#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 -0.82 -1.52 2.03 0.24 -1.20 -4.90 118.33 112.16 1wlo n VAL 2 Ca 0.00 0.82 -0.29 0.00 -2.04 0.00 0.00 64.34 62.83 1wlo n VAL 2 Cb 0.00 -1.24 0.17 0.00 -1.47 0.00 0.00 33.84 31.31 1wlo n VAL 2 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1wlo s PRO 3 N -4.47 0.46 -0.07 7.34 0.04 -1.26 -4.84 135.00 132.19 1wlo s PRO 3 Ca 0.00 0.04 -0.18 0.00 0.04 0.00 0.00 61.00 60.90 1wlo s PRO 3 Cb 0.00 -1.78 -0.14 0.00 0.04 0.00 0.00 34.50 32.62 1wlo s PRO 3 CO 0.00 -2.61 0.68 -1.00 0.04 0.00 0.00 177.00 174.11 1wlo h PRO 4 N -1.79 -0.17 -1.73 0.56 0.13 -1.92 -0.45 132.00 126.63 1wlo h PRO 4 Ca -0.48 0.01 0.52 0.00 -0.87 0.00 0.00 66.00 65.18 1wlo h PRO 4 Cb 1.30 0.04 -0.09 0.00 0.13 0.00 0.00 31.00 32.38 1wlo h PRO 4 CO 0.50 0.23 1.23 1.63 -0.23 0.00 0.00 178.00 181.35 1wlo n LYS 5 N -4.88 -0.01 -0.02 0.86 4.01 -1.26 0.16 118.16 117.02 1wlo n LYS 5 Ca -0.07 1.06 -0.01 0.00 -0.51 0.00 0.00 58.31 58.78 1wlo n LYS 5 Cb 0.24 -2.35 -0.00 0.00 -0.51 0.00 0.00 35.03 32.41 1wlo n LYS 5 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1wlo h LEU 6 N 0.00 0.00 -1.74 -0.35 5.85 -1.71 -2.76 115.31 114.60 1wlo h LEU 6 Ca 0.87 0.00 0.53 0.00 0.84 0.00 0.00 57.88 60.12 1wlo h LEU 6 Cb 3.36 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 44.29 1wlo h LEU 6 CO -0.11 0.18 1.22 1.17 -0.34 0.00 0.00 178.44 180.55 1wlo n LYS 7 N -2.82 -0.01 0.02 1.25 3.00 -0.17 0.88 118.16 120.31 1wlo n LYS 7 Ca -0.01 1.12 -0.07 0.00 -0.00 0.00 0.00 58.31 59.34 1wlo n LYS 7 Cb 0.06 -2.44 -0.05 0.00 0.00 0.00 0.00 35.03 32.60 1wlo n LYS 7 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 1wlo h GLN 8 N 0.00 -0.16 -0.73 1.64 -0.00 0.13 -0.07 115.11 115.92 1wlo h GLN 8 Ca 0.90 0.01 0.16 0.00 -0.00 0.00 0.00 58.65 59.73 1wlo h GLN 8 Cb 3.39 0.04 -0.11 0.00 0.00 0.00 0.00 27.48 30.79 1wlo h GLN 8 CO -0.16 0.16 0.13 0.00 0.00 0.00 0.00 178.83 178.95 1wlo h ALA 9 N -0.66 0.89 0.39 3.38 0.00 0.80 0.67 119.26 124.72 1wlo h ALA 9 Ca -0.02 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1wlo h ALA 9 Cb 0.39 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1wlo h ALA 9 CO 0.03 -0.37 -0.19 -0.07 0.00 0.00 0.00 179.25 178.65 1wlo h LEU 10 N 0.21 -0.45 -1.05 0.00 3.38 -0.58 0.80 115.31 117.63 1wlo h LEU 10 Ca 0.41 0.02 0.40 0.00 0.09 0.00 0.00 57.88 58.80 1wlo h LEU 10 Cb 0.71 0.12 -0.17 0.00 0.09 0.00 0.00 40.66 41.41 1wlo h LEU 10 CO -0.55 -0.23 0.59 -0.33 0.09 0.00 0.00 178.44 178.01 1wlo h GLU 11 N -0.70 0.08 -0.23 1.13 5.08 -0.43 1.66 114.58 121.17 1wlo h GLU 11 Ca -0.05 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 1wlo h GLU 11 Cb 0.40 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 1wlo h GLU 11 CO 0.09 0.06 -0.29 1.25 -1.00 0.00 0.00 179.01 179.11 1wlo h LEU 12 N 0.09 0.65 -0.59 1.33 5.85 0.43 -2.57 115.31 120.50 1wlo h LEU 12 Ca 0.82 -0.50 0.12 0.00 0.84 0.00 0.00 57.88 59.16 1wlo h LEU 12 Cb 2.16 -0.18 -0.09 0.00 0.37 0.00 0.00 40.66 42.92 1wlo h LEU 12 CO -0.69 1.02 0.07 0.15 -0.34 0.00 0.00 178.44 178.65 1wlo h PHE 13 N 0.29 0.09 -0.53 1.25 3.57 0.49 1.68 116.94 123.79 1wlo h PHE 13 Ca 0.03 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 1wlo h PHE 13 Cb 0.86 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.63 1wlo h PHE 13 CO 0.08 -0.09 0.26 -0.22 -2.23 0.00 0.00 178.31 176.11 1wlo h LYS 14 N 0.19 0.76 -0.03 1.11 3.64 -1.15 -1.96 116.57 119.12 1wlo h LYS 14 Ca 0.31 -0.11 -0.09 0.00 -1.27 0.00 0.00 60.65 59.49 1wlo h LYS 14 Cb 0.48 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1wlo h LYS 14 CO -0.44 0.62 -0.40 1.03 -2.27 0.00 0.00 179.45 177.99 1wlo h SER 15 N 0.71 0.07 -4.01 4.20 0.87 -0.58 -3.44 113.55 111.37 1wlo h SER 15 Ca 0.18 -0.03 -0.55 0.00 -1.23 0.00 0.00 61.79 60.16 1wlo h SER 15 Cb 0.11 -0.02 0.17 0.00 -0.44 0.00 0.00 62.40 62.22 1wlo h SER 15 CO -0.02 0.46 0.35 0.18 -0.53 0.00 0.00 176.83 177.27 1wlo n LEU 16 N -4.06 4.96 -4.75 2.23 4.77 