#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wdz n LEU 3 N 0.00 0.00 -0.68 -3.43 4.77 -1.26 -4.90 117.00 111.51 1wdz n LEU 3 Ca 0.00 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.01 1wdz n LEU 3 Cb 0.00 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.21 1wdz n LEU 3 CO 0.00 0.00 0.52 -0.24 -1.33 0.00 0.00 177.39 176.34 1wdz n SER 4 N 0.00 1.86 -0.45 -1.43 2.88 -1.26 -3.04 113.62 112.19 1wdz n SER 4 Ca 0.00 -2.14 0.11 0.00 -1.33 0.00 0.00 58.87 55.51 1wdz n SER 4 Cb 0.00 -0.35 -0.00 0.00 -0.75 0.00 0.00 64.21 63.11 1wdz n SER 4 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1wdz n ARG 5 N 0.20 1.10 0.00 -1.46 1.74 -1.26 -3.83 116.66 113.15 1wdz n ARG 5 Ca 0.08 -0.90 0.10 0.00 -0.77 0.00 0.00 57.85 56.37 1wdz n ARG 5 Cb 0.37 -1.48 0.60 0.00 -1.02 0.00 0.00 32.46 30.92 1wdz n ARG 5 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wdz n SER 6 N -0.16 0.00 0.13 0.55 2.88 -1.17 -1.04 113.62 114.81 1wdz n SER 6 Ca 0.09 -0.49 -0.22 0.00 -1.33 0.00 0.00 58.87 56.92 1wdz n SER 6 Cb 0.45 -0.07 -0.15 0.00 -0.75 0.00 0.00 64.21 63.69 1wdz n SER 6 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1wdz h GLU 7 N 0.00 0.46 -0.64 -1.46 4.57 -1.83 -3.22 114.58 112.46 1wdz h GLU 7 Ca 0.00 -0.77 -0.01 0.00 -1.18 0.00 0.00 59.36 57.40 1wdz h GLU 7 Cb 0.05 0.29 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 1wdz h GLU 7 CO 0.00 1.37 0.36 1.49 -1.18 0.00 0.00 179.01 181.04 1wdz h GLU 8 N 0.13 0.88 -0.76 1.92 4.81 -1.34 -0.67 114.58 119.55 1wdz h GLU 8 Ca -0.21 -0.10 0.01 0.00 -0.13 0.00 0.00 59.36 58.93 1wdz h GLU 8 Cb 2.10 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 31.26 1wdz h GLU 8 CO 0.25 0.66 0.50 1.98 -0.73 0.00 0.00 179.01 181.67 1wdz h MET 9 N 0.87 0.98 0.65 1.92 4.05 -1.62 0.12 114.93 121.90 1wdz h MET 9 Ca 0.22 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.55 1wdz h MET 9 Cb 0.03 -0.22 0.01 0.00 -0.80 0.00 0.00 31.60 30.61 1wdz h MET 9 CO -0.04 0.65 -0.31 1.25 0.23 0.00 0.00 176.91 178.69 1wdz h HIS 10 N 1.01 -0.82 -1.38 1.39 -0.00 -1.47 -2.11 115.15 111.79 1wdz h HIS 10 Ca 0.28 -0.02 0.41 0.00 -0.00 0.00 0.00 60.37 61.04 1wdz h HIS 10 Cb -0.10 0.27 -0.09 0.00 -0.00 0.00 0.00 27.41 27.49 1wdz h HIS 10 CO -0.02 -0.51 0.95 -0.09 -0.00 0.00 0.00 177.93 178.26 1wdz h ARG 11 N -0.90 0.09 -0.13 5.26 1.12 -0.90 0.20 114.38 119.12 1wdz h ARG 11 Ca -0.09 -0.01 -0.13 0.00 -1.11 0.00 0.00 59.98 58.65 1wdz h ARG 11 Cb 0.67 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 30.62 1wdz h ARG 11 CO 0.15 0.06 -0.42 -0.07 -3.11 0.00 0.00 179.97 176.58 1wdz h LEU 12 N 0.09 0.59 -0.73 3.80 3.38 -0.45 -2.22 115.31 119.78 1wdz h LEU 12 Ca 0.73 -0.60 0.10 0.00 0.09 0.00 0.00 57.88 58.20 1wdz h LEU 12 Cb 2.56 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 43.06 1wdz h LEU 12 CO -0.18 1.09 0.36 0.74 0.09 0.00 0.00 178.44 180.54 1wdz h THR 13 N 0.12 0.83 0.14 0.22 2.02 0.06 -0.26 112.91 116.04 1wdz h THR 13 Ca -0.02 -0.21 0.01 0.00 0.77 0.00 0.00 66.41 66.96 1wdz h THR 13 Cb 1.04 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 1wdz h THR 13 CO 0.09 0.11 -0.16 -0.33 0.37 0.00 0.00 175.52 175.60 1wdz h GLU 14 N 0.60 -0.32 -0.48 6.66 5.08 -1.32 -2.62 114.58 122.18 1wdz h GLU 14 Ca 0.37 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.71 1wdz h GLU 14 Cb 0.41 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1wdz h GLU 14 CO -0.28 -0.21 0.15 -0.91 -1.00 0.00 0.00 179.01 176.75 1wdz h ASN 15 N -0.33 0.64 -0.18 1.42 2.35 -0.73 -0.48 115.58 118.28 1wdz h ASN 15 Ca 0.01 -0.09 0.03 0.00 -0.55 0.00 0.00 56.30 55.70 1wdz h ASN 15 Cb 0.33 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 1wdz h ASN 15 CO -0.05 0.61 -0.03 0.58 -1.65 0.00 0.00 177.43 176.89 1wdz h VAL 16 N 0.69 0.84 -0.55 2.81 2.07 -0.81 0.28 116.25 121.58 1wdz h VAL 16 Ca 0.16 -0.01 -0.08 0.00 0.82 0.00 0.00 66.70 67.60 1wdz h VAL 16 Cb 0.20 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1wdz h VAL 16 CO -0.01 0.00 0.03 1.88 0.02 0.00 0.00 177.57 179.49 1wdz h TYR 17 N 0.02 0.99 -0.46 1.57 -1.99 -1.09 -2.46 116.97 113.56 1wdz h TYR 17 Ca 0.08 -0.14 -0.11 0.00 2.00 0.00 0.00 58.73 60.56 1wdz h TYR 17 Cb 0.12 -0.27 -0.01 0.00 2.00 0.00 0.00 36.73 38.57 1wdz h TYR 17 CO -0.19 0.88 -0.14 0.87 -0.00 0.00 0.00 178.16 179.58 1wdz h LYS 18 N 0.86 0.90 -0.16 4.88 1.57 -0.51 -3.00 116.57 121.12 1wdz h LYS 18 Ca 0.17 -0.36 -0.08 0.00 -1.87 0.00 0.00 60.65 58.50 1wdz h LYS 18 Cb 0.47 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1wdz h LYS 18 CO 0.02 1.01 -0.26 1.15 -0.57 0.00 0.00 179.45 180.80 1wdz h THR 19 N 0.74 1.25 -0.45 -0.16 2.02 -0.31 0.54 112.91 116.54 1wdz h THR 19 Ca 0.11 -1.17 -0.09 0.00 0.77 0.00 0.00 66.41 66.03 1wdz h THR 19 Cb 0.70 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 1wdz h THR 19 CO 0.05 0.36 -0.08 0.40 0.37 0.00 0.00 175.52 176.62 1wdz h ILE 20 N 0.26 1.25 0.07 3.11 2.04 -1.40 -0.71 117.51 122.14 1wdz h ILE 20 Ca 0.04 -1.13 -0.23 0.00 1.00 0.00 0.00 64.86 64.54 1wdz h ILE 20 Cb 0.60 0.99 0.02 0.00 -0.74 0.00 0.00 36.82 37.70 1wdz h ILE 20 CO 0.04 0.39 -0.94 0.24 0.00 0.00 0.00 178.15 177.88 1wdz h MET 21 N 0.73 0.51 -0.01 2.37 2.86 -1.25 0.28 114.93 120.41 1wdz h MET 21 Ca 0.13 -0.64 -0.22 0.00 -2.06 0.00 0.00 59.70 56.90 1wdz h MET 21 Cb 0.56 0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.42 1wdz h MET 21 CO 0.03 1.26 -0.93 0.93 1.06 0.00 0.00 176.91 179.27 1wdz h GLU 22 N 0.05 0.43 0.00 1.72 5.08 0.12 -3.40 114.58 118.58 1wdz h GLU 22 Ca -0.14 -0.45 -0.02 0.00 -1.00 0.00 0.00 59.36 57.75 1wdz h GLU 22 Cb 1.65 0.13 -0.00 0.00 0.50 0.00 0.00 28.75 31.03 1wdz h GLU 22 CO 0.18 1.11 -0.56 1.04 -1.00 0.00 0.00 179.01 179.78 1wdz n GLN 23 N -3.76 0.04 -0.03 2.33 6.02 -0.34 -4.69 117.38 116.96 1wdz n GLN 23 Ca -0.07 0.02 -0.10 0.00 -0.01 0.00 0.00 57.00 56.84 1wdz n GLN 23 Cb 0.83 -0.58 -0.04 0.00 1.02 0.00 0.00 30.24 31.47 1wdz n GLN 23 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1wdz h PHE 24 N -0.08 -0.90 -0.25 1.08 3.57 -1.25 -0.75 116.94 118.36 1wdz h PHE 24 Ca -0.03 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.41 1wdz h PHE 24 Cb 0.53 0.43 -0.00 0.00 2.79 0.00 0.00 35.95 39.69 1wdz h PHE 24 CO -0.02 -0.40 -0.25 -0.91 -2.23 0.00 0.00 178.31 174.50 1wdz h ASN 25 N -0.36 0.65 -0.88 0.41 2.35 -1.17 -0.63 115.58 115.95 1wdz h ASN 25 Ca 0.11 -0.48 -0.01 0.00 -0.55 0.00 0.00 56.30 55.38 1wdz h ASN 25 Cb 0.54 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.69 1wdz h ASN 25 CO -0.40 0.99 0.52 -0.65 -1.65 0.00 0.00 177.43 176.24 1wdz h PRO 26 N 0.32 1.21 -0.48 0.81 0.11 -1.74 0.45 132.00 132.67 1wdz h PRO 26 Ca 0.04 -0.12 -0.13 0.00 0.11 0.00 0.00 66.00 65.90 1wdz h PRO 26 Cb 0.81 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1wdz h PRO 26 CO 0.06 0.85 -0.20 0.77 -0.21 0.00 0.00 178.00 179.27 1wdz h SER 27 N 1.22 1.01 -0.94 -2.05 0.02 -1.06 -2.03 113.55 109.72 1wdz h SER 27 Ca 0.32 -0.39 0.01 0.00 -0.84 0.00 0.00 61.79 60.89 1wdz h SER 27 Cb -0.03 -0.28 -0.05 0.00 0.14 0.00 0.00 62.40 62.18 1wdz h SER 27 CO -0.06 1.18 0.63 0.25 -1.14 0.00 0.00 176.83 177.69 1wdz h LEU 28 N 0.84 1.08 -0.66 5.07 5.85 -0.58 0.38 115.31 127.30 1wdz h LEU 28 Ca 0.11 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1wdz h LEU 28 Cb 0.78 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 1wdz h LEU 28 CO 0.06 0.78 0.40 0.03 -0.34 0.00 0.00 178.44 179.38 1wdz h ARG 29 N 1.27 0.76 -0.12 1.25 3.08 -0.58 0.41 114.38 120.45 1wdz h ARG 29 Ca 0.35 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.36 1wdz h ARG 29 Cb -0.14 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 1wdz h ARG 29 CO -0.08 0.50 0.05 -0.97 -1.07 0.00 0.00 179.97 178.40 1wdz h ASN 30 N 0.78 0.06 -0.43 7.04 -1.24 -0.46 -0.08 115.58 121.25 