#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cw2 h PRO 6 N 0.00 0.00 -6.45 1.61 0.11 -1.92 -3.46 132.00 121.89 2cw2 h PRO 6 Ca 0.00 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.58 2cw2 h PRO 6 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 2cw2 h PRO 6 CO 0.00 0.47 -0.11 -0.06 -0.21 0.00 0.00 178.00 178.09 2cw2 s PHE 7 N -3.54 3.43 0.06 0.65 0.08 -1.26 -5.10 117.98 112.30 2cw2 s PHE 7 Ca -0.00 0.86 0.03 0.00 0.12 0.00 0.00 56.93 57.94 2cw2 s PHE 7 Cb 0.11 -2.25 -0.03 0.00 -0.57 0.00 0.00 43.02 40.28 2cw2 s PHE 7 CO 0.72 0.25 -0.09 1.14 -0.10 0.00 0.00 175.22 177.14 2cw2 s GLN 8 N -2.91 0.64 -0.39 0.44 -2.07 -1.26 -4.94 119.66 109.17 2cw2 s GLN 8 Ca 0.47 -0.89 -0.14 0.00 -1.82 0.00 0.00 55.36 52.98 2cw2 s GLN 8 Cb -0.11 -0.39 0.01 0.00 -1.09 0.00 0.00 33.01 31.43 2cw2 s GLN 8 CO 0.22 0.07 0.28 0.00 -1.32 0.00 0.00 175.29 174.54 2cw2 s PRO 10 N 1.69 3.36 0.78 0.00 0.02 -1.26 -4.99 135.00 134.60 2cw2 s PRO 10 Ca 0.05 1.91 -0.12 0.00 0.02 0.00 0.00 61.00 62.86 2cw2 s PRO 10 Cb -0.19 -2.22 0.06 0.00 0.02 0.00 0.00 34.50 32.18 2cw2 s PRO 10 CO 0.10 -0.92 1.14 -2.14 -0.33 0.00 0.00 177.00 174.85 2cw2 s PRO 11 N -2.96 2.01 0.56 5.54 0.02 -1.26 -4.96 135.00 133.94 2cw2 s PRO 11 Ca 0.70 1.47 -0.21 0.00 0.02 0.00 0.00 61.00 62.98 2cw2 s PRO 11 Cb -0.32 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.31 2cw2 s PRO 11 CO 0.37 -1.88 1.30 -1.17 -0.33 0.00 0.00 177.00 175.30 2cw2 s LEU 12 N -5.69 3.81 0.00 -5.54 2.96 -1.26 -4.90 118.68 108.05 2cw2 s LEU 12 Ca 0.67 2.63 0.22 0.00 -0.22 0.00 0.00 54.13 57.44 2cw2 s LEU 12 Cb -0.22 -4.36 1.30 0.00 0.50 0.00 0.00 46.19 43.40 2cw2 s LEU 12 CO 0.51 -1.55 1.69 -2.65 -1.32 0.00 0.00 176.35 173.03 2cw2 n PRO 13 N -1.16 0.66 -3.77 0.98 -0.02 -1.26 -4.85 135.00 125.58 2cw2 n PRO 13 Ca 0.11 0.01 -0.09 0.00 -2.02 0.00 0.00 63.50 61.50 2cw2 n PRO 13 Cb 0.46 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.41 2cw2 n PRO 13 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 2cw2 s TYR 14 N -2.04 -0.07 0.73 6.00 -0.85 -1.26 -5.09 117.35 114.78 2cw2 s TYR 14 Ca 0.32 -0.28 -0.11 0.00 -0.52 0.00 0.00 57.07 56.48 2cw2 s TYR 14 Cb 0.15 0.37 0.04 0.00 0.38 0.00 0.00 41.96 42.90 2cw2 s TYR 14 CO 0.26 -0.92 1.09 0.08 -1.52 0.00 0.00 175.55 174.54 2cw2 s VAL 15 N -3.89 3.47 0.55 -3.49 1.01 -1.26 -4.93 120.40 111.86 2cw2 s VAL 15 Ca 0.10 0.51 0.23 0.00 0.00 0.00 0.00 61.98 62.83 2cw2 s VAL 15 Cb -0.01 -3.05 0.33 0.00 0.00 0.00 0.00 36.38 33.65 2cw2 s VAL 15 CO -0.02 -0.59 2.14 0.11 0.00 0.00 0.00 175.10 176.74 2cw2 h LYS 16 N -0.82 0.00 -0.62 2.72 1.79 -1.98 -1.43 116.57 116.23 2cw2 h LYS 16 Ca -0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 2cw2 h LYS 16 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2cw2 h LYS 16 CO 0.53 0.00 0.00 0.27 -1.08 0.00 0.00 179.45 179.17 2cw2 n ASN 17 N -4.22 3.72 0.33 0.86 6.94 -1.26 -3.19 115.26 118.44 2cw2 n ASN 17 Ca 0.00 -1.99 0.21 0.00 -0.02 0.00 0.00 54.58 52.78 2cw2 n ASN 17 Cb 0.22 -0.41 1.14 0.00 -2.36 0.00 0.00 39.78 38.37 2cw2 n ASN 17 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2cw2 h ALA 18 N 3.98 1.12 -0.02 -2.53 0.00 -1.60 -2.76 119.26 117.44 2cw2 h ALA 18 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2cw2 h ALA 18 Cb 0.95 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2cw2 h ALA 18 CO 0.00 0.00 -0.03 1.28 0.00 0.00 0.00 179.25 180.50 2cw2 n LEU 19 N -3.25 2.47 -4.76 0.00 4.77 -1.26 -4.40 117.00 110.57 2cw2 n LEU 19 Ca -0.03 -0.98 -0.36 0.00 -0.03 0.00 0.00 56.01 54.61 2cw2 n LEU 19 Cb 0.08 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.20 2cw2 n LEU 19 CO 0.22 0.43 0.84 -1.61 -1.33 0.00 0.00 177.39 175.94 2cw2 s GLU 20 N -1.60 3.12 0.00 3.23 0.41 -1.04 -1.82 118.70 121.00 2cw2 s GLU 20 Ca 0.21 1.81 0.28 0.00 -0.41 0.00 0.00 54.97 56.87 2cw2 s GLU 20 Cb 0.15 -2.01 1.15 0.00 -1.78 0.00 0.00 34.13 31.65 2cw2 s GLU 20 CO 0.25 -1.08 1.80 -0.35 -0.49 0.00 0.00 175.26 175.39 2cw2 n PRO 21 N -1.40 1.47 -0.23 0.39 -0.04 -1.26 -4.87 135.00 129.07 2cw2 n PRO 21 Ca 0.12 -0.77 -0.07 0.00 -0.04 0.00 0.00 63.50 62.75 2cw2 n PRO 21 Cb 0.49 -1.48 0.07 0.00 -0.04 0.00 0.00 33.50 32.54 2cw2 n PRO 21 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2cw2 h HIS 22 N 1.87 1.13 -3.53 0.54 3.86 -1.75 -3.42 115.15 113.86 2cw2 h HIS 22 Ca 0.00 -0.14 -0.33 0.00 -1.16 0.00 0.00 60.37 58.74 2cw2 h HIS 22 Cb 0.43 -0.32 -0.33 0.00 1.06 0.00 0.00 27.41 28.24 2cw2 h HIS 22 CO 0.00 0.94 -0.74 1.41 0.86 0.00 0.00 177.93 180.39 2cw2 s MET 23 N -5.24 0.24 0.50 2.45 -2.45 -0.92 -4.97 119.30 108.91 2cw2 s MET 23 Ca -0.12 0.08 -0.08 0.00 -1.25 0.00 0.00 55.69 54.32 2cw2 s MET 23 Cb 0.15 -0.42 -0.05 0.00 1.25 0.00 0.00 34.83 35.76 2cw2 s MET 23 CO 0.84 -0.12 0.85 -1.54 1.05 0.00 0.00 175.02 176.10 2cw2 s SER 24 N 0.92 6.33 0.26 1.11 1.04 -1.26 -2.51 113.70 119.60 2cw2 s SER 24 Ca -0.09 1.12 -0.01 0.00 0.48 0.00 0.00 55.95 57.45 2cw2 s SER 24 Cb -0.12 -2.33 0.51 0.00 0.10 0.00 0.00 66.02 64.18 2cw2 s SER 24 CO -0.02 -0.60 1.79 0.00 0.98 0.00 0.00 173.24 175.39 2cw2 h ALA 25 N 0.38 1.32 -0.70 5.32 0.00 -1.89 -1.59 119.26 122.10 2cw2 h ALA 25 Ca -0.46 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 2cw2 h ALA 25 Cb 1.20 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 2cw2 h ALA 25 CO 0.62 0.03 0.33 1.49 0.00 0.00 0.00 179.25 181.73 2cw2 h GLU 26 N 0.76 1.00 -0.44 0.00 4.81 -1.93 -0.36 114.58 118.42 2cw2 h GLU 26 Ca 0.46 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.51 2cw2 h GLU 26 Cb 0.55 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 2cw2 h GLU 26 CO -0.31 0.79 0.18 1.15 -0.73 0.00 0.00 179.01 180.09 2cw2 h THR 27 N 0.97 1.20 -0.53 0.32 2.02 -1.81 -1.63 112.91 113.45 2cw2 h THR 27 Ca 0.24 -0.61 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 2cw2 h THR 27 Cb 0.12 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 2cw2 h THR 27 CO -0.03 0.23 0.23 -0.07 0.37 0.00 0.00 175.52 176.25 2cw2 h LEU 28 N 0.57 0.68 0.45 2.58 3.38 -0.93 0.38 115.31 122.42 2cw2 h LEU 28 Ca 0.15 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2cw2 h LEU 28 Cb 0.18 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2cw2 h LEU 28 CO -0.01 0.60 -0.22 0.74 0.09 0.00 0.00 178.44 179.64 2cw2 h THR 29 N 0.75 0.50 0.22 0.22 2.02 -0.81 -0.89 112.91 114.93 2cw2 h THR 29 Ca 0.18 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 2cw2 h THR 29 Cb 0.12 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 2cw2 h THR 29 CO -0.02 0.06 -0.11 1.88 0.37 0.00 0.00 175.52 177.70 2cw2 h TYR 30 N -0.84 -0.27 -0.35 3.16 0.05 -1.14 0.70 116.97 118.28 2cw2 h TYR 30 Ca -0.06 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.73 2cw2 h TYR 30 Cb 0.56 0.09 -0.03 0.00 1.01 0.00 0.00 36.73 38.37 2cw2 h TYR 30 CO 0.00 -0.11 0.19 1.25 -1.05 0.00 0.00 