0.55 -4.94 117.00 115.76 1wlo n LEU 16 Ca -0.02 0.74 -0.40 0.00 -0.03 0.00 0.00 56.01 56.30 1wlo n LEU 16 Cb 0.44 -1.50 -0.04 0.00 -2.33 0.00 0.00 43.42 39.98 1wlo n LEU 16 CO 0.40 -1.45 0.78 -2.16 -1.33 0.00 0.00 177.39 173.63 1wlo s PRO 17 N -3.48 4.65 0.01 3.23 0.04 -1.26 -4.70 135.00 133.49 1wlo s PRO 17 Ca 0.78 1.76 -0.02 0.00 0.04 0.00 0.00 61.00 63.56 1wlo s PRO 17 Cb -0.36 -3.21 -0.01 0.00 0.04 0.00 0.00 34.50 30.97 1wlo s PRO 17 CO 0.45 0.21 0.79 1.17 0.04 0.00 0.00 177.00 179.66 1wlo n LYS 18 N 1.43 -0.03 -0.27 4.56 4.81 -1.26 0.18 118.16 127.57 1wlo n LYS 18 Ca -0.01 0.79 -0.01 0.00 -0.87 0.00 0.00 58.31 58.21 1wlo n LYS 18 Cb 0.45 -1.18 0.02 0.00 0.02 0.00 0.00 35.03 34.35 1wlo n LYS 18 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1wlo n GLU 19 N -2.98 -0.18 -0.11 1.64 0.00 -1.26 0.23 120.64 117.99 1wlo n GLU 19 Ca 0.00 1.09 -0.10 0.00 0.00 0.00 0.00 57.16 58.15 1wlo n GLU 19 Cb 0.02 -1.61 -0.03 0.00 0.00 0.00 0.00 31.44 29.82 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 0.55 -1.41 -1.84 3.38 0.04 -2.07 115.31 113.96 1wlo h LEU 20 Ca 0.24 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 58.00 1wlo h LEU 20 Cb 0.41 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1wlo h LEU 20 CO -0.70 0.69 0.65 0.03 0.09 0.00 0.00 178.44 179.20 1wlo h ARG 21 N 0.39 0.00 0.04 1.13 3.08 1.35 1.80 114.38 122.17 1wlo h ARG 21 Ca 0.10 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.86 1wlo h ARG 21 Cb 0.39 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1wlo h ARG 21 CO 0.01 0.00 -1.58 1.03 -1.07 0.00 0.00 179.97 178.36 1wlo h SER 22 N 0.00 0.14 0.01 7.04 0.87 -0.24 -3.31 113.55 118.06 1wlo h SER 22 Ca 0.13 -0.24 -0.03 0.00 -1.23 0.00 0.00 61.79 60.42 1wlo h SER 22 Cb 1.42 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 1wlo h SER 22 CO -0.00 1.21 -0.13 1.56 -0.53 0.00 0.00 176.83 178.93 1wlo h GLN 23 N 0.02 0.08 -0.62 2.24 1.08 0.27 -3.28 115.11 114.90 1wlo h GLN 23 Ca -0.25 -0.09 0.08 0.00 -1.45 0.00 0.00 58.65 56.94 1wlo h GLN 23 Cb 1.98 0.03 -0.10 0.00 -0.05 0.00 0.00 27.48 29.33 1wlo h GLN 23 CO 0.11 0.91 -0.52 -0.24 -0.95 0.00 0.00 178.83 178.13 1wlo h VAL 24 N -0.71 0.03 -0.95 -0.54 3.04 -0.25 0.93 116.25 117.80 1wlo h VAL 24 Ca -0.02 0.00 0.29 0.00 -1.01 0.00 0.00 66.70 65.96 1wlo h VAL 24 Cb 0.96 0.03 -0.16 0.00 -2.01 0.00 0.00 31.29 30.10 1wlo h VAL 24 CO 0.03 0.00 0.24 -0.07 -1.01 0.00 0.00 177.57 176.75 1wlo h LEU 25 N -0.24 -0.08 -0.03 3.16 3.38 -1.68 0.69 115.31 120.51 1wlo h LEU 25 Ca 0.14 0.24 -0.01 0.00 0.09 0.00 0.00 57.88 58.34 1wlo h LEU 25 Cb 0.55 0.34 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 1wlo h LEU 25 CO -0.72 -0.28 -0.03 -0.07 0.09 0.00 0.00 178.44 177.43 1wlo h LEU 26 N 0.10 0.08 -0.56 1.67 -0.00 0.33 -3.23 115.31 113.69 1wlo h LEU 26 Ca 0.64 -0.47 0.09 0.00 -0.00 0.00 0.00 57.88 58.14 1wlo h LEU 26 Cb 1.40 -0.02 -0.11 0.00 -0.00 0.00 0.00 40.66 41.94 1wlo h LEU 26 CO -0.77 0.53 -0.38 -0.33 -0.00 0.00 0.00 178.44 177.49 1wlo h GLU 27 N -0.38 -0.20 -0.92 1.13 5.08 0.63 -0.11 114.58 119.82 1wlo h GLU 27 Ca 0.01 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 58.53 1wlo h GLU 27 Cb 0.51 0.04 -0.15 0.00 0.50 0.00 0.00 28.75 29.65 1wlo h GLU 27 CO 0.01 -0.13 -0.36 1.88 -1.00 0.00 0.00 179.01 179.40 1wlo h TYR 28 N -0.20 -1.00 -0.93 4.33 0.05 -0.70 1.61 116.97 120.12 1wlo h TYR 28 Ca 0.20 0.10 0.14 0.00 0.05 0.00 0.00 58.73 59.22 1wlo h TYR 28 Cb 0.56 0.57 -0.08 0.00 1.01 0.00 0.00 36.73 38.80 1wlo h TYR 28 CO -0.66 -0.40 0.60 0.00 -1.05 0.00 0.00 178.16 176.65 1wlo h ALA 29 N 1.37 1.75 0.00 3.88 0.00 -1.06 0.79 119.26 125.98 1wlo h ALA 29 Ca 0.34 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 55.22 1wlo h ALA 29 Cb 0.60 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1wlo h ALA 29 CO -0.93 -0.01 -0.26 0.00 0.00 0.00 0.00 179.25 178.05 1wlo h ALA 30 N 1.59 1.17 -0.92 0.00 0.00 0.28 -2.67 119.26 118.71 1wlo h ALA 30 Ca 0.48 -0.24 -0.66 0.00 0.00 0.00 0.00 54.91 54.49 1wlo h ALA 30 Cb 0.69 -0.04 -0.26 0.00 0.00 0.00 0.00 17.79 18.18 1wlo h ALA 30 CO -0.24 0.33 0.85 1.63 0.00 0.00 0.00 179.25 181.83 1wlo n LYS 31 N -3.66 2.60 -3.67 0.00 4.01 0.27 -4.78 118.16 112.93 1wlo n LYS 31 Ca -0.01 -3.11 -0.30 0.00 -0.51 0.00 0.00 58.31 54.38 1wlo n LYS 31 Cb 0.39 -2.20 -0.14 0.00 -0.51 0.00 0.00 35.03 32.56 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 -4.47 0.69 0.83 -0.18 1.01 -1.01 -4.81 120.40 112.46 1wlo s VAL 32 Ca 0.57 -1.45 -0.12 0.00 0.00 0.00 0.00 61.98 60.98 1wlo s VAL 32 Cb 0.45 -1.53 0.09 0.00 0.00 0.00 0.00 36.38 35.40 1wlo s VAL 32 CO -0.14 -0.74 1.11 -2.16 0.00 0.00 0.00 175.10 173.16 1wlo s PRO 33 N 1.50 1.83 0.59 2.72 0.04 -1.26 -5.04 135.00 135.38 1wlo s PRO 33 Ca 0.11 0.54 -0.16 0.00 0.04 0.00 0.00 61.00 61.54 1wlo s PRO 33 Cb -0.18 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.42 1wlo s PRO 33 CO -0.22 -1.77 1.05 -1.25 0.04 0.00 0.00 177.00 174.85 1wlo s PRO 34 N -5.19 3.38 0.71 0.56 0.04 -1.26 -4.77 135.00 128.46 1wlo s PRO 34 Ca 0.62 1.16 -0.11 0.00 0.04 0.00 0.00 61.00 62.71 1wlo s PRO 34 Cb -0.14 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.37 1wlo s PRO 34 CO 0.54 -0.76 1.06 -1.25 0.04 0.00 0.00 177.00 176.64 1wlo s PRO 35 N -4.12 2.85 0.75 0.56 0.04 -1.26 -5.02 135.00 128.80 1wlo s PRO 35 Ca 0.63 0.93 -0.11 0.00 0.04 0.00 0.00 61.00 62.48 1wlo s PRO 35 Cb -0.15 -1.98 0.04 0.00 0.04 0.00 0.00 34.50 32.45 1wlo s PRO 35 CO 0.37 -1.15 1.08 -1.25 0.04 0.00 0.00 177.00 176.09 1wlo s PRO 36 N -5.05 2.44 0.00 0.56 0.04 -1.26 -4.92 135.00 126.81 1wlo s PRO 36 Ca 0.58 0.77 0.17 0.00 0.04 0.00 0.00 61.00 62.56 1wlo s PRO 36 Cb -0.14 -1.95 0.99 0.00 0.04 0.00 0.00 34.50 33.44 1wlo s PRO 36 CO 0.55 -1.40 1.48 -0.35 0.04 0.00 0.00 177.00 177.31 1wlo n PRO 37 N -3.31 0.75 -3.21 0.56 -0.04 -1.26 -3.69 135.00 124.80 1wlo n PRO 37 Ca 0.07 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.29 1wlo n PRO 37 Cb 0.55 -1.35 -0.06 0.00 -0.04 0.00 0.00 33.50 32.60 1wlo n PRO 37 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1wlo n GLY 38 N 0.42 4.04 3.55 0.55 0.00 -1.26 -5.05 105.19 107.44 1wlo n GLY 38 Ca 0.12 -2.14 -0.11 0.00 0.00 0.00 0.00 46.02 43.90 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 -2.38 -0.00 -0.32 1.61 0.11 -1.24 -5.14 120.40 113.04 1wlo s VAL 39 Ca 0.40 0.01 -0.11 0.00 -2.93 0.00 0.00 61.98 59.35 1wlo s VAL 39 Cb 0.22 -0.90 -0.01 0.00 -1.53 0.00 0.00 36.38 34.15 1wlo s VAL 39 CO -0.08 0.00 0.18 -0.70 -3.33 0.00 0.00 175.10 171.18 1wlo s GLU 40 N 0.99 3.45 0.09 1.54 2.12 -1.26 -4.97 118.70 120.65 1wlo s GLU 40 Ca -0.05 -0.66 -0.07 0.00 0.36 0.00 0.00 54.97 54.55 1wlo s GLU 40 Cb -0.05 -3.65 -0.06 0.00 0.26 0.00 0.00 34.13 30.63 1wlo s GLU 40 CO -0.09 -0.40 0.37 -0.51 -0.54 0.00 0.00 175.26 174.09 1wlo s LEU 41 N 1.66 4.32 -0.05 2.70 1.43 -1.26 -4.62 118.68 122.87 1wlo s LEU 41 Ca 0.05 0.68 -0.02 0.00 -1.03 0.00 0.00 54.13 53.82 1wlo s LEU 41 Cb -0.17 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.97 1wlo s LEU 41 CO 0.08 0.14 0.05 -0.70 0.23 0.00 0.00 176.35 176.15 1wlo s GLU 42 N -2.14 3.04 0.01 1.70 2.12 0.23 -4.81 118.70 118.84 1wlo s GLU 42 Ca 0.35 -0.43 -0.30 0.00 0.36 0.00 0.00 54.97 54.95 1wlo s GLU 42 Cb -0.13 -2.85 -0.04 0.00 0.26 0.00 0.00 34.13 31.37 1wlo s GLU 42 CO 0.20 0.68 1.12 0.50 -0.54 0.00 0.00 175.26 177.22 1wlo s ARG 43 N -1.29 4.45 -0.90 4.30 6.06 -1.26 -2.59 118.95 127.73 1wlo s ARG 43 Ca 0.18 1.62 -0.15 0.00 -2.50 0.00 0.00 55.73 54.87 1wlo s ARG 43 Cb -0.12 -3.44 0.19 0.00 0.06 0.00 0.00 34.95 31.64 1wlo s ARG 43 CO 0.08 -0.24 0.95 0.08 -2.50 0.00 0.00 175.30 173.67 1wlo s VAL 44 N 1.36 5.30 0.38 7.11 1.01 0.10 -4.86 120.40 130.80 1wlo s VAL 44 Ca 0.55 -2.23 0.10 0.00 0.00 0.00 0.00 61.98 60.40 1wlo s VAL 44 Cb -0.25 -4.61 0.32 0.00 0.00 0.00 0.00 36.38 31.84 1wlo s VAL 44 CO 0.26 -1.24 1.91 0.45 0.00 0.00 0.00 175.10 176.49 1wlo h HIS 45 N 8.05 0.71 -0.86 5.22 -0.00 -1.89 0.10 115.15 126.48 1wlo h HIS 45 Ca 0.14 0.02 0.15 0.00 -0.00 0.00 0.00 60.37 60.68 1wlo h HIS 45 Cb 1.02 -0.23 -0.09 0.00 -0.00 0.00 0.00 27.41 28.10 1wlo h HIS 45 CO 1.07 0.30 0.45 0.93 -0.00 0.00 0.00 177.93 180.68 1wlo h GLU 46 N 0.63 0.61 -6.41 2.45 3.07 -1.92 -3.36 114.58 109.65 1wlo h GLU 46 Ca 0.39 -0.04 -0.57 0.00 -0.50 0.00 0.00 59.36 58.64 1wlo h GLU 46 Cb 0.62 -0.14 -0.06 0.00 -0.84 0.00 0.00 28.75 28.33 1wlo h GLU 46 CO -0.15 0.40 0.93 0.00 -1.40 0.00 0.00 179.01 178.79 1wlo n GLN 48 N 7.29 -0.07 -2.07 0.00 1.13 -1.26 -4.35 117.38 118.05 1wlo n GLN 48 Ca 0.13 1.40 -0.30 0.00 -1.94 0.00 0.00 57.00 56.29 1wlo n GLN 48 Cb 0.47 -2.31 0.01 0.00 0.11 0.00 0.00 30.24 28.52 1wlo n GLN 48 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1wlo s THR 49 N -5.80 4.75 -1.20 5.09 -4.23 -1.26 -4.94 115.64 108.05 1wlo s THR 49 Ca -0.11 0.74 -0.20 0.00 -1.18 0.00 0.00 61.69 60.94 1wlo s THR 49 Cb 0.29 -3.86 -0.02 0.00 1.34 0.00 0.00 72.50 70.25 1wlo s THR 49 CO 0.75 -1.06 1.90 -0.81 -0.54 0.00 0.00 174.62 174.86 1wlo n PRO 50 N -2.59 2.34 -3.28 3.99 -0.04 -1.26 -4.82 135.00 129.34 1wlo n PRO 50 Ca 0.05 -2.69 -0.37 0.00 -0.04 0.00 0.00 63.50 60.45 1wlo n PRO 50 Cb 0.54 -3.46 -0.06 0.00 -0.04 0.00 0.00 33.50 30.48 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 6.53 3.72 -0.03 0.54 5.36 -1.26 -4.60 117.98 128.23 1wlo s PHE 51 Ca 0.58 1.21 0.02 0.00 -0.96 0.00 0.00 56.93 57.79 1wlo s PHE 51 Cb 0.05 -2.47 0.01 0.00 -0.34 0.00 0.00 43.02 40.27 1wlo s PHE 51 CO 0.08 0.51 -0.09 -0.06 -1.46 0.00 0.00 175.22 174.19 1wlo s PHE 52 N -1.28 1.03 0.11 10.12 0.08 -1.13 -0.72 117.98 126.19 1wlo s PHE 52 Ca 0.33 -0.28 -0.08 0.00 0.12 0.00 0.00 56.93 57.03 1wlo s PHE 52 Cb -0.18 -0.74 -0.01 0.00 -0.57 0.00 0.00 43.02 41.52 1wlo s PHE 52 CO 0.19 -0.13 0.20 0.54 -0.10 0.00 0.00 175.22 175.93 1wlo s VAL 53 N 0.29 0.12 -0.09 -0.44 0.11 -1.07 -1.20 120.40 118.12 1wlo s VAL 53 Ca -0.05 -1.28 -0.05 0.00 -2.93 0.00 0.00 61.98 57.67 1wlo s VAL 53 Cb -0.10 -1.51 0.04 0.00 -1.53 0.00 0.00 36.38 33.29 1wlo s VAL 53 CO 0.01 -0.56 0.22 -2.28 -3.33 0.00 0.00 175.10 169.16 1wlo s HIS 54 N -3.90 -0.28 -0.07 1.54 2.46 -0.27 -0.60 115.29 114.17 1wlo s HIS 54 Ca 0.09 0.68 0.05 0.00 0.47 0.00 0.00 55.06 56.35 1wlo s HIS 54 Cb 0.05 0.02 -0.01 0.00 -0.13 0.00 0.00 32.58 32.50 1wlo s HIS 54 CO -0.08 -0.20 -0.22 0.00 -2.47 0.00 0.00 174.74 171.78 1wlo s ALA 55 N 1.09 2.30 0.15 1.58 0.00 -1.26 -2.11 121.76 123.52 1wlo s ALA 55 Ca -0.08 -1.00 -0.25 0.00 0.00 0.00 0.00 51.96 50.63 1wlo s ALA 55 Cb -0.10 -0.81 0.06 0.00 0.00 0.00 0.00 23.12 22.27 1wlo s ALA 55 CO -0.07 0.39 0.85 -0.51 0.00 0.00 0.00 175.76 176.42 1wlo s ASP 56 N -0.08 -0.28 -0.04 0.00 1.01 -1.11 -4.55 116.67 111.61 1wlo s ASP 56 Ca -0.05 -0.32 0.00 0.00 0.71 0.00 0.00 52.55 52.89 1wlo s ASP 56 Cb -0.14 0.53 0.02 0.00 1.01 0.00 0.00 42.92 44.35 1wlo s ASP 56 CO 0.04 -0.95 -0.02 0.54 0.21 0.00 0.00 175.17 174.99 1wlo s VAL 57 N -3.45 0.36 -0.32 -1.27 0.11 -1.26 0.25 120.40 114.81 1wlo s VAL 57 Ca 0.09 0.01 0.03 0.00 -2.93 0.00 0.00 61.98 59.19 1wlo s VAL 57 Cb -0.02 -0.44 0.09 0.00 -1.53 0.00 0.00 36.38 34.48 1wlo s VAL 57 CO -0.01 0.20 0.03 -1.61 -3.33 0.00 0.00 175.10 170.38 1wlo s GLU 58 N 1.17 1.52 0.06 1.54 0.41 -0.02 -4.90 118.70 118.48 1wlo s GLU 58 Ca -0.07 -1.70 0.00 0.00 -0.41 0.00 0.00 54.97 52.79 1wlo s GLU 58 Cb -0.14 -3.03 0.00 0.00 -1.78 0.00 0.00 34.13 29.19 1wlo s GLU 58 CO -0.02 -0.88 0.00 0.41 -0.49 0.00 0.00 175.26 174.28 1wlo n GLY 59 N 4.35 1.75 0.54 -1.39 0.00 -1.26 -3.91 105.19 105.26 1wlo n GLY 59 Ca 0.00 -0.54 -0.00 0.00 0.00 0.00 0.00 46.02 45.48 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 0.83 3.04 -0.02 0.00 -1.26 -5.11 105.19 102.67 1wlo n GLY 60 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 0.48 -0.21 1.61 1.02 -1.25 -4.57 119.74 116.82 1wlo s LYS 61 Ca 0.01 -0.74 -0.13 0.00 0.02 0.00 0.00 55.97 55.13 1wlo s LYS 61 