#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wlo n VAL 2 N 0.00 1.99 -1.52 1.12 0.31 -1.26 -4.73 118.33 114.24 1wlo n VAL 2 Ca 0.00 -0.50 -0.30 0.00 -0.01 0.00 0.00 64.34 63.53 1wlo n VAL 2 Cb 0.00 -0.75 0.18 0.00 -0.91 0.00 0.00 33.84 32.37 1wlo n VAL 2 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1wlo s PRO 3 N -1.50 0.24 -0.07 5.55 0.04 -1.26 -4.83 135.00 133.17 1wlo s PRO 3 Ca 0.61 -0.05 -0.17 0.00 0.04 0.00 0.00 61.00 61.43 1wlo s PRO 3 Cb -0.71 -1.77 -0.12 0.00 0.04 0.00 0.00 34.50 31.94 1wlo s PRO 3 CO 0.59 -2.74 0.64 -1.00 0.04 0.00 0.00 177.00 174.53 1wlo h PRO 4 N -1.88 -0.20 -1.58 0.56 0.13 -1.92 0.31 132.00 127.41 1wlo h PRO 4 Ca -0.47 0.01 0.49 0.00 -0.87 0.00 0.00 66.00 65.17 1wlo h PRO 4 Cb 1.29 0.05 -0.10 0.00 0.13 0.00 0.00 31.00 32.37 1wlo h PRO 4 CO 0.45 0.16 1.10 1.63 -0.23 0.00 0.00 178.00 181.11 1wlo n LYS 5 N -4.90 -0.01 -0.05 0.86 4.76 -1.26 0.19 118.16 117.75 1wlo n LYS 5 Ca -0.06 1.06 -0.03 0.00 -2.87 0.00 0.00 58.31 56.41 1wlo n LYS 5 Cb 0.23 -2.28 -0.01 0.00 -1.84 0.00 0.00 35.03 31.13 1wlo n LYS 5 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1wlo h LEU 6 N 0.00 0.00 -1.90 -0.35 6.46 -1.68 -3.12 115.31 114.73 1wlo h LEU 6 Ca 0.84 0.00 0.47 0.00 -0.12 0.00 0.00 57.88 59.07 1wlo h LEU 6 Cb 3.10 0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 42.95 1wlo h LEU 6 CO -0.19 0.50 1.14 0.50 -0.62 0.00 0.00 178.44 179.77 1wlo h LYS 7 N -0.71 0.02 -0.10 1.25 1.63 0.14 1.67 116.57 120.48 1wlo h LYS 7 Ca 0.00 -0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 1wlo h LYS 7 Cb 0.30 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.93 1wlo h LYS 7 CO 0.00 0.01 -0.40 1.96 -3.45 0.00 0.00 179.45 177.58 1wlo h GLN 8 N 0.02 0.44 0.69 1.90 1.08 0.20 -1.69 115.11 117.76 1wlo h GLN 8 Ca 0.79 -0.35 -0.03 0.00 -1.45 0.00 0.00 58.65 57.61 1wlo h GLN 8 Cb 3.06 0.07 0.01 0.00 -0.05 0.00 0.00 27.48 30.57 1wlo h GLN 8 CO -0.08 0.98 -0.33 0.00 -0.95 0.00 0.00 178.83 178.45 1wlo h ALA 9 N 0.47 -0.92 -0.38 3.87 0.00 0.24 0.75 119.26 123.28 1wlo h ALA 9 Ca -0.02 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.74 1wlo h ALA 9 Cb 1.04 0.36 -0.09 0.00 0.00 0.00 0.00 17.79 19.10 1wlo h ALA 9 CO 0.08 -0.91 -0.40 -0.07 0.00 0.00 0.00 179.25 177.95 1wlo h LEU 10 N -1.15 -1.34 0.45 0.00 3.38 -0.71 1.62 115.31 117.55 1wlo h LEU 10 Ca -0.09 0.21 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1wlo h LEU 10 Cb 0.74 0.59 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1wlo h LEU 10 CO 0.16 -0.36 -0.25 -0.33 0.09 0.00 0.00 178.44 177.74 1wlo h GLU 11 N -0.32 -0.62 -0.68 1.13 5.08 -1.29 0.38 114.58 118.25 1wlo h GLU 11 Ca 0.14 0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.65 1wlo h GLU 11 Cb 0.58 0.14 -0.12 0.00 0.50 0.00 0.00 28.75 29.85 1wlo h GLU 11 CO -0.55 -0.42 -0.41 1.25 -1.00 0.00 0.00 179.01 177.89 1wlo h LEU 12 N -0.65 -1.43 -0.12 1.33 5.85 0.87 0.15 115.31 121.31 1wlo h LEU 12 Ca -0.06 0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.94 1wlo h LEU 12 Cb 0.51 0.68 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 1wlo h LEU 12 CO 0.08 -0.31 -0.36 0.15 -0.34 0.00 0.00 178.44 177.65 1wlo h PHE 13 N -0.16 -1.09 -0.60 1.25 3.57 0.25 1.58 116.94 121.73 1wlo h PHE 13 Ca 0.22 0.04 0.17 0.00 3.53 0.00 0.00 57.97 61.94 1wlo h PHE 13 Cb 0.56 0.49 -0.02 0.00 2.79 0.00 0.00 35.95 39.77 1wlo h PHE 13 CO -0.74 -0.36 0.66 -0.22 -2.23 0.00 0.00 178.31 175.43 1wlo h LYS 14 N -0.37 0.00 0.16 1.11 3.64 0.22 0.92 116.57 122.26 1wlo h LYS 14 Ca 0.03 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.08 1wlo h LYS 14 Cb 0.44 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1wlo h LYS 14 CO -0.31 0.00 -1.60 1.03 -2.27 0.00 0.00 179.45 176.30 1wlo h SER 15 N 0.00 0.54 -3.27 4.20 0.87 0.28 -3.47 113.55 112.71 1wlo h SER 15 Ca 0.29 -0.74 -0.55 0.00 -1.23 0.00 0.00 61.79 59.56 1wlo h SER 15 Cb 1.61 -0.18 0.20 0.00 -0.44 0.00 0.00 62.40 63.59 1wlo h SER 15 CO -0.00 1.61 -0.51 0.18 -0.53 0.00 0.00 176.83 177.58 1wlo n LEU 16 N -3.55 0.20 -4.73 2.23 4.77 0.48 -4.89 117.00 111.51 1wlo n LEU 16 Ca -0.19 0.47 -0.41 0.00 -0.03 0.00 0.00 56.01 55.84 1wlo n LEU 16 Cb 1.06 -1.20 -0.04 0.00 -2.33 0.00 0.00 43.42 40.92 1wlo n LEU 16 CO 0.52 -3.42 0.82 -2.16 -1.33 0.00 0.00 177.39 171.83 1wlo s PRO 17 N -3.12 4.54 0.03 3.23 0.04 -1.26 -4.74 135.00 133.72 1wlo s PRO 17 Ca 0.61 1.74 -0.05 0.00 0.04 0.00 0.00 61.00 63.33 1wlo s PRO 17 Cb -0.28 -3.29 -0.01 0.00 0.04 0.00 0.00 34.50 30.95 1wlo s PRO 17 CO 0.63 -0.02 0.80 0.36 0.04 0.00 0.00 177.00 178.80 1wlo n LYS 18 N 2.77 -0.08 -0.30 4.56 2.85 -1.26 