178.16 178.44 2cw2 h HIS 31 N -0.38 0.35 0.00 4.88 2.76 -0.30 -0.75 115.15 121.72 2cw2 h HIS 31 Ca -0.03 0.01 -0.08 0.00 -2.20 0.00 0.00 60.37 58.08 2cw2 h HIS 31 Cb 0.29 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 2cw2 h HIS 31 CO -0.04 0.20 -0.60 1.25 -1.30 0.00 0.00 177.93 177.44 2cw2 h HIS 32 N 0.39 0.00 0.00 5.26 -0.00 -1.15 -0.50 115.15 119.15 2cw2 h HIS 32 Ca 0.14 0.00 -0.07 0.00 -0.00 0.00 0.00 60.37 60.44 2cw2 h HIS 32 Cb 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.43 2cw2 h HIS 32 CO -0.09 0.63 -0.34 -0.44 -0.00 0.00 0.00 177.93 177.69 2cw2 h ASP 33 N -1.00 0.00 0.00 3.26 3.32 0.31 -2.00 116.42 120.31 2cw2 h ASP 33 Ca -0.11 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.94 2cw2 h ASP 33 Cb 0.75 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.30 2cw2 h ASP 33 CO -0.07 0.34 0.00 0.29 -1.72 0.00 0.00 179.24 178.08 2cw2 n LYS 34 N -3.62 0.00 0.18 3.56 4.76 -0.82 -4.42 118.16 117.81 2cw2 n LYS 34 Ca -0.01 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.28 2cw2 n LYS 34 Cb 0.46 -0.31 -0.08 0.00 -1.84 0.00 0.00 35.03 33.25 2cw2 n LYS 34 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2cw2 h HIS 35 N 0.00 -1.10 -0.13 2.13 3.86 -1.12 -0.32 115.15 118.47 2cw2 h HIS 35 Ca 0.00 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 2cw2 h HIS 35 Cb 0.00 0.45 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 2cw2 h HIS 35 CO 0.00 -0.53 0.03 1.25 0.86 0.00 0.00 177.93 179.54 2cw2 h HIS 36 N -0.73 0.21 -0.89 2.45 -0.00 -1.02 -1.68 115.15 113.50 2cw2 h HIS 36 Ca -0.01 -0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.36 2cw2 h HIS 36 Cb 0.70 -0.06 -0.05 0.00 -0.00 0.00 0.00 27.41 28.00 2cw2 h HIS 36 CO -0.28 0.36 0.59 0.37 -0.00 0.00 0.00 177.93 178.96 2cw2 h GLN 37 N 0.01 1.12 -0.29 5.26 5.75 -1.37 -2.76 115.11 122.83 2cw2 h GLN 37 Ca 0.04 -0.07 -0.15 0.00 -0.15 0.00 0.00 58.65 58.32 2cw2 h GLN 37 Cb 0.25 -0.25 -0.01 0.00 1.07 0.00 0.00 27.48 28.54 2cw2 h GLN 37 CO 0.00 0.74 -0.44 1.15 -2.65 0.00 0.00 178.83 177.63 2cw2 h THR 38 N 1.16 1.29 -0.51 2.39 2.02 -0.67 -0.84 112.91 117.75 2cw2 h THR 38 Ca 0.34 -1.63 0.09 0.00 0.77 0.00 0.00 66.41 65.98 2cw2 h THR 38 Cb -0.05 1.54 -0.07 0.00 -1.74 0.00 0.00 68.15 67.82 2cw2 h THR 38 CO -0.09 0.53 0.10 1.88 0.37 0.00 0.00 175.52 178.31 2cw2 h TYR 39 N 0.60 0.16 -0.16 3.16 0.05 -1.10 0.07 116.97 119.74 2cw2 h TYR 39 Ca 0.04 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.85 2cw2 h TYR 39 Cb 1.00 0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.74 2cw2 h TYR 39 CO 0.05 -0.01 0.09 0.28 -1.05 0.00 0.00 178.16 177.52 2cw2 h VAL 40 N 0.24 1.09 -0.27 -2.88 2.07 -1.18 -0.66 116.25 114.66 2cw2 h VAL 40 Ca 0.26 -0.25 0.05 0.00 0.82 0.00 0.00 66.70 67.58 2cw2 h VAL 40 Cb 0.35 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 2cw2 h VAL 40 CO -0.34 0.09 -0.03 -0.78 0.02 0.00 0.00 177.57 176.53 2cw2 h ASP 41 N 0.16 -0.18 -0.58 0.57 1.82 -0.85 0.14 116.42 117.50 2cw2 h ASP 41 Ca 0.06 0.07 -0.05 0.00 -0.39 0.00 0.00 57.03 56.72 2cw2 h ASP 41 Cb 0.06 0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.18 2cw2 h ASP 41 CO -0.01 -0.05 0.18 0.74 -1.61 0.00 0.00 179.24 178.49 2cw2 h THR 42 N 0.04 1.24 -0.75 2.25 2.02 -0.85 -0.19 112.91 116.68 2cw2 h THR 42 Ca 0.13 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.48 2cw2 h THR 42 Cb 0.19 0.68 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 2cw2 h THR 42 CO -0.25 0.31 0.41 0.25 0.37 0.00 0.00 175.52 176.61 2cw2 h LEU 43 N 0.82 0.93 -0.91 2.58 5.85 -0.84 -0.76 115.31 122.98 2cw2 h LEU 43 Ca 0.19 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2cw2 h LEU 43 Cb 0.29 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 2cw2 h LEU 43 CO -0.01 0.76 0.60 0.78 -0.34 0.00 0.00 178.44 180.24 2cw2 h ASN 44 N 1.03 1.04 -0.73 1.25 2.35 -0.29 0.21 115.58 120.43 2cw2 h ASN 44 Ca 0.26 -0.02 -0.03 0.00 -0.55 0.00 0.00 56.30 55.96 2cw2 h ASN 44 Cb 0.04 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.12 2cw2 h ASN 44 CO -0.04 0.74 0.33 0.28 -1.65 0.00 0.00 177.43 177.09 2cw2 h SER 45 N 1.22 0.98 -0.64 5.81 0.02 -0.26 -0.90 113.55 119.77 2cw2 h SER 45 Ca 0.34 -0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 61.08 2cw2 h SER 45 Cb -0.12 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.14 2cw2 h SER 45 CO -0.08 0.85 0.15 0.40 -1.14 0.00 0.00 176.83 177.02 2cw2 h ILE 46 N 1.03 1.26 -0.74 3.27 2.04 -0.70 -2.98 117.51 120.69 2cw2 h ILE 46 Ca 0.25 -0.94 0.02 0.00 1.00 0.00 0.00 64.86 65.19 2cw2 h ILE 46 Cb 0.15 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 2cw2 h ILE 46 CO -0.03 0.36 0.49 0.00 0.00 0.00 0.00 178.15 178.97 2cw2 h ALA 47 N 1.06 1.52 0.00 1.87 0.00 -0.11 0.88 119.26 124.48 2cw2 h ALA 47 Ca 0.20 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2cw2 h ALA 47 Cb 0.37 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 2cw2 h ALA 47 CO 0.00 0.42 -0.01 0.00 0.00 0.00 0.00 179.25 179.66 2cw2 h ALA 48 N 1.56 1.34 -0.00 0.00 0.00 -1.02 -2.61 119.26 118.53 2cw2 h ALA 48 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2cw2 h ALA 48 Cb -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2cw2 h ALA 48 CO -0.07 0.02 -0.45 -1.91 0.00 0.00 0.00 179.25 176.84 2cw2 n GLU 49 N -3.59 2.50 -3.67 0.00 2.13 -0.27 -4.87 120.64 112.87 2cw2 n GLU 49 Ca -0.03 -0.30 -0.30 0.00 0.66 0.00 0.00 57.16 57.20 2cw2 n GLU 49 Cb 0.10 -1.12 -0.14 0.00 0.27 0.00 0.00 31.44 30.56 2cw2 n GLU 49 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 2cw2 s ASN 50 N -1.93 3.65 0.55 4.31 3.84 0.14 -5.00 114.94 120.50 2cw2 s ASN 50 Ca 0.07 -2.20 0.21 0.00 0.21 0.00 0.00 52.86 51.15 2cw2 s ASN 50 Cb 0.10 -0.86 1.47 0.00 -0.55 0.00 0.00 41.25 41.41 2cw2 s ASN 50 CO 0.43 -0.33 2.18 0.77 -2.79 0.00 0.00 177.10 177.36 2cw2 h SER 51 N 7.25 0.00 0.21 -4.21 4.64 -1.87 0.04 113.55 119.61 2cw2 h SER 51 Ca -0.04 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 2cw2 h SER 51 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.06 2cw2 h SER 51 CO 0.44 0.00 -0.10 0.74 -0.87 0.00 0.00 176.83 177.04 2cw2 h THR 52 N 0.00 0.87 -0.57 2.95 2.02 -1.94 -1.52 112.91 114.71 2cw2 h THR 52 Ca 0.02 -0.49 0.00 0.00 0.77 0.00 0.00 66.41 66.70 2cw2 h THR 52 Cb 0.07 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 2cw2 h THR 52 CO -0.00 0.11 0.36 0.40 0.37 0.00 0.00 175.52 176.76 2cw2 h ILE 53 N -0.53 1.16 -0.01 3.11 2.04 -1.70 -1.59 117.51 119.99 2cw2 h ILE 53 Ca -0.03 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2cw2 h ILE 53 Cb 0.40 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2cw2 h ILE 53 CO 0.05 0.16 0.01 0.00 0.00 0.00 0.00 178.15 178.37 2cw2 h ALA 54 N 1.19 1.51 0.00 1.87 0.00 -0.95 -2.30 119.26 120.58 2cw2 h ALA 54 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2cw2 h ALA 54 