1wdz h ASN 30 Ca 0.27 0.01 0.09 0.00 0.71 0.00 0.00 56.30 57.38 1wdz h ASN 30 Cb 0.04 0.00 -0.09 0.00 0.73 0.00 0.00 38.32 39.00 1wdz h ASN 30 CO -0.11 0.06 -0.14 0.15 -1.29 0.00 0.00 177.43 176.09 1wdz h PHE 31 N 0.11 -0.31 0.10 0.67 3.57 0.12 0.15 116.94 121.35 1wdz h PHE 31 Ca 0.05 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.61 1wdz h PHE 31 Cb 0.02 0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.93 1wdz h PHE 31 CO -0.10 -0.22 -0.24 0.82 -2.23 0.00 0.00 178.31 176.35 1wdz h ILE 32 N -0.04 0.47 -0.59 1.41 2.04 0.51 0.47 117.51 121.78 1wdz h ILE 32 Ca 0.21 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.15 1wdz h ILE 32 Cb 0.36 0.47 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 1wdz h ILE 32 CO -0.47 0.00 0.26 0.00 0.00 0.00 0.00 178.15 177.94 1wdz h ALA 33 N 0.35 0.76 -0.46 1.87 0.00 -0.50 0.54 119.26 121.83 1wdz h ALA 33 Ca 0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1wdz h ALA 33 Cb 0.46 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1wdz h ALA 33 CO -0.14 -0.13 0.26 0.52 0.00 0.00 0.00 179.25 179.76 1wdz h MET 34 N 0.48 0.63 -0.46 0.00 2.86 -0.24 -0.88 114.93 117.32 1wdz h MET 34 Ca 0.28 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.83 1wdz h MET 34 Cb 0.28 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1wdz h MET 34 CO -0.24 0.49 0.21 0.78 1.06 0.00 0.00 176.91 179.21 1wdz h GLY 35 N 0.61 0.71 0.61 8.32 0.00 0.11 -1.86 103.07 111.58 1wdz h GLY 35 Ca 0.16 -0.36 0.05 0.00 0.00 0.00 0.00 47.33 47.18 1wdz h GLY 35 CO -0.03 0.34 0.06 0.50 0.00 0.00 0.00 176.54 177.42 1wdz h LYS 36 N 0.59 0.17 -0.80 4.80 1.57 0.46 0.32 116.57 123.68 1wdz h LYS 36 Ca 0.16 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 59.03 1wdz h LYS 36 Cb 0.14 -0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.33 1wdz h LYS 36 CO -0.02 0.11 0.43 -0.91 -0.57 0.00 0.00 179.45 178.49 1wdz h ASN 37 N 0.17 0.58 -0.45 0.86 -0.26 -0.93 0.20 115.58 115.74 1wdz h ASN 37 Ca 0.15 0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.92 1wdz h ASN 37 Cb 0.17 -0.04 -0.02 0.00 -1.06 0.00 0.00 38.32 37.37 1wdz h ASN 37 CO -0.20 0.31 0.16 0.22 -1.06 0.00 0.00 177.43 176.85 1wdz h TYR 38 N 0.69 0.71 -0.32 1.19 3.20 -0.48 -2.56 116.97 119.41 1wdz h TYR 38 Ca 0.40 -0.07 0.03 0.00 3.14 0.00 0.00 58.73 62.24 1wdz h TYR 38 Cb 0.45 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1wdz h TYR 38 CO -0.08 0.63 0.15 1.49 -1.64 0.00 0.00 178.16 178.70 1wdz h GLU 39 N 0.59 0.30 -0.70 1.82 4.81 0.16 -2.26 114.58 119.31 1wdz h GLU 39 Ca 0.15 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.41 1wdz h GLU 39 Cb 0.24 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.51 1wdz h GLU 39 CO -0.01 0.20 0.46 -0.22 -0.73 0.00 0.00 179.01 178.71 1wdz h LYS 40 N 0.31 0.73 -0.16 1.92 3.64 -0.53 -1.18 116.57 121.31 1wdz h LYS 40 Ca 0.14 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.33 1wdz h LYS 40 Cb 0.07 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1wdz h LYS 40 CO -0.11 0.49 -0.51 0.00 -2.27 0.00 0.00 179.45 177.04 1wdz h ALA 41 N 1.61 0.83 0.05 5.00 0.00 -1.05 -2.66 119.26 123.05 1wdz h ALA 41 Ca 0.29 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1wdz h ALA 41 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1wdz h ALA 41 CO -0.09 0.67 -0.02 -0.07 0.00 0.00 0.00 179.25 179.74 1wdz h LEU 42 N 0.34 -0.06 -1.97 0.00 3.38 -0.68 -1.77 115.31 114.55 1wdz h LEU 42 Ca 0.01 -0.16 0.15 0.00 0.09 0.00 0.00 57.88 57.97 1wdz h LEU 42 Cb 1.01 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1wdz h LEU 42 CO 0.09 0.12 0.38 0.00 0.09 0.00 0.00 178.44 179.12 1wdz h ALA 43 N 0.70 2.46 -0.23 1.53 0.00 -1.29 0.17 119.26 122.60 1wdz h ALA 43 Ca -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1wdz h ALA 43 Cb 0.21 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1wdz h ALA 43 CO 0.01 -0.61 0.08 0.78 0.00 0.00 0.00 179.25 179.51 1wdz h GLY 44 N 0.03 0.38 1.36 0.00 0.00 -0.97 -2.45 103.07 101.42 1wdz h GLY 44 Ca 0.25 -0.22 0.04 0.00 0.00 0.00 0.00 47.33 47.40 1wdz h GLY 44 CO -0.01 0.21 0.33 -2.08 0.00 0.00 0.00 176.54 174.99 1wdz h VAL 45 N 0.21 1.02 -0.08 4.60 2.07 -0.22 -2.23 116.25 121.62 1wdz h VAL 45 Ca 0.08 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1wdz h VAL 45 Cb 0.22 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1wdz h VAL 45 CO -0.00 0.10 -0.01 0.74 0.02 0.00 0.00 177.57 178.41 1wdz h THR 46 N 0.52 0.93 -0.30 2.57 2.02 -0.92 -0.33 112.91 117.39 1wdz h THR 46 Ca 0.21 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.34 1wdz h THR 46 Cb 0.17 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1wdz h THR 46 CO -0.05 0.00 0.01 0.22 0.37 0.00 0.00 175.52 176.07 1wdz h TYR 47 N 0.01 0.57 -0.29 3.16 3.20 -1.18 -3.08 116.97 119.36 1wdz h TYR 47 Ca 0.04 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.76 1wdz h TYR 47 Cb 0.05 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 1wdz h TYR 47 CO -0.13 0.65 -0.06 0.00 -1.64 0.00 0.00 178.16 176.98 1wdz h ALA 48 N 0.85 1.35 -0.97 1.82 0.00 -1.36 -2.85 119.26 118.10 1wdz h ALA 48 Ca 0.09 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.91 1wdz h ALA 48 Cb 0.41 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 17.98 1wdz h ALA 48 CO 0.01 0.44 0.59 0.00 0.00 0.00 0.00 179.25 180.30 1wdz h ALA 49 N 1.50 1.49 -0.74 0.00 0.00 -0.96 -2.11 119.26 118.44 1wdz h ALA 49 Ca 0.09 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1wdz h ALA 49 Cb 0.39 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1wdz h ALA 49 CO 0.02 0.13 0.28 -0.22 0.00 0.00 0.00 179.25 179.46 1wdz h LYS 50 N 0.90 1.11 -0.76 0.00 3.64 -1.55 -0.05 116.57 119.86 1wdz h LYS 50 Ca 0.50 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1wdz h LYS 50 Cb 0.57 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 32.17 1wdz h LYS 50 CO -0.30 0.91 0.47 0.78 -2.27 0.00 0.00 179.45 179.04 1wdz h GLY 51 N 1.12 1.09 0.75 5.01 0.00 -1.48 -1.51 103.07 108.05 1wdz h GLY 51 Ca 0.25 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 1wdz h GLY 51 CO -0.02 0.42 0.01 -1.82 0.00 0.00 0.00 176.54 175.13 1wdz h TYR 52 N 1.03 0.08 -0.40 5.60 3.20 -1.32 -2.21 116.97 122.95 1wdz h TYR 52 Ca 0.27 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.21 1wdz h TYR 52 Cb -0.07 -0.02 -0.09 0.00 1.54 0.00 0.00 36.73 38.09 1wdz h TYR 52 CO -0.01 0.32 -0.33 0.35 -1.64 0.00 0.00 178.16 176.85 1wdz h PHE 53 N -0.19 -0.90 -0.01 -3.82 3.57 -0.71 0.22 116.94 115.10 1wdz h PHE 53 Ca 0.01 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.53 1wdz h PHE 53 Cb 0.28 0.45 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1wdz h PHE 53 CO 0.02 -0.38 -0.20 -0.44 -2.23 0.00 0.00 178.31 175.08 1wdz h ASP 54 N -0.25 0.02 -0.33 0.41 3.32 -1.24 -1.44 116.42 116.91 1wdz h ASP 54 Ca 0.17 -0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.06 1wdz h ASP 54 Cb 0.54 -0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 1wdz h ASP 54 CO -0.54 0.22 -0.41 0.00 -1.72 0.00 0.00 179.24 176.80 1wdz h ALA 55 N 1.78 0.49 0.22 3.45 0.00 -0.53 -0.94 119.26 123.74 1wdz h ALA 55 Ca 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 1wdz h ALA 55 Cb 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1wdz h ALA 55 CO 0.03 0.61 -0.16 -0.07 0.00 0.00 0.00 179.25 179.65 1wdz h LEU 56 N 0.64 -0.41 -0.44 0.00 3.38 -0.29 -1.37 115.31 116.82 1wdz h LEU 56 Ca 0.04 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.13 1wdz h LEU 56 Cb 1.00 0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.81 1wdz h LEU 56 CO 0.10 -0.25 0.01 0.58 0.09 0.00 0.00 178.44 178.96 1wdz h VAL 57 N -0.38 0.67 -0.97 1.22 2.07 -1.24 0.21 116.25 117.83 1wdz h VAL 57 Ca -0.01 -0.04 0.08 0.00 0.82 0.00 0.00 66.70 67.55 1wdz h VAL 57 Cb 0.34 0.54 