#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 -4.31 -1.52 2.03 0.31 -1.26 -4.97 118.33 108.60 1wlo n VAL 2 Ca 0.00 1.90 -0.30 0.00 -0.01 0.00 0.00 64.34 65.93 1wlo n VAL 2 Cb 0.00 -2.65 0.20 0.00 -0.91 0.00 0.00 33.84 30.47 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 -4.28 0.04 -0.06 5.55 0.04 -1.26 -4.80 135.00 130.22 1wlo s PRO 3 Ca 0.00 -0.13 -0.26 0.00 0.04 0.00 0.00 61.00 60.65 1wlo s PRO 3 Cb 0.00 -1.75 -0.23 0.00 0.04 0.00 0.00 34.50 32.56 1wlo s PRO 3 CO 0.00 -2.86 1.04 -1.00 0.04 0.00 0.00 177.00 174.22 1wlo h PRO 4 N -1.97 0.09 -0.90 0.56 0.13 -1.93 0.18 132.00 128.16 1wlo h PRO 4 Ca -0.46 -0.09 0.18 0.00 -0.87 0.00 0.00 66.00 64.76 1wlo h PRO 4 Cb 1.28 0.02 -0.11 0.00 0.13 0.00 0.00 31.00 32.32 1wlo h PRO 4 CO 0.42 0.82 0.46 0.87 -0.23 0.00 0.00 178.00 180.33 1wlo h LYS 5 N -0.60 0.56 0.17 0.86 1.57 -1.93 1.75 116.57 118.94 1wlo h LYS 5 Ca -0.01 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1wlo h LYS 5 Cb 0.85 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1wlo h LYS 5 CO 0.02 0.37 -0.08 1.25 -0.57 0.00 0.00 179.45 180.44 1wlo h LEU 6 N 0.57 -0.19 -1.92 2.94 7.12 -1.63 -2.91 115.31 119.30 1wlo h LEU 6 Ca 0.52 0.01 0.34 0.00 0.13 0.00 0.00 57.88 58.87 1wlo h LEU 6 Cb 0.85 0.05 -0.05 0.00 -0.53 0.00 0.00 40.66 40.98 1wlo h LEU 6 CO -0.42 0.17 0.89 0.50 -0.13 0.00 0.00 178.44 179.44 1wlo h LYS 7 N -0.83 0.00 0.06 1.25 1.63 -0.27 0.52 116.57 118.93 1wlo h LYS 7 Ca -0.02 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1wlo h LYS 7 Cb 0.17 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.80 1wlo h LYS 7 CO 0.04 0.00 -0.03 1.96 -3.45 0.00 0.00 179.45 177.97 1wlo h GLN 8 N 0.00 -0.08 0.14 1.90 4.20 0.26 -0.69 115.11 120.84 1wlo h GLN 8 Ca 0.55 0.01 0.01 0.00 0.06 0.00 0.00 58.65 59.28 1wlo h GLN 8 Cb 2.33 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 30.11 1wlo h GLN 8 CO -0.01 0.21 -0.18 0.00 -0.67 0.00 0.00 178.83 178.19 1wlo h ALA 9 N 0.54 -0.33 -0.03 3.87 0.00 0.20 0.96 119.26 124.46 1wlo h ALA 9 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1wlo h ALA 9 Cb 0.33 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1wlo h ALA 9 CO 0.01 -0.72 0.00 1.28 0.00 0.00 0.00 179.25 179.83 1wlo n LEU 10 N -5.31 0.00 -0.21 0.00 4.77 -0.58 0.22 117.00 115.89 1wlo n LEU 10 Ca -0.07 0.99 0.00 0.00 -0.03 0.00 0.00 56.01 56.90 1wlo n LEU 10 Cb 0.22 -0.49 0.08 0.00 -2.33 0.00 0.00 43.42 40.90 1wlo n LEU 10 CO 0.29 -0.49 0.78 -0.33 -1.33 0.00 0.00 177.39 176.31 1wlo h GLU 11 N 0.00 0.05 -0.45 3.23 5.08 -1.08 0.18 114.58 121.59 1wlo h GLU 11 Ca 0.00 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.42 1wlo h GLU 11 Cb 0.00 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.18 1wlo h GLU 11 CO 0.00 0.03 0.13 1.25 -1.00 0.00 0.00 179.01 179.43 1wlo h LEU 12 N 0.05 0.10 0.17 1.33 5.85 0.15 0.15 115.31 123.11 1wlo h LEU 12 Ca 0.31 0.06 0.01 0.00 0.84 0.00 0.00 57.88 59.10 1wlo h LEU 12 Cb 0.50 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.56 1wlo h LEU 12 CO -0.59 0.09 -0.42 0.15 -0.34 0.00 0.00 178.44 177.32 1wlo h PHE 13 N 0.29 -1.22 0.00 1.25 3.04 0.56 1.81 116.94 122.67 1wlo h PHE 13 Ca 0.22 0.03 0.00 0.00 3.98 0.00 0.00 57.97 62.20 1wlo h PHE 13 Cb 0.24 0.51 0.00 0.00 2.56 0.00 0.00 35.95 39.27 1wlo h PHE 13 CO -0.18 -0.50 0.00 -0.22 -2.02 0.00 0.00 178.31 175.39 1wlo h LYS 14 N -0.66 0.00 0.00 1.11 3.64 -0.91 0.55 116.57 120.30 1wlo h LYS 14 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1wlo h LYS 14 Cb 0.64 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1wlo h LYS 14 CO -0.19 0.00 -1.27 0.45 -2.27 0.00 0.00 179.45 176.17 1wlo n SER 15 N -2.40 0.54 -4.87 4.20 2.88 0.82 -4.93 113.62 109.87 1wlo n SER 15 Ca -0.02 0.04 -0.31 0.00 -1.33 0.00 0.00 58.87 57.26 1wlo n SER 15 Cb 0.04 0.98 -0.00 0.00 -0.75 0.00 0.00 64.21 64.47 1wlo n SER 15 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1wlo s LEU 16 N -4.61 3.40 0.19 2.46 1.43 0.58 -5.02 118.68 117.11 1wlo s LEU 16 Ca -0.01 1.39 -0.30 0.00 -1.03 0.00 0.00 54.13 54.18 1wlo s LEU 16 Cb 0.12 -4.40 -0.08 0.00 0.03 0.00 0.00 46.19 41.87 1wlo s LEU 16 CO 0.83 -0.75 1.11 -2.16 0.23 0.00 0.00 176.35 175.61 1wlo s PRO 17 N -4.79 4.58 0.01 1.29 0.04 -1.26 -4.70 135.00 130.17 1wlo s PRO 17 Ca 0.55 1.75 -0.02 0.00 0.04 0.00 0.00 61.00 63.32 1wlo s PRO 17 Cb -0.11 -3.26 -0.00 0.00 0.04 0.00 0.00 34.50 31.17 1wlo s PRO 17 CO 0.46 0.07 0.84 1.17 0.04 0.00 0.00 177.00 179.58 1wlo n LYS 18 N 2.24 -0.03 -0.27 4.56 3.00 -1.26 0.19 118.16 126.59 