#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wci s SER 2 N 0.00 0.91 0.44 7.83 1.04 -1.26 -5.02 113.70 117.64 2wci s SER 2 Ca 0.00 -1.16 0.13 0.00 0.48 0.00 0.00 55.95 55.41 2wci s SER 2 Cb 0.00 0.17 0.98 0.00 0.10 0.00 0.00 66.02 67.27 2wci s SER 2 CO 0.00 -0.61 1.99 0.71 0.98 0.00 0.00 173.24 176.32 2wci h THR 3 N 2.79 1.13 -0.10 2.02 1.35 -2.05 -1.77 112.91 116.28 2wci h THR 3 Ca -0.36 -0.58 -0.17 0.00 -0.55 0.00 0.00 66.41 64.75 2wci h THR 3 Cb 1.20 1.25 -0.01 0.00 -1.73 0.00 0.00 68.15 68.85 2wci h THR 3 CO 0.62 0.17 -0.66 0.00 -0.25 0.00 0.00 175.52 175.40 2wci h THR 4 N 0.07 1.37 -0.56 6.82 1.03 -1.96 -0.63 112.91 119.04 2wci h THR 4 Ca 0.01 -2.03 -0.03 0.00 -0.01 0.00 0.00 66.41 64.36 2wci h THR 4 Cb 0.29 2.01 -0.03 0.00 -1.07 0.00 0.00 68.15 69.35 2wci h THR 4 CO 0.02 0.61 0.25 0.40 -0.01 0.00 0.00 175.52 176.79 2wci h ILE 5 N 0.29 1.21 -0.71 0.00 1.08 -1.90 -0.54 117.51 116.95 2wci h ILE 5 Ca -0.02 -0.63 0.07 0.00 -0.39 0.00 0.00 64.86 63.89 2wci h ILE 5 Cb 1.22 0.60 -0.06 0.00 -3.07 0.00 0.00 36.82 35.50 2wci h ILE 5 CO 0.11 0.25 0.39 -0.33 -0.69 0.00 0.00 178.15 177.88 2wci h GLU 6 N 0.76 0.68 -0.17 2.37 5.08 -1.18 0.63 114.58 122.76 2wci h GLU 6 Ca 0.19 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2wci h GLU 6 Cb 0.16 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2wci h GLU 6 CO -0.02 0.45 0.09 -0.22 -1.00 0.00 0.00 179.01 178.31 2wci h LYS 7 N 0.70 0.23 -0.82 2.33 3.64 -0.44 -1.91 116.57 120.30 2wci h LYS 7 Ca 0.33 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.74 2wci h LYS 7 Cb 0.24 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.96 2wci h LYS 7 CO -0.21 0.23 0.50 0.82 -2.27 0.00 0.00 179.45 178.53 2wci h ILE 8 N 0.17 1.04 -0.86 2.00 2.04 -0.75 -1.97 117.51 119.18 2wci h ILE 8 Ca 0.06 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 2wci h ILE 8 Cb 0.07 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.15 2wci h ILE 8 CO -0.01 0.17 0.45 1.56 0.00 0.00 0.00 178.15 180.32 2wci h GLN 9 N 0.92 1.21 -0.46 2.37 4.20 -0.59 -1.02 115.11 121.74 2wci h GLN 9 Ca 0.35 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.88 2wci h GLN 9 Cb 0.16 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 2wci h GLN 9 CO -0.17 0.89 0.16 -0.09 -0.67 0.00 0.00 178.83 178.95 2wci h ARG 10 N 1.21 0.70 -0.29 1.46 2.43 -0.92 -0.51 114.38 118.46 2wci h ARG 10 Ca 0.30 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2wci h ARG 10 Cb 0.05 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2wci h ARG 10 CO -0.05 0.66 0.19 1.96 -1.51 0.00 0.00 179.97 181.22 2wci h GLN 11 N 0.60 0.39 -0.38 0.20 4.20 -0.79 0.15 115.11 119.48 2wci h GLN 11 Ca 0.15 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 2wci h GLN 11 Cb 0.24 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2wci h GLN 11 CO -0.01 0.27 -0.27 0.82 -0.67 0.00 0.00 178.83 178.97 2wci h ILE 12 N 0.39 1.28 -0.00 2.54 2.04 -1.14 -1.25 117.51 121.36 2wci h ILE 12 Ca 0.11 -1.41 -0.16 0.00 1.00 0.00 0.00 64.86 64.39 2wci h ILE 12 Cb -0.02 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 2wci h ILE 12 CO -0.02 0.47 -0.74 0.00 0.00 0.00 0.00 178.15 177.86 2wci h ALA 13 N 1.00 0.76 0.00 1.87 0.00 -0.73 -3.29 119.26 118.88 2wci h ALA 13 Ca 0.08 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2wci h ALA 13 Cb 0.81 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2wci h ALA 13 CO 0.07 0.91 -0.80 0.93 0.00 0.00 0.00 179.25 180.36 2wci h GLU 14 N 0.02 0.00 -4.14 0.00 5.08 -0.58 -3.44 114.58 111.52 2wci h GLU 14 Ca -0.01 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.73 2wci h GLU 14 Cb 1.31 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.16 2wci h GLU 14 CO 0.10 0.00 -0.74 -0.80 -1.00 0.00 0.00 179.01 176.57 2wci s ASN 15 N -4.44 