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 1wdz h VAL 57 CO -0.00 0.02 0.62 0.50 0.02 0.00 0.00 177.57 178.74 1wdz h LYS 58 N 0.12 1.03 -0.47 1.57 1.63 -0.81 0.66 116.57 120.31 1wdz h LYS 58 Ca 0.22 -0.06 -0.11 0.00 -0.85 0.00 0.00 60.65 59.85 1wdz h LYS 58 Cb 0.31 -0.23 -0.02 0.00 -0.60 0.00 0.00 32.23 31.69 1wdz h LYS 58 CO -0.36 0.68 -0.13 0.52 -3.45 0.00 0.00 179.45 176.72 1wdz h MET 59 N 1.07 0.89 -0.10 1.90 2.86 -0.05 -1.69 114.93 119.81 1wdz h MET 59 Ca 0.44 -0.32 0.03 0.00 -2.06 0.00 0.00 59.70 57.79 1wdz h MET 59 Cb 0.28 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 1wdz h MET 59 CO -0.19 0.96 -0.08 0.78 1.06 0.00 0.00 176.91 179.44 1wdz h GLY 60 N 0.96 -0.00 0.92 8.32 0.00 0.26 -0.57 103.07 112.95 1wdz h GLY 60 Ca 0.12 0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.57 1wdz h GLY 60 CO 0.05 -0.10 0.15 0.83 0.00 0.00 0.00 176.54 177.47 1wdz h GLU 61 N -0.10 0.30 -0.82 4.80 5.08 0.37 -0.59 114.58 123.62 1wdz h GLU 61 Ca 0.07 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1wdz h GLU 61 Cb 0.20 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.33 1wdz h GLU 61 CO -0.16 0.20 0.54 -0.07 -1.00 0.00 0.00 179.01 178.52 1wdz h LEU 62 N 0.31 0.87 -0.43 1.33 3.38 -1.01 0.52 115.31 120.27 1wdz h LEU 62 Ca 0.11 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 1wdz h LEU 62 Cb 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1wdz h LEU 62 CO -0.06 0.60 -0.05 0.00 0.09 0.00 0.00 178.44 179.02 1wdz h ALA 63 N 1.52 0.59 0.00 1.53 0.00 -0.66 -0.05 119.26 122.19 1wdz h ALA 63 Ca 0.33 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1wdz h ALA 63 Cb 0.04 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1wdz h ALA 63 CO -0.10 0.43 0.00 0.77 0.00 0.00 0.00 179.25 180.35 1wdz h SER 64 N 0.63 0.00 -0.01 0.00 0.02 0.09 -2.20 113.55 112.09 1wdz h SER 64 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1wdz h SER 64 Cb 0.56 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1wdz h SER 64 CO 0.03 0.00 -0.68 -0.62 -1.14 0.00 0.00 176.83 174.43 1wdz n GLU 65 N -2.77 1.01 -1.15 3.45 1.02 0.06 -4.87 120.64 117.39 1wdz n GLU 65 Ca 0.00 -0.45 -0.29 0.00 -0.02 0.00 0.00 57.16 56.40 1wdz n GLU 65 Cb 0.21 -1.41 0.17 0.00 -0.02 0.00 0.00 31.44 30.39 1wdz n GLU 65 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1wdz s SER 66 N -2.55 2.85 0.36 1.62 1.04 -0.08 -4.98 113.70 111.96 1wdz s SER 66 Ca 0.12 1.33 0.19 0.00 0.48 0.00 0.00 55.95 58.06 1wdz s SER 66 Cb 0.15 -2.00 0.58 0.00 0.10 0.00 0.00 66.02 64.86 1wdz s SER 66 CO 0.66 -3.01 1.68 1.56 0.98 0.00 0.00 173.24 175.11 1wdz h GLN 67 N -1.81 0.00 0.00 4.02 4.20 -1.90 -3.41 115.11 116.21 1wdz h GLN 67 Ca -0.53 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.10 1wdz h GLN 67 Cb 1.31 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 29.01 1wdz h GLN 67 CO 0.56 0.39 -0.19 0.41 -0.67 0.00 0.00 178.83 179.33 1wdz n GLY 68 N 0.43 0.65 0.53 3.46 0.00 -1.26 -4.91 105.19 104.08 1wdz n GLY 68 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 1wdz n GLY 68 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1wdz n SER 69 N 0.00 1.41 -0.32 1.61 7.64 -1.26 -4.85 113.62 117.85 1wdz n SER 69 Ca -0.18 -2.84 0.01 0.00 1.01 0.00 0.00 58.87 56.86 1wdz n SER 69 Cb 0.63 -0.38 0.15 0.00 -1.01 0.00 0.00 64.21 63.59 1wdz n SER 69 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1wdz h LYS 70 N 0.39 0.97 -0.09 1.43 1.57 -1.80 -1.95 116.57 117.10 1wdz h LYS 70 Ca -0.04 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.71 1wdz h LYS 70 Cb 1.24 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 1wdz h LYS 70 CO 0.02 0.64 0.07 1.05 -0.57 0.00 0.00 179.45 180.66 1wdz h GLU 71 N 1.00 0.00 0.00 3.15 9.09 -1.88 -0.23 114.58 125.70 1wdz h GLU 71 Ca 0.38 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.79 1wdz h GLU 71 Cb 0.18 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.28 1wdz h GLU 71 CO -0.17 0.00 -0.01 -0.07 0.05 0.00 0.00 179.01 178.80 1wdz h LEU 72 N 0.00 0.00 -1.19 3.06 3.38 -1.69 -2.61 115.31 116.26 1wdz h LEU 72 Ca 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1wdz h LEU 72 Cb 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1wdz h LEU 72 CO -0.00 0.01 0.26 1.23 0.09 0.00 0.00 178.44 180.04 1wdz h GLY 73 N 2.29 0.88 1.23 0.83 0.00 -1.08 -1.42 103.07 105.80 1wdz h GLY 73 Ca -0.00 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 46.82 1wdz h GLY 73 CO 0.00 0.40 -0.02 -0.55 0.00 0.00 0.00 176.54 176.38 1wdz h ASP 74 N 0.82 0.90 0.11 0.19 3.45 -1.56 -1.08 116.42 119.25 1wdz h ASP 74 Ca 0.20 -0.24 -0.01 0.00 0.43 0.00 0.00 57.03 57.41 1wdz h ASP 74 Cb 0.11 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 38.64 1wdz h ASP 74 CO -0.02 0.97 -0.05 0.58 -1.57 0.00 0.00 179.24 179.14 1wdz h VAL 75 N 0.85 1.04 0.00 -1.35 2.07 -1.47 -1.44 116.25 115.95 1wdz h VAL 75 Ca 0.15 -0.57 0.03 0.00 0.82 0.00 0.00 66.70 67.14 1wdz h VAL 75 Cb 0.53 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 1wdz h VAL 75 CO 0.03 0.14 -0.26 -0.07 0.02 0.00 0.00 177.57 177.43 1wdz h LEU 76 N -0.41 -0.76 -0.78 2.57 3.38 -1.14 0.19 115.31 118.36 1wdz h LEU 76 Ca -0.01 0.10 0.14 0.00 0.09 0.00 0.00 57.88 58.20 1wdz h LEU 76 Cb 0.34 0.31 -0.09 0.00 0.09 0.00 0.00 40.66 41.30 1wdz h LEU 76 CO 0.02 -0.32 0.35 -0.26 0.09 0.00 0.00 178.44 178.31 1wdz h PHE 77 N -0.40 0.60 -0.50 1.13 0.05 -1.17 0.12 116.94 116.77 1wdz h PHE 77 Ca 0.06 0.04 -0.06 0.00 3.82 0.00 0.00 57.97 61.82 1wdz h PHE 77 Cb 0.48 -0.15 -0.02 0.00 2.00 0.00 0.00 35.95 38.26 1wdz h PHE 77 CO -0.29 0.10 0.05 1.96 -0.18 0.00 0.00 178.31 179.96 1wdz h GLN 78 N 0.50 0.81 -0.39 1.51 4.20 -0.70 0.13 115.11 121.18 1wdz h GLN 78 Ca 0.43 -0.19 -0.12 0.00 0.06 0.00 0.00 58.65 58.83 1wdz h GLN 78 Cb 0.63 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 1wdz h GLN 78 CO -0.39 0.78 -0.21 0.52 -0.67 0.00 0.00 178.83 178.86 1wdz h MET 79 N 0.76 0.82 -0.60 1.46 2.86 0.12 -0.09 114.93 120.27 1wdz h MET 79 Ca 0.16 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.43 1wdz h MET 79 Cb 0.39 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.00 1wdz h MET 79 CO 0.01 1.00 0.39 0.00 1.06 0.00 0.00 176.91 179.37 1wdz h ALA 80 N 0.80 0.76 -0.49 6.32 0.00 -0.54 -1.69 119.26 124.43 1wdz h ALA 80 Ca 0.08 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1wdz h ALA 80 Cb 0.77 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1wdz h ALA 80 CO 0.06 0.20 0.29 1.49 0.00 0.00 0.00 179.25 181.29 1wdz h GLU 81 N 0.81 0.57 -0.84 0.00 4.57 -0.36 -0.46 114.58 118.87 1wdz h GLU 81 Ca 0.22 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.34 1wdz h GLU 81 Cb -0.08 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.35 1wdz h GLU 81 CO -0.05 0.38 0.44 0.28 -1.18 0.00 0.00 179.01 178.88 1wdz h VAL 82 N 0.59 1.25 -0.33 0.32 2.07 -0.63 -2.31 116.25 117.20 1wdz h VAL 82 Ca 0.19 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 1wdz h VAL 82 Cb 0.01 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 29.89 1wdz h VAL 82 CO -0.08 0.28 0.17 -0.74 0.02 0.00 0.00 177.57 177.22 1wdz h HIS 83 N 1.18 0.48 -0.16 1.57 -0.00 -0.70 -1.56 115.15 115.95 1wdz h HIS 83 Ca 0.29 -0.02 0.04 0.00 -0.00 0.00 0.00 60.37 60.68 1wdz h HIS 83 Cb 0.05 -0.15 -0.04 0.00 -0.00 0.00 0.00 27.41 27.27 1wdz h HIS 83 CO 0.01 0.41 -0.09 -0.09 -0.00 0.00 0.00 177.93 178.16 1wdz h ARG 84 N 0.41 -0.08 -0.60 5.26 2.43 -0.73 0.20 114.38 121.27 1wdz h ARG 84 Ca 0.12 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.26 1wdz h ARG 84 Cb 0.10 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 1wdz h ARG 84 CO -0.02 -0.05 0.26 1.96 -1.51 0.00 0.00 179.97 180.61 1wdz h GLN 85 N -0.08 0.88 -0.58 0.20 4.20 -1.29 -1.09 115.11 117.34 1wdz h GLN 85 Ca 0.09 -0.14 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 