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2cw2 h ALA 54 CO -0.04 -0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.06 2cw2 n SER 55 N -3.80 0.20 -4.75 0.00 3.41 -0.58 -4.93 113.62 103.17 2cw2 n SER 55 Ca -0.03 0.52 -0.29 0.00 -0.26 0.00 0.00 58.87 58.81 2cw2 n SER 55 Cb 0.09 -0.57 -0.07 0.00 -0.26 0.00 0.00 64.21 63.40 2cw2 n SER 55 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2cw2 s LYS 56 N -3.02 2.75 0.68 4.33 1.02 -0.87 -5.10 119.74 119.53 2cw2 s LYS 56 Ca 0.13 -0.83 -0.12 0.00 0.02 0.00 0.00 55.97 55.17 2cw2 s LYS 56 Cb 0.17 -2.61 0.01 0.00 -0.52 0.00 0.00 37.83 34.87 2cw2 s LYS 56 CO 0.55 0.52 1.07 0.99 -0.92 0.00 0.00 175.35 177.55 2cw2 s THR 58 N -1.52 3.80 0.22 2.17 2.01 -1.26 -4.92 115.64 116.13 2cw2 s THR 58 Ca 0.29 0.66 -0.08 0.00 0.31 0.00 0.00 61.69 62.87 2cw2 s THR 58 Cb -0.11 -3.29 0.18 0.00 0.01 0.00 0.00 72.50 69.29 2cw2 s THR 58 CO 0.21 -0.69 1.71 -0.07 -0.69 0.00 0.00 174.62 175.10 2cw2 h LEU 59 N -0.47 0.09 -1.08 4.42 4.07 -1.96 -1.70 115.31 118.68 2cw2 h LEU 59 Ca -0.45 0.11 -0.09 0.00 0.08 0.00 0.00 57.88 57.54 2cw2 h LEU 59 Cb 1.22 0.13 -0.01 0.00 1.08 0.00 0.00 40.66 43.07 2cw2 h LEU 59 CO 0.56 0.04 -0.30 -0.33 -1.08 0.00 0.00 178.44 177.33 2cw2 h GLU 60 N 0.32 0.27 -0.51 1.13 5.08 -1.93 0.45 114.58 119.40 2cw2 h GLU 60 Ca 0.34 -0.10 -0.08 0.00 -1.00 0.00 0.00 59.36 58.52 2cw2 h GLU 60 Cb 0.51 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 2cw2 h GLU 60 CO -0.40 0.55 -0.00 1.96 -1.00 0.00 0.00 179.01 180.12 2cw2 h GLN 61 N 0.24 0.86 -0.30 2.33 4.20 -1.82 -1.16 115.11 119.47 2cw2 h GLN 61 Ca 0.03 -0.24 -0.17 0.00 0.06 0.00 0.00 58.65 58.34 2cw2 h GLN 61 Cb 0.65 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 2cw2 h GLN 61 CO 0.05 0.86 -0.48 0.82 -0.67 0.00 0.00 178.83 179.41 2cw2 h ILE 62 N 0.79 1.28 -0.98 2.54 2.04 -0.49 -1.75 117.51 120.94 2cw2 h ILE 62 Ca 0.15 -1.67 0.02 0.00 1.00 0.00 0.00 64.86 64.36 2cw2 h ILE 62 Cb 0.48 1.56 -0.05 0.00 -0.74 0.00 0.00 36.82 38.07 2cw2 h ILE 62 CO 0.02 0.54 0.65 0.40 0.00 0.00 0.00 178.15 179.76 2cw2 h ILE 63 N 0.64 1.23 0.05 -0.67 2.04 -0.78 0.48 117.51 120.49 2cw2 h ILE 63 Ca 0.03 -0.45 -0.25 0.00 1.00 0.00 0.00 64.86 65.19 2cw2 h ILE 63 Cb 1.06 -0.19 0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2cw2 h ILE 63 CO 0.11 0.24 -1.06 0.11 0.00 0.00 0.00 178.15 177.55 2cw2 h LYS 64 N 1.31 0.43 0.00 2.37 1.57 -1.07 -3.40 116.57 117.77 2cw2 h LYS 64 Ca 0.37 -0.53 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2cw2 h LYS 64 Cb -0.12 0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2cw2 h LYS 64 CO -0.09 1.18 -0.06 2.41 -0.57 0.00 0.00 179.45 182.32 2cw2 n THR 65 N -3.72 0.00 -2.41 -0.16 -1.04 -0.67 -4.88 114.28 101.39 2cw2 n THR 65 Ca -0.08 -0.38 -0.25 0.00 -2.04 0.00 0.00 64.05 61.30 2cw2 n THR 65 Cb 0.90 0.95 0.12 0.00 -1.82 0.00 0.00 70.33 70.48 2cw2 n THR 65 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2cw2 s GLU 66 N -0.88 1.56 0.14 -2.82 0.41 0.15 -5.03 118.70 112.23 2cw2 s GLU 66 Ca 0.00 -0.86 -0.03 0.00 -0.41 0.00 0.00 54.97 53.67 2cw2 s GLU 66 Cb 0.00 -2.22 -0.03 0.00 -1.78 0.00 0.00 34.13 30.10 2cw2 s GLU 66 CO 0.00 -1.59 0.12 0.95 -0.49 0.00 0.00 175.26 174.25 2cw2 s THR 67 N -3.29 0.09 0.00 3.63 -4.23 -1.26 -4.78 115.64 105.80 2cw2 s THR 67 Ca 0.67 -1.75 0.00 0.00 -1.18 0.00 0.00 61.69 59.43 2cw2 s THR 67 Cb -0.06 -1.96 0.00 0.00 1.34 0.00 0.00 72.50 71.82 2cw2 s THR 67 CO 0.46 -0.43 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 2cw2 n GLY 68 N -0.12 2.45 0.21 3.99 0.00 -1.26 -2.54 105.19 107.92 2cw2 n GLY 68 Ca -0.06 -0.40 -0.08 0.00 0.00 0.00 0.00 46.02 45.48 2cw2 n GLY 68 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2cw2 h LYS 69 N 0.00 0.67 -0.85 1.61 3.64 -2.00 -2.13 116.57 117.51 2cw2 h LYS 69 Ca 0.00 -0.10 0.05 0.00 -1.27 0.00 0.00 60.65 59.34 2cw2 h LYS 69 Cb 0.00 -0.12 -0.06 0.00 -0.41 0.00 0.00 32.23 31.64 2cw2 h LYS 69 CO 0.00 0.56 0.53 -1.35 -2.27 0.00 0.00 179.45 176.92 2cw2 h PRO 70 N 0.61 0.95 -0.10 1.90 0.11 -1.99 -1.02 132.00 132.45 2cw2 h PRO 70 Ca 0.16 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.21 2cw2 h PRO 70 Cb 0.11 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.00 2cw2 h PRO 70 CO -0.02 0.63 0.06 0.35 -0.21 0.00 0.00 178.00 178.81 2cw2 h PHE 71 N 0.98 0.13 -0.98 0.65 3.57 -1.17 -1.28 116.94 118.84 2cw2 h PHE 71 Ca 0.36 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.87 2cw2 h PHE 71 Cb 0.13 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 2cw2 h PHE 71 CO -0.03 0.11 0.65 -0.91 -2.23 0.00 0.00 178.31 175.89 2cw2 h ASN 72 N 0.12 1.12 -0.08 0.41 2.35 -0.76 -0.29 115.58 118.45 2cw2 h ASN 72 Ca 0.04 -0.03 -0.10 0.00 -0.55 0.00 0.00 56.30 55.66 2cw2 h ASN 72 Cb 0.01 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.10 2cw2 h ASN 72 CO -0.01 0.81 -0.34 1.56 -1.65 0.00 0.00 177.43 177.81 2cw2 h GLN 73 N 1.33 0.37 -0.62 0.81 4.20 -1.10 -0.95 115.11 119.14 2cw2 h GLN 73 Ca 0.36 -0.29 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2cw2 h GLN 73 Cb -0.15 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 2cw2 h GLN 73 CO -0.08 0.93 0.36 0.00 -0.67 0.00 0.00 178.83 179.37 2cw2 h ALA 74 N 0.45 0.80 -0.18 3.87 0.00 -0.94 -0.35 119.26 122.91 2cw2 h ALA 74 Ca -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2cw2 h ALA 74 Cb 0.98 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2cw2 h ALA 74 CO 0.07 0.29 0.09 0.00 0.00 0.00 0.00 179.25 179.70 2cw2 h ALA 75 N 1.18 0.23 -0.64 0.00 0.00 -1.09 -2.07 119.26 116.88 2cw2 h ALA 75 Ca 0.22 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2cw2 h ALA 75 Cb 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2cw2 h ALA 75 CO -0.04 -0.21 0.37 1.96 0.00 0.00 0.00 179.25 181.33 2cw2 h GLN 76 N 0.17 0.86 0.26 0.00 1.08 -0.92 0.25 115.11 116.81 2cw2 h GLN 76 Ca 0.06 -0.08 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2cw2 h GLN 76 Cb 0.11 -0.18 -0.00 0.00 -0.05 0.00 0.00 27.48 27.36 2cw2 h GLN 76 CO -0.01 0.62 -0.16 0.28 -0.95 0.00 0.00 178.83 178.61 2cw2 h VAL 77 N 0.88 0.67 -0.27 -0.54 2.07 -0.78 -1.82 116.25 116.46 2cw2 h VAL 77 Ca 0.23 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.76 2cw2 h VAL 77 Cb -0.02 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2cw2 h VAL 77 CO -0.04 0.00 0.14 0.22 0.02 0.00 0.00 177.57 177.91 2cw2 h TYR 78 N -0.41 0.26 -0.83 1.57 3.20 -1.03 -2.16 116.97 117.57 2cw2 h TYR 78 Ca -0.03 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.91 2cw2 h TYR 78 Cb 0.34 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.47 2cw2 h TYR 78 CO -0.09 0.15 0.52 -0.91 -1.64 0.00 0.00 178.16 176.19 2cw2 h ASN 79 N 0.29 0.83 -0.12 -2.11 2.35 -0.39 0.68 115.58 117.11 2cw2 h ASN 79 Ca 0.11 0.01 -0.20 0.00 -0.55 0.00 0.00 56.30 55.67 2cw2 h ASN 79 Cb 0.02 -0.16 0.01 0.00 0.05 0.00 