0.16 118.16 126.87 1wlo n LYS 18 Ca 0.04 0.79 -0.01 0.00 -1.05 0.00 0.00 58.31 58.09 1wlo n LYS 18 Cb 0.46 -1.18 0.03 0.00 -0.65 0.00 0.00 35.03 33.69 1wlo n LYS 18 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1wlo n GLU 19 N -3.24 -0.18 -0.14 -1.58 0.00 -1.26 0.22 120.64 114.46 1wlo n GLU 19 Ca 0.00 1.19 -0.10 0.00 0.00 0.00 0.00 57.16 58.25 1wlo n GLU 19 Cb 0.05 -1.76 -0.01 0.00 0.00 0.00 0.00 31.44 29.71 1wlo n GLU 19 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 1wlo h LEU 20 N 0.00 0.70 -1.50 -1.84 3.38 0.46 -2.06 115.31 114.45 1wlo h LEU 20 Ca 0.27 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 58.01 1wlo h LEU 20 Cb 0.46 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1wlo h LEU 20 CO -0.77 0.82 0.59 0.03 0.09 0.00 0.00 178.44 179.20 1wlo h ARG 21 N 0.56 0.00 0.03 1.13 3.08 1.23 1.74 114.38 122.14 1wlo h ARG 21 Ca 0.12 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.90 1wlo h ARG 21 Cb 0.44 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1wlo h ARG 21 CO 0.02 0.00 -1.42 1.03 -1.07 0.00 0.00 179.97 178.52 1wlo h SER 22 N 0.00 0.10 0.03 7.04 0.87 -0.27 -3.21 113.55 118.12 1wlo h SER 22 Ca 0.10 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.46 1wlo h SER 22 Cb 1.27 -0.03 0.01 0.00 -0.44 0.00 0.00 62.40 63.20 1wlo h SER 22 CO -0.00 1.13 -0.22 0.06 -0.53 0.00 0.00 176.83 177.27 1wlo h GLN 23 N 0.02 0.09 -0.32 2.24 3.07 0.25 -3.26 115.11 117.19 1wlo h GLN 23 Ca -0.18 -0.14 0.07 0.00 0.09 0.00 0.00 58.65 58.49 1wlo h GLN 23 Cb 1.93 0.05 -0.08 0.00 0.08 0.00 0.00 27.48 29.46 1wlo h GLN 23 CO 0.12 1.03 -0.33 -0.24 0.09 0.00 0.00 178.83 179.49 1wlo h VAL 24 N -0.77 0.24 -1.11 1.86 3.04 -0.41 0.96 116.25 120.05 1wlo h VAL 24 Ca -0.04 0.00 0.33 0.00 -1.01 0.00 0.00 66.70 65.98 1wlo h VAL 24 Cb 1.13 0.24 -0.12 0.00 -2.01 0.00 0.00 31.29 30.53 1wlo h VAL 24 CO 0.04 0.00 0.69 -0.07 -1.01 0.00 0.00 177.57 177.22 1wlo h LEU 25 N -0.30 0.42 0.01 3.16 3.38 -1.68 0.45 115.31 120.76 1wlo h LEU 25 Ca 0.15 0.13 -0.06 0.00 0.09 0.00 0.00 57.88 58.19 1wlo h LEU 25 Cb 0.54 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1wlo h LEU 25 CO -0.48 -0.04 -0.22 -0.07 0.09 0.00 0.00 178.44 177.71 1wlo h LEU 26 N 0.30 0.18 -0.15 1.67 -0.00 -0.10 -3.28 115.31 113.92 1wlo h LEU 26 Ca 0.70 -0.83 0.03 0.00 -0.00 0.00 0.00 57.88 57.78 1wlo h LEU 26 Cb 1.83 -0.05 -0.07 0.00 -0.00 0.00 0.00 40.66 42.37 1wlo h LEU 26 CO -0.42 0.98 -0.53 -0.33 -0.00 0.00 0.00 178.44 178.14 1wlo h GLU 27 N -0.61 -0.54 -0.47 1.13 5.08 0.49 -0.61 114.58 119.05 1wlo h GLU 27 Ca -0.03 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.41 1wlo h GLU 27 Cb 1.03 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 30.34 1wlo h GLU 27 CO 0.04 -0.36 -0.28 0.66 -1.00 0.00 0.00 179.01 178.08 1wlo n TYR 28 N -5.43 -0.21 -0.24 4.33 4.02 0.74 0.24 117.16 120.62 1wlo n TYR 28 Ca -0.06 0.58 0.27 0.00 -0.01 0.00 0.00 57.90 58.68 1wlo n TYR 28 Cb 0.38 -0.52 0.65 0.00 -0.02 0.00 0.00 39.34 39.83 1wlo n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1wlo h ALA 29 N -0.23 2.66 -0.35 -0.72 0.00 -1.52 1.23 119.26 120.33 1wlo h ALA 29 Ca 0.07 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1wlo h ALA 29 Cb 0.19 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1wlo h ALA 29 CO -0.44 -0.96 -0.17 0.00 0.00 0.00 0.00 179.25 177.68 1wlo h ALA 30 N 1.55 1.05 0.03 0.00 0.00 0.47 -2.75 119.26 119.62 1wlo h ALA 30 Ca 0.48 -0.33 -0.25 0.00 0.00 0.00 0.00 54.91 54.82 1wlo h ALA 30 Cb 1.65 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 19.30 1wlo h ALA 30 CO -0.09 0.58 -1.03 0.87 0.00 0.00 0.00 179.25 179.58 1wlo h LYS 31 N 0.58 0.47 -4.89 0.00 1.57 0.47 -3.44 116.57 111.33 1wlo h LYS 31 Ca 0.09 -0.55 -0.48 0.00 -1.87 0.00 0.00 60.65 57.85 1wlo h LYS 31 Cb 0.62 0.17 -0.09 0.00 0.08 0.00 0.00 32.23 33.00 1wlo h LYS 31 CO 0.04 1.19 1.75 0.28 -0.57 0.00 0.00 179.45 182.14 1wlo n VAL 32 N -3.75 0.00 -1.94 0.50 0.31 0.96 -4.84 118.33 109.57 1wlo n VAL 32 Ca -0.08 -0.05 -0.32 0.00 -0.01 0.00 0.00 64.34 63.88 1wlo n VAL 32 Cb 0.88 -0.44 0.02 0.00 -0.91 0.00 0.00 33.84 33.39 1wlo n VAL 32 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1wlo s PRO 33 N 8.62 3.27 0.56 5.55 0.04 -1.26 -5.00 135.00 146.78 1wlo s PRO 33 Ca 1.33 1.11 -0.17 0.00 0.04 0.00 0.00 61.00 63.31 1wlo s PRO 33 Cb -1.20 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 31.26 1wlo s PRO 33 CO 0.49 -0.84 1.04 -1.25 0.04 0.00 0.00 177.00 176.48 1wlo s PRO 34 N -4.35 3.51 0.57 0.56 0.04 -1.26 -4.69 135.00 129.38 1wlo s PRO 34 Ca 0.62 1.22 -0.16 0.00 0.04 0.00 0.00 61.00 62.71 1wlo