1wdz h GLN 85 Cb 0.22 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 1wdz h GLN 85 CO -0.22 0.73 0.00 0.82 -0.67 0.00 0.00 178.83 179.50 1wdz h ILE 86 N 0.82 1.27 -0.14 2.54 2.04 -0.95 -2.28 117.51 120.81 1wdz h ILE 86 Ca 0.20 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 1wdz h ILE 86 Cb 0.16 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1wdz h ILE 86 CO -0.02 0.41 0.06 -0.61 0.00 0.00 0.00 178.15 177.99 1wdz h GLN 87 N 0.92 0.18 -0.12 2.37 5.75 -0.27 -1.60 115.11 122.34 1wdz h GLN 87 Ca 0.17 -0.01 -0.19 0.00 -0.15 0.00 0.00 58.65 58.46 1wdz h GLN 87 Cb 0.55 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.06 1wdz h GLN 87 CO 0.03 0.15 -0.70 -0.91 -2.65 0.00 0.00 178.83 174.75 1wdz h ASN 88 N 0.19 0.64 0.51 -0.69 4.21 -0.69 -2.27 115.58 117.48 1wdz h ASN 88 Ca 0.05 -0.40 -0.09 0.00 1.21 0.00 0.00 56.30 57.07 1wdz h ASN 88 Cb 0.03 -0.19 -0.01 0.00 -1.12 0.00 0.00 38.32 37.03 1wdz h ASN 88 CO -0.01 1.15 -0.41 1.56 -1.29 0.00 0.00 177.43 178.43 1wdz h GLN 89 N 0.38 0.00 -0.09 0.81 1.08 -0.83 -1.39 115.11 115.07 1wdz h GLN 89 Ca -0.03 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.12 1wdz h GLN 89 Cb 1.29 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.72 1wdz h GLN 89 CO 0.13 0.41 -0.14 1.25 -0.95 0.00 0.00 178.83 179.53 1wdz h LEU 90 N 0.00 0.28 -1.40 1.46 5.85 -1.21 -1.96 115.31 118.34 1wdz h LEU 90 Ca -0.00 -0.54 0.00 0.00 0.84 0.00 0.00 57.88 58.18 1wdz h LEU 90 Cb 0.78 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 1wdz h LEU 90 CO 0.05 0.76 0.36 -0.33 -0.34 0.00 0.00 178.44 178.95 1wdz h GLU 91 N -0.19 0.76 0.19 1.25 5.08 -1.16 0.16 114.58 120.68 1wdz h GLU 91 Ca 0.01 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1wdz h GLU 91 Cb 0.71 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1wdz h GLU 91 CO 0.03 0.52 -0.09 0.93 -1.00 0.00 0.00 179.01 179.40 1wdz h GLU 92 N 0.78 -0.25 -0.31 2.33 4.39 -1.13 -0.71 114.58 119.69 1wdz h GLU 92 Ca 0.21 0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.98 1wdz h GLU 92 Cb -0.05 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 28.60 1wdz h GLU 92 CO -0.04 -0.16 -0.01 1.98 -1.16 0.00 0.00 179.01 179.62 1wdz h MET 93 N -0.27 0.08 -0.12 2.33 4.05 -0.49 -1.49 114.93 119.01 1wdz h MET 93 Ca -0.03 -0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.43 1wdz h MET 93 Cb 0.21 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 30.95 1wdz h MET 93 CO 0.04 0.05 -0.14 1.25 0.23 0.00 0.00 176.91 178.34 1wdz h LEU 94 N 0.08 -0.43 -1.06 3.39 5.85 -0.48 0.31 115.31 122.96 1wdz h LEU 94 Ca 0.15 0.08 0.15 0.00 0.84 0.00 0.00 57.88 59.10 1wdz h LEU 94 Cb 0.20 0.21 -0.09 0.00 0.37 0.00 0.00 40.66 41.35 1wdz h LEU 94 CO -0.26 -0.18 0.62 0.50 -0.34 0.00 0.00 178.44 178.78 1wdz h LYS 95 N -0.17 0.83 0.00 1.25 3.64 -0.76 0.38 116.57 121.74 1wdz h LYS 95 Ca 0.09 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1wdz h LYS 95 Cb 0.30 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1wdz h LYS 95 CO -0.23 0.55 -0.18 1.03 -2.27 0.00 0.00 179.45 178.36 1wdz h SER 96 N 0.86 0.00 -0.08 4.20 0.87 -0.13 -0.32 113.55 118.94 1wdz h SER 96 Ca 0.52 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.90 1wdz h SER 96 Cb 0.69 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.66 1wdz h SER 96 CO -0.30 0.18 -0.66 0.15 -0.53 0.00 0.00 176.83 175.66 1wdz h PHE 97 N 0.00 0.83 0.25 2.24 3.57 0.17 -2.49 116.94 121.50 1wdz h PHE 97 Ca -0.00 -0.39 -0.01 0.00 3.53 0.00 0.00 57.97 61.09 1wdz h PHE 97 Cb 0.73 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.35 1wdz h PHE 97 CO 0.00 1.20 -0.12 1.25 -2.23 0.00 0.00 178.31 178.41 1wdz h HIS 98 N 0.22 -0.31 -0.15 0.41 2.76 -1.09 -1.34 115.15 115.66 1wdz h HIS 98 Ca -0.06 -0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.04 1wdz h HIS 98 Cb 1.32 0.10 -0.01 0.00 1.55 0.00 0.00 27.41 30.37 1wdz h HIS 98 CO 0.11 -0.10 -0.20 -0.91 -1.30 0.00 0.00 177.93 175.52 1wdz h ASN 99 N -1.06 0.24 0.00 3.26 2.35 -1.20 0.98 115.58 120.15 1wdz h ASN 99 Ca -0.03 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.61 1wdz h ASN 99 Cb 0.34 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1wdz h ASN 99 CO 0.06 0.46 -1.69 -0.62 -1.65 0.00 0.00 177.43 173.98 1wdz n GLU 100 N -4.20 0.67 -0.01 0.81 1.02 -0.94 -4.40 120.64 113.59 1wdz n GLU 100 Ca -0.01 -0.11 -0.01 0.00 -0.02 0.00 0.00 57.16 57.01 1wdz n GLU 100 Cb 0.33 -1.34 -0.00 0.00 -0.02 0.00 0.00 31.44 30.40 1wdz n GLU 100 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1wdz n LEU 101 N -2.08 0.38 0.39 -4.62 7.94 -1.16 -4.63 117.00 113.23 1wdz n LEU 101 Ca -0.06 0.06 -0.19 0.00 -1.11 0.00 0.00 56.01 54.71 1wdz n LEU 101 Cb 0.47 -0.34 -0.10 0.00 0.53 0.00 0.00 43.42 43.97 1wdz n LEU 101 CO 0.30 -0.50 0.55 -0.07 -1.11 0.00 0.00 177.39 176.56 1wdz h LEU 102 N -0.13 -1.22 -0.72 -1.96 3.38 -1.21 -1.33 115.31 112.12 1wdz h LEU 102 Ca 0.00 0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.08 1wdz h LEU 102 Cb 0.13 0.37 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 1wdz h LEU 102 CO 0.00 -0.71 0.44 0.74 0.09 0.00 0.00 178.44 179.00 1wdz h THR 103 N -1.12 1.08 0.54 0.22 2.02 -1.06 -1.14 112.91 113.44 1wdz h THR 103 Ca -0.09 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 1wdz h THR 103 Cb 0.92 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 1wdz h THR 103 CO 0.07 0.16 -0.38 1.56 0.37 0.00 0.00 175.52 177.29 1wdz h GLN 104 N 0.86 -0.86 -0.91 6.66 1.08 -1.75 -2.23 115.11 117.96 1wdz h GLN 104 Ca 0.29 0.06 0.10 0.00 -1.45 0.00 0.00 58.65 57.65 1wdz h GLN 104 Cb 0.04 0.20 -0.08 0.00 -0.05 0.00 0.00 27.48 27.59 1wdz h GLN 104 CO -0.12 -0.57 0.55 -0.07 -0.95 0.00 0.00 178.83 177.66 1wdz h LEU 105 N -0.89 0.80 0.09 1.46 3.38 -1.03 -0.95 115.31 118.16 1wdz h LEU 105 Ca -0.06 0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1wdz h LEU 105 Cb 0.75 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 1wdz h LEU 105 CO 0.03 0.45 -0.26 -0.33 0.09 0.00 0.00 178.44 178.42 1wdz h GLU 106 N 0.90 -0.43 -0.99 1.13 5.08 -1.02 -1.35 114.58 117.90 1wdz h GLU 106 Ca 0.44 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.88 1wdz h GLU 106 Cb 0.39 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.68 1wdz h GLU 106 CO -0.25 -0.29 0.64 1.96 -1.00 0.00 0.00 179.01 180.08 1wdz h GLN 107 N -0.45 1.17 0.00 2.33 4.20 -0.72 -1.34 115.11 120.29 1wdz h GLN 107 Ca 0.04 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1wdz h GLN 107 Cb 0.49 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1wdz h GLN 107 CO -0.17 0.77 0.00 1.63 -0.67 0.00 0.00 178.83 180.39 1wdz n LYS 108 N -4.49 0.08 -0.05 1.46 5.02 -0.44 -4.02 118.16 115.73 1wdz n LYS 108 Ca 0.14 0.07 -0.02 0.00 -2.02 0.00 0.00 58.31 56.48 1wdz n LYS 108 Cb 0.14 -1.59 -0.10 0.00 -0.02 0.00 0.00 35.03 33.46 1wdz n LYS 108 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1wdz n VAL 109 N -1.72 0.61 -0.33 -0.18 3.14 -0.53 -4.36 118.33 114.95 1wdz n VAL 109 Ca 0.06 -0.47 0.16 0.00 -2.96 0.00 0.00 64.34 61.14 1wdz n VAL 109 Cb 0.36 -0.42 0.36 0.00 -1.06 0.00 0.00 33.84 33.09 1wdz n VAL 109 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 1wdz h GLU 110 N 0.00 0.53 0.00 1.45 4.81 -1.40 -2.70 114.58 117.27 1wdz h GLU 110 Ca -0.24 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1wdz h GLU 110 Cb 1.44 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1wdz h GLU 110 CO 0.01 0.35 0.00 1.28 -0.73 0.00 0.00 179.01 179.92 1wdz n LEU 111 N -4.92 1.57 -0.37 1.64 4.77 -1.26 -4.78 117.00 113.65 1wdz n LEU 111 Ca 0.25 -1.57 -0.00 0.00 -0.03 0.00 0.00 56.01 54.66 1wdz n LEU 111 Cb 0.71 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.93 1wdz n LEU 111 CO 0.16 0.39 1.28 -0.78 -1.33 0.00 0.00 177.39 177.11 1wdz h