Cb 0.01 -0.18 -0.05 0.00 -0.52 0.00 0.00 37.83 37.09 1wlo s LYS 61 CO -0.00 0.02 0.25 0.14 -0.92 0.00 0.00 175.35 174.84 1wlo s VAL 62 N -1.48 5.31 -0.35 3.17 -7.23 0.58 -0.84 120.40 119.55 1wlo s VAL 62 Ca -0.11 0.41 -0.18 0.00 -1.81 0.00 0.00 61.98 60.30 1wlo s VAL 62 Cb -0.09 -3.59 -0.00 0.00 0.56 0.00 0.00 36.38 33.25 1wlo s VAL 62 CO -0.00 0.33 0.49 -0.13 -0.31 0.00 0.00 175.10 175.48 1wlo s ARG 63 N 0.95 3.60 -0.05 4.82 1.81 0.68 -2.34 118.95 128.42 1wlo s ARG 63 Ca 0.13 -0.22 -0.09 0.00 -1.72 0.00 0.00 55.73 53.83 1wlo s ARG 63 Cb -0.13 -3.81 -0.05 0.00 -0.45 0.00 0.00 34.95 30.51 1wlo s ARG 63 CO 0.05 -0.63 0.25 -0.51 -0.68 0.00 0.00 175.30 173.78 1wlo s LEU 64 N 2.32 4.41 -0.06 2.53 1.43 -1.26 -2.75 118.68 125.30 1wlo s LEU 64 Ca 0.17 0.62 -0.02 0.00 -1.03 0.00 0.00 54.13 53.87 1wlo s LEU 64 Cb -0.16 -2.40 0.04 0.00 0.03 0.00 0.00 46.19 43.71 1wlo s LEU 64 CO 0.13 0.34 0.13 -0.31 0.23 0.00 0.00 176.35 176.86 1wlo s TYR 65 N -1.13 -0.13 0.21 0.29 2.02 -0.90 -4.99 117.35 112.73 1wlo s TYR 65 Ca 0.21 0.43 0.09 0.00 -0.37 0.00 0.00 57.07 57.43 1wlo s TYR 65 Cb -0.14 -0.14 -0.05 0.00 -0.40 0.00 0.00 41.96 41.24 1wlo s TYR 65 CO 0.10 -0.16 -0.16 -0.06 -1.57 0.00 0.00 175.55 173.70 1wlo s PHE 66 N 1.28 1.83 -0.23 2.71 0.08 -1.26 -1.11 117.98 121.28 1wlo s PHE 66 Ca -0.08 -0.51 -0.08 0.00 0.12 0.00 0.00 56.93 56.38 1wlo s PHE 66 Cb -0.12 -0.85 0.10 0.00 -0.57 0.00 0.00 43.02 41.59 1wlo s PHE 66 CO -0.05 0.42 0.50 -1.58 -0.10 0.00 0.00 175.22 174.41 1wlo s HIS 67 N -2.75 -0.99 -0.18 0.36 5.65 -0.34 -4.28 115.29 112.75 1wlo s HIS 67 Ca 0.23 1.81 0.00 0.00 0.25 0.00 0.00 55.06 57.35 1wlo s HIS 67 Cb -0.02 0.48 0.04 0.00 -1.18 0.00 0.00 32.58 31.90 1wlo s HIS 67 CO 0.08 -0.54 -0.08 0.08 -0.65 0.00 0.00 174.74 173.63 1wlo s VAL 68 N 2.66 1.37 -0.02 0.89 1.01 -1.26 -2.83 120.40 122.22 1wlo s VAL 68 Ca -0.04 -0.83 -0.03 0.00 0.00 0.00 0.00 61.98 61.08 1wlo s VAL 68 Cb -0.12 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.73 1wlo s VAL 68 CO -0.15 0.13 0.30 1.55 0.00 0.00 0.00 175.10 176.94 1wlo h PRO 69 N 8.04 -0.12 -0.87 2.72 0.13 -2.00 -3.25 132.00 136.65 1wlo h PRO 69 Ca -0.26 0.01 0.25 0.00 -0.87 0.00 0.00 66.00 65.13 1wlo h PRO 69 Cb 1.10 0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.23 1wlo h PRO 69 CO 0.44 -0.08 0.85 0.22 -0.23 0.00 0.00 178.00 179.20 1wlo h ASP 70 N -0.39 0.00 -4.36 1.44 1.82 -1.96 -3.44 116.42 109.53 1wlo h ASP 70 Ca -0.01 0.00 -0.19 0.00 -0.39 0.00 0.00 57.03 56.44 1wlo h ASP 70 Cb 0.09 0.00 0.11 0.00 0.68 0.00 0.00 39.33 40.22 1wlo h ASP 70 CO 0.02 0.00 -0.50 -0.62 -1.61 0.00 0.00 179.24 176.53 1wlo n GLU 71 N -3.64 -3.20 -2.66 0.28 1.02 -1.23 -4.98 120.64 106.23 1wlo n GLU 71 Ca 0.19 0.53 -0.41 0.00 -0.02 0.00 0.00 57.16 57.44 1wlo n GLU 71 Cb 1.14 -4.46 -0.04 0.00 -0.02 0.00 0.00 31.44 28.06 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 -3.23 3.26 -0.06 0.62 0.00 -1.26 -4.93 121.76 116.16 1wlo s ALA 72 Ca 0.10 0.63 0.23 0.00 0.00 0.00 0.00 51.96 52.92 1wlo s ALA 72 Cb -0.01 -3.32 0.67 0.00 0.00 0.00 0.00 23.12 20.45 1wlo s ALA 72 CO 0.46 -0.14 1.72 -1.00 0.00 0.00 0.00 175.76 176.79 1wlo h PRO 73 N 5.91 0.00 0.00 0.00 0.13 -1.97 0.27 132.00 136.33 1wlo h PRO 73 Ca -0.43 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.56 1wlo h PRO 73 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1wlo h PRO 73 CO 0.74 0.21 -1.06 1.79 -0.23 0.00 0.00 178.00 179.45 1wlo h THR 74 N 0.00 0.67 0.02 1.56 1.35 -1.94 -2.28 112.91 112.30 1wlo h THR 74 Ca -0.00 -2.12 -0.22 0.00 -0.55 0.00 0.00 66.41 63.52 1wlo h THR 74 Cb 0.91 2.20 -0.03 0.00 -1.73 0.00 0.00 68.15 69.51 1wlo h THR 74 CO 0.03 0.38 -1.19 0.58 -0.25 0.00 0.00 175.52 175.07 1wlo h VAL 75 N 0.00 1.01 -0.43 6.82 2.07 -1.93 -3.35 116.25 120.44 1wlo h VAL 75 Ca -0.10 -2.24 -0.03 0.00 0.82 0.00 0.00 66.70 65.16 1wlo h VAL 75 Cb 1.51 2.44 -0.02 0.00 -1.52 0.00 0.00 31.29 33.70 1wlo h VAL 75 CO 0.06 0.44 0.17 0.50 0.02 0.00 