0.00 38.32 38.24 2cw2 h ASN 79 CO -0.07 0.54 -0.70 0.45 -1.65 0.00 0.00 177.43 176.01 2cw2 h HIS 80 N 0.96 0.94 -0.49 1.19 3.86 -1.18 -0.36 115.15 120.07 2cw2 h HIS 80 Ca 0.35 -0.42 0.04 0.00 -1.16 0.00 0.00 60.37 59.18 2cw2 h HIS 80 Cb 0.12 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.41 2cw2 h HIS 80 CO -0.03 1.24 0.25 1.15 0.86 0.00 0.00 177.93 181.39 2cw2 h THR 81 N 0.37 0.96 -0.09 2.45 2.02 -1.01 -1.28 112.91 116.33 2cw2 h THR 81 Ca -0.05 -0.17 0.02 0.00 0.77 0.00 0.00 66.41 66.98 2cw2 h THR 81 Cb 1.34 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 2cw2 h THR 81 CO 0.14 0.09 -0.04 0.15 0.37 0.00 0.00 175.52 176.23 2cw2 h PHE 82 N 0.49 -0.10 0.03 3.16 3.57 -0.76 -2.20 116.94 121.12 2cw2 h PHE 82 Ca 0.22 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.73 2cw2 h PHE 82 Cb 0.12 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 2cw2 h PHE 82 CO -0.10 -0.07 -0.06 0.35 -2.23 0.00 0.00 178.31 176.19 2cw2 h PHE 83 N -0.04 -0.16 -0.41 0.41 3.57 -0.77 -0.17 116.94 119.38 2cw2 h PHE 83 Ca 0.05 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 2cw2 h PHE 83 Cb 0.11 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 2cw2 h PHE 83 CO -0.16 -0.10 0.07 0.74 -2.23 0.00 0.00 178.31 176.63 2cw2 h PHE 84 N -0.12 0.63 0.00 0.41 0.05 -1.24 0.19 116.94 116.85 2cw2 h PHE 84 Ca 0.02 -0.05 -0.05 0.00 3.82 0.00 0.00 57.97 61.71 2cw2 h PHE 84 Cb 0.14 -0.19 -0.01 0.00 2.00 0.00 0.00 35.95 37.90 2cw2 h PHE 84 CO -0.12 0.56 -0.22 -0.91 -0.18 0.00 0.00 178.31 177.44 2cw2 h ASN 85 N 0.59 0.00 0.50 2.17 -0.26 -1.08 -2.99 115.58 114.52 2cw2 h ASN 85 Ca 0.13 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2cw2 h ASN 85 Cb 0.28 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.54 2cw2 h ASN 85 CO 0.00 0.22 0.00 -3.20 -1.06 0.00 0.00 177.43 173.40 2cw2 n ASN 86 N -3.71 0.00 -4.50 5.81 4.05 0.63 -4.75 115.26 112.79 2cw2 n ASN 86 Ca -0.01 -0.08 -0.30 0.00 0.45 0.00 0.00 54.58 54.64 2cw2 n ASN 86 Cb 0.34 -0.29 -0.11 0.00 1.23 0.00 0.00 39.78 40.95 2cw2 n ASN 86 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 2cw2 s LEU 87 N -2.58 2.77 -0.07 1.20 1.43 -1.07 -1.07 118.68 119.29 2cw2 s LEU 87 Ca 0.25 -0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 52.71 2cw2 s LEU 87 Cb 0.18 -1.62 0.04 0.00 0.03 0.00 0.00 46.19 44.82 2cw2 s LEU 87 CO 0.40 0.21 0.42 0.00 0.23 0.00 0.00 176.35 177.61 2cw2 s ALA 88 N -1.09 -1.07 0.13 4.21 0.00 -0.10 -4.69 121.76 119.14 2cw2 s ALA 88 Ca 0.18 0.82 -0.31 0.00 0.00 0.00 0.00 51.96 52.65 2cw2 s ALA 88 Cb -0.11 -0.21 -0.07 0.00 0.00 0.00 0.00 23.12 22.73 2cw2 s ALA 88 CO 0.09 -0.26 1.28 -1.25 0.00 0.00 0.00 175.76 175.61 2cw2 s PRO 89 N -0.78 4.40 -0.53 0.00 0.04 -1.26 -1.78 135.00 135.09 2cw2 s PRO 89 Ca -0.09 1.94 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2cw2 s PRO 89 Cb -0.04 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.24 2cw2 s PRO 89 CO 0.04 -0.27 0.00 0.09 0.04 0.00 0.00 177.00 176.90 2cw2 n ASN 90 N 3.37 -3.64 -1.38 6.66 5.03 -1.26 -5.04 115.26 119.00 2cw2 n ASN 90 Ca 0.08 0.12 0.00 0.00 0.87 0.00 0.00 54.58 55.65 2cw2 n ASN 90 Cb 0.44 -1.58 0.00 0.00 -1.02 0.00 0.00 39.78 37.62 2cw2 n ASN 90 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2cw2 n GLY 91 N -2.32 1.05 4.41 7.41 0.00 -0.73 -5.02 105.19 109.99 2cw2 n GLY 91 Ca -0.05 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.19 2cw2 n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cw2 n GLY 92 N 5.00 -2.15 7.00 -0.02 0.00 0.13 -4.68 105.19 110.47 2cw2 n GLY 92 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2cw2 n GLY 92 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cw2 n GLY 93 N -0.40 -1.31 3.76 -0.02 0.00 -1.22 -4.83 105.19 101.16 2cw2 n GLY 93 Ca 0.00 -1.23 -0.40 0.00 0.00 0.00 0.00 46.02 44.39 2cw2 n GLY 93 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cw2 s GLU 94 N 0.00 4.74 0.70 1.61 2.02 -1.26 -5.01 118.70 121.50 2cw2 s GLU 94 Ca 0.00 1.58 -0.15 0.00 0.02 0.00 0.00 54.97 56.42 2cw2 s GLU 94 Cb 0.00 -3.18 0.02 0.00 0.10 0.00 0.00 34.13 31.08 2cw2 s GLU 94 CO 0.00 0.37 1.15 -1.25 0.02 0.00 0.00 175.26 175.55 2cw2 s PRO 95 N -1.40 2.44 0.22 0.39 0.04 -1.26 -5.07 135.00 130.37 2cw2 s PRO 95 Ca 0.44 1.55 0.02 0.00 0.04 0.00 0.00 61.00 63.05 2cw2 s PRO 95 Cb -0.27 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2cw2 s PRO 95 CO 0.34 -1.56 0.08 0.25 0.04 0.00 0.00 177.00 176.16 2cw2 n THR 96 N -2.62 0.00 -4.57 1.26 -2.24 -1.26 -4.69 114.28 100.17 2cw2 n THR 96 Ca 0.12 -1.31 0.00 0.00 -2.27 0.00 0.00 64.05 60.59 2cw2 n THR 96 Cb 0.51 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 2cw2 n THR 96 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cw2 n GLY 97 N 0.58 -0.01 0.30 3.38 0.00 -1.26 -3.29 105.19 104.89 2cw2 n GLY 97 Ca -0.03 -1.00 0.01 0.00 0.00 0.00 0.00 46.02 45.00 2cw2 n GLY 97 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2cw2 h LYS 98 N 0.00 0.65 -0.58 1.61 1.63 -1.99 -2.48 116.57 115.41 2cw2 h LYS 98 Ca 0.00 -0.09 -0.09 0.00 -0.85 0.00 0.00 60.65 59.62 2cw2 h LYS 98 Cb 0.00 -0.12 -0.02 0.00 -0.60 0.00 0.00 32.23 31.49 2cw2 h LYS 98 CO 0.00 0.54 0.01 -0.84 -3.45 0.00 0.00 179.45 175.71 2cw2 h ILE 99 N 0.65 1.26 -0.67 2.00 3.07 -1.94 -0.02 117.51 121.86 2cw2 h ILE 99 Ca 0.16 -1.12 0.04 0.00 1.55 0.00 0.00 64.86 65.49 2cw2 h ILE 99 Cb 0.14 0.81 -0.05 0.00 -0.27 0.00 0.00 36.82 37.45 2cw2 h ILE 99 CO -0.01 0.40 0.40 0.00 -1.05 0.00 0.00 178.15 177.89 2cw2 h ALA 100 N 1.07 0.89 -0.46 0.16 0.00 -1.44 0.11 119.26 119.60 2cw2 h ALA 100 Ca 0.17 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2cw2 h ALA 100 Cb 0.53 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2cw2 h ALA 100 CO 0.03 0.14 0.07 0.93 0.00 0.00 0.00 179.25 180.41 2cw2 h GLU 101 N 0.78 0.76 -0.30 0.00 5.08 -1.14 -1.96 114.58 117.80 2cw2 h GLU 101 Ca 0.28 -0.21 -0.11 0.00 -1.00 0.00 0.00 59.36 58.32 2cw2 h GLU 101 Cb 0.08 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2cw2 h GLU 101 CO -0.13 0.78 -0.29 -0.07 -1.00 0.00 0.00 179.01 178.30 2cw2 h LEU 102 N 0.63 0.63 -0.47 1.33 3.38 -0.67 -1.24 115.31 118.90 2cw2 h LEU 102 Ca 0.14 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.78 2cw2 h LEU 102 Cb 0.39 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2cw2 h LEU 102 CO 0.01 0.88 -0.07 0.40 0.09 0.00 0.00 178.44 179.75 2cw2 h ILE 103 N 0.53 1.27 -0.76 1.22 2.04 -0.66 0.11 117.51 121.26 2cw2 h ILE 103 Ca 0.07 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 2cw2 h ILE 103 Cb 0.76 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.89 2cw2 h ILE 103 CO 0.06 0.41 0.44 0.74 0.00 0.00 0.00 178.15 179.79 2cw2 h THR 104 N 0.72 1.22 -0.01 -0.27 2.02 -1.20 0.17 112.91 115.56 2cw2 h THR 104 Ca 0.12 -0.53 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 2cw2 h THR 104 Cb 