ASP 112 N 0.00 1.09 -0.74 -1.43 3.58 -1.68 -2.27 116.42 114.98 1wdz h ASP 112 Ca 0.00 -0.01 -0.05 0.00 0.42 0.00 0.00 57.03 57.38 1wdz h ASP 112 Cb 0.33 -0.25 -0.03 0.00 1.72 0.00 0.00 39.33 41.09 1wdz h ASP 112 CO 0.00 0.76 0.26 0.28 -2.88 0.00 0.00 179.24 177.65 1wdz h SER 113 N 1.27 1.05 -0.54 2.28 0.02 -1.87 -1.75 113.55 114.02 1wdz h SER 113 Ca 0.39 -0.19 0.04 0.00 -0.84 0.00 0.00 61.79 61.18 1wdz h SER 113 Cb -0.03 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.20 1wdz h SER 113 CO -0.12 0.96 0.30 -0.09 -1.14 0.00 0.00 176.83 176.75 1wdz h ARG 114 N 1.08 0.57 -0.21 3.45 2.43 -1.78 0.78 114.38 120.70 1wdz h ARG 114 Ca 0.24 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.20 1wdz h ARG 114 Cb 0.27 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1wdz h ARG 114 CO -0.01 0.38 -0.57 1.88 -1.51 0.00 0.00 179.97 180.13 1wdz h TYR 115 N 0.59 0.85 -0.69 2.20 -1.99 -1.26 -2.44 116.97 114.22 1wdz h TYR 115 Ca 0.23 -0.31 -0.04 0.00 2.00 0.00 0.00 58.73 60.61 1wdz h TYR 115 Cb 0.08 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 38.62 1wdz h TYR 115 CO -0.08 1.08 0.28 -0.07 -0.00 0.00 0.00 178.16 179.37 1wdz h LEU 116 N 0.51 0.92 0.15 3.88 3.38 -0.99 0.28 115.31 123.43 1wdz h LEU 116 Ca 0.00 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1wdz h LEU 116 Cb 1.15 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1wdz h LEU 116 CO 0.11 0.81 -0.21 -1.28 0.09 0.00 0.00 178.44 177.96 1wdz h SER 117 N 0.99 -0.59 -0.77 -0.43 0.87 -0.60 0.31 113.55 113.33 1wdz h SER 117 Ca 0.23 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.83 1wdz h SER 117 Cb 0.18 0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.32 1wdz h SER 117 CO -0.02 -0.31 0.36 0.00 -0.53 0.00 0.00 176.83 176.33 1wdz h ALA 118 N 0.34 1.00 -0.88 6.23 0.00 -1.05 -0.15 119.26 124.75 1wdz h ALA 118 Ca 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1wdz h ALA 118 Cb 0.43 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1wdz h ALA 118 CO -0.10 0.58 0.53 0.00 0.00 0.00 0.00 179.25 180.26 1wdz h ALA 119 N 1.18 1.12 -0.05 0.00 0.00 0.09 0.52 119.26 122.12 1wdz h ALA 119 Ca 0.26 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1wdz h ALA 119 Cb 0.14 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1wdz h ALA 119 CO -0.03 0.58 -0.04 1.25 0.00 0.00 0.00 179.25 181.02 1wdz h LEU 120 N 1.21 0.12 -0.57 0.00 5.85 -0.02 -2.26 115.31 119.64 1wdz h LEU 120 Ca 0.32 -0.45 0.08 0.00 0.84 0.00 0.00 57.88 58.67 1wdz h LEU 120 Cb -0.05 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 40.89 1wdz h LEU 120 CO -0.06 0.54 0.22 0.50 -0.34 0.00 0.00 178.44 179.30 1wdz h LYS 121 N -0.30 0.40 -0.77 1.25 3.64 -0.77 -0.70 116.57 119.32 1wdz h LYS 121 Ca 0.01 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 1wdz h LYS 121 Cb 0.50 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 1wdz h LYS 121 CO 0.01 0.26 0.49 -0.22 -2.27 0.00 0.00 179.45 177.72 1wdz h LYS 122 N 0.41 0.94 0.16 1.90 3.64 -0.88 -0.76 116.57 121.98 1wdz h LYS 122 Ca 0.28 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1wdz h LYS 122 Cb 0.32 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 1wdz h LYS 122 CO -0.28 0.62 -0.08 -0.92 -2.27 0.00 0.00 179.45 176.53 1wdz h TYR 123 N 0.97 -0.20 -0.97 1.91 3.20 -0.60 -2.56 116.97 118.73 1wdz h TYR 123 Ca 0.30 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.17 1wdz h TYR 123 Cb -0.01 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.27 1wdz h TYR 123 CO -0.03 -0.11 0.63 1.96 -1.64 0.00 0.00 178.16 178.97 1wdz h GLN 124 N -0.23 1.29 -0.03 1.82 4.20 -0.95 -0.61 115.11 120.60 1wdz h GLN 124 Ca -0.02 -0.09 0.01 0.00 0.06 0.00 0.00 58.65 58.61 1wdz h GLN 124 Cb 0.18 -0.29 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1wdz h GLN 124 CO 0.04 0.86 -0.04 1.15 -0.67 0.00 0.00 178.83 180.17 1wdz h THR 125 N 1.32 0.90 0.00 -0.54 2.02 -0.96 1.07 112.91 116.71 1wdz h THR 125 Ca 0.35 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.44 1wdz h THR 125 Cb -0.13 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1wdz h THR 125 CO -0.07 0.00 -0.46 -0.33 0.37 0.00 0.00 175.52 175.03 1wdz h GLU 126 N -0.05 0.00 -0.36 6.66 5.08 -1.33 -0.29 114.58 124.29 1wdz h GLU 126 Ca 0.03 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.28 1wdz h GLU 126 Cb 0.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1wdz h GLU 126 CO -0.06 0.46 -0.20 0.37 -1.00 0.00 0.00 179.01 178.58 1wdz h GLN 127 N 0.00 0.77 -0.06 2.33 5.75 -0.21 -1.70 115.11 121.98 1wdz h GLN 127 Ca -0.00 -0.35 -0.10 0.00 -0.15 0.00 0.00 58.65 58.05 1wdz h GLN 127 Cb 0.95 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.47 1wdz h GLN 127 CO 0.06 0.97 -0.41 -0.09 -2.65 0.00 0.00 178.83 176.70 1wdz h ARG 128 N 0.55 0.14 0.03 1.69 2.43 0.14 -2.86 114.38 116.50 1wdz h ARG 128 Ca 0.08 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1wdz h ARG 128 Cb 0.75 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1wdz h ARG 128 CO 0.06 0.54 -0.01 1.03 -1.51 0.00 0.00 179.97 180.07 1wdz h SER 129 N 0.12 -0.03 0.78 -3.80 0.87 -0.66 -1.03 113.55 109.80 1wdz h SER 129 Ca 0.01 -0.37 -0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1wdz h SER 129 Cb 0.79 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.75 1wdz h SER 129 CO 0.06 0.36 -0.00 0.11 -0.53 0.00 0.00 176.83 176.83 1wdz h LYS 130 N -0.42 0.00 0.00 2.24 1.57 -1.35 -1.27 116.57 117.35 1wdz h LYS 130 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wdz h LYS 130 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1wdz h LYS 130 CO 0.01 0.00 -0.00 0.78 -0.57 0.00 0.00 179.45 179.67 1wdz h GLY 131 N 1.56 -0.00 2.00 3.86 0.00 -1.38 -2.78 103.07 106.33 1wdz h GLY 131 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1wdz h GLY 131 CO 0.00 -0.00 -0.10 -0.55 0.00 0.00 0.00 176.54 175.89 1wdz h ASP 132 N -0.92 0.00 0.73 0.19 3.32 -0.92 -1.04 116.42 117.79 1wdz h ASP 132 Ca -0.00 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 1wdz h ASP 132 Cb 0.91 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.44 1wdz h ASP 132 CO 0.00 0.10 -0.80 0.00 -1.72 0.00 0.00 179.24 176.82 1wdz h ALA 133 N 1.90 0.67 0.01 3.45 0.00 -1.30 -2.39 119.26 121.60 1wdz h ALA 133 Ca -0.00 -0.71 -0.08 0.00 0.00 0.00 0.00 54.91 54.12 1wdz h ALA 133 Cb 0.19 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1wdz h ALA 133 CO 0.01 0.96 -0.30 1.25 0.00 0.00 0.00 179.25 181.17 1wdz h LEU 134 N 0.03 0.24 0.27 0.00 5.85 -1.09 -2.68 115.31 117.94 1wdz h LEU 134 Ca -0.02 -0.82 0.01 0.00 0.84 0.00 0.00 57.88 57.89 1wdz h LEU 134 Cb 1.41 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 1wdz h LEU 134 CO 0.11 1.03 -0.38 0.44 -0.34 0.00 0.00 178.44 179.30 1wdz h ASP 135 N -0.52 -1.07 -0.59 1.25 3.32 -1.26 0.22 116.42 117.77 1wdz h ASP 135 Ca -0.04 0.10 0.12 0.00 0.02 0.00 0.00 57.03 57.24 1wdz h ASP 135 Cb 1.09 0.38 -0.03 0.00 0.22 0.00 0.00 39.33 40.99 1wdz h ASP 135 CO 0.06 -0.50 0.40 0.11 -1.72 0.00 0.00 179.24 177.59 1wdz h LYS 136 N -0.71 0.26 -0.01 3.56 6.56 -1.55 0.64 116.57 125.31 1wdz h LYS 136 Ca -0.01 -0.02 -0.14 0.00 -1.06 0.00 0.00 60.65 59.43 1wdz h LYS 136 Cb 0.68 -0.06 -0.02 0.00 -0.57 0.00 0.00 32.23 32.26 1wdz h LYS 136 CO -0.13 0.17 -0.63 0.00 -2.06 0.00 0.00 179.45 176.79 1wdz h GLN 138 N 0.03 0.21 0.00 0.00 4.20 0.27 -2.98 115.11 116.83 1wdz h GLN 138 Ca -0.01 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.35 1wdz h GLN 138 Cb 1.13 0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.04 1wdz h GLN 138 CO 0.09 1.09 0.00 0.00 -0.67 0.00 0.00 178.83 179.34 1wdz n ALA 139 N -2.58 1.97 -0.07 3.87 0.00 0.19 -2.02 120.51 121.87 1wdz n ALA 139 Ca -0.12 -0.05 -0.14 0.00 0.00 0.00 0.00 53.44 53.13 1wdz n ALA 139 Cb 1.02 -1.13 -0.05 0.00 0.00 0.00 0.00 19.45 