s PRO 34 Cb -0.15 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.28 1wlo s PRO 34 CO 0.42 -0.65 1.05 -1.25 0.04 0.00 0.00 177.00 176.60 1wlo s PRO 35 N -3.85 3.45 0.85 0.56 0.04 -1.26 -5.03 135.00 129.77 1wlo s PRO 35 Ca 0.64 1.19 -0.12 0.00 0.04 0.00 0.00 61.00 62.76 1wlo s PRO 35 Cb -0.15 -2.05 0.10 0.00 0.04 0.00 0.00 34.50 32.44 1wlo s PRO 35 CO 0.32 -0.70 1.12 -1.25 0.04 0.00 0.00 177.00 176.52 1wlo s PRO 36 N -3.97 1.61 -0.23 0.56 0.04 -1.26 -4.98 135.00 126.77 1wlo s PRO 36 Ca 0.63 0.46 -0.29 0.00 0.04 0.00 0.00 61.00 61.85 1wlo s PRO 36 Cb -0.15 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 1wlo s PRO 36 CO 0.34 -1.91 1.31 -1.25 0.04 0.00 0.00 177.00 175.53 1wlo s PRO 37 N -5.22 4.06 0.00 0.56 0.04 -1.26 -3.61 135.00 129.58 1wlo s PRO 37 Ca 0.62 1.48 0.00 0.00 0.04 0.00 0.00 61.00 63.15 1wlo s PRO 37 Cb -0.15 -3.84 0.00 0.00 0.04 0.00 0.00 34.50 30.56 1wlo s PRO 37 CO 0.54 -0.93 0.00 0.41 0.04 0.00 0.00 177.00 177.06 1wlo n GLY 38 N 4.00 3.01 3.29 0.56 0.00 -1.26 -5.09 105.19 109.70 1wlo n GLY 38 Ca 0.15 -0.75 -0.49 0.00 0.00 0.00 0.00 46.02 44.92 1wlo n GLY 38 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wlo n VAL 39 N 0.00 1.33 -3.88 1.61 3.14 -1.24 -4.91 118.33 114.37 1wlo n VAL 39 Ca 0.00 -0.33 -0.35 0.00 -2.96 0.00 0.00 64.34 60.69 1wlo n VAL 39 Cb 0.00 0.00 -0.13 0.00 -1.06 0.00 0.00 33.84 32.65 1wlo n VAL 39 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1wlo s GLU 40 N -0.66 3.49 0.09 1.45 2.12 -1.26 -4.96 118.70 118.97 1wlo s GLU 40 Ca 0.69 -0.57 -0.12 0.00 0.36 0.00 0.00 54.97 55.34 1wlo s GLU 40 Cb -0.99 -3.11 -0.06 0.00 0.26 0.00 0.00 34.13 30.22 1wlo s GLU 40 CO 0.54 -0.17 0.45 -0.51 -0.54 0.00 0.00 175.26 175.03 1wlo s LEU 41 N 1.46 4.36 -0.23 2.70 1.43 -1.26 -4.65 118.68 122.50 1wlo s LEU 41 Ca 0.05 0.91 -0.07 0.00 -1.03 0.00 0.00 54.13 53.99 1wlo s LEU 41 Cb -0.15 -3.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.03 1wlo s LEU 41 CO -0.01 0.17 0.05 -0.70 0.23 0.00 0.00 176.35 176.10 1wlo s GLU 42 N -1.81 3.67 0.34 1.70 2.12 0.30 -4.68 118.70 120.34 1wlo s GLU 42 Ca 0.33 -0.48 -0.29 0.00 0.36 0.00 0.00 54.97 54.90 1wlo s GLU 42 Cb -0.15 -3.25 -0.11 0.00 0.26 0.00 0.00 34.13 30.88 1wlo s GLU 42 CO 0.18 -0.10 1.48 0.50 -0.54 0.00 0.00 175.26 176.77 1wlo s ARG 43 N 1.36 4.17 -0.83 4.30 3.52 -1.25 -2.42 118.95 127.80 1wlo s ARG 43 Ca 0.05 2.49 -0.16 0.00 -0.13 0.00 0.00 55.73 57.98 1wlo s ARG 43 Cb -0.15 -3.01 0.18 0.00 -1.56 0.00 0.00 34.95 30.41 1wlo s ARG 43 CO 0.03 -0.49 0.86 0.08 -0.81 0.00 0.00 175.30 174.97 1wlo s VAL 44 N -0.75 5.27 0.28 7.11 1.01 0.55 -4.88 120.40 128.98 1wlo s VAL 44 Ca 0.55 -2.04 0.01 0.00 0.00 0.00 0.00 61.98 60.51 1wlo s VAL 44 Cb -0.45 -4.56 0.26 0.00 0.00 0.00 0.00 36.38 31.63 1wlo s VAL 44 CO 0.56 -1.17 1.75 0.45 0.00 0.00 0.00 175.10 176.68 1wlo h HIS 45 N 8.26 0.78 -1.50 5.22 3.86 -1.88 0.28 115.15 130.16 1wlo h HIS 45 Ca 0.07 0.04 0.46 0.00 -1.16 0.00 0.00 60.37 59.78 1wlo h HIS 45 Cb 1.04 -0.21 -0.10 0.00 1.06 0.00 0.00 27.41 29.20 1wlo h HIS 45 CO 1.05 0.13 1.03 1.49 0.86 0.00 0.00 177.93 182.48 1wlo h GLU 46 N 0.58 0.05 -5.57 2.45 4.57 -1.94 -3.35 114.58 111.38 1wlo h GLU 46 Ca 0.51 -0.00 -0.61 0.00 -1.18 0.00 0.00 59.36 58.07 1wlo h GLU 46 Cb 0.80 -0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 29.29 1wlo h GLU 46 CO -0.41 0.04 -0.37 0.00 -1.18 0.00 0.00 179.01 177.09 1wlo h GLN 48 N 6.00 0.89 -7.24 0.00 4.20 -1.81 -3.42 115.11 113.72 1wlo h GLN 48 Ca -0.46 -0.05 -0.49 0.00 0.06 0.00 0.00 58.65 57.71 1wlo h GLN 48 Cb 1.18 -0.20 0.06 0.00 0.30 0.00 0.00 27.48 28.82 1wlo h GLN 48 CO 0.70 0.59 0.38 0.95 -0.67 0.00 0.00 178.83 180.78 1wlo s THR 49 N -6.03 4.15 -1.17 -0.54 -4.23 -1.26 -4.92 115.64 101.64 1wlo s THR 49 Ca -0.12 0.92 -0.19 0.00 -1.18 0.00 0.00 61.69 61.12 1wlo s THR 49 Cb 0.19 -3.53 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 1wlo s THR 49 CO 0.79 -0.70 1.97 -0.81 -0.54 0.00 0.00 174.62 175.33 1wlo n PRO 50 N -2.20 2.28 -3.01 3.99 -0.04 -1.26 -4.73 135.00 130.02 1wlo n PRO 50 Ca 0.08 -2.51 -0.42 0.00 -0.04 0.00 0.00 63.50 60.61 1wlo n PRO 50 Cb 0.53 -3.33 -0.06 0.00 -0.04 0.00 0.00 33.50 30.61 1wlo n PRO 50 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1wlo s PHE 51 N 5.65 3.20 0.11 0.54 2.19 -1.26 -4.57 117.98 123.83 1wlo s PHE 51 Ca 0.56 0.70 0.04 0.00 0.33 0.00 0.00 56.93 58.57 1wlo s PHE 51 Cb 0.09 -3.15 -0.04 0.00 -1.31 0.00 0.00 43.02 38.61 1wlo s PHE 51 CO 0.06 -0.55 0.06 -0.06 1.83 0.00 0.00 175.22 176.56 1wlo s PHE 52 N 2.84 3.08 0.29 10.12 0.08 -1.15 0.21 117.98 133.44 1wlo s PHE 52 Ca 0.30 0.00 -0.20 0.00 0.12 0.00 0.00 56.93 57.14 1wlo s PHE 52 Cb -0.14 -1.54 0.02 0.00 -0.57 0.00 0.00 43.02 40.79 1wlo s PHE 52 CO 0.13 0.51 0.73 0.54 -0.10 0.00 0.00 175.22 177.02 1wlo s VAL 53 N -1.47 0.00 -0.29 -0.44 0.11 -1.02 -2.49 120.40 114.80 1wlo s VAL 53 Ca 0.28 -1.