4.39 0.50 1.42 0.01 -0.48 -5.00 114.94 111.34 2wci s ASN 15 Ca 0.04 -1.88 0.33 0.00 -0.71 0.00 0.00 52.86 50.65 2wci s ASN 15 Cb 0.13 -1.25 1.54 0.00 0.41 0.00 0.00 41.25 42.08 2wci s ASN 15 CO 0.75 -0.39 2.00 1.55 -1.51 0.00 0.00 177.10 179.50 2wci h PRO 16 N 7.85 0.00 -3.68 -0.60 0.13 -1.86 -3.36 132.00 130.48 2wci h PRO 16 Ca -0.09 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.51 2wci h PRO 16 Cb 1.02 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.75 2wci h PRO 16 CO 0.49 0.00 -0.77 0.42 -0.23 0.00 0.00 178.00 177.92 2wci s ILE 17 N -3.71 0.70 -0.03 -3.56 1.01 -1.26 0.51 121.20 114.86 2wci s ILE 17 Ca -0.00 -0.69 -0.01 0.00 0.00 0.00 0.00 60.65 59.95 2wci s ILE 17 Cb 0.10 -1.18 0.03 0.00 0.01 0.00 0.00 42.46 41.42 2wci s ILE 17 CO 0.45 -0.20 0.04 -0.22 0.00 0.00 0.00 174.94 175.01 2wci s LEU 18 N 1.77 0.67 -0.23 2.97 2.96 -0.49 -1.25 118.68 125.09 2wci s LEU 18 Ca -0.02 0.05 -0.00 0.00 -0.22 0.00 0.00 54.13 53.95 2wci s LEU 18 Cb -0.17 -0.11 0.03 0.00 0.50 0.00 0.00 46.19 46.44 2wci s LEU 18 CO -0.08 -0.18 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.44 2wci s LEU 19 N 1.55 2.86 -0.09 -0.68 2.96 -0.19 -0.80 118.68 124.28 2wci s LEU 19 Ca -0.03 -0.85 -0.25 0.00 -0.22 0.00 0.00 54.13 52.79 2wci s LEU 19 Cb -0.13 -1.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 2wci s LEU 19 CO -0.03 -0.09 0.77 -0.31 -1.32 0.00 0.00 176.35 175.38 2wci s TYR 20 N 1.29 3.54 0.26 5.38 2.02 0.05 -1.44 117.35 128.45 2wci s TYR 20 Ca 0.01 1.30 -0.08 0.00 -0.37 0.00 0.00 57.07 57.93 2wci s TYR 20 Cb -0.16 -2.91 -0.01 0.00 -0.40 0.00 0.00 41.96 38.49 2wci s TYR 20 CO -0.07 -0.03 0.41 0.00 -1.57 0.00 0.00 175.55 174.29 2wci s MET 21 N 1.25 1.56 -0.29 -0.62 0.23 -0.21 -0.97 119.30 120.25 2wci s MET 21 Ca 0.39 -1.44 -0.15 0.00 -1.03 0.00 0.00 55.69 53.46 2wci s MET 21 Cb -0.18 0.43 -0.03 0.00 -1.53 0.00 0.00 34.83 33.52 2wci s MET 21 CO 0.18 -0.63 0.36 0.15 -2.03 0.00 0.00 175.02 173.05 2wci s LYS 22 N -3.82 3.88 1.14 3.16 1.02 -1.26 -1.02 119.74 122.85 2wci s LYS 22 Ca 0.28 -0.10 0.00 0.00 0.02 0.00 0.00 55.97 56.16 2wci s LYS 22 Cb 0.01 -3.70 0.00 0.00 -0.52 0.00 0.00 37.83 33.62 2wci s LYS 22 CO 0.12 -0.35 0.00 0.41 -0.92 0.00 0.00 175.35 174.61 2wci n GLY 23 N 4.78 -1.71 3.54 -3.33 0.00 -1.26 -0.89 105.19 106.32 2wci n GLY 23 Ca -0.09 -1.59 -0.26 0.00 0.00 0.00 0.00 46.02 44.09 2wci n GLY 23 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wci s SER 24 N -4.00 3.72 0.39 1.61 1.04 -0.87 -4.27 113.70 111.33 2wci s SER 24 Ca 0.00 -1.20 0.11 0.00 0.48 0.00 0.00 55.95 55.34 2wci s SER 24 Cb 0.00 -0.35 0.90 0.00 0.10 0.00 0.00 66.02 66.67 2wci s SER 24 CO 0.00 -0.21 1.93 -0.65 0.98 0.00 0.00 173.24 175.29 2wci h PRO 25 N 2.02 0.57 0.00 4.02 0.11 -1.97 -1.08 132.00 135.66 2wci h PRO 25 Ca -0.42 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 2wci h PRO 25 Cb 1.25 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2wci h PRO 25 CO 0.70 0.37 -0.50 0.87 -0.21 0.00 0.00 178.00 179.24 2wci h LYS 26 N 0.58 0.00 -2.11 1.05 1.57 -2.01 -3.40 116.57 112.25 2wci h LYS 26 Ca 0.36 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.58 2wci h LYS 26 Cb 0.60 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 32.54 2wci h LYS 26 CO -0.13 0.50 -1.01 -0.11 -0.57 0.00 0.00 179.45 178.13 2wci n LEU 27 N -3.26 -0.37 -4.78 2.94 7.94 -0.53 -5.13 117.00 113.82 2wci n LEU 27 Ca 0.02 -4.43 -0.34 0.00 -1.11 0.00 0.00 56.01 50.15 2wci n LEU 27 Cb 0.71 0.60 0.02 0.00 0.53 0.00 0.00 43.42 45.29 2wci n LEU 27 CO 0.40 1.95 0.75 -2.16 -1.11 0.00 0.00 177.39 177.23 2wci s PRO 28 N -0.42 3.11 0.00 1.96 0.04 -0.53 -2.04 135.00 137.13 2wci s PRO 28 Ca 0.34 1.45 0.13 0.00 0.04 0.00 0.00 61.00 62.96 2wci s PRO 28 Cb 0.10 -1.99 0.27 0.00 0.04 0.00 0.00 