19.30 1wdz n ALA 139 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1wdz n GLU 140 N -0.79 0.29 0.11 0.00 1.02 -1.19 -3.81 120.64 116.27 1wdz n GLU 140 Ca 0.06 0.13 0.06 0.00 -0.02 0.00 0.00 57.16 57.39 1wdz n GLU 140 Cb 0.03 -0.99 0.35 0.00 -0.02 0.00 0.00 31.44 30.80 1wdz n GLU 140 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1wdz n LEU 141 N -3.59 0.33 -0.03 -4.62 7.94 -0.93 -0.03 117.00 116.07 1wdz n LEU 141 Ca -0.27 0.60 -0.21 0.00 -1.11 0.00 0.00 56.01 55.02 1wdz n LEU 141 Cb 0.69 -0.61 -0.13 0.00 0.53 0.00 0.00 43.42 43.89 1wdz n LEU 141 CO 0.02 -0.71 -0.87 1.17 -1.11 0.00 0.00 177.39 175.89 1wdz n LYS 142 N -1.95 0.72 0.24 1.96 4.81 -0.86 -2.73 118.16 120.37 1wdz n LYS 142 Ca -0.01 0.28 0.11 0.00 -0.87 0.00 0.00 58.31 57.82 1wdz n LYS 142 Cb 0.13 -1.68 0.61 0.00 0.02 0.00 0.00 35.03 34.11 1wdz n LYS 142 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 1wdz h LYS 143 N -0.07 0.00 0.00 1.64 2.10 -0.55 -2.36 116.57 117.33 1wdz h LYS 143 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 1wdz h LYS 143 Cb 1.93 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.26 1wdz h LYS 143 CO 0.02 0.18 -0.11 1.25 -2.00 0.00 0.00 179.45 178.79 1wdz h LEU 144 N 0.00 0.00 -1.18 7.07 5.85 -1.19 -3.06 115.31 122.80 1wdz h LEU 144 Ca -0.00 0.00 0.28 0.00 0.84 0.00 0.00 57.88 59.00 1wdz h LEU 144 Cb 0.49 0.00 -0.12 0.00 0.37 0.00 0.00 40.66 41.40 1wdz h LEU 144 CO 0.02 0.53 0.64 0.03 -0.34 0.00 0.00 178.44 179.33 1wdz h ARG 145 N -0.96 0.42 -0.00 1.25 3.08 -1.54 0.67 114.38 117.30 1wdz h ARG 145 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1wdz h ARG 145 Cb 0.11 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1wdz h ARG 145 CO 0.00 0.28 -0.18 1.63 -1.07 0.00 0.00 179.97 180.63 1wdz n LYS 146 N -4.78 0.04 -0.05 0.04 5.02 -0.89 -3.63 118.16 113.91 1wdz n LYS 146 Ca 0.28 -0.01 -0.02 0.00 -2.02 0.00 0.00 58.31 56.54 1wdz n LYS 146 Cb 0.88 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 34.25 1wdz n LYS 146 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1wdz n LYS 147 N -1.47 0.67 0.00 1.97 3.00 0.21 -4.18 118.16 118.35 1wdz n LYS 147 Ca 0.07 -0.01 0.04 0.00 -0.00 0.00 0.00 58.31 58.41 1wdz n LYS 147 Cb 0.33 -1.58 0.23 0.00 0.00 0.00 0.00 35.03 34.01 1wdz n LYS 147 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1wdz n SER 148 N -2.65 0.00 -1.88 3.14 2.88 0.13 -5.08 113.62 110.16 1wdz n SER 148 Ca -0.20 -0.81 0.00 0.00 -1.33 0.00 0.00 58.87 56.53 1wdz n SER 148 Cb 0.93 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.39 1wdz n SER 148 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wdz n GLN 149 N -0.73 0.02 0.00 -1.46 1.13 -1.26 -5.10 117.38 109.98 1wdz n GLN 149 Ca 0.06 0.00 0.03 0.00 -1.94 0.00 0.00 57.00 55.15 1wdz n GLN 149 Cb 0.03 -1.49 0.18 0.00 0.11 0.00 0.00 30.24 29.06 1wdz n GLN 149 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1wdz n ASP 159 N 1.88 0.00 0.24 1.08 10.43 -1.26 -5.19 116.55 123.73 1wdz n ASP 159 Ca 0.00 -0.46 0.14 0.00 2.57 0.00 0.00 54.79 57.04 1wdz n ASP 159 Cb 0.01 0.00 0.42 0.00 1.84 0.00 0.00 41.12 43.39 1wdz n ASP 159 CO 0.00 0.00 0.00 0.50 -1.07 0.00 0.00 177.20 176.63 1wdz h LYS 160 N 0.00 0.00 0.03 -1.24 1.63 -2.05 -2.86 116.57 112.07 1wdz h LYS 160 Ca 0.00 0.00 -0.26 0.00 -0.85 0.00 0.00 60.65 59.54 1wdz h LYS 160 Cb 0.00 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 31.65 1wdz h LYS 160 CO 0.00 0.04 -1.05 1.49 -3.45 0.00 0.00 179.45 176.48 1wdz h GLU 161 N 0.00 0.66 0.00 1.90 4.81 -2.01 -3.12 114.58 116.82 1wdz h GLU 161 Ca -0.00 -0.75 -0.01 0.00 -0.13 0.00 0.00 59.36 58.47 1wdz h GLU 161 Cb 0.77 0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.37 1wdz h GLU 161 CO 0.01 1.32 -0.04 -0.07 -0.73 0.00 0.00 179.01 179.50 1wdz h LEU 162 N 0.31 0.00 -0.97 1.64 3.38 -1.95 -1.23 115.31 116.49 1wdz h LEU 162 Ca -0.14 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 1wdz h LEU 162 Cb 1.72 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.45 1wdz h LEU 162 CO 0.21 0.04 -0.50 -0.61 0.09 0.00 0.00 178.44 177.67 1wdz h GLN 163 N 0.00 0.00 0.00 1.13 4.15 -1.46 -3.12 115.11 115.81 1wdz h GLN 163 Ca -0.00 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.25 1wdz h GLN 163 Cb 0.12 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 1wdz h GLN 163 CO 0.01 0.50 -1.03 1.88 -1.93 0.00 0.00 178.83 178.26 1wdz h TYR 164 N 0.00 0.00 -0.68 3.99 -1.99 -1.32 -3.00 116.97 113.97 1wdz h TYR 164 Ca -0.01 0.00 0.20 0.00 2.00 0.00 0.00 58.73 60.92 1wdz h TYR 164 Cb 0.91 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.62 1wdz h TYR 164 CO 0.00 1.09 0.59 0.82 -0.00 0.00 0.00 178.16 180.66 1wdz h ILE 165 N -1.00 0.43 0.00 -2.88 2.04 -1.52 1.37 117.51 115.95 1wdz h ILE 165 Ca -0.25 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.61 1wdz h ILE 165 Cb 1.08 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 1wdz h ILE 165 CO -0.15 0.00 -1.07 -0.67 0.00 0.00 0.00 178.15 176.25 1wdz n ASP 166 N -3.95 0.60 -0.01 1.72 -0.08 -1.18 -3.14 116.55 110.52 1wdz n ASP 166 Ca 0.14 -0.09 -0.07 0.00 -1.51 0.00 0.00 54.79 53.26 1wdz n ASP 166 Cb 0.84 0.79 -0.13 0.00 2.34 0.00 0.00 41.12 44.97 1wdz n ASP 166 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wdz h ALA 167 N 2.41 0.74 0.25 -1.67 0.00 0.14 -3.23 119.26 117.90 1wdz h ALA 167 Ca 0.00 -1.35 -0.01 0.00 0.00 0.00 0.00 54.91 53.55 1wdz h ALA 167 Cb 0.79 0.42 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1wdz h ALA 167 CO 0.00 1.48 -0.12 0.82 0.00 0.00 0.00 179.25 181.43 1wdz h ILE 168 N 0.00 0.78 -0.38 0.00 1.08 0.11 -2.72 117.51 116.38 1wdz h ILE 168 Ca -0.25 -0.75 0.11 0.00 -0.39 0.00 0.00 64.86 63.58 1wdz h ILE 168 Cb 1.94 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 36.84 1wdz h ILE 168 CO 0.08 0.15 0.31 0.28 -0.69 0.00 0.00 178.15 178.27 1wdz h SER 169 N -0.75 0.00 0.09 1.72 0.02 -1.69 0.23 113.55 113.17 1wdz h SER 169 Ca -0.03 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.68 1wdz h SER 169 Cb 0.50 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.05 1wdz h SER 169 CO 0.06 0.00 -0.92 0.78 -1.14 0.00 0.00 176.83 175.61 1wdz h ASN 170 N 0.00 0.76 0.58 3.07 -0.26 -1.55 -2.24 115.58 115.94 1wdz h ASN 170 Ca 0.18 -0.57 -0.17 0.00 -0.56 0.00 0.00 56.30 55.18 1wdz h ASN 170 Cb 0.79 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 37.80 1wdz h ASN 170 CO -0.00 1.37 -0.74 0.11 -1.06 0.00 0.00 177.43 177.10 1wdz h LYS 171 N 0.37 0.13 -0.25 0.81 1.57 -0.74 -0.40 116.57 118.06 1wdz h LYS 171 Ca -0.09 -0.12 -0.09 0.00 -1.87 0.00 0.00 60.65 58.49 1wdz h LYS 171 Cb 1.55 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.88 1wdz h LYS 171 CO 0.17 0.81 -0.23 0.37 -0.57 0.00 0.00 179.45 180.01 1wdz h GLN 172 N 0.08 0.47 0.00 3.15 5.75 -0.61 -1.77 115.11 122.19 1wdz h GLN 172 Ca -0.02 -0.17 -0.08 0.00 -0.15 0.00 0.00 58.65 58.23 1wdz h GLN 172 Cb 1.31 -0.03 0.01 0.00 1.07 0.00 0.00 27.48 29.83 1wdz h GLN 172 CO 0.11 0.68 -0.32 0.78 -2.65 0.00 0.00 178.83 177.43 1wdz h GLY 173 N 1.00 0.24 2.00 2.39 0.00 -1.12 -1.97 103.07 105.61 1wdz h GLY 173 Ca 0.06 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1wdz h GLY 173 CO 0.05 0.37 0.00 0.83 0.00 0.00 0.00 176.54 177.79 1wdz h GLU 174 N -0.44 0.00 0.00 4.80 5.08 -1.00 -1.87 114.58 121.16 1wdz h GLU 174 Ca -0.04 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.04 1wdz h GLU 174 Cb 1.07 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.28 1wdz h GLU 174 CO 0.06 0.00 -1.56 -0.11 -1.00 0.00 0.00 179.01 176.40 1wdz n LEU 175 N -2.55 1.88 0.05 1.33 0.00 -0.67 -3.60 117.00 113.44 1wdz n LEU 175 Ca -0.01 0.41 0.20 0.00 0.00 0.00 0.00 56.01 56.61 1wdz n LEU 175 Cb 0.12 -0.92 0.72 0.00 0.00 0.00 0.00 43.42 43.34 1wdz n LEU 175 CO 0.16 0.31 1.18 -0.33 0.00 0.00 0.00 177.39 178.71 1wdz h GLU 176 N -1.00 0.00 -0.65 1.96 5.08 -1.14 0.18 114.58 119.02 1wdz h GLU 176 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1wdz h GLU 176 Cb 1.