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.19 1wlo s VAL 53 Cb -0.11 -2.11 0.14 0.00 -1.53 0.00 0.00 36.38 32.76 1wlo s VAL 53 CO 0.21 0.00 0.84 -2.28 -3.33 0.00 0.00 175.10 170.54 1wlo s HIS 54 N -3.72 -0.91 -0.07 1.54 5.04 -0.55 0.11 115.29 116.73 1wlo s HIS 54 Ca 0.12 1.65 0.00 0.00 -1.54 0.00 0.00 55.06 55.29 1wlo s HIS 54 Cb -0.06 0.54 -0.03 0.00 0.04 0.00 0.00 32.58 33.08 1wlo s HIS 54 CO 0.08 -0.45 -0.06 0.00 -2.34 0.00 0.00 174.74 171.97 1wlo s ALA 55 N 2.20 3.02 0.27 1.58 0.00 -1.26 -1.98 121.76 125.59 1wlo s ALA 55 Ca -0.06 -0.88 -0.09 0.00 0.00 0.00 0.00 51.96 50.93 1wlo s ALA 55 Cb -0.07 -1.26 -0.01 0.00 0.00 0.00 0.00 23.12 21.78 1wlo s ALA 55 CO -0.18 0.57 0.43 -0.51 0.00 0.00 0.00 175.76 176.08 1wlo s ASP 56 N -0.82 0.19 -0.22 0.00 1.11 -0.80 -4.45 116.67 111.68 1wlo s ASP 56 Ca 0.12 -1.14 0.01 0.00 0.18 0.00 0.00 52.55 51.72 1wlo s ASP 56 Cb -0.11 0.58 0.05 0.00 1.07 0.00 0.00 42.92 44.51 1wlo s ASP 56 CO 0.02 -1.14 -0.07 -0.69 1.18 0.00 0.00 175.17 174.46 1wlo s VAL 57 N -3.77 1.55 -0.06 -1.27 1.01 -1.26 0.62 120.40 117.22 1wlo s VAL 57 Ca 0.27 -1.13 -0.00 0.00 0.00 0.00 0.00 61.98 61.11 1wlo s VAL 57 Cb 0.01 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.66 1wlo s VAL 57 CO 0.12 -0.01 -0.03 -1.61 0.00 0.00 0.00 175.10 173.57 1wlo s GLU 58 N 1.40 0.87 -1.01 2.72 2.02 -0.56 -4.78 118.70 119.37 1wlo s GLU 58 Ca -0.04 -0.05 -0.03 0.00 0.02 0.00 0.00 54.97 54.86 1wlo s GLU 58 Cb -0.18 -1.01 0.00 0.00 0.10 0.00 0.00 34.13 33.04 1wlo s GLU 58 CO -0.07 -0.19 0.45 0.41 0.02 0.00 0.00 175.26 175.89 1wlo n GLY 59 N 4.58 -0.10 2.90 -1.39 0.00 -1.26 -1.76 105.19 108.17 1wlo n GLY 59 Ca -0.16 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1wlo n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wlo n GLY 60 N -1.29 0.29 3.93 -0.02 0.00 -1.26 -4.96 105.19 101.87 1wlo n GLY 60 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.71 1wlo n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wlo s LYS 61 N -0.95 2.29 -0.27 1.61 1.02 -0.72 -4.57 119.74 118.15 1wlo s LYS 61 Ca 0.00 -1.90 -0.05 0.00 0.02 0.00 0.00 55.97 54.05 1wlo s LYS 61 Cb 0.00 -2.23 0.01 0.00 -0.52 0.00 0.00 37.83 35.09 1wlo s LYS 61 CO 0.00 -0.62 0.01 0.08 -0.92 0.00 0.00 175.35 173.90 1wlo s VAL 62 N -2.72 3.50 -0.58 3.17 1.01 0.26 -1.49 120.40 123.54 1wlo s VAL 62 Ca 0.41 -0.77 -0.26 0.00 0.00 0.00 0.00 61.98 61.36 1wlo s VAL 62 Cb -0.03 -2.76 0.04 0.00 0.00 0.00 0.00 36.38 33.63 1wlo s VAL 62 CO 0.25 0.18 1.09 -0.13 0.00 0.00 0.00 175.10 176.49 1wlo s ARG 63 N 1.44 3.40 -0.04 2.72 1.81 0.20 -3.11 118.95 125.38 1wlo s ARG 63 Ca 0.02 -0.03 -0.16 0.00 -1.72 0.00 0.00 55.73 53.84 1wlo s ARG 63 Cb -0.16 -4.05 -0.05 0.00 -0.45 0.00 0.00 34.95 30.24 1wlo s ARG 63 CO -0.01 -1.63 0.44 -0.51 -0.68 0.00 0.00 175.30 172.91 1wlo s LEU 64 N 4.55 4.40 -0.05 2.53 1.02 -1.26 -1.90 118.68 127.98 1wlo s LEU 64 Ca 0.36 0.92 -0.02 0.00 0.02 0.00 0.00 54.13 55.42 1wlo s LEU 64 Cb -0.10 -2.65 0.03 0.00 0.02 0.00 0.00 46.19 43.49 1wlo s LEU 64 CO 0.22 0.20 0.06 -0.31 0.02 0.00 0.00 176.35 176.53 1wlo s TYR 65 N -0.42 0.10 0.11 0.29 2.02 -0.84 -5.01 117.35 113.60 1wlo s TYR 65 Ca 0.25 0.22 0.09 0.00 -0.37 0.00 0.00 57.07 57.26 1wlo s TYR 65 Cb -0.16 -0.50 -0.04 0.00 -0.40 0.00 0.00 41.96 40.86 1wlo s TYR 65 CO 0.12 -0.21 -0.22 -0.06 -1.57 0.00 0.00 175.55 173.61 1wlo s PHE 66 N 2.16 1.92 -0.19 2.71 0.08 -1.26 -1.48 117.98 121.92 1wlo s PHE 66 Ca 0.05 -0.41 -0.05 0.00 0.12 0.00 0.00 56.93 56.64 1wlo s PHE 66 Cb -0.12 -1.05 0.10 0.00 -0.57 0.00 0.00 43.02 41.37 1wlo s PHE 66 CO -0.03 0.23 0.34 -1.58 -0.10 0.00 0.00 175.22 174.08 1wlo s HIS 67 N -1.12 -0.64 -0.20 0.36 5.65 -1.04 -4.34 115.29 113.96 1wlo s HIS 67 Ca 0.08 1.01 0.01 0.00 0.25 0.00 0.00 55.06 56.42 1wlo s HIS 67 Cb -0.10 0.05 0.03 0.00 -1.18 0.00 0.00 32.58 31.38 1wlo s HIS 67 CO 0.05 -0.53 -0.16 0.08 -0.65 0.00 0.00 174.74 173.52 1wlo s VAL 68 N 2.51 2.02 -0.01 0.89 1.01 -1.26 -2.95 120.40 122.60 1wlo s VAL 68 Ca 0.04 -1.10 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 1wlo s VAL 68 Cb -0.13 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 1wlo s VAL 68 CO -0.12 0.36 0.28 1.55 0.00 0.00 0.00 175.10 177.16 1wlo h PRO 69 N 7.91 -0.08 -0.94 2.72 0.13 -2.00 -3.25 132.00 136.49 1wlo h PRO 69 Ca -0.37 0.01 0.27 0.00 -0.87 0.00 