34.50 32.92 2wci s PRO 28 CO -0.16 -1.01 1.16 0.43 0.04 0.00 0.00 177.00 177.46 2wci n SER 29 N -1.89 2.73 -3.64 6.66 7.64 -0.07 -4.87 113.62 120.19 2wci n SER 29 Ca 0.11 -1.83 -0.10 0.00 1.01 0.00 0.00 58.87 58.06 2wci n SER 29 Cb 0.52 -0.17 -0.07 0.00 -1.01 0.00 0.00 64.21 63.48 2wci n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wci h GLY 31 N 5.58 0.80 1.00 0.00 0.00 -1.96 0.44 103.07 108.92 2wci h GLY 31 Ca -0.29 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 2wci h GLY 31 CO 0.10 0.14 0.33 0.74 0.00 0.00 0.00 176.54 177.85 2wci h PHE 32 N 0.57 0.88 -0.28 5.60 0.04 -1.97 0.00 116.94 121.79 2wci h PHE 32 Ca 0.32 -0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.91 2wci h PHE 32 Cb 0.47 -0.28 -0.00 0.00 2.20 0.00 0.00 35.95 38.34 2wci h PHE 32 CO -0.00 0.65 -0.40 0.77 -0.60 0.00 0.00 178.31 178.73 2wci h SER 33 N 0.86 0.83 -0.12 2.17 0.02 -1.67 -2.52 113.55 113.12 2wci h SER 33 Ca 0.22 -0.51 0.02 0.00 -0.84 0.00 0.00 61.79 60.69 2wci h SER 33 Cb 0.07 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 2wci h SER 33 CO -0.03 1.18 -0.03 0.00 -1.14 0.00 0.00 176.83 176.81 2wci h ALA 34 N 0.68 0.08 -0.28 3.77 0.00 -0.74 -1.04 119.26 121.72 2wci h ALA 34 Ca 0.03 0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2wci h ALA 34 Cb 0.99 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2wci h ALA 34 CO 0.09 -0.48 0.14 1.96 0.00 0.00 0.00 179.25 180.95 2wci h GLN 35 N 0.00 0.28 -0.62 0.00 4.20 -1.03 -1.16 115.11 116.79 2wci h GLN 35 Ca 0.06 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 2wci h GLN 35 Cb 0.09 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 2wci h GLN 35 CO -0.12 0.18 0.29 0.00 -0.67 0.00 0.00 178.83 178.51 2wci h ALA 36 N 1.15 0.80 -0.14 3.87 0.00 -1.36 -2.33 119.26 121.25 2wci h ALA 36 Ca 0.12 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 2wci h ALA 36 Cb 0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2wci h ALA 36 CO -0.09 0.37 -0.46 -0.39 0.00 0.00 0.00 179.25 178.69 2wci h VAL 37 N 0.85 1.32 0.12 0.00 -1.51 -1.00 -0.40 116.25 115.63 2wci h VAL 37 Ca 0.21 -1.65 -0.01 0.00 -1.23 0.00 0.00 66.70 64.03 2wci h VAL 37 Cb 0.14 1.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 2wci h VAL 37 CO -0.02 0.50 -0.06 -0.61 -1.23 0.00 0.00 177.57 176.14 2wci h GLN 38 N 0.27 -0.16 -0.73 5.19 4.15 -1.08 0.35 115.11 123.11 2wci h GLN 38 Ca 0.02 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.45 2wci h GLN 38 Cb 0.91 0.04 -0.04 0.00 0.21 0.00 0.00 27.48 28.61 2wci h GLN 38 CO 0.08 0.07 0.46 0.00 -1.93 0.00 0.00 178.83 177.50 2wci h ALA 39 N 0.48 0.93 0.09 3.38 0.00 -1.31 -0.67 119.26 122.16 2wci h ALA 39 Ca -0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 2wci h ALA 39 Cb 0.30 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2wci h ALA 39 CO 0.03 0.39 -0.04 1.25 0.00 0.00 0.00 179.25 180.87 2wci h LEU 40 N 1.00 -0.10 -1.24 0.00 5.85 -0.96 -3.09 115.31 116.78 2wci h LEU 40 Ca 0.26 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.75 2wci h LEU 40 Cb -0.06 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 2wci h LEU 40 CO -0.05 0.21 0.52 0.00 -0.34 0.00 0.00 178.44 178.78 2wci h ALA 41 N 0.46 1.48 0.00 1.25 0.00 -0.84 -0.74 119.26 120.86 2wci h ALA 41 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2wci h ALA 41 Cb 0.35 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2wci h ALA 41 CO 0.02 0.47 0.00 0.00 0.00 0.00 0.00 179.25 179.73 2wci h ALA 42 N 1.52 1.00 0.00 0.00 0.00 -1.03 -1.09 119.26 119.66 2wci h ALA 42 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2wci h ALA 42 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2wci h ALA 42 CO -0.08 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.17 2wci n GLY 44 N 0.25 0.43 3.45 0.00 0.00 -0.41 -4.87 105.19 104.03 2wci n GLY 44 Ca 0.02 -1.00 -0.25 0.00 0.00 0.00 0.00 46.02 44.79 2wci n GLY 44 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wci s GLU 45 N -2.06 1.60 0.33 1.61 0.41 -1.26 -5.10 118.70 114.23 2wci s GLU 45 Ca 0.00 -1.67 -0.29 0.00 -0.41 0.00 0.00 54.97 52.60 2wci s GLU 45 Cb 0.00 -1.78 -0.11 0.00 -1.78 0.00 0.00 34.13 30.46 2wci s GLU 45 CO 0.00 0.35 1.51 0.50 -0.49 0.00 0.00 175.26 177.14 2wci s ARG 46 N -3.17 4.14 0.04 1.61 3.52 -1.26 -4.93 118.95 118.91 2wci s ARG 46 Ca 0.26 2.53 0.01 0.00 -0.13 0.00 0.00 55.73 58.40 2wci s ARG 46 Cb -0.06 -3.01 -0.03 0.00 -1.56 0.00 0.00 34.95 30.29 2wci s ARG 46 CO 0.13 -0.54 -0.05 -0.59 -0.81 0.00 0.00 175.30 173.43 2wci s PHE 47 N -0.59 0.54 0.13 5.12 -0.12 -1.26 -4.84 117.98 116.96 2wci s PHE 47 Ca 0.57 -0.64 0.03 0.00 -0.05 0.00 0.00 56.93 56.84 2wci s PHE 47 Cb -0.46 -0.34 -0.04 0.00 -0.63 0.00 0.00 43.02 41.55 2wci s PHE 47 CO 0.55 -0.17 0.22 0.00 -0.05 0.00 0.00 175.22 175.77 2wci s ALA 48 N -2.04 3.84 0.11 1.99 0.00 -0.38 -5.02 121.76 120.25 2wci s ALA 48 Ca -0.07 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 50.88 2wci s ALA 48 Cb -0.06 -1.65 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 2wci s ALA 48 CO -0.02 0.59 -0.10 1.52 0.00 0.00 0.00 175.76 177.75 2wci s TYR 49 N -1.68 1.07 -0.08 0.00 -0.85 -1.26 -1.03 117.35 113.53 2wci s TYR 49 Ca 0.33 -0.71 0.02 0.00 -0.52 0.00 0.00 57.07 56.19 2wci s TYR 49 Cb -0.11 -0.58 0.02 0.00 0.38 0.00 0.00 41.96 41.66 2wci s TYR 49 CO 0.27 -0.00 -0.12 0.08 -1.52 0.00 0.00 175.55 174.25 2wci s VAL 50 N -2.74 1.17 -0.60 -3.49 1.01 -0.52 -4.92 120.40 110.30 2wci s VAL 50 Ca 0.08 -0.46 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 2wci s VAL 50 Cb -0.01 -1.09 0.06 0.00 0.00 0.00 0.00 36.38 35.34 2wci s VAL 50 CO -0.00 0.37 0.94 -0.62 0.00 0.00 0.00 175.10 175.78 2wci s ASP 51 N 0.94 6.25 0.00 3.32 -1.08 -1.26 -1.04 116.67 123.80 2wci s ASP 51 Ca -0.09 -0.69 0.16 0.00 -0.52 0.00 0.00 52.55 51.41 2wci s ASP 51 Cb -0.15 -2.42 0.69 0.00 -1.46 0.00 0.00 42.92 39.58 2wci s ASP 51 CO 0.00 -1.32 1.49 2.30 0.52 0.00 0.00 175.17 178.17 2wci n ILE 52 N 6.03 0.85 1.29 4.11 -6.64 -0.19 -1.16 119.36 123.66 2wci n ILE 52 Ca -0.01 0.21 0.14 0.00 -1.77 0.00 0.00 62.75 61.32 2wci n ILE 52 Cb 0.46 -0.94 0.69 0.00 -1.44 0.00 0.00 39.64 38.41 2wci n ILE 52 CO 0.00 0.00 0.00 0.18 -1.77 0.00 0.00 176.55 174.96 2wci n LEU 53 N -1.46 0.07 -0.58 7.28 4.77 -1.26 -2.71 117.00 123.11 2wci n LEU 53 Ca 0.04 0.30 0.05 0.00 -0.03 0.00 0.00 56.01 56.38 2wci n LEU 53 Cb 0.17 -0.33 0.14 0.00 -2.33 0.00 0.00 43.42 41.07 2wci n LEU 53 CO 0.14 0.01 0.62 0.00 -1.33 0.00 0.00 177.39 176.83 2wci n GLN 54 N -1.32 2.89 -3.26 3.23 1.13 -0.31 -4.80 117.38 114.94 2wci n GLN 54 Ca 0.12 -2.02 -0.24 0.00 -1.94 0.00 0.00 57.00 52.91 2wci n GLN 54 Cb 0.28 -1.26 -0.08 0.00 0.11 0.00 0.00 30.24 29.29 2wci n GLN 54 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2wci n ASN 55 N 0.36 -0.35 0.10 1.08 3.02 -1.10 -4.99 115.26 113.38 2wci n ASN 55 Ca 0.11 -2.56 0.10 0.00 -0.03 0.00 0.00 54.58 52.19 2wci n ASN 55 Cb 0.42 -0.46 0.57 0.00 -0.61 0.00 0.00 39.78 39.71 2wci n ASN 55 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2wci h PRO 56 N 4.83 0.20 -0.35 3.52 0.11 -1.87 -1.19 132.00 137.25 2wci h PRO 56 Ca 0.16 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.23 2wci h PRO 56 Cb 0.91 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 2wci h PRO 56 CO 0.40 0.13 0.12 0.38 -0.21 0.00 0.00 178.00 178.82 2wci h ASP 57 N 0.21 0.50 -0.38 -2.05 2.03 -1.94 -1.78 116.42 113.01 2wci h ASP 57 Ca 0.12 -0.20 -0.07 0.00 -0.73 0.00 0.00 57.03 56.16 2wci h ASP 57 Cb 0.23 -0.13 -0.01 0.00 -0.83 0.00 0.00 39.33 38.59 2wci h ASP 57 CO -0.02 0.56 -0.03 0.40 -1.03 0.00 