1wlo n LYS 18 Ca 0.02 0.84 0.17 0.00 -0.00 0.00 0.00 58.31 59.34 1wlo n LYS 18 Cb 0.46 -1.25 0.32 0.00 0.00 0.00 0.00 35.03 34.56 1wlo n LYS 18 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1wlo n GLU 19 N -2.99 -0.06 -0.04 1.64 0.28 -1.26 0.18 120.64 118.39 1wlo n GLU 19 Ca 0.00 1.16 -0.14 0.00 -0.16 0.00 0.00 57.16 58.02 1wlo n GLU 19 Cb 0.02 -1.93 -0.11 0.00 1.43 0.00 0.00 31.44 30.85 1wlo n GLU 19 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 1wlo h LEU 20 N 0.00 0.08 -1.77 -1.84 3.38 0.16 -3.15 115.31 112.17 1wlo h LEU 20 Ca 0.56 -0.70 0.52 0.00 0.09 0.00 0.00 57.88 58.34 1wlo h LEU 20 Cb 1.30 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.95 1wlo h LEU 20 CO -0.70 0.77 1.27 0.54 0.09 0.00 0.00 178.44 180.41 1wlo n ARG 21 N -4.68 -0.00 0.09 1.13 1.74 0.51 0.20 116.66 115.66 1wlo n ARG 21 Ca -0.09 1.01 -0.13 0.00 -0.77 0.00 0.00 57.85 57.87 1wlo n ARG 21 Cb 0.39 -2.30 -0.08 0.00 -1.02 0.00 0.00 32.46 29.45 1wlo n ARG 21 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1wlo h SER 22 N 0.00 -0.20 -0.67 0.55 0.87 -1.24 -3.05 113.55 109.82 1wlo h SER 22 Ca 0.86 -0.23 -0.02 0.00 -1.23 0.00 0.00 61.79 61.17 1wlo h SER 22 Cb 3.40 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 65.38 1wlo h SER 22 CO -0.05 0.13 0.34 0.06 -0.53 0.00 0.00 176.83 176.78 1wlo h GLN 23 N -0.55 0.97 -0.82 2.24 3.07 0.22 -2.39 115.11 117.86 1wlo h GLN 23 Ca -0.02 -0.13 0.20 0.00 0.09 0.00 0.00 58.65 58.79 1wlo h GLN 23 Cb 0.42 -0.18 -0.14 0.00 0.08 0.00 0.00 27.48 27.65 1wlo h GLN 23 CO 0.04 0.75 0.06 0.28 0.09 0.00 0.00 178.83 180.05 1wlo h VAL 24 N 0.97 0.29 -0.13 1.86 2.07 -0.95 1.48 116.25 121.84 1wlo h VAL 24 Ca 0.24 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.71 1wlo h VAL 24 Cb 0.09 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.02 1wlo h VAL 24 CO -0.03 0.02 0.05 -0.07 0.02 0.00 0.00 177.57 177.56 1wlo h LEU 25 N 0.12 0.18 0.43 2.57 3.38 -1.36 -2.21 115.31 118.42 1wlo h LEU 25 Ca 0.47 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 1wlo h LEU 25 Cb 0.87 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1wlo h LEU 25 CO -0.70 0.31 -0.32 -0.07 0.09 0.00 0.00 178.44 177.75 1wlo h LEU 26 N 0.04 -0.84 -0.19 1.67 -0.00 -0.10 -2.76 115.31 113.13 1wlo h LEU 26 Ca 0.04 0.06 0.02 0.00 -0.00 0.00 0.00 57.88 58.00 1wlo h LEU 26 Cb 0.19 0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 41.09 1wlo h LEU 26 CO -0.00 -0.48 -0.14 -0.33 -0.00 0.00 0.00 178.44 177.48 1wlo h GLU 27 N -0.74 -0.03 -0.61 1.13 5.08 0.19 -0.44 114.58 119.14 1wlo h GLU 27 Ca -0.04 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1wlo h GLU 27 Cb 0.64 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.82 1wlo h GLU 27 CO 0.00 -0.02 -0.36 0.66 -1.00 0.00 0.00 179.01 178.29 1wlo n TYR 28 N -3.48 -0.27 -0.19 4.33 4.01 -0.84 0.37 117.16 121.09 1wlo n TYR 28 Ca 0.00 0.77 -0.10 0.00 -0.16 0.00 0.00 57.90 58.41 1wlo n TYR 28 Cb 0.07 -0.53 -0.05 0.00 -0.31 0.00 0.00 39.34 38.52 1wlo n TYR 28 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1wlo h ALA 29 N 0.14 -0.46 -0.73 -0.72 0.00 -0.99 1.68 119.26 118.18 1wlo h ALA 29 Ca 0.10 0.08 0.21 0.00 0.00 0.00 0.00 54.91 55.30 1wlo h ALA 29 Cb 0.25 1.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 1wlo h ALA 29 CO -0.58 -0.89 0.62 0.00 0.00 0.00 0.00 179.25 178.40 1wlo h ALA 30 N 0.44 2.59 -0.61 0.00 0.00 0.15 0.84 119.26 122.66 1wlo h ALA 30 Ca 0.15 -0.03 -0.38 0.00 0.00 0.00 0.00 54.91 54.65 1wlo h ALA 30 Cb 0.57 0.06 -0.18 0.00 0.00 0.00 0.00 17.79 18.23 1wlo h ALA 30 CO -0.67 -1.00 0.49 1.63 0.00 0.00 0.00 179.25 179.70 1wlo n LYS 31 N -3.96 1.94 -3.52 0.00 4.01 0.57 -4.64 118.16 112.56 1wlo n LYS 31 Ca 0.15 -1.95 -0.29 0.00 -0.51 0.00 0.00 58.31 55.70 1wlo n LYS 31 Cb 0.89 -1.77 -0.13 0.00 -0.51 0.00 0.00 35.03 33.52 1wlo n LYS 31 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1wlo s VAL 32 N -2.63 0.32 0.66 -0.18 1.01 0.29 -4.82 120.40 115.05 1wlo s VAL 32 Ca 0.38 -1.65 -0.12 0.00 0.00 0.00 0.00 61.98 60.59 1wlo s VAL 32 Cb 0.31 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.43 1wlo s VAL 32 CO 0.02 -0.92 1.06 -2.16 0.00 0.00 0.00 175.10 173.10 1wlo s PRO 33 N 1.17 3.07 0.54 2.72 0.04 -1.26 -5.02 135.00 136.26 1wlo s PRO 33 Ca 0.16 1.01 -0.18 0.00 0.04 0.00 0.00 61.00 62.03 1wlo s PRO 33 Cb -0.22 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.26 1wlo s PRO 33 CO -0.07 -1.00 1.04 -1.25 0.04 0.00 0.00 177.00 175.77 1wlo s PRO 34 N -4.78 3.58 0.71 0.56 0.04 -1.26 -4.64 135.00 