0.00 177.57 178.75 1wlo h LYS 76 N -0.83 0.65 -0.94 1.57 3.64 -0.62 -2.86 116.57 117.17 1wlo h LYS 76 Ca -0.31 -0.12 0.09 0.00 -1.27 0.00 0.00 60.65 59.04 1wlo h LYS 76 Cb 1.38 -0.10 -0.11 0.00 -0.41 0.00 0.00 32.23 32.99 1wlo h LYS 76 CO -0.13 0.60 -0.56 0.00 -2.27 0.00 0.00 179.45 177.09 1wlo n ALA 77 N -2.32 -0.60 -0.07 5.00 0.00 -0.86 0.00 120.51 121.66 1wlo n ALA 77 Ca 0.00 0.80 -0.07 0.00 0.00 0.00 0.00 53.44 54.18 1wlo n ALA 77 Cb 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 19.45 19.48 1wlo n ALA 77 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1wlo h PHE 78 N 0.00 -0.37 -0.75 0.00 3.57 -1.66 -0.17 116.94 117.56 1wlo h PHE 78 Ca 0.15 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.82 1wlo h PHE 78 Cb 0.39 0.21 -0.14 0.00 2.79 0.00 0.00 35.95 39.20 1wlo h PHE 78 CO -1.01 -0.22 -0.28 0.00 -2.23 0.00 0.00 178.31 174.57 1wlo h ALA 79 N 1.11 0.25 -0.05 2.41 0.00 -0.19 1.65 119.26 124.45 1wlo h ALA 79 Ca 0.15 0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 1wlo h ALA 79 Cb 0.34 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1wlo h ALA 79 CO -0.36 -0.54 -0.17 0.78 0.00 0.00 0.00 179.25 178.96 1wlo h GLY 80 N -0.06 0.08 2.00 0.00 0.00 0.06 -0.04 103.07 105.10 1wlo h GLY 80 Ca 0.32 -0.04 -0.13 0.00 0.00 0.00 0.00 47.33 47.47 1wlo h GLY 80 CO -0.79 0.04 -0.62 -2.00 0.00 0.00 0.00 176.54 173.16 1wlo h LEU 81 N 0.07 0.00 -0.02 3.11 5.85 0.33 0.86 115.31 125.51 1wlo h LEU 81 Ca 0.01 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1wlo h LEU 81 Cb 0.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1wlo h LEU 81 CO 0.02 0.62 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.51 1wlo h LEU 82 N 0.00 0.18 -0.69 2.25 3.38 0.30 -3.17 115.31 117.56 1wlo h LEU 82 Ca -0.01 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 57.25 1wlo h LEU 82 Cb 1.30 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1wlo h LEU 82 CO 0.08 0.87 0.00 0.08 0.09 0.00 0.00 178.44 179.56 1wlo h ARG 83 N -0.49 0.00 -0.96 1.13 0.11 -1.08 -2.94 114.38 110.15 1wlo h ARG 83 Ca -0.02 0.00 0.09 0.00 0.10 0.00 0.00 59.98 60.15 1wlo h ARG 83 Cb 0.88 0.00 -0.07 0.00 1.11 0.00 0.00 29.97 31.88 1wlo h ARG 83 CO 0.03 0.00 0.60 0.93 0.10 0.00 0.00 179.97 181.63 1wlo h GLU 84 N 0.00 0.99 -1.19 0.08 4.39 -0.79 -1.80 114.58 116.26 1wlo h GLU 84 Ca 0.00 -0.06 -0.47 0.00 0.34 0.00 0.00 59.36 59.18 1wlo h GLU 84 Cb 0.68 -0.22 -0.41 0.00 -0.10 0.00 0.00 28.75 28.70 1wlo h GLU 84 CO 0.00 0.65 -0.97 0.41 -1.16 0.00 0.00 179.01 177.94 1wlo n GLY 85 N -1.35 3.75 0.83 -3.84 0.00 -1.18 -4.67 105.19 98.73 1wlo n GLY 85 Ca 0.16 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.30 0.00 -4.56 0.99 4.77 -1.12 -4.13 117.00 112.65 1wlo n LEU 86 Ca 0.24 0.00 -0.49 0.00 -0.03 0.00 0.00 56.01 55.73 1wlo n LEU 86 Cb 0.76 0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.94 1wlo n LEU 86 CO 0.29 -0.21 1.71 1.21 -1.33 0.00 0.00 177.39 179.06 1wlo n GLU 87 N -1.91 1.60 -1.36 3.23 0.00 -0.69 0.18 120.64 121.69 1wlo n GLU 87 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 57.16 57.66 1wlo n GLU 87 Cb 0.00 -2.68 0.00 0.00 0.00 0.00 0.00 31.44 28.76 1wlo n GLU 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1wlo n GLY 88 N 5.66 0.73 1.56 8.31 0.00 -0.99 -4.99 105.19 115.46 1wlo n GLY 88 Ca 0.33 -0.70 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.33 1.00 -3.39 1.61 -0.58 0.13 -4.72 120.64 113.35 1wlo n GLU 89 Ca 0.00 -1.33 -0.26 0.00 -0.42 0.00 0.00 57.16 55.16 1wlo n GLU 89 Cb 0.31 0.03 -0.02 0.00 -0.57 0.00 0.00 31.44 31.18 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 -2.38 6.34 0.01 1.62 1.04 -1.26 0.21 113.70 119.28 1wlo s SER 90 Ca 0.19 0.52 0.22 0.00 0.48 0.00 0.00 55.95 57.35 1wlo s SER 90 Cb -0.01 -2.06 0.93 0.00 0.10 0.00 0.00 66.02 64.98 1wlo s SER 90 CO 0.12 -0.25 1.70 -0.81 0.98 0.00 0.00 173.24 174.98 1wlo n PRO 91 N -1.45 0.01 -0.05 4.02 -0.04 -1.26 -1.35 135.00 134.88 1wlo n PRO 91 Ca -0.04 0.13 -0.16 0.00 -0.04 0.00 0.00 63.50 63.40 1wlo n PRO 91 Cb 0.55 -1.51 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.53 0.69 0.08 0.54 -0.58 -1.26 -3.44 120.64 115.15 1wlo n GLU 92 Ca 0.05 0.21 -0.14 0.00 -0.42 0.00 0.00 57.16 56.86 1wlo n GLU 92 Cb 0.26 -1.66 -0.07 0.00 -0.57 0.00 0.00 31.44 29.40 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 0.30 0.00 0.62 0.00 -1.93 -0.48 119.26 118.20 1wlo h ALA 93 Ca -0.44 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 53.72 1wlo h ALA 93 Cb 2.