0.00 179.24 179.12 2wci h ILE 58 N 0.41 1.27 -1.00 4.15 2.04 -1.69 -1.44 117.51 121.24 2wci h ILE 58 Ca 0.11 -1.06 0.15 0.00 1.00 0.00 0.00 64.86 65.06 2wci h ILE 58 Cb 0.24 1.19 -0.09 0.00 -0.74 0.00 0.00 36.82 37.42 2wci h ILE 58 CO -0.00 0.35 0.62 -0.09 0.00 0.00 0.00 178.15 179.03 2wci h ARG 59 N 0.50 0.87 -0.14 2.37 2.43 -1.12 0.22 114.38 119.51 2wci h ARG 59 Ca 0.10 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 2wci h ARG 59 Cb 0.52 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 2wci h ARG 59 CO 0.03 0.58 -0.44 0.00 -1.51 0.00 0.00 179.97 178.62 2wci h ALA 60 N 1.58 0.24 0.00 2.80 0.00 -1.14 -3.39 119.26 119.34 2wci h ALA 60 Ca 0.53 -0.48 -0.28 0.00 0.00 0.00 0.00 54.91 54.68 2wci h ALA 60 Cb 0.65 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2wci h ALA 60 CO -0.31 0.37 -2.04 0.39 0.00 0.00 0.00 179.25 177.66 2wci n GLU 61 N -4.26 0.66 -0.22 0.00 -0.58 -0.56 -4.56 120.64 111.12 2wci n GLU 61 Ca -0.07 0.07 -0.05 0.00 -0.42 0.00 0.00 57.16 56.70 2wci n GLU 61 Cb 0.56 -1.63 0.12 0.00 -0.57 0.00 0.00 31.44 29.92 2wci n GLU 61 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2wci h LEU 62 N 0.00 0.97 -0.41 -4.62 5.85 -1.15 -2.71 115.31 113.24 2wci h LEU 62 Ca -0.37 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.24 2wci h LEU 62 Cb 1.94 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.68 2wci h LEU 62 CO 0.04 0.89 0.17 -0.65 -0.34 0.00 0.00 178.44 178.55 2wci h PRO 63 N 1.02 0.34 -0.58 5.25 0.11 -1.80 0.29 132.00 136.63 2wci h PRO 63 Ca 0.23 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.25 2wci h PRO 63 Cb 0.25 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 2wci h PRO 63 CO -0.01 0.22 0.11 0.87 -0.21 0.00 0.00 178.00 178.98 2wci h LYS 64 N 0.35 0.95 -0.68 1.05 1.57 -1.81 -0.96 116.57 117.03 2wci h LYS 64 Ca 0.19 -0.24 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 2wci h LYS 64 Cb 0.14 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2wci h LYS 64 CO -0.17 0.89 0.26 -0.92 -0.57 0.00 0.00 179.45 178.95 2wci h TYR 65 N 0.85 1.05 0.00 -1.35 3.20 -1.07 -2.88 116.97 116.76 2wci h TYR 65 Ca 0.18 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.97 2wci h TYR 65 Cb 0.39 -0.31 0.00 0.00 1.54 0.00 0.00 36.73 38.35 2wci h TYR 65 CO 0.03 0.82 0.00 0.00 -1.64 0.00 0.00 178.16 177.37 2wci n ALA 66 N -2.40 2.22 -3.80 1.82 0.00 0.98 -4.92 120.51 114.41 2wci n ALA 66 Ca 0.05 -0.04 -0.25 0.00 0.00 0.00 0.00 53.44 53.20 2wci n ALA 66 Cb 0.18 -1.45 0.03 0.00 0.00 0.00 0.00 19.45 18.20 2wci n ALA 66 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wci n ASN 67 N -1.98 -2.56 -3.19 0.00 4.13 -0.47 -4.97 115.26 106.22 2wci n ASN 67 Ca 0.06 -0.82 0.03 0.00 1.68 0.00 0.00 54.58 55.53 2wci n ASN 67 Cb 0.37 -3.92 -0.02 0.00 -1.54 0.00 0.00 39.78 34.68 2wci n ASN 67 CO 0.00 0.00 0.00 0.86 0.28 0.00 0.00 177.26 178.40 2wci s TRP 68 N -3.54 -1.53 -0.67 3.10 -0.11 -0.61 -5.05 118.94 110.53 2wci s TRP 68 Ca 0.27 1.67 0.22 0.00 1.22 0.00 0.00 56.10 59.47 2wci s TRP 68 Cb -0.13 0.53 0.88 0.00 -1.50 0.00 0.00 33.47 33.24 2wci s TRP 68 CO 0.82 -0.85 1.66 -0.35 -4.62 0.00 0.00 176.95 173.61 2wci n PRO 69 N 5.42 0.14 -4.36 5.86 -0.04 -1.26 -4.23 135.00 136.53 2wci n PRO 69 Ca -0.02 0.33 -0.18 0.00 -0.04 0.00 0.00 63.50 63.59 2wci n PRO 69 Cb 0.51 -1.75 -0.10 0.00 -0.04 0.00 0.00 33.50 32.12 2wci n PRO 69 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2wci s THR 70 N -3.19 1.07 0.08 0.52 -4.23 -1.26 -4.86 115.64 103.76 2wci s THR 70 Ca 0.06 -2.03 0.08 0.00 -1.18 0.00 0.00 61.69 58.62 2wci s THR 70 Cb 0.10 -2.46 -0.04 0.00 1.34 0.00 0.00 72.50 71.44 2wci s THR 70 CO 0.39 -0.23 -0.19 -0.36 -0.54 0.00 0.00 174.62 173.69 2wci s PHE 71 N -3.39 2.53 0.71 3.99 0.08 -1.26 -4.47 117.98 116.17 2wci s PHE 