0.00 66.00 65.04 1wlo h PRO 69 Cb 1.11 0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.22 1wlo h PRO 69 CO 0.57 -0.05 0.96 0.38 -0.23 0.00 0.00 178.00 179.62 1wlo h ASP 70 N -0.26 0.00 -1.70 1.44 3.04 -1.96 -3.43 116.42 113.54 1wlo h ASP 70 Ca -0.01 0.00 -0.20 0.00 -3.24 0.00 0.00 57.03 53.59 1wlo h ASP 70 Cb 0.06 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.36 1wlo h ASP 70 CO 0.01 0.00 -0.26 -0.62 -2.04 0.00 0.00 179.24 176.33 1wlo n GLU 71 N -3.55 -1.26 -1.71 4.15 1.02 -1.23 -4.94 120.64 113.13 1wlo n GLU 71 Ca 0.20 0.47 -0.43 0.00 -0.02 0.00 0.00 57.16 57.38 1wlo n GLU 71 Cb 1.26 -4.46 -0.03 0.00 -0.02 0.00 0.00 31.44 28.18 1wlo n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wlo n ALA 72 N -1.83 2.52 1.05 0.62 0.00 -1.26 -4.84 120.51 116.77 1wlo n ALA 72 Ca -0.10 0.41 0.11 0.00 0.00 0.00 0.00 53.44 53.86 1wlo n ALA 72 Cb 0.58 -2.49 0.56 0.00 0.00 0.00 0.00 19.45 18.10 1wlo n ALA 72 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wlo n PRO 73 N 3.91 0.29 -0.08 0.00 -0.04 -1.26 -0.59 135.00 137.23 1wlo n PRO 73 Ca 0.16 0.08 -0.19 0.00 -0.04 0.00 0.00 63.50 63.51 1wlo n PRO 73 Cb 0.34 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.17 1wlo n PRO 73 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1wlo n THR 74 N -1.30 1.58 0.15 0.52 -2.24 -1.26 -2.86 114.28 108.87 1wlo n THR 74 Ca 0.10 -0.62 -0.25 0.00 -2.27 0.00 0.00 64.05 61.02 1wlo n THR 74 Cb 0.19 -1.47 -0.16 0.00 -2.10 0.00 0.00 70.33 66.79 1wlo n THR 74 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1wlo h VAL 75 N 0.02 1.28 -0.03 2.28 2.07 -1.92 -3.22 116.25 116.73 1wlo h VAL 75 Ca -0.52 -2.71 -0.02 0.00 0.82 0.00 0.00 66.70 64.27 1wlo h VAL 75 Cb 1.96 3.04 0.00 0.00 -1.52 0.00 0.00 31.29 34.77 1wlo h VAL 75 CO -0.02 0.81 -0.06 0.50 0.02 0.00 0.00 177.57 178.82 1wlo h LYS 76 N 0.15 0.10 -0.55 1.57 3.64 -1.06 -2.65 116.57 117.76 1wlo h LYS 76 Ca -0.26 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.11 1wlo h LYS 76 Cb 2.17 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 33.93 1wlo h LYS 76 CO 0.27 0.63 -0.35 0.00 -2.27 0.00 0.00 179.45 177.74 1wlo h ALA 77 N 0.47 -0.37 -0.31 5.00 0.00 -1.65 0.17 119.26 122.57 1wlo h ALA 77 Ca 0.00 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.04 1wlo h ALA 77 Cb 0.63 1.19 -0.07 0.00 0.00 0.00 0.00 17.79 19.54 1wlo h ALA 77 CO 0.01 -0.61 -0.20 0.35 0.00 0.00 0.00 179.25 178.81 1wlo h PHE 78 N -0.04 -0.50 -0.96 0.00 3.57 -1.63 0.72 116.94 118.11 1wlo h PHE 78 Ca 0.09 0.04 0.29 0.00 3.53 0.00 0.00 57.97 61.92 1wlo h PHE 78 Cb 0.26 0.27 -0.15 0.00 2.79 0.00 0.00 35.95 39.12 1wlo h PHE 78 CO -0.95 -0.27 0.41 0.00 -2.23 0.00 0.00 178.31 175.27 1wlo h ALA 79 N 1.02 1.67 0.00 2.41 0.00 -0.49 2.17 119.26 126.04 1wlo h ALA 79 Ca 0.16 0.22 -0.09 0.00 0.00 0.00 0.00 54.91 55.20 1wlo h ALA 79 Cb 0.41 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1wlo h ALA 79 CO -0.41 -0.56 -0.43 0.78 0.00 0.00 0.00 179.25 178.63 1wlo h GLY 80 N 0.24 0.00 1.04 0.00 0.00 0.15 -2.84 103.07 101.66 1wlo h GLY 80 Ca 0.67 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.91 1wlo h GLY 80 CO -0.66 0.00 -0.03 -2.00 0.00 0.00 0.00 176.54 173.85 1wlo h LEU 81 N 0.00 0.93 0.36 3.11 7.12 0.45 0.61 115.31 127.89 1wlo h LEU 81 Ca -0.00 -0.32 -0.02 0.00 0.13 0.00 0.00 57.88 57.67 1wlo h LEU 81 Cb 0.83 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 40.71 1wlo h LEU 81 CO 0.06 1.03 -0.18 -0.07 -0.13 0.00 0.00 178.44 179.14 1wlo h LEU 82 N 0.81 -0.43 -1.44 2.25 -0.00 -0.91 -0.96 115.31 114.63 1wlo h LEU 82 Ca 0.14 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 1wlo h LEU 82 Cb 0.57 0.12 0.00 0.00 -0.00 0.00 0.00 40.66 41.34 1wlo h LEU 82 CO 0.03 -0.30 0.00 0.08 -0.00 0.00 0.00 178.44 178.25 1wlo h ARG 83 N -0.50 0.00 0.00 1.13 0.11 -1.42 0.23 114.38 113.93 1wlo h ARG 83 Ca -0.05 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 59.99 1wlo h ARG 83 Cb 0.39 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 1wlo h ARG 83 CO 0.07 0.00 -0.19 0.93 0.10 0.00 0.00 179.97 180.88 1wlo h GLU 84 N 0.00 0.00 -0.37 0.08 4.39 0.52 -3.02 114.58 116.17 1wlo h GLU 84 Ca 0.00 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.46 1wlo h GLU 84 Cb 0.23 0.00 -0.33 0.00 -0.10 0.00 0.00 28.75 28.55 1wlo h GLU 84 CO 0.00 0.19 -0.90 0.41 -1.16 0.00 0.00 179.01 177.55 1wlo n GLY 85 N 0.43 1.80 1.09 -3.84 0.00 -0.32 -4.20 105.19 100.15 1wlo n GLY 85 Ca 0.01 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1wlo n GLY 85 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wlo n LEU 86 N -0.77 0.00 -4.61 0.99 4.77 