0.60 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2cw2 h THR 104 CO 0.04 0.24 0.01 -0.09 0.37 0.00 0.00 175.52 176.08 2cw2 h ARG 105 N 1.05 0.02 0.00 6.66 2.43 -0.95 -0.48 114.38 123.10 2cw2 h ARG 105 Ca 0.27 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 2cw2 h ARG 105 Cb 0.00 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2cw2 h ARG 105 CO -0.05 0.09 -0.78 -0.25 -1.51 0.00 0.00 179.97 177.47 2cw2 n ASP 106 N -5.04 0.77 0.00 -3.80 8.00 0.00 -4.20 116.55 112.28 2cw2 n ASP 106 Ca -0.07 -0.65 0.00 0.00 0.71 0.00 0.00 54.79 54.78 2cw2 n ASP 106 Cb 0.06 0.67 0.00 0.00 -0.02 0.00 0.00 41.12 41.83 2cw2 n ASP 106 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2cw2 n PHE 107 N -1.51 0.00 0.00 1.24 3.72 0.03 -5.01 117.46 115.92 2cw2 n PHE 107 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 2cw2 n PHE 107 Cb 0.34 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.88 2cw2 n PHE 107 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2cw2 n GLY 108 N 0.31 2.46 3.40 1.37 0.00 -0.19 -4.56 105.19 107.99 2cw2 n GLY 108 Ca 0.00 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 2cw2 n GLY 108 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2cw2 s SER 109 N 0.00 -0.29 0.28 1.61 1.04 -1.26 -4.72 113.70 110.36 2cw2 s SER 109 Ca 0.00 -0.33 -0.03 0.00 0.48 0.00 0.00 55.95 56.07 2cw2 s SER 109 Cb 0.00 0.53 0.40 0.00 0.10 0.00 0.00 66.02 67.05 2cw2 s SER 109 CO 0.00 -0.94 1.93 0.15 0.98 0.00 0.00 173.24 175.35 2cw2 h PHE 110 N 2.25 1.15 -0.74 5.02 3.57 -1.91 -1.33 116.94 124.94 2cw2 h PHE 110 Ca -0.32 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.21 2cw2 h PHE 110 Cb 1.27 -0.38 -0.04 0.00 2.79 0.00 0.00 35.95 39.59 2cw2 h PHE 110 CO 0.32 0.67 0.48 0.93 -2.23 0.00 0.00 178.31 178.48 2cw2 h GLU 111 N 1.19 0.99 -0.57 1.11 3.07 -1.96 0.17 114.58 118.58 2cw2 h GLU 111 Ca 0.37 -0.07 -0.08 0.00 -0.50 0.00 0.00 59.36 59.08 2cw2 h GLU 111 Cb -0.01 -0.22 -0.02 0.00 -0.84 0.00 0.00 28.75 27.66 2cw2 h GLU 111 CO -0.11 0.67 0.04 0.87 -1.40 0.00 0.00 179.01 179.08 2cw2 h LYS 112 N 1.01 0.98 -0.47 2.33 1.57 -1.75 -1.10 116.57 119.14 2cw2 h LYS 112 Ca 0.27 -0.29 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2cw2 h LYS 112 Cb -0.09 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 2cw2 h LYS 112 CO -0.06 0.96 0.26 0.35 -0.57 0.00 0.00 179.45 180.39 2cw2 h PHE 113 N 0.87 0.65 -0.63 -1.35 3.57 -0.85 -2.04 116.94 117.16 2cw2 h PHE 113 Ca 0.17 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.70 2cw2 h PHE 113 Cb 0.49 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 38.97 2cw2 h PHE 113 CO 0.04 0.49 0.35 0.87 -2.23 0.00 0.00 178.31 177.83 2cw2 h LYS 114 N 0.62 0.65 -0.05 1.11 1.57 -0.44 0.20 116.57 120.23 2cw2 h LYS 114 Ca 0.17 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 58.93 2cw2 h LYS 114 Cb 0.06 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 2cw2 h LYS 114 CO -0.03 0.43 -0.09 0.93 -0.57 0.00 0.00 179.45 180.13 2cw2 h GLU 115 N 0.67 -0.12 -0.13 3.15 5.08 -0.93 -0.98 114.58 121.32 2cw2 h GLU 115 Ca 0.28 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2cw2 h GLU 115 Cb 0.15 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2cw2 h GLU 115 CO -0.16 -0.08 0.07 -0.44 -1.00 0.00 0.00 179.01 177.39 2cw2 h ASP 116 N -0.12 0.16 -0.49 1.42 5.19 -0.95 -1.15 116.42 120.48 2cw2 h ASP 116 Ca 0.05 -0.09 -0.12 0.00 -0.62 0.00 0.00 57.03 56.26 2cw2 h ASP 116 Cb 0.20 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.65 2cw2 h ASP 116 CO -0.13 0.20 -0.15 0.15 -3.12 0.00 0.00 179.24 176.20 2cw2 h PHE 117 N 0.11 1.08 -0.24 4.55 3.04 -0.94 -2.08 116.94 122.47 2cw2 h PHE 117 Ca 0.04 -0.24 -0.02 0.00 3.98 0.00 0.00 57.97 61.73 2cw2 h PHE 117 Cb 0.08 -0.26 -0.01 0.00 2.56 0.00 0.00 35.95 38.32 2cw2 h PHE 117 CO -0.04 1.04 0.06 0.77 -2.02 0.00 0.00 178.31 178.12 2cw2 h SER 118 N 0.81 0.36 -0.89 0.41 0.02 -1.10 -1.89 113.55 111.27 2cw2 h SER 118 Ca 0.12 -0.23 0.06 0.00 -0.84 0.00 0.00 61.79 60.90 2cw2 h SER 118 Cb 0.71 -0.09 -0.06 0.00 0.14 0.00 0.00 62.40 63.09 2cw2 h SER 118 CO 0.05 0.50 0.55 0.00 -1.14 0.00 0.00 176.83 176.80 2cw2 h ALA 119 N 0.87 1.22 -0.44 3.77 0.00 -1.11 0.19 119.26 123.77 2cw2 h ALA 119 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2cw2 h ALA 119 Cb 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2cw2 h ALA 119 CO 0.00 0.31 0.24 0.00 0.00 0.00 0.00 179.25 179.80 2cw2 h ALA 120 N 1.41 0.56 -0.32 0.00 0.00 -1.21 -0.48 119.26 119.22 2cw2 h ALA 120 Ca 0.39 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 55.08 2cw2 h ALA 120 Cb 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2cw2 h ALA 120 CO -0.17 0.09 -0.31 0.00 0.00 0.00 0.00 179.25 178.85 2cw2 h ALA 121 N 1.09 0.47 -0.03 0.00 0.00 -0.62 -2.27 119.26 117.91 2cw2 h ALA 121 Ca 0.15 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 2cw2 h ALA 121 Cb 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2cw2 h ALA 121 CO -0.02 0.51 -0.52 0.28 0.00 0.00 0.00 179.25 179.50 2cw2 h VAL 122 N 0.55 1.37 0.00 0.00 2.07 -0.66 -3.23 116.25 116.35 2cw2 h VAL 122 Ca 0.05 -1.79 0.00 0.00 0.82 0.00 0.00 66.70 65.79 2cw2 h VAL 122 Cb 0.89 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 2cw2 h VAL 122 CO 0.08 0.52 0.00 1.23 0.02 0.00 0.00 177.57 179.41 2cw2 h GLY 123 N 1.50 0.00 -5.32 2.17 0.00 -0.92 -3.47 103.07 97.04 2cw2 h GLY 123 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 2cw2 h GLY 123 CO 0.07 0.00 1.02 -1.58 0.00 0.00 0.00 176.54 176.06 2cw2 s HIS 124 N -3.21 2.31 -0.09 5.60 5.04 -0.87 -4.96 115.29 119.13 2cw2 s HIS 124 Ca 0.08 0.53 -0.23 0.00 -1.54 0.00 0.00 55.06 53.91 2cw2 s HIS 124 Cb 0.08 -3.77 -0.04 0.00 0.04 0.00 0.00 32.58 28.89 2cw2 s HIS 124 CO 0.62 -2.94 0.68 0.12 -2.34 0.00 0.00 174.74 170.88 2cw2 s PHE 125 N 3.98 3.55 0.00 3.88 5.36 -1.26 -4.85 117.98 128.64 2cw2 s PHE 125 Ca 0.66 1.19 0.00 0.00 -0.96 0.00 0.00 56.93 57.82 2cw2 s PHE 125 Cb -0.28 -2.78 0.00 0.00 -0.34 0.00 0.00 43.02 39.62 2cw2 s PHE 125 CO 0.24 0.07 0.00 0.41 -1.46 0.00 0.00 175.22 174.48 2cw2 n GLY 126 N 3.18 -1.46 3.80 13.12 0.00 -1.26 -4.89 105.19 117.69 2cw2 n GLY 126 Ca -0.02 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 44.11 2cw2 n GLY 126 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cw2 s SER 127 N -4.00 7.17 0.00 1.61 0.01 -1.26 -4.75 113.70 112.47 2cw2 s SER 127 Ca 0.00 1.38 0.00 0.00 1.31 0.00 0.00 55.95 58.64 2cw2 s SER 127 Cb 0.00 -2.40 0.00 0.00 0.21 0.00 0.00 66.02 63.83 2cw2 s SER 127 CO 0.00 0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.51 2cw2 n GLY 128 N 1.69 -1.04 2.96 3.44 0.00 -1.26 0.04 105.19 111.03 2cw2 n GLY 128 Ca -0.09 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 2cw2 n GLY 128 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2cw2 s TRP 129 N -3.00 0.20 -0.08 