71 Ca 0.31 -0.27 -0.11 0.00 0.12 0.00 0.00 56.93 56.98 2wci s PHE 71 Cb 0.06 -1.40 0.02 0.00 -0.57 0.00 0.00 43.02 41.13 2wci s PHE 71 CO 0.11 0.31 1.10 -1.25 -0.10 0.00 0.00 175.22 175.38 2wci s PRO 72 N -1.75 2.80 -0.09 0.24 0.04 -1.26 -4.78 135.00 130.19 2wci s PRO 72 Ca 0.16 0.42 0.00 0.00 0.04 0.00 0.00 61.00 61.63 2wci s PRO 72 Cb -0.10 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.43 2wci s PRO 72 CO 0.07 -1.07 -0.08 -0.65 0.04 0.00 0.00 177.00 175.31 2wci s GLN 73 N -5.37 1.50 -0.25 4.56 -0.21 -0.15 -4.14 119.66 115.61 2wci s GLN 73 Ca 0.58 -0.28 -0.11 0.00 0.02 0.00 0.00 55.36 55.57 2wci s GLN 73 Cb -0.11 -1.47 -0.05 0.00 1.00 0.00 0.00 33.01 32.38 2wci s GLN 73 CO 0.51 -0.18 0.21 -1.17 -2.12 0.00 0.00 175.29 172.55 2wci s LEU 74 N 1.38 4.08 -0.14 2.90 2.96 -0.57 -0.77 118.68 128.52 2wci s LEU 74 Ca -0.01 0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 54.00 2wci s LEU 74 Cb -0.14 -2.17 -0.02 0.00 0.50 0.00 0.00 46.19 44.36 2wci s LEU 74 CO -0.04 -0.01 -0.09 0.26 -1.32 0.00 0.00 176.35 175.15 2wci s TRP 75 N 1.39 2.91 -0.12 5.38 0.52 0.02 -0.05 118.94 128.98 2wci s TRP 75 Ca 0.09 -0.50 -0.00 0.00 0.02 0.00 0.00 56.10 55.71 2wci s TRP 75 Cb -0.15 -1.90 0.03 0.00 -1.15 0.00 0.00 33.47 30.30 2wci s TRP 75 CO 0.07 -0.14 -0.09 0.08 0.02 0.00 0.00 176.95 176.89 2wci s VAL 76 N 0.38 1.13 -1.45 4.03 1.01 0.17 -1.40 120.40 124.28 2wci s VAL 76 Ca -0.07 -0.37 -0.10 0.00 0.00 0.00 0.00 61.98 61.43 2wci s VAL 76 Cb -0.15 -1.14 0.05 0.00 0.00 0.00 0.00 36.38 35.14 2wci s VAL 76 CO 0.04 0.37 0.96 -0.67 0.00 0.00 0.00 175.10 175.80 2wci n ASP 77 N 4.91 -4.18 0.00 3.32 -0.08 0.18 -1.77 116.55 118.93 2wci n ASP 77 Ca -0.13 -0.75 0.00 0.00 -1.51 0.00 0.00 54.79 52.40 2wci n ASP 77 Cb 0.50 -4.14 0.00 0.00 2.34 0.00 0.00 41.12 39.82 2wci n ASP 77 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2wci n GLY 78 N -1.70 0.98 3.49 0.27 0.00 -1.26 -5.04 105.19 101.93 2wci n GLY 78 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 2wci n GLY 78 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wci s GLU 79 N -0.04 2.63 -0.27 1.61 2.12 -0.73 -5.06 118.70 118.96 2wci s GLU 79 Ca 0.00 -0.66 -0.29 0.00 0.36 0.00 0.00 54.97 54.38 2wci s GLU 79 Cb 0.00 -2.45 0.00 0.00 0.26 0.00 0.00 34.13 31.95 2wci s GLU 79 CO 0.00 0.60 1.20 -1.17 -0.54 0.00 0.00 175.26 175.35 2wci s LEU 80 N -0.65 3.98 -0.05 2.70 2.96 -1.26 -0.66 118.68 125.70 2wci s LEU 80 Ca 0.10 1.28 -0.25 0.00 -0.22 0.00 0.00 54.13 55.03 2wci s LEU 80 Cb -0.11 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.81 2wci s LEU 80 CO 0.01 -0.92 1.07 0.58 -1.32 0.00 0.00 176.35 175.77 2wci h VAL 81 N 5.75 1.54 0.00 1.68 2.07 -0.82 -3.48 116.25 122.98 2wci h VAL 81 Ca -0.24 -1.75 0.00 0.00 0.82 0.00 0.00 66.70 65.53 2wci h VAL 81 Cb 1.08 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.50 2wci h VAL 81 CO 1.02 0.47 0.00 0.61 0.02 0.00 0.00 177.57 179.69 2wci n GLY 82 N 0.86 0.12 0.00 2.17 0.00 -1.22 -4.94 105.19 102.18 2wci n GLY 82 Ca -0.09 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2wci n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wci n GLY 83 N 0.00 3.75 0.24 -0.02 0.00 -1.26 -1.51 105.19 106.39 2wci n GLY 83 Ca 0.00 -1.83 -0.15 0.00 0.00 0.00 0.00 46.02 44.03 2wci n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wci h ASP 85 N -0.52 0.06 0.11 0.00 3.32 -1.96 -0.35 116.42 117.08 2wci h ASP 85 Ca -0.04 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 2wci h ASP 85 Cb 0.42 0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.03 2wci h ASP 85 CO 0.06 0.07 -0.05 0.40 -1.72 0.00 0.00 179.24 177.99 2wci h ILE 86 N 0.22 0.94 -0.50 0.35 2.04 -1.93 -1.55 117.51 117.08 2wci h ILE 86 Ca 0.16 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.86 2wci h ILE 86 Cb 0.17 1.