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1wlo h ALA 93 CO 0.04 0.85 0.00 0.28 0.00 0.00 0.00 179.25 180.42 1wlo h VAL 94 N 0.19 0.00 0.00 0.00 2.07 -1.39 -2.59 116.25 114.53 1wlo h VAL 94 Ca -0.09 -0.43 -0.28 0.00 0.82 0.00 0.00 66.70 66.71 1wlo h VAL 94 Cb 1.68 1.32 -0.05 0.00 -1.52 0.00 0.00 31.29 32.72 1wlo h VAL 94 CO 0.17 0.00 -1.93 0.18 0.02 0.00 0.00 177.57 176.01 1wlo n LEU 95 N -2.64 0.49 0.00 2.57 4.77 -1.12 -3.89 117.00 117.18 1wlo n LEU 95 Ca 0.02 0.23 0.06 0.00 -0.03 0.00 0.00 56.01 56.29 1wlo n LEU 95 Cb 0.31 0.27 0.32 0.00 -2.33 0.00 0.00 43.42 41.98 1wlo n LEU 95 CO 0.25 0.36 0.67 -0.62 -1.33 0.00 0.00 177.39 176.72 1wlo n GLU 96 N -2.86 0.16 -2.78 3.23 -0.58 -0.20 -4.60 120.64 113.01 1wlo n GLU 96 Ca -0.21 0.18 -0.42 0.00 -0.42 0.00 0.00 57.16 56.28 1wlo n GLU 96 Cb 1.02 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 30.36 1wlo n GLU 96 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1wlo s VAL 97 N -2.62 4.66 1.01 2.62 1.01 -1.19 -3.27 120.40 122.63 1wlo s VAL 97 Ca 0.12 1.52 -0.15 0.00 0.00 0.00 0.00 61.98 63.46 1wlo s VAL 97 Cb 0.09 -4.28 0.20 0.00 0.00 0.00 0.00 36.38 32.39 1wlo s VAL 97 CO 0.20 -0.33 1.19 -2.16 0.00 0.00 0.00 175.10 174.00 1wlo s PRO 98 N 3.27 0.30 0.00 2.72 0.04 -1.26 -4.93 135.00 135.14 1wlo s PRO 98 Ca 0.39 -0.03 0.23 0.00 0.04 0.00 0.00 61.00 61.63 1wlo s PRO 98 Cb -0.13 -1.77 1.24 0.00 0.04 0.00 0.00 34.50 33.87 1wlo s PRO 98 CO 0.13 -2.70 1.76 -0.35 0.04 0.00 0.00 177.00 175.87 1wlo n PRO 99 N -4.05 0.46 -2.86 0.56 -0.04 -1.26 -3.40 135.00 124.41 1wlo n PRO 99 Ca 0.11 0.05 -0.14 0.00 -0.04 0.00 0.00 63.50 63.48 1wlo n PRO 99 Cb 0.59 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 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 0.60 2.71 0.02 0.55 0.00 -1.26 -4.86 105.19 102.95 1wlo n GLY 100 Ca 0.13 -1.59 0.14 0.00 0.00 0.00 0.00 46.02 44.70 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 0.03 0.00 -0.11 1.61 1.16 -1.22 -3.91 117.46 115.03 1wlo n PHE 101 Ca 0.18 0.00 -0.20 0.00 -1.87 0.00 0.00 57.45 55.56 1wlo n PHE 101 Cb 0.73 -0.37 -0.09 0.00 -1.61 0.00 0.00 39.48 38.15 1wlo n PHE 101 CO 0.00 0.00 0.00 2.48 -1.87 0.00 0.00 176.76 177.37 1wlo n TYR 102 N -1.39 0.00 -1.31 2.97 4.11 -1.26 -4.98 117.16 115.30 1wlo n TYR 102 Ca 0.09 0.00 -0.51 0.00 -0.00 0.00 0.00 57.90 57.48 1wlo n TYR 102 Cb 0.32 -0.82 -0.07 0.00 -0.00 0.00 0.00 39.34 38.77 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 -3.59 0.00 0.00 -3.48 1.74 -1.25 -2.70 116.66 107.37 1wlo n ARG 103 Ca -0.41 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.67 1wlo n ARG 103 Cb 0.86 -1.15 0.00 0.00 -1.02 0.00 0.00 32.46 31.14 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 2.70 2.09 0.21 -0.13 0.00 -1.26 -4.94 105.19 103.85 1wlo n GLY 104 Ca 0.22 -0.57 -0.05 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 -0.22 0.00 1.61 4.01 -1.10 -4.81 117.16 116.65 1wlo n TYR 105 Ca 0.00 0.61 0.00 0.00 -0.16 0.00 0.00 57.90 58.35 1wlo n TYR 105 Cb 0.00 -0.51 0.00 0.00 -0.31 0.00 0.00 39.34 38.52 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 -1.12 -0.24 0.06 2.72 0.00 -1.26 -4.81 105.19 100.54 1wlo n GLY 106 Ca 0.01 -0.18 -0.03 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 -0.22 0.99 4.32 -1.26 -4.37 117.00 116.46 1wlo n LEU 107 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.92 1wlo n LEU 107 Cb 0.00 0.31 0.03 0.00 -1.62 0.00 0.00 43.42 