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1wdz h GLU 176 CO -0.26 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 177.84 1wdz n ASN 177 N -4.16 3.71 -0.12 1.42 3.02 -0.72 -2.94 115.26 115.47 1wdz n ASN 177 Ca 0.08 -2.00 -0.16 0.00 -0.03 0.00 0.00 54.58 52.47 1wdz n ASN 177 Cb 0.57 -0.43 -0.13 0.00 -0.61 0.00 0.00 39.78 39.19 1wdz n ASN 177 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1wdz n TYR 178 N 1.55 0.04 0.29 3.10 9.36 0.57 -3.75 117.16 128.31 1wdz n TYR 178 Ca 0.23 0.01 -0.12 0.00 3.32 0.00 0.00 57.90 61.34 1wdz n TYR 178 Cb 0.60 -1.01 -0.06 0.00 -0.63 0.00 0.00 39.34 38.24 1wdz n TYR 178 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 1wdz h VAL 179 N 0.00 0.00 -1.06 2.97 2.07 -1.51 -0.55 116.25 118.17 1wdz h VAL 179 Ca -0.57 -0.40 0.30 0.00 0.82 0.00 0.00 66.70 66.85 1wdz h VAL 179 Cb 1.98 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 31.63 1wdz h VAL 179 CO -0.06 0.00 0.65 0.77 0.02 0.00 0.00 177.57 178.95 1wdz h SER 180 N -1.18 0.50 -0.40 0.57 4.64 -1.76 0.40 113.55 116.32 1wdz h SER 180 Ca -0.08 0.13 -0.08 0.00 -0.47 0.00 0.00 61.79 61.29 1wdz h SER 180 Cb 0.60 0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.74 1wdz h SER 180 CO 0.13 -0.00 -0.08 -0.78 -0.87 0.00 0.00 176.83 175.23 1wdz h ASP 181 N 0.39 0.76 -0.35 4.97 -0.00 -1.62 -2.50 116.42 118.07 1wdz h ASP 181 Ca 0.68 -0.35 -0.02 0.00 -0.00 0.00 0.00 57.03 57.33 1wdz h ASP 181 Cb 1.62 -0.21 -0.02 0.00 -0.00 0.00 0.00 39.33 40.73 1wdz h ASP 181 CO -0.44 0.93 0.14 1.23 -0.00 0.00 0.00 179.24 181.10 1wdz h GLY 182 N 0.57 0.55 0.76 -0.78 0.00 0.14 -2.64 103.07 101.67 1wdz h GLY 182 Ca 0.10 -0.30 0.05 0.00 0.00 0.00 0.00 47.33 47.19 1wdz h GLY 182 CO 0.04 0.28 0.50 -1.82 0.00 0.00 0.00 176.54 175.53 1wdz h TYR 183 N 0.41 0.92 0.37 5.60 3.20 -1.13 0.30 116.97 126.65 1wdz h TYR 183 Ca 0.12 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1wdz h TYR 183 Cb 0.18 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 1wdz h TYR 183 CO -0.00 0.48 -0.27 -0.22 -1.64 0.00 0.00 178.16 176.50 1wdz h LYS 184 N 0.92 -0.62 -0.22 1.82 3.64 -1.26 -1.12 116.57 119.74 1wdz h LYS 184 Ca 0.34 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.82 1wdz h LYS 184 Cb 0.13 0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.04 1wdz h LYS 184 CO -0.16 -0.41 -0.13 1.15 -2.27 0.00 0.00 179.45 177.63 1wdz h THR 185 N -0.64 0.62 -0.48 1.00 2.02 -1.08 -1.73 112.91 112.62 1wdz h THR 185 Ca -0.03 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.23 1wdz h THR 185 Cb 0.55 0.62 -0.10 0.00 -1.74 0.00 0.00 68.15 67.48 1wdz h THR 185 CO 0.00 0.00 -0.36 0.00 0.37 0.00 0.00 175.52 175.53 1wdz h ALA 186 N 1.06 -0.21 -0.62 6.16 0.00 -0.10 0.96 119.26 126.51 1wdz h ALA 186 Ca 0.12 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1wdz h ALA 186 Cb 0.30 0.80 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 1wdz h ALA 186 CO -0.29 -0.75 0.37 -0.07 0.00 0.00 0.00 179.25 178.51 1wdz h LEU 187 N -0.24 0.73 -0.32 0.00 3.38 -0.79 -0.67 115.31 117.40 1wdz h LEU 187 Ca 0.18 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.13 1wdz h LEU 187 Cb 0.56 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1wdz h LEU 187 CO -0.60 0.56 0.19 0.74 0.09 0.00 0.00 178.44 179.41 1wdz h THR 188 N 0.85 1.03 -0.96 0.22 2.02 -0.05 0.12 112.91 116.15 1wdz h THR 188 Ca 0.22 -0.13 0.14 0.00 0.77 0.00 0.00 66.41 67.41 1wdz h THR 188 Cb -0.04 0.62 -0.09 0.00 -1.74 0.00 0.00 68.15 66.90 1wdz h THR 188 CO -0.04 0.07 0.57 -0.08 0.37 0.00 0.00 175.52 176.41 1wdz h GLU 189 N 0.38 0.82 -0.00 6.66 4.57 0.48 0.28 114.58 127.78 1wdz h GLU 189 Ca 0.13 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.15 1wdz h GLU 189 Cb 0.00 -0.19 0.01 0.00 -0.16 0.00 0.00 28.75 28.42 1wdz h GLU 189 CO -0.06 0.54 -0.43 1.49 -1.18 0.00 0.00 179.01 179.37 1wdz h GLU 190 N 0.85 0.29 -0.45 1.92 4.81 -0.46 -3.23 114.58 118.30 1wdz h GLU 190 Ca 0.50 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 59.39 1wdz h GLU 190 Cb 0.61 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 1wdz h GLU 190 CO -0.31 1.02 0.17 -0.09 -0.73 0.00 0.00 179.01 179.07 1wdz h ARG 191 N -0.30 0.68 -0.85 1.92 1.12 -0.31 -3.07 114.38 113.57 1wdz h ARG 191 Ca -0.05 -0.13 0.07 0.00 -1.11 0.00 0.00 59.98 58.76 1wdz h ARG 191 Cb 1.17 -0.11 -0.06 0.00 -0.01 0.00 0.00 29.97 30.96 1wdz h ARG 191 CO 0.08 0.63 0.55 0.00 -3.11 0.00 0.00 179.97 178.13 1wdz h ARG 192 N 0.59 0.90 -0.37 0.20 3.08 -0.56 -1.02 114.38 117.20 1wdz h ARG 192 Ca 0.15 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 60.00 1wdz h ARG 192 Cb 0.21 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1wdz h ARG 192 CO -0.01 0.60 -0.36 0.00 -1.07 0.00 0.00 179.97 179.13 1wdz h ARG 193 N 0.93 0.86 0.16 0.04 3.08 -1.55 -1.37 114.38 116.52 1wdz h ARG 193 Ca 0.37 -0.43 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1wdz h ARG 193 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1wdz h ARG 193 CO -0.14 1.07 -0.07 0.74 -1.07 0.00 0.00 179.97 180.50 1wdz h PHE 194 N 0.71 -0.19 -0.66 3.04 -1.00 -1.42 -2.97 116.94 114.45 1wdz h PHE 194 Ca 0.07 -0.00 0.06 0.00 2.81 0.00 0.00 57.97 60.90 1wdz h PHE 194 Cb 0.93 0.06 -0.09 0.00 3.61 0.00 0.00 35.95 40.46 1wdz h PHE 194 CO 0.05 0.22 -0.47 0.00 -1.61 0.00 0.00 178.31 176.51 1wdz h PHE 196 N -0.10 0.12 0.47 0.00 3.57 -1.31 0.17 116.94 119.87 1wdz h PHE 196 Ca 0.11 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1wdz h PHE 196 Cb 0.37 0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 1wdz h PHE 196 CO -0.92 -0.26 -0.27 1.25 -2.23 0.00 0.00 178.31 175.88 1wdz h LEU 197 N 0.13 -0.67 0.01 0.59 5.85 -0.54 -2.54 115.31 118.15 1wdz h LEU 197 Ca 0.51 0.04 0.03 0.00 0.84 0.00 0.00 57.88 59.29 1wdz h LEU 197 Cb 0.98 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.16 1wdz h LEU 197 CO -0.71 -0.44 -0.27 0.58 -0.34 0.00 0.00 178.44 177.27 1wdz h VAL 198 N -0.70 0.40 -0.23 1.05 2.07 0.99 -1.63 116.25 118.19 1wdz h VAL 198 Ca -0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.49 1wdz h VAL 198 Cb 0.56 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.69 1wdz h VAL 198 CO 0.07 0.00 -0.24 -0.33 0.02 0.00 0.00 177.57 177.09 1wdz h GLU 199 N -0.42 -0.13 -0.98 1.57 5.08 -0.74 0.20 114.58 119.17 1wdz h GLU 199 Ca 0.06 0.01 0.19 0.00 -1.00 0.00 0.00 59.36 58.62 1wdz h GLU 199 Cb 0.50 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.68 1wdz h GLU 199 CO -0.23 -0.09 0.61 0.87 -1.00 0.00 0.00 179.01 179.18 1wdz h LYS 200 N -0.13 0.65 -0.37 2.33 1.79 -1.35 0.45 116.57 119.95 1wdz h LYS 200 Ca 0.04 -0.04 0.02 0.00 -2.18 0.00 0.00 60.65 58.49 1wdz h LYS 200 Cb 0.24 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 30.71 1wdz h LYS 200 CO -0.29 0.43 0.20 0.37 -1.08 0.00 0.00 179.45 179.08 1wdz h GLN 201 N 0.67 0.39 -0.35 3.15 5.75 -0.04 -0.96 115.11 123.73 1wdz h GLN 201 Ca 0.54 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 59.03 1wdz h GLN 201 Cb 0.95 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.40 1wdz h GLN 201 CO -0.30 0.26 0.21 0.00 -2.65 0.00 0.00 178.83 176.35 1wdz h ALA 203 N 1.15 1.83 0.10 0.00 0.00 0.22 0.32 119.26 122.88 1wdz h ALA 203 Ca 0.14 0.02 -0.30 0.00 0.00 0.00 0.00 54.91 54.76 1wdz h ALA 203 Cb -0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1wdz h ALA 203 CO -0.05 -0.08 -1.57 0.28 0.00 0.00 0.00 179.25 177.83 1wdz h VAL 204 N 0.69 1.09 0.00 0.00 2.07 -0.58 -3.09 116.25 116.43 1wdz h VAL 204 Ca 0.46 -2.78 -0.02 0.00 0.82 0.00 0.00 66.70 65.18 1wdz h VAL 204 Cb 0.75 2.69 -0.00 0.00 -1.52 0.00 0.00 31.29 33.21 1wdz h VAL 204 CO -0.22 0.79 -0.11 0.00 0.02 0.00 0.00 177.57 178.06 1wdz h ALA 205 N 0.55 1.55 -0.03 1.67 0.00 0.56 0.31 119.26 123.87 1wdz h ALA 205 Ca -0.25 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.36 1wdz h ALA 205 Cb 2.