 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 50.90 2wdk s ALA 200 Cb -0.15 -0.80 0.02 0.00 0.00 0.00 0.00 23.12 22.19 2wdk s ALA 200 CO -0.01 0.34 -0.11 0.71 0.00 0.00 0.00 175.76 176.70 2wdk s TYR 201 N 0.11 1.72 -0.26 0.00 1.51 0.23 -1.75 117.35 118.92 2wdk s TYR 201 Ca -0.11 -0.88 0.02 0.00 -1.01 0.00 0.00 57.07 55.09 2wdk s TYR 201 Cb -0.16 -1.34 0.07 0.00 -0.11 0.00 0.00 41.96 40.41 2wdk s TYR 201 CO 0.06 -0.54 -0.07 0.42 -1.11 0.00 0.00 175.55 174.31 2wdk s ILE 202 N 1.51 1.97 0.00 2.71 -1.09 -0.49 0.11 121.20 125.92 2wdk s ILE 202 Ca 0.03 -1.61 -0.30 0.00 -2.23 0.00 0.00 60.65 56.54 2wdk s ILE 202 Cb -0.13 -2.18 -0.04 0.00 -1.58 0.00 0.00 42.46 38.53 2wdk s ILE 202 CO -0.08 -0.14 1.14 0.12 -1.23 0.00 0.00 174.94 174.75 2wdk s PHE 203 N 1.17 3.42 0.00 3.97 5.36 0.21 -1.86 117.98 130.26 2wdk s PHE 203 Ca -0.05 1.39 0.00 0.00 -0.96 0.00 0.00 56.93 57.30 2wdk s PHE 203 Cb -0.19 -3.34 0.00 0.00 -0.34 0.00 0.00 43.02 39.15 2wdk s PHE 203 CO -0.06 -0.93 0.00 1.28 -1.46 0.00 0.00 175.22 174.05 2wdk n LEU 204 N 4.36 0.00 -4.59 6.12 4.77 -1.11 -2.11 117.00 124.44 2wdk n LEU 204 Ca 0.09 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 55.61 2wdk n LEU 204 Cb 0.48 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 2wdk n LEU 204 CO 0.54 0.00 0.63 0.61 -1.33 0.00 0.00 177.39 177.85 2wdk n GLY 205 N 4.21 -0.12 0.00 -0.72 0.00 -1.26 -4.73 105.19 102.57 2wdk n GLY 205 Ca 0.00 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.40 2wdk n GLY 205 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2wdk n GLU 206 N 1.04 0.00 0.00 1.61 2.13 -1.26 -4.42 120.64 119.74 2wdk n GLU 206 Ca 0.11 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.93 2wdk n GLU 206 Cb 0.30 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.01 2wdk n GLU 206 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2wdk n VAL 207 N 0.00 0.00 0.00 6.31 0.31 -1.25 -4.74 118.33 118.96 2wdk n VAL 207 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2wdk n VAL 207 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2wdk n VAL 207 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81