1.61 0.52 0.21 -0.61 118.94 117.80 2cw2 s TRP 129 Ca 0.00 -0.42 0.04 0.00 0.02 0.00 0.00 56.10 55.74 2cw2 s TRP 129 Cb 0.00 -0.15 -0.01 0.00 -1.15 0.00 0.00 33.47 32.16 2cw2 s TRP 129 CO 0.00 -0.16 -0.21 0.08 0.02 0.00 0.00 176.95 176.68 2cw2 s VAL 130 N -1.18 2.37 0.04 4.03 1.01 -0.73 -0.40 120.40 125.54 2cw2 s VAL 130 Ca -0.13 -0.94 0.09 0.00 0.00 0.00 0.00 61.98 61.00 2cw2 s VAL 130 Cb -0.08 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 2cw2 s VAL 130 CO -0.01 0.56 -0.25 0.26 0.00 0.00 0.00 175.10 175.66 2cw2 s TRP 131 N -0.02 2.35 -0.17 5.22 0.52 0.13 -1.25 118.94 125.72 2cw2 s TRP 131 Ca -0.07 -0.40 -0.12 0.00 0.02 0.00 0.00 56.10 55.53 2cw2 s TRP 131 Cb -0.15 -1.42 -0.05 0.00 -1.15 0.00 0.00 33.47 30.71 2cw2 s TRP 131 CO 0.05 0.12 0.23 -1.17 0.02 0.00 0.00 176.95 176.20 2cw2 s LEU 132 N -1.17 4.24 0.13 2.99 2.96 -0.27 -1.32 118.68 126.23 2cw2 s LEU 132 Ca 0.12 0.41 0.08 0.00 -0.22 0.00 0.00 54.13 54.52 2cw2 s LEU 132 Cb -0.10 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 2cw2 s LEU 132 CO 0.02 0.13 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.36 2cw2 s ILE 133 N 0.39 1.73 -0.20 6.68 1.09 -0.02 -0.28 121.20 130.59 2cw2 s ILE 133 Ca 0.14 -1.73 -0.09 0.00 -1.10 0.00 0.00 60.65 57.86 2cw2 s ILE 133 Cb -0.12 -1.69 -0.05 0.00 -1.06 0.00 0.00 42.46 39.54 2cw2 s ILE 133 CO 0.02 -0.21 0.11 0.00 -0.10 0.00 0.00 174.94 174.76 2cw2 s ALA 134 N -1.66 3.59 -0.29 9.38 0.00 0.61 -1.63 121.76 131.77 2cw2 s ALA 134 Ca 0.11 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.35 2cw2 s ALA 134 Cb -0.08 -2.12 0.08 0.00 0.00 0.00 0.00 23.12 21.01 2cw2 s ALA 134 CO 0.05 0.11 0.01 0.34 0.00 0.00 0.00 175.76 176.27 2cw2 s ASP 135 N 0.47 4.22 -1.38 0.00 -1.08 0.30 -1.92 116.67 117.28 2cw2 s ASP 135 Ca 0.06 -1.60 -0.10 0.00 -0.52 0.00 0.00 52.55 50.40 2cw2 s ASP 135 Cb -0.12 -1.28 0.07 0.00 -1.46 0.00 0.00 42.92 40.13 2cw2 s ASP 135 CO -0.00 -0.32 0.59 -0.67 0.52 0.00 0.00 175.17 175.29 2cw2 n ASP 136 N 4.56 -4.23 0.00 -0.34 2.03 -1.26 -1.38 116.55 115.93 2cw2 n ASP 136 Ca -0.05 -0.46 0.00 0.00 0.52 0.00 0.00 54.79 54.80 2cw2 n ASP 136 Cb 0.43 -3.46 0.00 0.00 -0.72 0.00 0.00 41.12 37.37 2cw2 n ASP 136 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2cw2 n GLY 137 N -1.31 1.07 3.76 0.27 0.00 -1.26 -5.04 105.19 102.69 2cw2 n GLY 137 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 2cw2 n GLY 137 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cw2 s LYS 138 N -0.54 4.15 0.11 1.61 2.47 -0.48 -5.02 119.74 122.04 2cw2 s LYS 138 Ca 0.00 0.27 -0.30 0.00 -1.56 0.00 0.00 55.97 54.37 2cw2 s LYS 138 Cb 0.00 -3.36 -0.07 0.00 -1.46 0.00 0.00 37.83 32.94 2cw2 s LYS 138 CO 0.00 0.36 1.20 -0.51 0.16 0.00 0.00 175.35 176.56 2cw2 s LEU 139 N 0.02 4.40 0.02 5.43 1.43 -1.26 -0.54 118.68 128.19 2cw2 s LEU 139 Ca 0.21 2.09 -0.01 0.00 -1.03 0.00 0.00 54.13 55.39 2cw2 s LEU 139 Cb -0.14 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 2cw2 s LEU 139 CO 0.08 -0.42 0.00 -0.54 0.23 0.00 0.00 176.35 175.70 2cw2 s LYS 140 N 0.57 0.33 -0.24 1.70 1.02 -0.64 -4.95 119.74 117.54 2cw2 s LYS 140 Ca 0.56 -0.55 -0.12 0.00 0.02 0.00 0.00 55.97 55.88 2cw2 s LYS 140 Cb -0.31 0.12 -0.05 0.00 -0.52 0.00 0.00 37.83 37.08 2cw2 s LYS 140 CO 0.32 -0.06 0.24 0.42 -0.92 0.00 0.00 175.35 175.34 2cw2 s ILE 141 N -1.40 5.30 0.05 2.17 1.01 -1.26 -0.84 121.20 126.23 2cw2 s ILE 141 Ca -0.15 0.34 0.05 0.00 0.00 0.00 0.00 60.65 60.88 2cw2 s ILE 141 Cb -0.09 -3.57 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 2cw2 s ILE 141 CO -0.01 0.30 -0.14 0.68 0.00 0.00 0.00 174.94 175.78 2cw2 s VAL 142 N 1.27 1.07 -0.12 2.92 -7.23 -0.44 -4.99 120.40 112.89 2cw2 s VAL 142 Ca 0.11 -1.15 -0.05 0.00 -1.81 0.00 0.00 61.98 59.08 2cw2 s VAL 142 Cb -0.14 -1.01 -0.04 0.00 0.56 0.00 0.00 36.38 35.75 2cw2 s VAL 142 CO 0.06 -0.13 0.08 -1.10 -0.31 0.00 0.00 175.10 173.71 2cw2 s GLN 143 N -1.45 3.37 -0.30 4.82 -0.21 -1.26 -0.69 119.66 123.94 2cw2 s GLN 143 Ca -0.01 -0.26 0.00 0.00 0.02 0.00 0.00 55.36 55.12 2cw2 s GLN 143 Cb -0.09 -3.06 0.06 0.00 1.00 0.00 0.00 33.01 30.93 2cw2 s GLN 143 CO 0.02 0.67 -0.01 0.20 -2.12 0.00 0.00 175.29 174.04 2cw2 s GLY 144 N -0.74 1.77 0.30 3.09 0.00 0.47 -4.98 107.32 107.22 2cw2 s GLY 144 Ca 0.13 -1.93 -0.28 0.00 0.00 0.00 0.00 44.72 42.64 2cw2 s GLY 144 CO 0.03 0.72 1.06 -1.58 0.00 0.00 0.00 173.10 173.33 2cw2 s HIS 145 N 1.15 3.57 0.00 1.90 2.46 -1.26 -0.61 115.29 122.49 2cw2 s HIS 145 Ca -0.03 1.72 0.00 0.00 0.47 0.00 0.00 55.06 57.22 2cw2 s HIS 145 Cb -0.20 -3.19 0.00 0.00 -0.13 0.00 0.00 32.58 29.06 2cw2 s HIS 145 CO -0.04 -0.38 0.00 -0.25 -2.47 0.00 0.00 174.74 171.61 2cw2 n ASP 146 N 0.91 0.00 -1.24 9.88 8.00 0.11 -1.11 116.55 133.09 2cw2 n ASP 146 Ca 0.00 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.62 2cw2 n ASP 146 Cb 0.46 0.00 0.26 0.00 -0.02 0.00 0.00 41.12 41.83 2cw2 n ASP 146 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cw2 n ALA 147 N 9.48 2.39 -1.54 2.24 0.00 -1.26 -4.21 120.51 127.60 2cw2 n ALA 147 Ca 0.00 -1.15 -0.55 0.00 0.00 0.00 0.00 53.44 51.74 2cw2 n ALA 147 Cb 0.00 -0.88 -0.07 0.00 0.00 0.00 0.00 19.45 18.50 2cw2 n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cw2 n GLY 148 N 1.56 0.08 2.72 0.00 0.00 -0.27 -4.65 105.19 104.63 2cw2 n GLY 148 Ca 0.22 0.72 -0.18 0.00 0.00 0.00 0.00 46.02 46.78 2cw2 n GLY 148 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2cw2 s ASN 149 N 0.23 0.64 0.08 1.61 3.84 -1.26 -4.43 114.94 115.65 2cw2 s ASN 149 Ca 0.87 0.07 0.12 0.00 0.21 0.00 0.00 52.86 54.13 2cw2 s ASN 149 Cb -1.11 -0.10 0.54 0.00 -0.55 0.00 0.00 41.25 40.04 2cw2 s ASN 149 CO 0.52 -0.20 1.38 -0.81 -2.79 0.00 0.00 177.10 175.20 2cw2 n PRO 150 N 4.79 0.05 0.11 0.43 -0.04 -1.26 -1.70 135.00 137.38 2cw2 n PRO 150 Ca -0.14 0.40 0.16 0.00 -0.04 0.00 0.00 63.50 63.88 2cw2 n PRO 150 Cb 0.50 -1.61 0.70 0.00 -0.04 0.00 0.00 33.50 33.05 2cw2 n PRO 150 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2cw2 h ILE 151 N 0.00 0.77 -0.05 0.52 2.04 -1.94 -0.66 117.51 118.18 2cw2 h ILE 151 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 2cw2 h ILE 151 Cb 0.16 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 2cw2 h ILE 151 CO 0.00 0.00 -0.02 -0.09 0.00 0.00 0.00 178.15 178.04 2cw2 h ARG 152 N 0.00 0.07 -0.69 2.37 2.43 -1.55 0.11 114.38 117.12 2cw2 h ARG 152 Ca 0.15 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.22 2cw2 h ARG 152 Cb 0.64 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 30.12 2cw2 h ARG 152 CO -0.00 0.10 0.12 0.39 -1.51 0.00 0.00 179.97 179.07 2cw2 n GLU 153 N -4.47 4.13 -3.37 0.20 4.71 -0.36 -4.90 120.64 116.59 2cw2 n GLU 153 Ca -0.02 -2.90 -0.24 0.00 -0.01 0.00 0.00 57.16 53.99 2cw2 n GLU 153 Cb 0.13 -2.19 0.01 0.00 -1.01 0.00 0.00 31.44 28.38 2cw2 n GLU 153 