129.21 1wlo s PRO 34 Ca 0.59 1.25 -0.11 0.00 0.04 0.00 0.00 61.00 62.78 1wlo s PRO 34 Cb -0.14 -2.07 0.02 0.00 0.04 0.00 0.00 34.50 32.35 1wlo s PRO 34 CO 0.50 -0.60 1.07 -1.25 0.04 0.00 0.00 177.00 176.75 1wlo s PRO 35 N -3.70 2.82 0.92 0.56 0.04 -1.25 -5.01 135.00 129.37 1wlo s PRO 35 Ca 0.65 0.91 -0.12 0.00 0.04 0.00 0.00 61.00 62.47 1wlo s PRO 35 Cb -0.16 -1.98 0.14 0.00 0.04 0.00 0.00 34.50 32.55 1wlo s PRO 35 CO 0.29 -1.17 1.14 -1.25 0.04 0.00 0.00 177.00 176.05 1wlo s PRO 36 N -5.06 1.09 0.26 0.56 0.04 -1.26 -4.95 135.00 125.67 1wlo s PRO 36 Ca 0.58 0.27 0.25 0.00 0.04 0.00 0.00 61.00 62.14 1wlo s PRO 36 Cb -0.14 -1.84 0.90 0.00 0.04 0.00 0.00 34.50 33.46 1wlo s PRO 36 CO 0.55 -2.23 1.75 -1.00 0.04 0.00 0.00 177.00 176.11 1wlo h PRO 37 N -1.52 0.00 -2.12 0.56 0.13 -2.07 -3.27 132.00 123.70 1wlo h PRO 37 Ca -0.50 0.00 -0.78 0.00 -0.87 0.00 0.00 66.00 63.85 1wlo h PRO 37 Cb 1.33 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.18 1wlo h PRO 37 CO 0.61 0.00 0.93 0.41 -0.23 0.00 0.00 178.00 179.72 1wlo n GLY 38 N 0.65 5.86 3.52 1.56 0.00 -1.26 -4.92 105.19 110.60 1wlo n GLY 38 Ca 0.04 -2.55 -0.17 0.00 0.00 0.00 0.00 46.02 43.34 1wlo n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wlo s VAL 39 N -4.70 0.00 -0.21 1.61 0.11 -1.24 -5.15 120.40 110.83 1wlo s VAL 39 Ca 0.45 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.51 1wlo s VAL 39 Cb 0.31 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 34.21 1wlo s VAL 39 CO -0.26 0.00 -0.07 -0.70 -3.33 0.00 0.00 175.10 170.75 1wlo s GLU 40 N -1.30 1.68 0.76 1.54 2.12 -1.26 -4.96 118.70 117.28 1wlo s GLU 40 Ca -0.09 -0.82 -0.11 0.00 0.36 0.00 0.00 54.97 54.31 1wlo s GLU 40 Cb -0.00 -2.39 0.05 0.00 0.26 0.00 0.00 34.13 32.05 1wlo s GLU 40 CO 0.08 -0.51 1.12 -0.51 -0.54 0.00 0.00 175.26 174.90 1wlo s LEU 41 N 1.46 2.69 -0.38 2.70 1.43 -1.26 -4.91 118.68 120.41 1wlo s LEU 41 Ca -0.03 0.84 -0.00 0.00 -1.03 0.00 0.00 54.13 53.91 1wlo s LEU 41 Cb -0.17 -3.46 0.10 0.00 0.03 0.00 0.00 46.19 42.69 1wlo s LEU 41 CO -0.07 -1.66 0.14 -0.70 0.23 0.00 0.00 176.35 174.28 1wlo s GLU 42 N -5.45 1.84 0.01 1.70 2.12 0.93 -4.86 118.70 114.99 1wlo s GLU 42 Ca 0.60 -1.81 -0.37 0.00 0.36 0.00 0.00 54.97 53.75 1wlo s GLU 42 Cb -0.11 -3.43 -0.16 0.00 0.26 0.00 0.00 34.13 30.69 1wlo s GLU 42 CO 0.49 -1.00 1.48 -2.13 -0.54 0.00 0.00 175.26 173.56 1wlo n ARG 43 N 4.47 1.32 -2.94 4.30 0.63 -1.26 -3.33 116.66 119.85 1wlo n ARG 43 Ca -0.01 0.48 -0.43 0.00 -0.92 0.00 0.00 57.85 56.97 1wlo n ARG 43 Cb 0.42 -2.15 -0.04 0.00 0.45 0.00 0.00 32.46 31.13 1wlo n ARG 43 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1wlo s VAL 44 N 1.32 4.49 0.29 5.15 1.01 -0.13 -4.88 120.40 127.66 1wlo s VAL 44 Ca 0.87 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 62.36 1wlo s VAL 44 Cb -0.93 -4.60 0.19 0.00 0.00 0.00 0.00 36.38 31.04 1wlo s VAL 44 CO 0.50 -1.31 1.88 0.45 0.00 0.00 0.00 175.10 176.62 1wlo h HIS 45 N 9.42 0.90 -1.04 5.22 -0.00 -1.89 -2.04 115.15 125.71 1wlo h HIS 45 Ca -0.29 -0.05 0.27 0.00 -0.00 0.00 0.00 60.37 60.30 1wlo h HIS 45 Cb 1.08 -0.28 -0.11 0.00 -0.00 0.00 0.00 27.41 28.10 1wlo h HIS 45 CO 0.92 0.68 0.64 1.49 -0.00 0.00 0.00 177.93 181.66 1wlo h GLU 46 N 0.88 0.44 -5.15 2.45 4.81 -1.91 -3.33 114.58 112.78 1wlo h GLU 46 Ca 0.21 -0.03 -0.65 0.00 -0.13 0.00 0.00 59.36 58.76 1wlo h GLU 46 Cb 0.16 -0.10 -0.16 0.00 0.63 0.00 0.00 28.75 29.28 1wlo h GLU 46 CO -0.02 0.29 -0.11 0.00 -0.73 0.00 0.00 179.01 178.44 1wlo n GLN 48 N 5.67 -0.34 -1.19 0.00 6.02 -1.25 -4.45 117.38 121.84 1wlo n GLN 48 Ca -0.06 1.49 -0.34 0.00 -0.01 0.00 0.00 57.00 58.08 1wlo n GLN 48 Cb 0.49 -2.19 0.12 0.00 1.02 0.00 0.00 30.24 29.67 1wlo n GLN 48 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1wlo n THR 49 N -5.32 2.37 -1.48 5.09 -2.24 -1.26 -4.82 114.28 106.61 1wlo n THR 49 Ca 0.06 -0.25 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 1wlo n THR 49 Cb 0.32 -1.20 -0.03 0.00 -2.10 0.00 0.00 70.33 67.31 1wlo n THR 49 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1wlo n PRO 50 N -2.96 2.16 -3.06 -0.78 -0.04 -1.26 -4.81 135.00 124.25 1wlo n PRO 50 Ca 0.14 -2.25 -0.43 0.00 -0.04 0.00 0.00 63.50 60.92 1wlo n PRO 50 Cb 0.50 -3.13 -0.06 0.00 -0.04 0.00 0.00 33.50 30.78 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 4.39 2.96 -0.04 0.54 5.36 -1.26 -4.51 117.98 125.42 1wlo s PHE 51 Ca 0.53 -0.39 -0.11 0.00 -0.96 0.00 0.00 56.93 56.01 1wlo s PHE 51 Cb 0.13 -3.72 -0.05 0.00 -0.34 0.00 0.00 43.02 39.05 1wlo s PHE 51 CO 0.03 -1.14 0.30 -0.06 -1.46 0.00 0.00 175.22 172.88 1wlo s PHE 52 N 3.05 3.66 0.11 10.12 0.40 -0.72 -0.95 117.98 133.64 1wlo s PHE 52 Ca 0.20 0.77 0.01 0.00 -0.60 0.00 0.00 56.93 57.32 1wlo s PHE 52 Cb -0.17 -2.13 -0.04 0.00 0.51 0.00 0.00 43.02 41.19 1wlo s PHE 52 CO 0.14 0.67 -0.05 0.14 0.70 0.00 0.00 175.22 176.82 1wlo s VAL 53 N -1.10 0.64 -0.26 -0.44 -7.23 -1.21 -0.91 120.40 109.89 1wlo s VAL 53 Ca 0.21 -1.93 -0.14 0.00 -1.81 0.00 0.00 61.98 58.31 1wlo s VAL 53 Cb -0.14 -1.75 0.08 0.00 0.56 0.00 0.00 36.38 35.13 1wlo s VAL 53 CO 0.10 -0.81 0.62 -2.28 -0.31 0.00 0.00 175.10 172.43 1wlo s HIS 54 N -3.67 -1.02 -0.08 2.82 5.04 0.53 -0.05 115.29 118.87 1wlo s HIS 54 Ca 0.14 1.99 0.02 0.00 -1.54 0.00 0.00 55.06 55.67 1wlo s HIS 54 Cb 0.06 0.58 0.01 0.00 0.04 0.00 0.00 32.58 33.27 1wlo s HIS 54 CO -0.04 -0.51 -0.13 0.00 -2.34 0.00 0.00 174.74 171.71 1wlo s ALA 55 N 1.81 1.44 0.38 1.58 0.00 -1.26 0.59 121.76 126.30 1wlo s ALA 55 Ca -0.09 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.36 1wlo s ALA 55 Cb -0.07 -0.68 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 1wlo s ALA 55 CO -0.18 0.04 0.12 0.34 0.00 0.00 0.00 175.76 176.07 1wlo s ASP 56 N 0.81 2.58 -0.30 0.00 -1.08 0.49 -4.38 116.67 114.78 1wlo s ASP 56 Ca -0.11 -1.60 -0.01 0.00 -0.52 0.00 0.00 52.55 50.30 1wlo s ASP 56 Cb -0.15 0.38 0.10 0.00 -1.46 0.00 0.00 42.92 41.78 1wlo s ASP 56 CO 0.02 -0.86 0.10 -0.69 0.52 0.00 0.00 175.17 174.25 1wlo s VAL 57 N -3.27 0.76 -0.55 1.11 1.01 -1.26 0.28 120.40 118.48 1wlo s VAL 57 Ca 0.27 -1.30 -0.18 0.00 0.00 0.00 0.00 61.98 60.78 1wlo s VAL 57 Cb 0.04 -1.57 0.10 0.00 0.00 0.00 0.00 36.38 34.95 1wlo s VAL 57 CO 0.15 -0.67 0.60 -0.70 0.00 0.00 0.00 175.10 174.48 1wlo s GLU 58 N 1.68 3.04 1.58 2.72 2.56 -0.88 -4.80 118.70 124.59 1wlo s GLU 58 Ca 0.09 -1.35 0.00 0.00 0.00 0.00 0.00 54.97 53.72 1wlo s GLU 58 Cb -0.17 -4.23 0.00 0.00 2.00 0.00 0.00 34.13 31.73 1wlo s GLU 58 CO -0.26 -1.37 0.00 0.41 -0.56 0.00 0.00 175.26 173.48 1wlo n GLY 59 N 5.24 1.96 0.00 -1.50 0.00 -1.26 -2.94 105.19 106.70 1wlo n GLY 59 Ca -0.10 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 -1.85 3.83 -0.02 0.00 -1.26 -5.10 105.19 100.79 1wlo n GLY 60 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1wlo n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wlo s LYS 61 N -0.02 2.28 -0.19 1.61 -2.85 -1.15 -4.62 119.74 114.81 1wlo s LYS 61 Ca 0.00 -1.92 -0.04 0.00 -1.00 0.00 0.00 55.97 53.01 1wlo s LYS 61 Cb 0.00 -2.05 -0.02 0.00 -2.06 0.00 0.00 37.83 33.70 1wlo s LYS 61 CO 0.00 -0.35 -0.03 0.14 0.10 0.00 0.00 175.35 175.21 1wlo s VAL 62 N -2.68 3.73 -0.20 1.79 -7.23 -0.57 -2.06 120.40 113.18 1wlo s VAL 62 Ca 0.36 -0.39 -0.23 0.00 -1.81 0.00 0.00 61.98 59.91 1wlo s VAL 62 Cb 0.00 -2.67 -0.02 0.00 0.56 0.00 0.00 36.38 34.25 1wlo s VAL 62 CO 0.21 0.45 0.72 -0.13 -0.31 0.00 0.00 175.10 176.04 1wlo s ARG 63 N 0.92 4.22 -0.16 4.82 1.81 0.79 -3.62 118.95 127.72 1wlo s ARG 63 Ca 0.00 0.78 -0.13 0.00 -1.72 0.00 0.00 55.73 54.66 1wlo s ARG 63 Cb -0.14 -3.60 -0.05 0.00 -0.45 0.00 0.00 34.95 30.71 1wlo s ARG 63 CO 0.01 -0.33 0.25 -0.51 -0.68 0.00 0.00 175.30 174.04 1wlo s LEU 64 N 2.21 4.25 -0.07 2.53 1.02 -1.26 -0.38 118.68 126.98 1wlo s LEU 64 Ca 0.32 0.44 -0.03 0.00 0.02 0.00 0.00 54.13 54.89 1wlo s LEU 64 Cb -0.16 -2.29 0.04 0.00 0.02 0.00 0.00 46.19 43.80 1wlo s LEU 64 CO 0.10 0.14 0.13 -0.31 0.02 0.00 0.00 176.35 176.43 1wlo s TYR 65 N 0.33 -0.11 -0.11 0.29 1.51 0.20 -5.00 117.35 114.46 1wlo s TYR 65 Ca 0.14 0.51 0.02 0.00 -1.01 0.00 0.00 57.07 56.73 1wlo s TYR 65 Cb -0.12 -0.33 0.01 0.00 -0.11 0.00 0.00 41.96 41.41 1wlo s TYR 65 CO 0.03 -0.25 -0.16 -0.06 -1.11 0.00 0.00 175.55 173.99 1wlo s PHE 66 N 2.26 2.05 -0.20 2.71 0.08 -1.26 0.20 117.98 123.82 1wlo s PHE 66 Ca 0.04 -0.94 -0.04 0.00 0.12 0.00 0.00 56.93 56.11 1wlo s PHE 66 Cb -0.12 -1.46 -0.02 0.00 -0.57 0.00 0.00 43.02 40.86 1wlo s PHE 66 CO -0.05 -0.47 -0.04 -1.58 -0.10 0.00 0.00 175.22 172.99 1wlo s HIS 67 N 0.87 2.97 -0.16 0.36 5.65 -0.09 -3.92 115.29 120.97 1wlo s HIS 67 Ca -0.09 -0.68 -0.02 0.00 0.25 0.00 0.00 55.06 54.52 1wlo s HIS 67 Cb -0.15 -2.06 0.05 0.00 -1.18 0.00 0.00 32.58 29.24 1wlo s HIS 67 CO -0.00 -0.36 0.02 0.08 -0.65 0.00 0.00 174.74 173.82 1wlo s VAL 68 N 1.10 0.58 -0.04 0.89 1.01 -1.26 -1.76 120.40 120.91 1wlo s VAL 68 Ca 0.02 -0.43 -0.07 0.00 0.00 0.00 0.00 61.98 61.50 1wlo s VAL 68 Cb -0.15 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1wlo s VAL 68 CO 0.00 -0.07 0.35 1.55 0.00 0.00 0.00 175.10 