0.66 -3.95 117.00 114.09 1wlo n LEU 86 Ca 0.01 0.00 -0.50 0.00 -0.03 0.00 0.00 56.01 55.48 1wlo n LEU 86 Cb 0.82 0.20 -0.06 0.00 -2.33 0.00 0.00 43.42 42.06 1wlo n LEU 86 CO 0.03 -0.27 1.58 1.21 -1.33 0.00 0.00 177.39 178.61 1wlo n GLU 87 N -2.04 1.63 -0.47 3.23 2.13 -1.14 0.14 120.64 124.12 1wlo n GLU 87 Ca 0.00 0.55 0.00 0.00 0.66 0.00 0.00 57.16 58.37 1wlo n GLU 87 Cb 0.00 -2.53 0.00 0.00 0.27 0.00 0.00 31.44 29.18 1wlo n GLU 87 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wlo n GLY 88 N 5.12 0.75 3.97 8.31 0.00 -1.18 -4.96 105.19 117.19 1wlo n GLY 88 Ca 0.30 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.06 1wlo n GLY 88 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wlo s GLU 89 N -0.53 1.30 0.45 1.61 0.41 0.38 -4.58 118.70 117.73 1wlo s GLU 89 Ca 0.00 -0.88 -0.04 0.00 -0.41 0.00 0.00 54.97 53.64 1wlo s GLU 89 Cb 0.00 -2.16 -0.03 0.00 -1.78 0.00 0.00 34.13 30.16 1wlo s GLU 89 CO 0.00 -1.80 0.72 -1.54 -0.49 0.00 0.00 175.26 172.15 1wlo s SER 90 N -4.80 6.25 0.00 -0.19 1.04 -1.26 0.90 113.70 115.64 1wlo s SER 90 Ca 0.69 0.78 0.22 0.00 0.48 0.00 0.00 55.95 58.12 1wlo s SER 90 Cb -0.05 -2.16 1.03 0.00 0.10 0.00 0.00 66.02 64.95 1wlo s SER 90 CO 0.47 -0.52 1.72 -0.81 0.98 0.00 0.00 173.24 175.09 1wlo n PRO 91 N -2.14 0.15 -0.05 4.02 -0.04 -1.26 -1.78 135.00 133.90 1wlo n PRO 91 Ca -0.01 0.10 -0.16 0.00 -0.04 0.00 0.00 63.50 63.40 1wlo n PRO 91 Cb 0.55 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.38 1wlo n PRO 91 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1wlo n GLU 92 N -1.40 0.69 0.08 0.54 -0.58 -1.26 -3.21 120.64 115.51 1wlo n GLU 92 Ca 0.08 0.20 -0.09 0.00 -0.42 0.00 0.00 57.16 56.93 1wlo n GLU 92 Cb 0.22 -1.65 -0.01 0.00 -0.57 0.00 0.00 31.44 29.43 1wlo n GLU 92 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wlo h ALA 93 N 0.43 0.52 -0.25 0.62 0.00 -1.83 -2.68 119.26 116.07 1wlo h ALA 93 Ca -0.45 -0.72 -0.12 0.00 0.00 0.00 0.00 54.91 53.62 1wlo h ALA 93 Cb 2.03 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.75 1wlo h ALA 93 CO 0.03 0.91 -0.30 0.28 0.00 0.00 0.00 179.25 180.17 1wlo h VAL 94 N 0.11 1.31 0.00 0.00 2.07 -1.52 -2.71 116.25 115.51 1wlo h VAL 94 Ca -0.04 -1.49 -0.02 0.00 0.82 0.00 0.00 66.70 65.97 1wlo h VAL 94 Cb 1.50 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 32.94 1wlo h VAL 94 CO 0.13 0.47 -0.08 -0.07 0.02 0.00 0.00 177.57 178.04 1wlo h LEU 95 N 0.38 0.00 -0.57 2.57 -0.00 -1.54 -1.65 115.31 114.50 1wlo h LEU 95 Ca 0.03 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.86 1wlo h LEU 95 Cb 0.88 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.52 1wlo h LEU 95 CO 0.07 0.08 0.16 -0.33 -0.00 0.00 0.00 178.44 178.42 1wlo h GLU 96 N 0.00 0.90 -5.83 1.13 4.39 -1.16 -3.41 114.58 110.60 1wlo h GLU 96 Ca -0.00 -0.21 -0.61 0.00 0.34 0.00 0.00 59.36 58.89 1wlo h GLU 96 Cb 0.15 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1wlo h GLU 96 CO 0.01 0.82 1.50 0.28 -1.16 0.00 0.00 179.01 180.47 1wlo n VAL 97 N -4.41 0.14 -1.53 3.13 0.31 -0.62 -4.63 118.33 110.73 1wlo n VAL 97 Ca 0.03 -0.36 -0.29 0.00 -0.01 0.00 0.00 64.34 63.71 1wlo n VAL 97 Cb 0.22 -1.86 0.15 0.00 -0.91 0.00 0.00 33.84 31.44 1wlo n VAL 97 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1wlo s PRO 98 N 6.86 0.80 0.00 5.55 0.04 -1.26 -4.92 135.00 142.06 1wlo s PRO 98 Ca 1.09 0.16 0.24 0.00 0.04 0.00 0.00 61.00 62.53 1wlo s PRO 98 Cb -0.71 -1.81 1.39 0.00 0.04 0.00 0.00 34.50 33.41 1wlo s PRO 98 CO 0.43 -2.40 1.79 -0.35 0.04 0.00 0.00 177.00 176.51 1wlo n PRO 99 N -3.88 0.68 -1.29 0.56 -0.04 -1.26 -2.66 135.00 127.11 1wlo n PRO 99 Ca 0.08 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1wlo n PRO 99 Cb 0.59 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.66 1wlo n PRO 99 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wlo n GLY 100 N 0.52 3.79 0.10 0.55 0.00 -1.26 -4.75 105.19 104.15 1wlo n GLY 100 Ca 0.17 -1.35 0.12 0.00 0.00 0.00 0.00 46.02 44.96 1wlo n GLY 100 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1wlo n PHE 101 N -0.53 0.80 -0.01 1.61 -1.74 -1.09 -2.97 117.46 113.53 1wlo n PHE 101 Ca 0.18 0.26 -0.10 0.00 -0.56 0.00 0.00 57.45 57.23 1wlo n PHE 101 Cb 0.88 -0.93 -0.14 0.00 1.52 0.00 0.00 39.48 40.81 1wlo n PHE 101 CO 0.00 0.00 0.00 0.10 -0.56 0.00 0.00 176.76 176.30 1wlo h TYR 102 N 0.00 0.07 -1.45 2.97 -0.00 -1.85 -3.47 116.97 113.23 1wlo h TYR 102 Ca 0.00 -0.05 -0.71 0.00 0.00 0.00 0.00 58.73 57.96 1wlo h TYR 102 Cb 0.57 -0.00 0.06 0.00 0.00 0.00 0.00 36.73 37.35 1wlo h TYR 102 CO 0.00 1.11 0.27 0.54 -0.00 0.00 0.00 178.16 180.08 1wlo n ARG 103 N -3.12 