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65 2cw2 n SER 154 N 0.25 -4.41 -4.93 1.62 7.64 0.39 -4.99 113.62 109.21 2cw2 n SER 154 Ca 0.32 -0.42 -0.25 0.00 1.01 0.00 0.00 58.87 59.52 2cw2 n SER 154 Cb 1.23 -3.60 -0.03 0.00 -1.01 0.00 0.00 64.21 60.79 2cw2 n SER 154 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2cw2 s LYS 155 N -6.03 3.37 -0.34 1.43 1.02 -0.57 -4.98 119.74 113.63 2cw2 s LYS 155 Ca 0.42 -0.66 -0.12 0.00 0.02 0.00 0.00 55.97 55.63 2cw2 s LYS 155 Cb -0.21 -2.91 -0.01 0.00 -0.52 0.00 0.00 37.83 34.18 2cw2 s LYS 155 CO 0.51 0.50 0.21 0.99 -0.92 0.00 0.00 175.35 176.65 2cw2 s THR 156 N -1.78 4.98 0.17 2.17 2.01 -0.81 -3.65 115.64 118.73 2cw2 s THR 156 Ca 0.34 -0.40 -0.30 0.00 0.31 0.00 0.00 61.69 61.64 2cw2 s THR 156 Cb -0.11 -3.60 -0.08 0.00 0.01 0.00 0.00 72.50 68.72 2cw2 s THR 156 CO 0.28 -0.04 1.24 -2.16 -0.69 0.00 0.00 174.62 173.25 2cw2 s PRO 157 N 1.66 4.45 -0.04 4.92 0.04 -1.26 -0.28 135.00 144.48 2cw2 s PRO 157 Ca 0.05 1.93 0.01 0.00 0.04 0.00 0.00 61.00 63.03 2cw2 s PRO 157 Cb -0.18 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 2cw2 s PRO 157 CO 0.09 -0.17 -0.03 1.28 0.04 0.00 0.00 177.00 178.21 2cw2 n LEU 158 N 2.74 2.07 -3.81 -3.56 4.77 0.61 -4.90 117.00 114.92 2cw2 n LEU 158 Ca 0.06 -0.02 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 2cw2 n LEU 158 Cb 0.44 -0.09 -0.09 0.00 -2.33 0.00 0.00 43.42 41.35 2cw2 n LEU 158 CO 0.56 0.43 -0.05 -0.32 -1.33 0.00 0.00 177.39 176.68 2cw2 s MET 159 N -2.09 0.62 0.15 3.23 0.00 -1.02 -4.47 119.30 115.71 2cw2 s MET 159 Ca -0.05 -0.33 -0.08 0.00 0.00 0.00 0.00 55.69 55.23 2cw2 s MET 159 Cb 0.01 0.27 -0.01 0.00 0.00 0.00 0.00 34.83 35.10 2cw2 s MET 159 CO 0.12 -0.17 0.25 0.54 0.00 0.00 0.00 175.02 175.77 2cw2 s ASN 160 N -1.48 0.07 -0.01 1.11 2.20 -1.26 -1.12 114.94 114.46 2cw2 s ASN 160 Ca -0.13 -0.87 0.01 0.00 -0.94 0.00 0.00 52.86 50.93 2cw2 s ASN 160 Cb -0.05 0.41 0.00 0.00 -2.00 0.00 0.00 41.25 39.61 2cw2 s ASN 160 CO 0.02 -0.86 -0.02 -0.51 -2.94 0.00 0.00 177.10 172.79 2cw2 s ILE 161 N -3.96 0.22 -0.17 0.54 2.07 -0.38 -4.90 121.20 114.62 2cw2 s ILE 161 Ca 0.16 -0.09 -0.22 0.00 -1.41 0.00 0.00 60.65 59.09 2cw2 s ILE 161 Cb 0.04 -0.21 -0.02 0.00 0.13 0.00 0.00 42.46 42.39 2cw2 s ILE 161 CO -0.01 0.08 0.69 -0.62 -1.91 0.00 0.00 174.94 173.16 2cw2 s ASP 162 N 0.09 6.80 -0.04 4.50 -1.08 -1.26 -1.78 116.67 123.90 2cw2 s ASP 162 Ca -0.01 0.97 0.06 0.00 -0.52 0.00 0.00 52.55 53.05 2cw2 s ASP 162 Cb -0.03 -2.38 0.12 0.00 -1.46 0.00 0.00 42.92 39.17 2cw2 s ASP 162 CO -0.00 -0.28 1.08 1.33 0.52 0.00 0.00 175.17 177.82 2cw2 n VAL 163 N 4.56 1.25 -1.62 1.11 0.24 0.22 -4.85 118.33 119.24 2cw2 n VAL 163 Ca 0.00 -1.31 -0.44 0.00 -2.04 0.00 0.00 64.34 60.55 2cw2 n VAL 163 Cb 0.50 0.31 -0.01 0.00 -1.47 0.00 0.00 33.84 33.17 2cw2 n VAL 163 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 2cw2 n TRP 164 N -0.58 1.51 0.06 6.34 7.02 -1.10 -4.44 117.44 126.24 2cw2 n TRP 164 Ca 0.06 0.65 0.05 0.00 -1.02 0.00 0.00 57.50 57.24 2cw2 n TRP 164 Cb 0.38 -2.29 0.48 0.00 -2.42 0.00 0.00 31.31 27.47 2cw2 n TRP 164 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 2cw2 h GLU 165 N 2.07 0.40 -0.04 -0.99 5.08 -1.94 -1.20 114.58 117.96 2cw2 h GLU 165 Ca -0.42 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 57.93 2cw2 h GLU 165 Cb 1.33 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2cw2 h GLU 165 CO 0.61 0.27 0.10 1.12 -1.00 0.00 0.00 179.01 180.10 2cw2 h HIS 166 N 0.41 0.00 0.00 4.33 2.07 -1.99 0.55 115.15 120.53 2cw2 h HIS 166 Ca 0.12 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.57 2cw2 h HIS 166 Cb -0.02 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.95 2cw2 h HIS 166 CO -0.00 0.00 -0.35 0.00 -3.07 0.00 0.00 177.93 174.51 2cw2 h ALA 167 N 1.84 1.10 0.00 6.11 0.00 -1.54 -3.38 119.26 123.39 2cw2 h ALA 167 Ca 0.02 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2cw2 h ALA 167 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2cw2 h ALA 167 CO -0.00 0.44 -0.20 2.48 0.00 0.00 0.00 179.25 181.97 2cw2 n TYR 168 N -3.66 0.00 0.04 0.00 0.18 -0.81 -4.89 117.16 108.03 2cw2 n TYR 168 Ca -0.01 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.81 2cw2 n TYR 168 Cb 0.46 0.00 0.43 0.00 -0.38 0.00 0.00 39.34 39.85 2cw2 n TYR 168 CO 0.00 0.00 0.00 -0.92 -2.08 0.00 0.00 176.86 173.86 2cw2 h TYR 169 N 0.00 0.43 -0.53 -3.48 3.20 -1.09 0.32 116.97 115.82 2cw2 h TYR 169 Ca 0.00 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 2cw2 h TYR 169 Cb 0.00 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 2cw2 h TYR 169 CO 0.00 0.32 0.05 0.82 -1.64 0.00 0.00 178.16 177.71 2cw2 h ILE 170 N 0.45 1.24 0.00 1.81 2.04 -1.84 -0.87 117.51 120.34 2cw2 h ILE 170 Ca 0.12 -0.97 -0.24 0.00 1.00 0.00 0.00 64.86 64.77 2cw2 h ILE 170 Cb 0.04 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 36.87 2cw2 h ILE 170 CO -0.02 0.35 -1.94 0.47 0.00 0.00 0.00 178.15 177.01 2cw2 n ASP 171 N -4.23 0.37 0.00 1.72 8.00 -0.74 -4.62 116.55 117.04 2cw2 n ASP 171 Ca 0.03 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.70 2cw2 n ASP 171 Cb 0.28 0.79 0.00 0.00 -0.02 0.00 0.00 41.12 42.17 2cw2 n ASP 171 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2cw2 n TYR 172 N -2.74 0.00 0.00 1.24 4.01 0.10 -5.10 117.16 114.67 2cw2 n TYR 172 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 2cw2 n TYR 172 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.98 2cw2 n TYR 172 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2cw2 n ARG 173 N -0.04 0.00 0.00 -0.72 5.12 -0.33 -1.05 116.66 119.64 2cw2 n ARG 173 Ca 0.00 0.00 0.12 0.00 -1.93 0.00 0.00 57.85 56.04 2cw2 n ARG 173 Cb 0.12 0.00 0.58 0.00 -1.16 0.00 0.00 32.46 32.00 2cw2 n ARG 173 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2cw2 n ASN 174 N 2.88 0.00 -3.80 0.55 0.23 -1.26 -4.38 115.26 109.48 2cw2 n ASN 174 Ca 0.00 0.08 -0.42 0.00 -0.53 0.00 0.00 54.58 53.71 2cw2 n ASN 174 Cb 0.00 -0.34 0.00 0.00 -2.08 0.00 0.00 39.78 37.36 2cw2 n ASN 174 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2cw2 n ALA 175 N -1.34 5.41 0.21 -2.53 0.00 -0.21 -4.72 120.51 117.33 2cw2 n ALA 175 Ca 0.10 -3.94 0.05 0.00 0.00 0.00 0.00 53.44 49.65 2cw2 n ALA 175 Cb 0.21 -3.47 0.48 0.00 0.00 0.00 0.00 19.45 16.67 2cw2 n ALA 175 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2cw2 h ARG 176 N 6.06 0.00 0.00 0.00 2.43 -1.83 -2.38 114.38 118.66 2cw2 h ARG 176 Ca 0.54 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.61 2cw2 h ARG 176 Cb 0.65 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 2cw2 h ARG 176 CO 1.83 0.24 -0.48 0.00 -1.51 0.00 0.00 179.97 180.06 2cw2 h ALA 177 N 1.76 1.16 -0.34 2.80 0.00 -1.94 -0.59 119.26 122.11 2cw2 h ALA 177 Ca -0.00 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 2cw2 h ALA 177 Cb 0.45 