176.94 1wlo h PRO 69 N 8.24 -0.23 -0.31 2.72 0.13 -1.99 -3.31 132.00 137.25 1wlo h PRO 69 Ca -0.18 0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.96 1wlo h PRO 69 Cb 1.12 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1wlo h PRO 69 CO 0.33 -0.15 0.15 0.22 -0.23 0.00 0.00 178.00 178.32 1wlo h ASP 70 N -0.76 0.37 -4.31 1.44 1.82 -1.96 -3.47 116.42 109.54 1wlo h ASP 70 Ca -0.02 -0.02 -0.04 0.00 -0.39 0.00 0.00 57.03 56.56 1wlo h ASP 70 Cb 0.18 -0.09 0.03 0.00 0.68 0.00 0.00 39.33 40.13 1wlo h ASP 70 CO 0.04 0.31 -0.13 -0.62 -1.61 0.00 0.00 179.24 177.24 1wlo n GLU 71 N -4.44 -0.86 -3.05 0.28 1.02 -1.25 -5.00 120.64 107.35 1wlo n GLU 71 Ca 0.02 0.89 -0.40 0.00 -0.02 0.00 0.00 57.16 57.65 1wlo n GLU 71 Cb 0.11 -3.85 -0.05 0.00 -0.02 0.00 0.00 31.44 27.63 1wlo n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wlo s ALA 72 N -3.06 3.37 -1.44 0.62 0.00 -1.26 -4.93 121.76 115.07 1wlo s ALA 72 Ca 0.07 0.18 0.23 0.00 0.00 0.00 0.00 51.96 52.43 1wlo s ALA 72 Cb -0.01 -2.94 1.14 0.00 0.00 0.00 0.00 23.12 21.32 1wlo s ALA 72 CO 0.41 0.01 1.74 -0.35 0.00 0.00 0.00 175.76 177.57 1wlo n PRO 73 N 3.21 0.33 -0.08 0.00 -0.04 -1.26 -0.38 135.00 136.77 1wlo n PRO 73 Ca -0.03 0.07 -0.19 0.00 -0.04 0.00 0.00 63.50 63.31 1wlo n PRO 73 Cb 0.51 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.28 1.60 0.08 0.52 -2.24 -1.26 -3.32 114.28 108.37 1wlo n THR 74 Ca 0.11 -0.61 -0.22 0.00 -2.27 0.00 0.00 64.05 61.06 1wlo n THR 74 Cb 0.18 -1.53 -0.15 0.00 -2.10 0.00 0.00 70.33 66.73 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 0.03 1.31 -0.63 2.28 2.07 -1.95 -3.31 116.25 116.05 1wlo h VAL 75 Ca -0.52 -2.56 -0.05 0.00 0.82 0.00 0.00 66.70 64.38 1wlo h VAL 75 Cb 1.95 3.03 -0.03 0.00 -1.52 0.00 0.00 31.29 34.73 1wlo h VAL 75 CO -0.02 0.76 0.18 0.50 0.02 0.00 0.00 177.57 179.01 1wlo h LYS 76 N -0.15 0.96 -0.14 1.57 3.64 -0.94 -3.10 116.57 118.41 1wlo h LYS 76 Ca -0.22 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 58.97 1wlo h LYS 76 Cb 1.87 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 33.53 1wlo h LYS 76 CO 0.18 0.84 -0.09 0.00 -2.27 0.00 0.00 179.45 178.10 1wlo h ALA 77 N 1.27 -0.15 -0.64 5.00 0.00 -1.63 0.79 119.26 123.89 1wlo h ALA 77 Ca 0.20 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.25 1wlo h ALA 77 Cb 0.29 1.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.95 1wlo h ALA 77 CO -0.01 -0.22 -0.26 0.35 0.00 0.00 0.00 179.25 179.12 1wlo h PHE 78 N -0.01 -0.65 -0.86 0.00 3.57 -1.67 0.32 116.94 117.64 1wlo h PHE 78 Ca 0.02 0.07 0.21 0.00 3.53 0.00 0.00 57.97 61.80 1wlo h PHE 78 Cb 0.07 0.38 -0.15 0.00 2.79 0.00 0.00 35.95 39.04 1wlo h PHE 78 CO -0.88 -0.34 -0.00 0.00 -2.23 0.00 0.00 178.31 174.85 1wlo h ALA 79 N 1.34 0.91 -0.31 2.41 0.00 -0.88 0.56 119.26 123.29 1wlo h ALA 79 Ca 0.28 0.29 -0.06 0.00 0.00 0.00 0.00 54.91 55.42 1wlo h ALA 79 Cb 0.53 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1wlo h ALA 79 CO -0.70 -0.46 -0.03 0.78 0.00 0.00 0.00 179.25 178.84 1wlo h GLY 80 N 0.07 0.62 1.86 0.00 0.00 0.17 -0.45 103.07 105.33 1wlo h GLY 80 Ca 0.48 -0.48 0.01 0.00 0.00 0.00 0.00 47.33 47.35 1wlo h GLY 80 CO -0.78 0.44 0.06 -2.00 0.00 0.00 0.00 176.54 174.26 1wlo h LEU 81 N 0.35 0.00 0.10 3.11 5.85 0.20 1.68 115.31 126.59 1wlo h LEU 81 Ca 0.08 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.62 1wlo h LEU 81 Cb 0.49 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.53 1wlo h LEU 81 CO 0.02 0.00 -0.87 -0.07 -0.34 0.00 0.00 178.44 177.18 1wlo h LEU 82 N 0.00 0.32 -0.87 2.25 3.38 0.44 -3.31 115.31 117.53 1wlo h LEU 82 Ca 0.02 -0.90 -0.01 0.00 0.09 0.00 0.00 57.88 57.08 1wlo h LEU 82 Cb 0.13 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1wlo h LEU 82 CO -0.00 1.39 -0.05 -0.09 0.09 0.00 0.00 178.44 179.79 1wlo h ARG 83 N -0.52 0.00 -0.88 1.13 2.43 0.15 -2.87 114.38 113.81 1wlo h ARG 83 Ca -0.18 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.04 1wlo h ARG 83 Cb 1.53 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 31.03 1wlo h ARG 83 CO 0.07 0.05 0.58 1.05 -1.51 0.00 0.00 179.97 180.20 1wlo h GLU 84 N 0.00 1.01 -1.70 0.20 -0.00 0.24 -2.80 114.58 111.53 1wlo h GLU 84 Ca -0.00 -0.06 -0.48 0.00 -0.00 0.00 0.00 59.36 58.82 1wlo h GLU 84 Cb 0.74 -0.23 -0.41 0.00 -0.00 0.00 0.00 28.75 28.85 1wlo h GLU 84 CO 0.01 0.67 -1.02 0.41 -0.00 0.00 0.00 179.01 179.07 1wlo n GLY 85 N -1.40 3.75 0.73 1.06 0.00 -1.16 -4.75 105.19 103.42 1wlo n GLY 85 Ca 0.13 -1.95 0.00 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.03 