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.77 1wdz h ALA 205 CO 0.14 0.13 -0.83 -0.22 0.00 0.00 0.00 179.25 178.47 1wdz h LYS 206 N 0.00 0.37 0.00 0.00 3.64 -0.46 -1.76 116.57 118.36 1wdz h LYS 206 Ca -0.00 -0.35 -0.15 0.00 -1.27 0.00 0.00 60.65 58.88 1wdz h LYS 206 Cb 0.23 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1wdz h LYS 206 CO 0.01 1.02 -0.71 -0.97 -2.27 0.00 0.00 179.45 176.53 1wdz h ASN 207 N 0.23 0.00 -0.03 4.20 -1.24 -1.03 -3.03 115.58 114.68 1wdz h ASN 207 Ca -0.05 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.96 1wdz h ASN 207 Cb 1.44 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.49 1wdz h ASN 207 CO 0.14 0.71 0.01 -1.28 -1.29 0.00 0.00 177.43 175.72 1wdz h SER 208 N 0.00 0.04 -0.63 1.15 0.87 -0.29 -2.91 113.55 111.78 1wdz h SER 208 Ca -0.01 -0.21 0.12 0.00 -1.23 0.00 0.00 61.79 60.46 1wdz h SER 208 Cb 1.39 -0.01 -0.09 0.00 -0.44 0.00 0.00 62.40 63.25 1wdz h SER 208 CO 0.09 0.24 0.14 0.00 -0.53 0.00 0.00 176.83 176.77 1wdz h ALA 209 N 0.80 0.75 0.00 6.23 0.00 -1.23 0.39 119.26 126.21 1wdz h ALA 209 Ca 0.01 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1wdz h ALA 209 Cb 0.22 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1wdz h ALA 209 CO -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 179.25 178.94 1wdz h ALA 210 N 1.50 1.00 0.02 0.00 0.00 -1.41 -0.18 119.26 120.19 1wdz h ALA 210 Ca 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1wdz h ALA 210 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1wdz h ALA 210 CO -0.42 0.00 -0.01 -0.92 0.00 0.00 0.00 179.25 177.90 1wdz h TYR 211 N 0.00 -0.02 -0.64 0.00 3.20 -0.04 -3.08 116.97 116.37 1wdz h TYR 211 Ca 0.00 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.78 1wdz h TYR 211 Cb 0.09 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 1wdz h TYR 211 CO 0.00 0.70 0.06 0.45 -1.64 0.00 0.00 178.16 177.73 1wdz h HIS 212 N -0.95 1.18 -0.74 -3.82 3.86 -0.92 -2.42 115.15 111.33 1wdz h HIS 212 Ca -0.00 -0.18 -0.02 0.00 -1.16 0.00 0.00 60.37 59.01 1wdz h HIS 212 Cb 0.73 -0.32 -0.04 0.00 1.06 0.00 0.00 27.41 28.85 1wdz h HIS 212 CO 0.19 1.00 0.38 1.03 0.86 0.00 0.00 177.93 181.39 1wdz h SER 213 N 1.01 0.94 -0.24 2.45 0.87 -1.19 0.30 113.55 117.69 1wdz h SER 213 Ca 0.19 -0.09 -0.17 0.00 -1.23 0.00 0.00 61.79 60.49 1wdz h SER 213 Cb 0.49 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 1wdz h SER 213 CO 0.02 0.78 -0.49 0.50 -0.53 0.00 0.00 176.83 177.11 1wdz h LYS 214 N 1.04 0.82 -0.12 2.24 1.63 -1.43 0.15 116.57 120.90 1wdz h LYS 214 Ca 0.26 -0.48 -0.03 0.00 -0.85 0.00 0.00 60.65 59.54 1wdz h LYS 214 Cb 0.07 0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.74 1wdz h LYS 214 CO -0.04 1.12 -0.05 0.78 -3.45 0.00 0.00 179.45 177.81 1wdz h GLY 215 N 0.81 0.27 0.83 5.01 0.00 -0.94 0.18 103.07 109.23 1wdz h GLY 215 Ca 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1wdz h GLY 215 CO 0.11 0.22 -0.26 1.70 0.00 0.00 0.00 176.54 178.31 1wdz h LYS 216 N -0.09 -0.61 0.07 4.80 3.64 -0.43 -1.43 116.57 122.51 1wdz h LYS 216 Ca 0.03 0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1wdz h LYS 216 Cb 0.51 0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.42 1wdz h LYS 216 CO 0.02 -0.41 -0.52 1.49 -2.27 0.00 0.00 179.45 177.77 1wdz h GLU 217 N -0.63 -0.67 -0.70 1.90 4.81 -0.91 0.10 114.58 118.48 1wdz h GLU 217 Ca -0.04 0.05 0.13 0.00 -0.13 0.00 0.00 59.36 59.37 1wdz h GLU 217 Cb 0.54 0.15 -0.09 0.00 0.63 0.00 0.00 28.75 29.98 1wdz h GLU 217 CO 0.02 -0.45 0.24 -0.07 -0.73 0.00 0.00 179.01 178.02 1wdz h LEU 218 N -0.70 0.18 -0.31 1.64 3.38 -0.57 -2.14 115.31 116.79 1wdz h LEU 218 Ca 0.00 0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 1wdz h LEU 218 Cb 0.72 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1wdz h LEU 218 CO -0.31 0.07 -0.40 -0.07 0.09 0.00 0.00 178.44 177.82 1wdz h LEU 219 N 0.38 0.89 -0.56 1.67 3.38 -1.02 -2.97 115.31 117.08 1wdz h LEU 219 Ca 0.38 -0.49 0.11 0.00 0.09 0.00 0.00 57.88 57.97 1wdz h LEU 219 Cb 0.57 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 1wdz h LEU 219 CO -0.40 1.21 0.02 0.00 0.09 0.00 0.00 178.44 179.36 1wdz h ALA 220 N 0.71 0.57 0.58 1.53 0.00 -0.32 0.46 119.26 122.78 1wdz h ALA 220 Ca 0.04 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1wdz h ALA 220 Cb 1.00 0.27 0.01 0.00 0.00 0.00 0.00 17.79 19.06 1wdz h ALA 220 CO 0.10 -0.38 -0.28 0.37 0.00 0.00 0.00 179.25 179.06 1wdz h GLN 221 N 0.14 -0.74 -0.00 0.00 -0.00 -1.49 -3.35 115.11 109.66 1wdz h GLN 221 Ca 0.29 0.05 -0.22 0.00 -0.00 0.00 0.00 58.65 58.77 1wdz h GLN 221 Cb 0.45 0.17 -0.00 0.00 0.00 0.00 0.00 27.48 28.10 1wdz h GLN 221 CO -0.46 -0.46 -0.92 0.87 0.00 0.00 0.00 178.83 177.85 1wdz h LYS 222 N -0.86 0.36 -0.54 1.69 1.79 -1.28 -3.38 116.57 114.34 1wdz h LYS 222 Ca -0.08 -0.39 0.11 0.00 -2.18 0.00 0.00 60.65 58.11 1wdz h LYS 222 Cb 0.63 0.11 -0.10 0.00 -1.58 0.00 0.00 32.23 31.29 1wdz h LYS 222 CO 0.13 1.07 -0.05 1.25 -1.08 0.00 0.00 179.45 180.77 1wdz h LEU 223 N 0.21 -0.34 -1.22 2.94 5.85 -0.22 -0.54 115.31 121.98 1wdz h LEU 223 Ca -0.07 0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1wdz h LEU 223 Cb 1.55 0.27 -0.03 0.00 0.37 0.00 0.00 40.66 42.83 1wdz h LEU 223 CO 0.16 -0.13 0.31 -0.65 -0.34 0.00 0.00 178.44 177.79 1wdz h PRO 224 N 0.07 0.85 -0.39 5.25 0.11 -1.75 -0.79 132.00 135.35 1wdz h PRO 224 Ca 0.27 -0.10 -0.15 0.00 0.11 0.00 0.00 66.00 66.14 1wdz h PRO 224 Cb 0.42 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1wdz h PRO 224 CO -0.50 0.64 -0.34 -0.07 -0.21 0.00 0.00 178.00 177.52 1wdz h LEU 225 N 0.85 0.98 -0.48 2.35 3.38 -1.48 -1.33 115.31 119.58 1wdz h LEU 225 Ca 0.22 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 1wdz h LEU 225 Cb 0.06 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1wdz h LEU 225 CO -0.03 1.23 0.03 -0.50 0.09 0.00 0.00 178.44 179.25 1wdz h TRP 226 N 0.74 0.90 -0.81 1.13 6.55 -0.78 -1.09 115.95 122.59 1wdz h TRP 226 Ca 0.07 -0.15 0.02 0.00 0.95 0.00 0.00 58.89 59.78 1wdz h TRP 226 Cb 0.93 -0.24 -0.04 0.00 -0.86 0.00 0.00 29.16 28.95 1wdz h TRP 226 CO 0.06 0.85 0.53 0.37 -1.05 0.00 0.00 178.44 179.20 1wdz h GLN 227 N 0.70 1.02 -0.41 0.49 5.75 -1.08 -2.00 115.11 119.57 1wdz h GLN 227 Ca 0.14 -0.06 -0.12 0.00 -0.15 0.00 0.00 58.65 58.46 1wdz h GLN 227 Cb 0.47 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.78 1wdz h GLN 227 CO 0.02 0.67 -0.22 1.96 -2.65 0.00 0.00 178.83 178.61 1wdz h GLN 228 N 1.05 0.82 -0.09 1.69 4.20 -0.97 -1.26 115.11 120.56 1wdz h GLN 228 Ca 0.31 -0.34 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1wdz h GLN 228 Cb -0.06 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1wdz h GLN 228 CO -0.09 0.96 -0.03 0.78 -0.67 0.00 0.00 178.83 179.79 1wdz h GLY 229 N 0.95 0.13 0.21 3.46 0.00 -0.51 0.19 103.07 107.50 1wdz h GLY 229 Ca 0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1wdz h GLY 229 CO 0.06 0.06 -0.07 -2.08 0.00 0.00 0.00 176.54 174.51 1wdz h VAL 230 N 0.12 0.58 0.00 4.60 2.07 -1.06 -3.17 116.25 119.40 1wdz h VAL 230 Ca 0.03 -1.17 0.00 0.00 0.82 0.00 0.00 66.70 66.38 1wdz h VAL 230 Cb 0.13 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1wdz h VAL 230 CO 0.00 0.17 0.00 0.47 0.02 0.00 0.00 177.57 178.24 1wdz n ASP 231 N -4.88 0.00 0.00 0.57 8.00 -0.50 -5.12 116.55 114.62 1wdz n ASP 231 Ca -0.06 0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.94 1wdz n ASP 231 Cb 0.21 -0.49 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 1wdz n ASP 231 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57