0.72 -2.18 0.10 1.74 -1.16 -3.43 116.66 109.34 1wlo n ARG 103 Ca -0.18 0.26 -0.03 0.00 -0.77 0.00 0.00 57.85 57.13 1wlo n ARG 103 Cb 1.05 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 1wlo n ARG 103 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wlo n GLY 104 N 2.10 -0.94 0.38 -0.13 0.00 -1.26 -4.96 105.19 100.39 1wlo n GLY 104 Ca 0.19 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.66 1wlo n GLY 104 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1wlo n TYR 105 N -0.64 -0.48 0.00 1.61 4.01 -1.22 -5.03 117.16 115.41 1wlo n TYR 105 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1wlo n TYR 105 Cb 0.29 0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 1wlo n TYR 105 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wlo n GLY 106 N -1.03 2.66 0.41 2.72 0.00 -1.26 -4.11 105.19 104.56 1wlo n GLY 106 Ca 0.00 -0.30 0.22 0.00 0.00 0.00 0.00 46.02 45.94 1wlo n GLY 106 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wlo h LEU 107 N 0.00 0.45 0.21 0.99 3.38 -1.95 0.36 115.31 118.75 1wlo h LEU 107 Ca 0.00 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1wlo h LEU 107 Cb 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1wlo h LEU 107 CO 0.00 0.10 -0.46 -0.08 0.09 0.00 0.00 178.44 178.09 1wlo h GLU 108 N 0.41 -0.71 0.92 1.13 4.22 -1.80 0.17 114.58 118.92 1wlo h GLU 108 Ca 0.58 0.05 -0.05 0.00 0.08 0.00 0.00 59.36 60.02 1wlo h GLU 108 Cb 1.45 0.16 0.01 0.00 0.50 0.00 0.00 28.75 30.87 1wlo h GLU 108 CO -0.28 -0.47 -0.44 0.93 -2.18 0.00 0.00 179.01 176.56 1wlo h GLU 109 N -0.74 -1.19 0.00 1.92 5.08 -1.57 -3.31 114.58 114.77 1wlo h GLU 109 Ca -0.02 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1wlo h GLU 109 Cb 0.70 0.27 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1wlo h GLU 109 CO -0.19 -0.79 0.00 1.19 -1.00 0.00 0.00 179.01 178.21 1wlo n PHE 110 N -5.60 0.00 -2.70 4.33 3.72 -0.03 -4.12 117.46 113.07 1wlo n PHE 110 Ca -0.15 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.82 1wlo n PHE 110 Cb 0.49 -0.41 -0.02 0.00 -0.94 0.00 0.00 39.48 38.60 1wlo n PHE 110 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1wlo s PHE 111 N -2.63 3.36 1.02 1.38 0.08 0.60 -5.01 117.98 116.77 1wlo s PHE 111 Ca 0.00 1.44 -0.16 0.00 0.12 0.00 0.00 56.93 58.33 1wlo s PHE 111 Cb 0.00 -3.23 0.04 0.00 -0.57 0.00 0.00 43.02 39.26 1wlo s PHE 111 CO 0.00 -0.44 0.11 0.25 -0.10 0.00 0.00 175.22 175.04 1wlo n THR 112 N 5.21 0.00 1.07 0.64 -2.24 -1.26 -4.56 114.28 113.15 1wlo n THR 112 Ca 0.11 -0.24 0.11 0.00 -2.27 0.00 0.00 64.05 61.75 1wlo n THR 112 Cb 0.47 -0.55 0.57 0.00 -2.10 0.00 0.00 70.33 68.72 1wlo n THR 112 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1wlo n PRO 113 N -1.41 0.32 -0.10 -0.78 -0.04 -1.26 -1.21 135.00 130.53 1wlo n PRO 113 Ca 0.04 0.07 -0.18 0.00 -0.04 0.00 0.00 63.50 63.38 1wlo n PRO 113 Cb 0.58 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.44 1wlo n PRO 113 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1wlo h LEU 114 N 0.00 0.00 -0.77 1.53 5.85 -1.98 -3.33 115.31 116.60 1wlo h LEU 114 Ca 0.00 -0.43 -0.13 0.00 0.84 0.00 0.00 57.88 58.16 1wlo h LEU 114 Cb 0.21 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1wlo h LEU 114 CO 0.00 1.33 -0.51 0.03 -0.34 0.00 0.00 178.44 178.95 1wlo h ARG 115 N -1.00 0.27 -0.50 1.25 3.08 -1.90 -3.07 114.38 112.51 1wlo h ARG 115 Ca -0.27 -0.15 0.09 0.00 0.07 0.00 0.00 59.98 59.72 1wlo h ARG 115 Cb 1.14 0.01 -0.08 0.00 0.08 0.00 0.00 29.97 31.12 1wlo h ARG 115 CO -0.16 0.71 0.03 -0.07 -1.07 0.00 0.00 179.97 179.41 1wlo h LEU 116 N 0.21 -0.16 -0.99 3.04 3.38 -1.34 -1.70 115.31 117.75 1wlo h LEU 116 Ca 0.01 0.11 0.11 0.00 0.09 0.00 0.00 57.88 58.20 1wlo h LEU 116 Cb 0.97 0.19 -0.13 0.00 0.09 0.00 0.00 40.66 41.78 1wlo h LEU 116 CO 0.08 -0.05 -0.52 0.54 0.09 0.00 0.00 178.44 178.58 1wlo n ARG 117 N -5.20 -0.37 -0.05 1.13 1.74 -1.16 -0.04 116.66 112.71 1wlo n ARG 117 Ca 0.06 1.51 -0.09 0.00 -0.77 0.00 0.00 57.85 58.56 1wlo n ARG 117 Cb 0.27 -2.22 -0.02 0.00 -1.02 0.00 0.00 32.46 29.46 1wlo n ARG 117 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 1wlo h GLY 118 N 0.00 0.27 -0.30 -0.13 0.00 -1.49 -1.78 103.07 99.65 1wlo h GLY 118 Ca 0.22 -0.05 0.16 0.00 0.00 0.00 0.00 47.33 47.66 1wlo h GLY 118 CO -0.95 0.03 -0.02 1.41 0.00 0.00 0.00 176.54 177.01 1wlo h LEU 119 N 0.18 -0.37 -0.38 3.11 4.07 0.36 0.26 115.31 122.54 1wlo h LEU 119 Ca 0.10 0.19 0.01 0.00 0.08 0.00 0.00 57.88 58.25 1wlo h LEU 119 Cb 0.07 0.34 -0.02 0.00 1.08 0.00 0.00 40.66 42.12 1wlo h LEU 119 CO -0.10 -0.17 0.24 -0.33 -1.08 0.00 0.00 178.44 177.00 1wlo h GLU 