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 2wci h ILE 86 CO -0.20 0.05 0.27 0.58 0.00 0.00 0.00 178.15 178.85 2wci h VAL 87 N -0.24 0.99 -0.20 1.67 2.07 -1.04 -0.12 116.25 119.38 2wci h VAL 87 Ca -0.02 -0.18 -0.18 0.00 0.82 0.00 0.00 66.70 67.15 2wci h VAL 87 Cb 0.20 0.42 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2wci h VAL 87 CO 0.03 0.10 -0.59 0.16 0.02 0.00 0.00 177.57 177.29 2wci h ILE 88 N 0.53 1.31 -0.08 4.57 -0.00 -1.04 -1.17 117.51 121.63 2wci h ILE 88 Ca 0.21 -1.83 0.02 0.00 -0.00 0.00 0.00 64.86 63.26 2wci h ILE 88 Cb 0.09 1.78 -0.02 0.00 -0.00 0.00 0.00 36.82 38.67 2wci h ILE 88 CO -0.13 0.57 -0.04 -0.08 -0.00 0.00 0.00 178.15 178.48 2wci h GLU 89 N 0.49 -0.03 -0.99 0.16 4.22 -0.92 0.16 114.58 117.67 2wci h GLU 89 Ca 0.00 0.00 0.11 0.00 0.08 0.00 0.00 59.36 59.55 2wci h GLU 89 Cb 1.16 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 30.34 2wci h GLU 89 CO 0.12 -0.02 0.63 0.52 -2.18 0.00 0.00 179.01 178.07 2wci h MET 90 N -0.03 0.96 -0.35 1.92 2.86 -0.84 -0.13 114.93 119.32 2wci h MET 90 Ca 0.04 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.59 2wci h MET 90 Cb 0.09 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 2wci h MET 90 CO -0.10 0.64 0.07 -0.92 1.06 0.00 0.00 176.91 177.66 2wci h TYR 91 N 0.99 0.61 -0.99 -0.22 3.20 -0.49 0.81 116.97 120.88 2wci h TYR 91 Ca 0.48 -0.08 0.08 0.00 3.14 0.00 0.00 58.73 62.35 2wci h TYR 91 Cb 0.45 -0.17 -0.07 0.00 1.54 0.00 0.00 36.73 38.48 2wci h TYR 91 CO -0.00 0.62 0.64 1.96 -1.64 0.00 0.00 178.16 179.73 2wci h GLN 92 N 0.42 1.06 -0.00 1.82 1.08 0.98 -1.65 115.11 118.82 2wci h GLN 92 Ca 0.11 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 2wci h GLN 92 Cb 0.33 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 2wci h GLN 92 CO 0.00 0.70 -0.10 0.54 -0.95 0.00 0.00 178.83 179.03 2wci n ARG 93 N -4.53 0.21 -0.76 1.46 1.74 -0.30 -4.92 116.66 109.56 2wci n ARG 93 Ca 0.16 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2wci n ARG 93 Cb 0.24 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2wci n ARG 93 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wci n GLY 94 N 1.42 0.84 0.10 -0.13 0.00 -0.62 -4.93 105.19 101.87 2wci n GLY 94 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 2wci n GLY 94 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2wci h GLU 95 N 3.20 0.22 -0.40 1.61 4.57 -1.12 -3.13 114.58 119.53 2wci h GLU 95 Ca 0.00 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 57.82 2wci h GLU 95 Cb 0.00 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2wci h GLU 95 CO 0.00 1.15 0.22 1.25 -1.18 0.00 0.00 179.01 180.45 2wci h LEU 96 N 0.07 0.50 -0.85 1.64 5.85 -1.72 -0.85 115.31 119.95 2wci h LEU 96 Ca -0.10 -0.09 0.14 0.00 0.84 0.00 0.00 57.88 58.68 2wci h LEU 96 Cb 1.88 -0.13 -0.09 0.00 0.37 0.00 0.00 40.66 42.69 2wci h LEU 96 CO 0.18 0.44 0.44 1.56 -0.34 0.00 0.00 178.44 180.72 2wci h GLN 97 N 0.52 0.62 -0.06 1.25 7.50 -1.81 -0.41 115.11 122.72 2wci h GLN 97 Ca 0.14 -0.04 -0.04 0.00 0.50 0.00 0.00 58.65 59.21 2wci h GLN 97 Cb 0.05 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.44 2wci h GLN 97 CO -0.02 0.41 -0.12 1.96 -1.50 0.00 0.00 178.83 179.56 2wci h GLN 98 N 0.64 0.18 -0.50 1.46 4.20 -1.41 -0.39 115.11 119.29 2wci h GLN 98 Ca 0.46 -0.12 0.08 0.00 0.06 0.00 0.00 58.65 59.13 2wci h GLN 98 Cb 0.62 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.35 2wci h GLN 98 CO -0.35 0.71 0.13 1.25 -0.67 0.00 0.00 178.83 179.90 2wci h LEU 99 N -0.32 0.07 -0.21 1.46 5.85 -0.91 -0.94 115.31 120.31 2wci h LEU 99 Ca 0.00 0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.68 2wci h LEU 99 Cb 0.71 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.83 2wci h LEU 99 CO 0.03 0.07 -0.33 0.40 -0.34 0.00 