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2cw2 h ALA 177 CO 0.03 0.59 -0.31 1.96 0.00 0.00 0.00 179.25 181.52 2cw2 h GLN 178 N 0.00 0.73 -0.17 0.00 4.20 -1.83 -0.90 115.11 117.13 2cw2 h GLN 178 Ca -0.00 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.36 2cw2 h GLN 178 Cb 0.87 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.63 2cw2 h GLN 178 CO 0.06 0.95 0.08 -0.92 -0.67 0.00 0.00 178.83 178.33 2cw2 h TYR 179 N 0.62 0.25 -0.89 2.96 3.20 -1.22 -2.12 116.97 119.76 2cw2 h TYR 179 Ca 0.07 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 2cw2 h TYR 179 Cb 0.84 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.99 2cw2 h TYR 179 CO 0.04 0.27 0.48 0.28 -1.64 0.00 0.00 178.16 177.59 2cw2 h VAL 180 N 0.16 1.26 -0.32 1.81 2.07 -1.00 -1.23 116.25 119.00 2cw2 h VAL 180 Ca 0.06 -0.65 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 2cw2 h VAL 180 Cb 0.11 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.93 2cw2 h VAL 180 CO -0.01 0.29 -0.10 0.07 0.02 0.00 0.00 177.57 177.85 2cw2 h LYS 181 N 1.25 0.54 0.00 1.57 2.10 -0.95 -2.62 116.57 118.47 2cw2 h LYS 181 Ca 0.31 -0.15 -0.05 0.00 -2.00 0.00 0.00 60.65 58.76 2cw2 h LYS 181 Cb 0.04 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.30 2cw2 h LYS 181 CO -0.05 0.64 -0.25 -0.91 -2.00 0.00 0.00 179.45 176.88 2cw2 h ASN 182 N 0.50 0.00 -0.75 7.07 2.35 -0.97 -3.02 115.58 120.76 2cw2 h ASN 182 Ca 0.10 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.94 2cw2 h ASN 182 Cb 0.47 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.79 2cw2 h ASN 182 CO 0.03 0.25 0.49 0.22 -1.65 0.00 0.00 177.43 176.77 2cw2 h TYR 183 N 0.00 0.71 0.00 1.19 3.20 -0.83 -0.93 116.97 120.31 2cw2 h TYR 183 Ca -0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 2cw2 h TYR 183 Cb 1.01 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 39.05 2cw2 h TYR 183 CO 0.00 0.34 -0.01 -1.49 -1.64 0.00 0.00 178.16 175.35 2cw2 h TRP 184 N 0.67 0.00 0.00 -3.82 4.06 -1.59 -0.73 115.95 114.53 2cw2 h TRP 184 Ca 0.34 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.29 2cw2 h TRP 184 Cb 0.45 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.61 2cw2 h TRP 184 CO -0.00 0.01 0.00 0.09 -3.56 0.00 0.00 178.44 174.98 2cw2 n ASN 185 N -3.91 0.00 -0.00 -3.49 3.02 -0.35 -3.42 115.26 107.11 2cw2 n ASN 185 Ca -0.03 -0.05 0.03 0.00 -0.03 0.00 0.00 54.58 54.49 2cw2 n ASN 185 Cb 0.10 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 38.93 2cw2 n ASN 185 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2cw2 n LEU 186 N -1.30 0.09 -4.68 3.41 4.77 -0.30 -3.31 117.00 115.68 2cw2 n LEU 186 Ca 0.12 -0.19 -0.45 0.00 -0.03 0.00 0.00 56.01 55.46 2cw2 n LEU 186 Cb 0.22 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 2cw2 n LEU 186 CO 0.20 0.02 1.34 0.52 -1.33 0.00 0.00 177.39 178.15 2cw2 n VAL 187 N -1.47 0.18 -2.92 4.08 0.31 -1.10 -0.93 118.33 116.48 2cw2 n VAL 187 Ca -0.00 -0.03 -0.44 0.00 -0.01 0.00 0.00 64.34 63.86 2cw2 n VAL 187 Cb 0.12 -1.81 -0.02 0.00 -0.91 0.00 0.00 33.84 31.22 2cw2 n VAL 187 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2cw2 s ASN 188 N 1.89 6.64 0.51 4.52 3.04 -0.24 0.17 114.94 131.47 2cw2 s ASN 188 Ca 0.81 -2.07 0.28 0.00 0.04 0.00 0.00 52.86 51.92 2cw2 s ASN 188 Cb -0.60 -2.40 1.36 0.00 -1.54 0.00 0.00 41.25 38.07 2cw2 s ASN 188 CO 0.39 -1.06 2.02 -0.50 -3.04 0.00 0.00 177.10 174.91 2cw2 h TRP 189 N 8.79 0.00 -0.36 0.43 -0.00 -1.90 -2.11 115.95 120.80 2cw2 h TRP 189 Ca 0.16 0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 59.04 2cw2 h TRP 189 Cb 1.02 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 30.16 2cw2 h TRP 189 CO 1.17 0.13 0.16 -0.44 -0.00 0.00 0.00 178.44 179.46 2cw2 h ASP 190 N 0.00 0.48 -0.36 -3.49 3.45 -1.97 0.34 116.42 114.87 2cw2 h ASP 190 Ca -0.00 -0.14 -0.02 0.00 0.43 0.00 0.00 57.03 57.30 2cw2 h ASP 190 Cb 0.43 -0.12 -0.02 0.00 -0.56 0.00 0.00 39.33 39.06 2cw2 h ASP 190 CO 0.02 0.49 0.15 0.15 -1.57 0.00 0.00 179.24 178.48 2cw2 h PHE 191 N 0.44 0.53 -0.62 4.55 3.57 -1.71 0.88 116.94 124.59 2cw2 h PHE 191 Ca 0.12 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2cw2 h PHE 191 Cb 0.15 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 2cw2 h PHE 191 CO -0.01 0.48 0.37 0.28 -2.23 0.00 0.00 178.31 177.20 2cw2 h VAL 192 N 0.43 1.18 -0.37 1.41 2.07 -1.17 -1.44 116.25 118.36 2cw2 h VAL 192 Ca 0.12 -0.41 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2cw2 h VAL 192 Cb 0.16 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 2cw2 h VAL 192 CO -0.01 0.19 -0.07 0.78 0.02 0.00 0.00 177.57 178.48 2cw2 h ASN 193 N 0.84 0.60 -0.63 0.57 2.35 -0.04 -1.50 115.58 117.77 2cw2 h ASN 193 Ca 0.22 -0.15 0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2cw2 h ASN 193 Cb -0.02 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 2cw2 h ASN 193 CO -0.04 0.72 0.40 0.44 -1.65 0.00 0.00 177.43 177.30 2cw2 h ASP 194 N 0.58 0.68 -0.88 5.81 3.32 -0.40 0.17 116.42 125.70 2cw2 h ASP 194 Ca 0.11 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2cw2 h ASP 194 Cb 0.47 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.82 2cw2 h ASP 194 CO 0.02 0.48 0.53 0.78 -1.72 0.00 0.00 179.24 179.33 2cw2 h ASN 195 N 0.81 1.06 -0.42 6.45 -0.26 -0.90 -1.59 115.58 120.73 2cw2 h ASN 195 Ca 0.24 -0.07 -0.05 0.00 -0.56 0.00 0.00 56.30 55.86 2cw2 h ASN 195 Cb -0.04 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 36.94 2cw2 h ASN 195 CO -0.08 0.82 0.05 0.58 -1.06 0.00 0.00 177.43 177.74 2cw2 h VAL 196 N 1.22 1.25 0.00 2.81 2.07 -0.60 -1.97 116.25 121.02 2cw2 h VAL 196 Ca 0.32 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 2cw2 h VAL 196 Cb -0.04 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 2cw2 h VAL 196 CO -0.06 0.32 -0.00 0.00 0.02 0.00 0.00 177.57 177.85 2cw2 h ALA 197 N 0.92 -0.00 -0.27 1.67 0.00 -0.51 -2.55 119.26 118.52 2cw2 h ALA 197 Ca 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2cw2 h ALA 197 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2cw2 h ALA 197 CO 0.01 -0.50 0.14 0.87 0.00 0.00 0.00 179.25 179.77 2cw2 h LYS 198 N -0.00 0.37 0.00 0.00 1.57 -1.25 -1.85 116.57 115.40 2cw2 h LYS 198 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2cw2 h LYS 198 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2cw2 h LYS 198 CO 0.00 0.28 0.00 0.00 -0.57 0.00 0.00 179.45 179.16 2cw2 h ALA 199 N 1.78 1.00 -1.44 3.86 0.00 -1.10 -3.47 119.26 119.89 2cw2 h ALA 199 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.80 2cw2 h ALA 199 Cb 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2cw2 h ALA 199 CO -0.02 0.00 -0.26 0.41 0.00 0.00 0.00 179.25 179.38 2cw2 n GLY 200 N 0.69 -0.00 0.68 0.00 0.00 -0.70 -5.06 105.19 100.81 2cw2 n GLY 200 Ca 0.03 -0.45 0.09 0.00 0.00 0.00 0.00 46.02 45.68 2cw2 n GLY 200 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61