120 N 0.09 0.48 -0.95 1.13 4.39 -0.09 -2.50 114.58 117.14 1wlo h GLU 120 Ca 0.38 -0.03 0.19 0.00 0.34 0.00 0.00 59.36 60.24 1wlo h GLU 120 Cb 0.65 -0.11 -0.18 0.00 -0.10 0.00 0.00 28.75 29.02 1wlo h GLU 120 CO -0.64 0.32 -0.24 0.00 -1.16 0.00 0.00 179.01 177.28 1wlo h ALA 121 N 1.15 0.60 -0.52 3.43 0.00 0.34 -0.46 119.26 123.81 1wlo h ALA 121 Ca 0.14 0.37 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1wlo h ALA 121 Cb -0.03 0.73 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1wlo h ALA 121 CO -0.05 -0.40 0.00 0.00 0.00 0.00 0.00 179.25 178.81 1wlo n ALA 122 N -3.55 -0.03 -0.34 0.00 0.00 -0.94 0.10 120.51 115.75 1wlo n ALA 122 Ca 0.15 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.63 1wlo n ALA 122 Cb 0.47 0.42 0.12 0.00 0.00 0.00 0.00 19.45 20.47 1wlo n ALA 122 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1wlo h LEU 123 N 0.00 -0.93 -0.72 0.00 5.85 -1.21 1.71 115.31 120.02 1wlo h LEU 123 Ca 0.00 0.29 0.12 0.00 0.84 0.00 0.00 57.88 59.12 1wlo h LEU 123 Cb 0.00 0.60 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 1wlo h LEU 123 CO 0.00 -0.31 0.31 -0.07 -0.34 0.00 0.00 178.44 178.03 1wlo h LEU 124 N -0.00 0.35 0.02 2.25 3.38 0.32 0.59 115.31 122.21 1wlo h LEU 124 Ca 0.45 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.50 1wlo h LEU 124 Cb 0.69 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1wlo h LEU 124 CO -0.98 0.18 -0.01 0.03 0.09 0.00 0.00 178.44 177.75 1wlo h ARG 125 N 0.51 -0.02 -0.54 1.13 2.47 0.96 -1.16 114.38 117.72 1wlo h ARG 125 Ca 0.37 0.00 0.05 0.00 -1.26 0.00 0.00 59.98 59.14 1wlo h ARG 125 Cb 0.49 0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 28.75 1wlo h ARG 125 CO -0.33 -0.02 -0.32 1.28 0.56 0.00 0.00 179.97 181.14 1wlo n LEU 126 N -2.07 -0.58 -0.33 3.04 7.99 -0.02 0.13 117.00 125.17 1wlo n LEU 126 Ca -0.00 1.40 0.21 0.00 -0.01 0.00 0.00 56.01 57.61 1wlo n LEU 126 Cb 0.01 -0.34 0.41 0.00 -0.11 0.00 0.00 43.42 43.39 1wlo n LEU 126 CO 0.01 -1.00 0.95 1.56 -1.51 0.00 0.00 177.39 177.39 1wlo h GLN 127 N 0.00 0.07 -0.62 3.23 4.20 -0.93 2.00 115.11 123.07 1wlo h GLN 127 Ca 0.09 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 1wlo h GLN 127 Cb 0.22 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.96 1wlo h GLN 127 CO -0.51 0.05 0.36 0.00 -0.67 0.00 0.00 178.83 178.06 1wlo h ALA 128 N 1.94 0.79 0.26 3.87 0.00 0.24 -0.81 119.26 125.55 1wlo h ALA 128 Ca 0.69 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.50 1wlo h ALA 128 Cb 1.60 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1wlo h ALA 128 CO -0.79 0.28 -0.13 1.96 0.00 0.00 0.00 179.25 180.58 1wlo h GLN 129 N 0.84 -0.34 -0.93 0.00 4.20 0.48 -3.24 115.11 116.12 1wlo h GLN 129 Ca 0.22 0.02 0.20 0.00 0.06 0.00 0.00 58.65 59.15 1wlo h GLN 129 Cb 0.00 0.08 -0.18 0.00 0.30 0.00 0.00 27.48 27.68 1wlo h GLN 129 CO -0.04 -0.23 -0.19 0.28 -0.67 0.00 0.00 178.83 177.99 1wlo n VAL 130 N -4.92 -0.39 -0.11 -0.54 0.31 0.51 0.21 118.33 113.41 1wlo n VAL 130 Ca -0.04 2.11 -0.12 0.00 -0.01 0.00 0.00 64.34 66.27 1wlo n VAL 130 Cb 0.14 -2.94 -0.09 0.00 -0.91 0.00 0.00 33.84 30.04 1wlo n VAL 130 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 1wlo h ARG 131 N 0.00 -0.34 -1.01 5.55 3.08 -1.22 0.57 114.38 121.01 1wlo h ARG 131 Ca 0.46 0.02 0.24 0.00 0.07 0.00 0.00 59.98 60.78 1wlo h ARG 131 Cb 0.76 0.08 -0.10 0.00 0.08 0.00 0.00 29.97 30.79 1wlo h ARG 131 CO -0.94 -0.23 0.64 -0.22 -1.07 0.00 0.00 179.97 178.16 1wlo h LYS 132 N -0.35 0.46 -0.16 0.04 3.11 -0.26 2.01 116.57 121.43 1wlo h LYS 132 Ca 0.06 -0.03 -0.08 0.00 -2.81 0.00 0.00 60.65 57.79 1wlo h LYS 132 Cb 0.51 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.63 1wlo h LYS 132 CO -0.50 0.31 -0.26 0.00 -2.81 0.00 0.00 179.45 176.19 1wlo h ALA 133 N 1.64 1.27 0.07 5.00 0.00 0.11 -3.06 119.26 124.29 1wlo h ALA 133 Ca 0.58 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 55.03 1wlo h ALA 133 Cb 1.33 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1wlo h ALA 133 CO -0.32 0.49 -0.71 1.37 0.00 0.00 0.00 179.25 180.08 1wlo h LEU 134 N 0.26 0.23 -3.92 0.00 8.10 0.62 -3.34 115.31 117.26 1wlo h LEU 134 Ca 0.04 -0.89 -0.17 0.00 0.11 0.00 0.00 57.88 56.97 1wlo h LEU 134 Cb 0.60 -0.07 -0.06 0.00 -0.44 0.00 0.00 40.66 40.68 1wlo h LEU 134 CO 0.04 1.32 -0.34 0.35 -4.11 0.00 0.00 178.44 175.70 1wlo n THR 135 N -4.29 2.85 0.60 0.15 -2.24 0.57 -5.08 114.28 106.84 1wlo n THR 135 Ca -0.17 -1.37 0.05 0.00 -2.27 0.00 0.00 64.05 60.28 1wlo n THR 135 Cb 0.70 -1.94 0.29 0.00 -2.10 0.00 0.00 70.33 67.28 1wlo n THR 135 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26