0.00 -4.57 0.99 4.77 -1.10 -3.66 117.00 113.41 1wlo n LEU 86 Ca 0.24 0.00 -0.57 0.00 -0.03 0.00 0.00 56.01 55.64 1wlo n LEU 86 Cb 0.65 0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 41.81 1wlo n LEU 86 CO 0.27 -0.18 1.50 1.21 -1.33 0.00 0.00 177.39 178.86 1wlo n GLU 87 N -1.86 0.81 0.00 3.23 4.07 -1.06 0.20 120.64 126.03 1wlo n GLU 87 Ca 0.00 0.27 0.00 0.00 -0.06 0.00 0.00 57.16 57.37 1wlo n GLU 87 Cb 0.00 -2.03 0.00 0.00 -0.06 0.00 0.00 31.44 29.35 1wlo n GLU 87 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1wlo n GLY 88 N 5.36 2.98 2.27 8.31 0.00 -1.24 -5.03 105.19 117.83 1wlo n GLY 88 Ca 0.36 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.26 1wlo n GLY 88 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wlo n GLU 89 N -0.42 -0.98 -3.85 1.61 -0.58 0.54 -4.24 120.64 112.73 1wlo n GLU 89 Ca 0.00 -0.54 -0.21 0.00 -0.42 0.00 0.00 57.16 56.00 1wlo n GLU 89 Cb 0.00 -1.10 -0.02 0.00 -0.57 0.00 0.00 31.44 29.75 1wlo n GLU 89 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1wlo s SER 90 N -1.88 6.12 0.00 1.62 1.04 -1.26 -1.52 113.70 117.83 1wlo s SER 90 Ca 0.25 -0.05 0.22 0.00 0.48 0.00 0.00 55.95 56.85 1wlo s SER 90 Cb -0.04 -1.63 1.06 0.00 0.10 0.00 0.00 66.02 65.51 1wlo s SER 90 CO 0.21 -0.17 1.73 -0.81 0.98 0.00 0.00 173.24 175.17 1wlo n PRO 91 N -1.45 0.18 0.05 4.02 -0.04 -1.26 -0.91 135.00 135.59 1wlo n PRO 91 Ca -0.06 0.09 -0.20 0.00 -0.04 0.00 0.00 63.50 63.29 1wlo n PRO 91 Cb 0.57 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.39 1wlo n PRO 91 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1wlo h GLU 92 N 0.00 0.30 0.13 0.54 5.08 -1.96 -3.07 114.58 115.60 1wlo h GLU 92 Ca 0.00 -0.52 -0.32 0.00 -1.00 0.00 0.00 59.36 57.52 1wlo h GLU 92 Cb 0.28 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 1wlo h GLU 92 CO 0.00 1.20 -1.60 0.00 -1.00 0.00 0.00 179.01 177.61 1wlo h ALA 93 N 0.24 0.25 0.00 3.43 0.00 -1.93 -1.80 119.26 119.44 1wlo h ALA 93 Ca -0.34 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.44 1wlo h ALA 93 Cb 2.06 0.33 0.00 0.00 0.00 0.00 0.00 17.79 20.18 1wlo h ALA 93 CO 0.14 1.12 0.00 0.28 0.00 0.00 0.00 179.25 180.79 1wlo h VAL 94 N 0.08 0.00 0.05 0.00 2.07 -1.19 -2.30 116.25 114.95 1wlo h VAL 94 Ca -0.27 -0.29 -0.36 0.00 0.82 0.00 0.00 66.70 66.60 1wlo h VAL 94 Cb 2.04 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 32.89 1wlo h VAL 94 CO 0.16 0.00 -2.04 0.18 0.02 0.00 0.00 177.57 175.89 1wlo n LEU 95 N -2.64 2.45 0.27 2.57 4.77 -1.16 -4.04 117.00 119.21 1wlo n LEU 95 Ca 0.01 0.19 0.17 0.00 -0.03 0.00 0.00 56.01 56.35 1wlo n LEU 95 Cb 0.22 -0.99 0.91 0.00 -2.33 0.00 0.00 43.42 41.23 1wlo n LEU 95 CO 0.21 0.71 1.04 1.05 -1.33 0.00 0.00 177.39 179.07 1wlo h GLU 96 N -0.35 0.00 -6.40 3.23 4.11 -1.05 -3.42 114.58 110.70 1wlo h GLU 96 Ca -0.49 0.00 -0.53 0.00 0.07 0.00 0.00 59.36 58.41 1wlo h GLU 96 Cb 1.78 0.00 0.02 0.00 0.50 0.00 0.00 28.75 31.05 1wlo h GLU 96 CO -0.10 0.00 1.18 0.08 0.07 0.00 0.00 179.01 180.23 1wlo s VAL 97 N -3.90 2.90 0.71 -1.06 1.01 -0.89 -4.59 120.40 114.59 1wlo s VAL 97 Ca -0.04 0.10 -0.11 0.00 0.00 0.00 0.00 61.98 61.93 1wlo s VAL 97 Cb 0.10 -3.06 0.02 0.00 0.00 0.00 0.00 36.38 33.43 1wlo s VAL 97 CO 0.30 -0.01 1.07 -2.16 0.00 0.00 0.00 175.10 174.30 1wlo s PRO 98 N 3.81 2.79 0.00 2.72 0.04 -1.26 -4.93 135.00 138.17 1wlo s PRO 98 Ca 0.84 0.90 0.23 0.00 0.04 0.00 0.00 61.00 63.02 1wlo s PRO 98 Cb -0.43 -1.98 1.32 0.00 0.04 0.00 0.00 34.50 33.46 1wlo s PRO 98 CO 0.39 -1.19 1.77 -0.35 0.04 0.00 0.00 177.00 177.66 1wlo n PRO 99 N -3.18 0.59 -1.35 0.56 -0.04 -1.26 -2.69 135.00 127.62 1wlo n PRO 99 Ca 0.07 0.03 -0.03 0.00 -0.04 0.00 0.00 63.50 63.53 1wlo n PRO 99 Cb 0.54 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.61 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 0.55 4.39 0.16 0.55 0.00 -1.26 -4.76 105.19 104.82 1wlo n GLY 100 Ca 0.15 -1.55 0.12 0.00 0.00 0.00 0.00 46.02 44.75 1wlo n GLY 100 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1wlo h PHE 101 N 1.46 0.00 0.00 1.61 -0.00 -1.89 -1.70 116.94 116.42 1wlo h PHE 101 Ca 0.04 0.00 -0.23 0.00 -0.00 0.00 0.00 57.97 57.77 1wlo h PHE 101 Cb 1.33 0.00 -0.04 0.00 -0.00 0.00 0.00 35.95 37.23 1wlo h PHE 101 CO 0.65 0.00 -2.01 2.48 -0.00 0.00 0.00 178.31 179.43 1wlo n TYR 102 N -2.33 0.32 -1.64 6.09 4.11 -1.26 -4.95 117.16 117.50 1wlo n TYR 102 Ca 0.00 0.11 -0.53 0.00 -0.00 0.00 0.00 57.90 57.48 1wlo n TYR 102 Cb 0.14 -0.93 -0.06 0.00 -0.00 0.00 0.00 39.34 38.49 1wlo n TYR 102 