0.00 178.44 178.26 2wci h ILE 100 N 0.28 1.33 -0.28 4.05 1.08 -1.07 -1.12 117.51 121.77 2wci h ILE 100 Ca 0.25 -1.54 0.04 0.00 -0.39 0.00 0.00 64.86 63.22 2wci h ILE 100 Cb 0.31 1.81 -0.04 0.00 -3.07 0.00 0.00 36.82 35.84 2wci h ILE 100 CO -0.30 0.48 0.06 0.50 -0.69 0.00 0.00 178.15 178.20 2wci h LYS 101 N 0.27 0.17 -0.53 2.37 3.64 -0.91 -0.59 116.57 120.99 2wci h LYS 101 Ca 0.02 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.28 2wci h LYS 101 Cb 0.92 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.68 2wci h LYS 101 CO 0.08 0.11 -0.10 0.93 -2.27 0.00 0.00 179.45 178.20 2wci h GLU 102 N 0.17 1.00 -0.10 1.90 5.08 -1.13 -1.83 114.58 119.67 2wci h GLU 102 Ca 0.13 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 2wci h GLU 102 Cb 0.13 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2wci h GLU 102 CO -0.17 1.03 0.04 1.15 -1.00 0.00 0.00 179.01 180.07 2wci h THR 103 N 0.89 0.99 -0.80 1.13 2.02 -0.96 -0.80 112.91 115.38 2wci h THR 103 Ca 0.14 -0.03 0.01 0.00 0.77 0.00 0.00 66.41 67.30 2wci h THR 103 Cb 0.65 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.90 2wci h THR 103 CO 0.05 0.02 0.53 0.00 0.37 0.00 0.00 175.52 176.49 2wci h ALA 104 N 1.05 1.44 -0.51 6.16 0.00 -0.99 -2.48 119.26 123.92 2wci h ALA 104 Ca 0.04 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2wci h ALA 104 Cb 0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2wci h ALA 104 CO -0.03 0.52 -0.09 0.00 0.00 0.00 0.00 179.25 179.64 2wci h ALA 105 N 1.50 0.87 -0.07 0.00 0.00 -1.06 -1.82 119.26 118.68 2wci h ALA 105 Ca 0.30 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2wci h ALA 105 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2wci h ALA 105 CO -0.07 0.65 -0.12 -0.22 0.00 0.00 0.00 179.25 179.49 2wci h LYS 106 N 0.84 0.11 -0.19 0.00 3.64 -0.70 -3.08 116.57 117.19 2wci h LYS 106 Ca 0.14 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2wci h LYS 106 Cb 0.63 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2wci h LYS 106 CO 0.04 0.24 0.00 0.66 -2.27 0.00 0.00 179.45 178.12 2wci n TYR 107 N -4.34 0.24 -2.33 1.91 4.01 -1.07 -4.98 117.16 110.59 2wci n TYR 107 Ca -0.02 -0.17 -0.41 0.00 -0.16 0.00 0.00 57.90 57.14 2wci n TYR 107 Cb 0.22 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.22 2wci n TYR 107 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2wci s LYS 108 N -1.28 4.46 0.00 -0.72 2.47 -0.70 -4.93 119.74 119.04 2wci s LYS 108 Ca 0.25 1.92 0.00 0.00 -1.56 0.00 0.00 55.97 56.58 2wci s LYS 108 Cb 0.16 -3.23 0.00 0.00 -1.46 0.00 0.00 37.83 33.30 2wci s LYS 108 CO 0.22 -0.13 0.00 -1.13 0.16 0.00 0.00 175.35 174.47 2wci n SER 109 N 2.54 0.00 -4.78 1.43 3.41 -1.26 -5.05 113.62 109.91 2wci n SER 109 Ca 0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.32 2wci n SER 109 Cb 0.44 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.41 2wci n SER 109 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2wci s GLU 110 N 0.00 3.14 0.03 4.33 1.03 -1.26 -5.06 118.70 120.91 2wci s GLU 110 Ca 0.00 1.38 0.04 0.00 0.03 0.00 0.00 54.97 56.43 2wci s GLU 110 Cb 0.00 -2.00 -0.02 0.00 -0.80 0.00 0.00 34.13 31.31 2wci s GLU 110 CO 0.00 -0.98 -0.12 -1.21 -1.33 0.00 0.00 175.26 171.62 2wci s GLU 111 N -3.84 0.86 0.52 -4.83 0.41 -1.26 -5.13 118.70 105.42 2wci s GLU 111 Ca 0.67 -0.67 -0.20 0.00 -0.41 0.00 0.00 54.97 54.37 2wci s GLU 111 Cb -0.20 -0.83 -0.07 0.00 -1.78 0.00 0.00 34.13 31.25 2wci s GLU 111 CO 0.35 0.21 1.07 -1.25 -0.49 0.00 0.00 175.26 175.15 2wci s PRO 112 N -1.00 3.60 0.00 0.39 0.04 -1.26 -5.32 135.00 131.45 2wci s PRO 112 Ca 0.01 1.43 0.00 0.00 0.04 0.00 0.00 61.00 62.48 2wci s PRO 112 Cb -0.07 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.41 2wci s PRO 112 CO 0.01 -0.61 0.00 -0.25 0.04 0.00 0.00 177.00 176.19