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1wlo n ARG 103 N -2.70 1.26 -2.05 -3.48 1.74 -0.64 -3.36 116.66 107.43 1wlo n ARG 103 Ca -0.20 0.46 -0.02 0.00 -0.77 0.00 0.00 57.85 57.32 1wlo n ARG 103 Cb 0.95 -2.13 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 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 3.24 -0.87 0.52 -0.13 0.00 -1.26 -4.98 105.19 101.71 1wlo n GLY 104 Ca 0.21 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 -0.63 -0.65 0.00 1.61 4.01 -1.21 -5.03 117.16 115.26 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 0.26 0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 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 -1.10 2.22 0.37 2.72 0.00 -1.26 -3.96 105.19 104.18 1wlo n GLY 106 Ca 0.00 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 1wlo n GLY 106 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wlo n LEU 107 N 0.00 -0.92 -0.35 0.99 7.99 -1.26 0.18 117.00 123.63 1wlo n LEU 107 Ca 0.00 1.64 0.14 0.00 -0.01 0.00 0.00 56.01 57.78 1wlo n LEU 107 Cb 0.00 -0.25 0.34 0.00 -0.11 0.00 0.00 43.42 43.40 1wlo n LEU 107 CO 0.00 -1.31 1.19 -0.08 -1.51 0.00 0.00 177.39 175.68 1wlo h GLU 108 N 0.00 0.70 -0.77 3.23 4.81 -1.83 1.96 114.58 122.69 1wlo h GLU 108 Ca 0.14 -0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.40 1wlo h GLU 108 Cb 0.36 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.53 1wlo h GLU 108 CO -0.82 0.47 0.50 1.49 -0.73 0.00 0.00 179.01 179.92 1wlo h GLU 109 N 0.73 0.75 0.06 1.92 4.81 0.16 -2.96 114.58 120.04 1wlo h GLU 109 Ca 0.59 -0.04 -0.31 0.00 -0.13 0.00 0.00 59.36 59.47 1wlo h GLU 109 Cb 0.97 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.15 1wlo h GLU 109 CO -0.40 0.49 -1.71 1.19 -0.73 0.00 0.00 179.01 177.86 1wlo n PHE 110 N -4.49 1.04 -3.44 0.92 3.72 0.16 -4.85 117.46 110.51 1wlo n PHE 110 Ca 0.12 0.32 -0.38 0.00 -0.05 0.00 0.00 57.45 57.46 1wlo n PHE 110 Cb 0.26 -1.12 -0.08 0.00 -0.94 0.00 0.00 39.48 37.60 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 -2.46 3.32 0.79 1.38 0.08 0.62 -5.06 117.98 116.64 1wlo s PHE 111 Ca -0.27 0.47 -0.15 0.00 0.12 0.00 0.00 56.93 57.10 1wlo s PHE 111 Cb 0.07 -2.49 -0.03 0.00 -0.57 0.00 0.00 43.02 39.99 1wlo s PHE 111 CO 0.67 -0.08 0.41 -2.37 -0.10 0.00 0.00 175.22 173.75 1wlo n THR 112 N 4.61 1.17 1.25 0.64 5.66 -1.26 -4.15 114.28 122.21 1wlo n THR 112 Ca -0.10 -0.35 0.11 0.00 -3.05 0.00 0.00 64.05 60.67 1wlo n THR 112 Cb 0.51 -0.65 0.63 0.00 -1.55 0.00 0.00 70.33 69.28 1wlo n THR 112 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1wlo n PRO 113 N -0.74 0.51 -0.05 1.09 -0.04 -1.26 -2.33 135.00 132.18 1wlo n PRO 113 Ca 0.08 0.04 -0.22 0.00 -0.04 0.00 0.00 63.50 63.37 1wlo n PRO 113 Cb 0.51 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 1wlo n PRO 113 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1wlo n LEU 114 N -1.16 2.35 -0.11 1.53 -0.00 -1.26 -3.70 117.00 114.65 1wlo n LEU 114 Ca 0.14 0.28 -0.10 0.00 -0.00 0.00 0.00 56.01 56.33 1wlo n LEU 114 Cb 0.14 -1.05 0.04 0.00 -0.00 0.00 0.00 43.42 42.56 1wlo n LEU 114 CO 0.16 0.64 0.66 0.03 -0.00 0.00 0.00 177.39 178.87 1wlo h ARG 115 N -0.36 0.85 -0.24 1.96 3.08 -1.88 -3.06 114.38 114.73 1wlo h ARG 115 Ca -0.42 -0.38 0.05 0.00 0.07 0.00 0.00 59.98 59.31 1wlo h ARG 115 Cb 1.75 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 31.73 1wlo h ARG 115 CO -0.05 1.02 -0.06 -0.07 -1.07 0.00 0.00 179.97 179.74 1wlo h LEU 116 N 0.73 -0.23 -1.74 3.04 -0.00 -1.64 0.31 115.31 115.78 1wlo h LEU 116 Ca 0.09 0.07 0.51 0.00 -0.00 0.00 0.00 57.88 58.55 1wlo h LEU 116 Cb 0.81 0.15 -0.08 0.00 -0.00 0.00 0.00 40.66 41.55 1wlo h LEU 116 CO 0.07 -0.08 1.24 0.54 -0.00 0.00 0.00 178.44 180.21 1wlo n ARG 117 N -5.22 -0.00 -0.09 1.13 1.74 -1.16 -0.24 116.66 112.82 1wlo n ARG 117 Ca -0.01 1.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.94 1wlo n ARG 117 Cb 0.15 -2.27 -0.05 0.00 -1.02 0.00 0.00 32.46 29.26 1wlo n ARG 117 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1wlo n GLY 118 N -1.79 -0.85 0.31 -0.13 0.00 -0.03 -4.00 105.19 98.71 1wlo n GLY 118 Ca 0.40 -0.09 0.22 0.00 0.00 0.00 0.00 46.02 46.56 1wlo n GLY 118 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1wlo n LEU 119 N -4.52 0.11 0.18 0.99 4.32 0.67 0.11 117.00 118.86 1wlo n LEU 119 Ca -0.19 1.58 -0.15 0.00 -0.02 0.00 0.00 56.01 57.23 1wlo n LEU 119 Cb 0.47 -0.68 -0.07 0.00 -1.62 0.00 0.00 43.42 41.52 1wlo n LEU 119 CO 0.14 -1.69 0.64 -0.33 -1.22 0.00 0.00 177.39 174.93 1wlo h GLU 120 N 0.00 -0.64 -1.37 3.23 5.08 -1.04 -0.74 114.58 119.11 1wlo h GLU 120 Ca 0.69 0.04 0.46 0.00 -1.00 0.00 0.00 59.36 59.55 1wlo h GLU 120 Cb 1.66 0.14 -0.12 0.00 0.50 0.00 0.00 28.75 30.93 1wlo h GLU 120 CO -0.81 -0.42 0.90 0.00 -1.00 0.00 0.00 179.01 177.68 1wlo n ALA 121 N -2.67 1.35 0.07 3.43 0.00 0.30 0.15 120.51 123.14 1wlo n ALA 121 Ca -0.09 0.80 -0.13 0.00 0.00 0.00 0.00 53.44 54.02 1wlo n ALA 121 Cb 0.35 -1.01 -0.06 0.00 0.00 0.00 0.00 19.45 18.73 1wlo n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wlo h ALA 122 N 1.43 -0.59 0.89 0.00 0.00 -0.90 1.72 119.26 121.80 1wlo h ALA 122 Ca 0.84 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.67 1wlo h ALA 122 Cb 2.78 0.66 0.01 0.00 0.00 0.00 0.00 17.79 21.24 1wlo h ALA 122 CO -0.39 -0.91 -0.43 1.25 0.00 0.00 0.00 179.25 178.77 1wlo h LEU 123 N -0.54 -1.03 -0.69 0.00 5.85 0.14 0.16 115.31 119.19 1wlo h LEU 123 Ca 0.05 0.04 0.13 0.00 0.84 0.00 0.00 57.88 58.94 1wlo h LEU 123 Cb 0.62 0.27 -0.13 0.00 0.37 0.00 0.00 40.66 41.79 1wlo h LEU 123 CO -0.28 -0.73 -0.23 -0.07 -0.34 0.00 0.00 178.44 176.79 1wlo h LEU 124 N -1.20 -0.84 0.23 2.25 -0.00 -1.17 0.94 115.31 115.52 1wlo h LEU 124 Ca -0.12 0.22 -0.00 0.00 -0.00 0.00 0.00 57.88 57.98 1wlo h LEU 124 Cb 0.92 0.49 -0.02 0.00 -0.00 0.00 0.00 40.66 42.06 1wlo h LEU 124 CO 0.19 -0.26 -0.29 0.03 -0.00 0.00 0.00 178.44 178.11 1wlo h ARG 125 N -0.05 -0.52 -0.60 1.13 3.08 0.28 0.23 114.38 117.94 1wlo h ARG 125 Ca 0.31 0.04 0.12 0.00 0.07 0.00 0.00 59.98 60.52 1wlo h ARG 125 Cb 0.54 0.12 -0.11 0.00 0.08 0.00 0.00 29.97 30.59 1wlo h ARG 125 CO -0.73 -0.34 -0.12 -0.07 -1.07 0.00 0.00 179.97 177.64 1wlo h LEU 126 N -0.54 -0.49 -2.06 3.04 3.38 0.32 1.14 115.31 120.10 1wlo h LEU 126 Ca -0.03 0.17 0.10 0.00 0.09 0.00 0.00 57.88 58.22 1wlo h LEU 126 Cb 0.48 0.35 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1wlo h LEU 126 CO -0.07 -0.18 0.29 1.56 0.09 0.00 0.00 178.44 180.12 1wlo h GLN 127 N 0.02 0.00 0.00 1.13 4.20 0.13 0.65 115.11 121.24 1wlo h GLN 127 Ca 0.29 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.88 1wlo h GLN 127 Cb 0.46 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 1wlo h GLN 127 CO -0.59 0.00 -0.70 0.00 -0.67 0.00 0.00 178.83 176.87 1wlo h ALA 128 N 1.76 0.64 0.08 3.87 0.00 0.46 -2.97 119.26 123.10 1wlo h ALA 128 Ca 0.17 -0.55 -0.26 0.00 0.00 0.00 0.00 54.91 54.26 1wlo h ALA 128 Cb 0.74 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.51 1wlo h ALA 128 CO -0.00 0.72 -1.13 1.96 0.00 0.00 0.00 179.25 180.80 1wlo h GLN 129 N 0.00 0.42 -0.30 0.00 4.20 0.32 -3.28 115.11 116.47 1wlo h GLN 129 Ca -0.03 -0.56 -0.04 0.00 0.06 0.00 0.00 58.65 58.08 1wlo h GLN 129 Cb 1.45 0.18 -0.01 0.00 0.30 0.00 0.00 27.48 29.40 1wlo h GLN 129 CO 0.07 1.22 0.03 0.28 -0.67 0.00 0.00 178.83 179.75 1wlo h VAL 130 N 0.19 1.24 -0.70 -0.54 2.07 -0.72 -2.18 116.25 115.60 1wlo h VAL 130 Ca -0.13 -0.86 0.20 0.00 0.82 0.00 0.00 66.70 66.73 1wlo h VAL 130 Cb 1.80 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 32.77 1wlo h VAL 130 CO 0.20 0.28 0.77 0.03 0.02 0.00 0.00 177.57 178.87 1wlo h ARG 131 N 0.32 0.00 0.17 1.57 3.08 -1.58 1.58 114.38 119.52 1wlo h ARG 131 Ca 0.09 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.83 1wlo h ARG 131 Cb 0.38 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.44 1wlo h ARG 131 CO 0.01 0.00 -1.45 0.87 -1.07 0.00 0.00 179.97 178.33 1wlo h LYS 132 N 0.00 0.36 -0.37 0.04 1.79 -1.49 -3.23 116.57 113.67 1wlo h LYS 132 Ca 0.33 -0.61 -0.09 0.00 -2.18 0.00 0.00 60.65 58.10 1wlo h LYS 132 Cb 1.88 0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 32.74 1wlo h LYS 132 CO -0.00 1.27 -0.16 0.00 -1.08 0.00 0.00 179.45 179.48 1wlo h ALA 133 N 0.38 1.04 -0.59 3.86 0.00 0.23 -2.55 119.26 121.63 1wlo h ALA 133 Ca -0.22 -0.32 0.06 0.00 0.00 0.00 0.00 54.91 54.42 1wlo h ALA 133 Cb 2.06 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.64 1wlo h ALA 133 CO 0.21 0.58 0.29 -0.07 0.00 0.00 0.00 179.25 180.27 1wlo h LEU 134 N 0.61 0.41 0.00 0.00 3.38 -0.73 0.43 115.31 119.41 1wlo h LEU 134 Ca 0.10 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1wlo h LEU 134 Cb 0.61 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1wlo h LEU 134 CO 0.04 0.27 0.00 1.07 0.09 0.00 0.00 178.44 179.91 1wlo n THR 135 N -4.87 0.01 1.49 0.22 5.66 -1.02 -5.12 114.28 110.65 1wlo n THR 135 Ca 0.07 0.00 0.14 0.00 -3.05 0.00 0.00 64.05 61.21 1wlo n THR 135 Cb 0.18 -0.59 0.52 0.00 -1.55 0.00 0.00 70.33 68.89 1wlo n THR 135 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78