42.14 1wlo n LEU 107 CO 0.00 0.31 1.04 -0.33 -1.22 0.00 0.00 177.39 177.19 1wlo h GLU 108 N 0.00 0.86 -1.49 3.23 5.08 -1.94 0.30 114.58 120.62 1wlo h GLU 108 Ca -0.34 -0.11 0.43 0.00 -1.00 0.00 0.00 59.36 58.34 1wlo h GLU 108 Cb 1.75 -0.16 -0.06 0.00 0.50 0.00 0.00 28.75 30.77 1wlo h GLU 108 CO 0.02 0.68 1.07 1.05 -1.00 0.00 0.00 179.01 180.83 1wlo h GLU 109 N 0.83 0.01 0.00 2.33 4.11 -1.97 -1.49 114.58 118.39 1wlo h GLU 109 Ca 0.21 -0.00 -0.46 0.00 0.07 0.00 0.00 59.36 59.18 1wlo h GLU 109 Cb 0.08 -0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.26 1wlo h GLU 109 CO -0.03 0.00 -2.53 1.19 0.07 0.00 0.00 179.01 177.72 1wlo n PHE 110 N -4.10 0.02 -3.19 2.06 3.72 -0.72 -4.90 117.46 110.35 1wlo n PHE 110 Ca 0.33 0.01 -0.41 0.00 -0.05 0.00 0.00 57.45 57.33 1wlo n PHE 110 Cb 1.54 -1.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.01 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 -2.51 3.23 0.91 1.38 0.08 0.98 -5.04 117.98 117.01 1wlo s PHE 111 Ca -0.39 0.53 -0.15 0.00 0.12 0.00 0.00 56.93 57.05 1wlo s PHE 111 Cb 0.15 -2.87 -0.06 0.00 -0.57 0.00 0.00 43.02 39.67 1wlo s PHE 111 CO 0.50 -0.41 -0.06 0.25 -0.10 0.00 0.00 175.22 175.40 1wlo n THR 112 N 5.30 0.27 0.83 0.64 -2.24 -1.25 -4.22 114.28 113.61 1wlo n THR 112 Ca -0.03 -0.36 0.11 0.00 -2.27 0.00 0.00 64.05 61.50 1wlo n THR 112 Cb 0.49 -0.37 0.49 0.00 -2.10 0.00 0.00 70.33 68.85 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 0.21 0.08 -0.07 -0.78 -0.04 -1.26 -2.19 135.00 130.95 1wlo n PRO 113 Ca 0.04 0.11 -0.05 0.00 -0.04 0.00 0.00 63.50 63.56 1wlo n PRO 113 Cb 0.53 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 1wlo n PRO 113 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1wlo n LEU 114 N -1.45 1.65 -0.29 1.53 7.99 -1.26 -4.15 117.00 121.02 1wlo n LEU 114 Ca 0.07 0.56 0.16 0.00 -0.01 0.00 0.00 56.01 56.78 1wlo n LEU 114 Cb 0.24 -0.82 0.42 0.00 -0.11 0.00 0.00 43.42 43.15 1wlo n LEU 114 CO 0.20 -0.45 1.21 -0.09 -1.51 0.00 0.00 177.39 176.75 1wlo h ARG 115 N -0.90 0.58 -0.54 3.23 2.43 -1.92 -0.37 114.38 116.88 1wlo h ARG 115 Ca 0.00 -0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.24 1wlo h ARG 115 Cb 0.52 -0.13 -0.11 0.00 -0.42 0.00 0.00 29.97 29.84 1wlo h ARG 115 CO 0.00 0.38 -0.24 -0.07 -1.51 0.00 0.00 179.97 178.53 1wlo h LEU 116 N 0.59 -0.84 -0.94 3.80 3.38 -1.63 0.23 115.31 119.90 1wlo h LEU 116 Ca 0.51 0.19 0.28 0.00 0.09 0.00 0.00 57.88 58.96 1wlo h LEU 116 Cb 1.01 0.46 -0.17 0.00 0.09 0.00 0.00 40.66 42.04 1wlo h LEU 116 CO -0.26 -0.26 0.10 0.54 0.09 0.00 0.00 178.44 178.66 1wlo n ARG 117 N -5.42 -0.07 0.18 1.13 3.00 -0.15 0.03 116.66 115.35 1wlo n ARG 117 Ca 0.05 1.38 -0.13 0.00 -0.01 0.00 0.00 57.85 59.14 1wlo n ARG 117 Cb 0.33 -2.25 -0.08 0.00 0.00 0.00 0.00 32.46 30.47 1wlo n ARG 117 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1wlo h GLY 118 N 0.00 -0.51 -0.64 -0.13 0.00 -0.67 -2.45 103.07 98.67 1wlo h GLY 118 Ca 0.61 0.19 0.06 0.00 0.00 0.00 0.00 47.33 48.19 1wlo h GLY 118 CO -0.85 -0.19 -0.49 1.41 0.00 0.00 0.00 176.54 176.43 1wlo h LEU 119 N -0.86 -1.72 -0.36 3.11 3.38 0.34 -0.31 115.31 118.89 1wlo h LEU 119 Ca -0.05 0.25 0.05 0.00 0.09 0.00 0.00 57.88 58.22 1wlo h LEU 119 Cb 0.54 0.74 -0.08 0.00 0.09 0.00 0.00 40.66 41.94 1wlo h LEU 119 CO 0.08 -0.25 -0.52 -0.33 0.09 0.00 0.00 178.44 177.50 1wlo h GLU 120 N -0.14 -0.40 -0.73 1.13 5.08 -1.04 0.12 114.58 118.60 1wlo h GLU 120 Ca 0.10 0.03 0.19 0.00 -1.00 0.00 0.00 59.36 58.68 1wlo h GLU 120 Cb 0.41 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 29.61 1wlo h GLU 120 CO -0.67 -0.27 -0.03 0.00 -1.00 0.00 0.00 179.01 177.04 1wlo n ALA 121 N -3.07 0.32 -0.30 3.43 0.00 -0.20 0.22 120.51 120.92 1wlo n ALA 121 Ca -0.03 0.79 -0.03 0.00 0.00 0.00 0.00 53.44 54.17 1wlo n ALA 121 Cb 0.35 -0.55 0.02 0.00 0.00 0.00 0.00 19.45 19.27 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 1.47 0.04 -0.11 0.00 0.00 -0.01 1.27 119.26 121.92 1wlo h ALA 122 Ca 0.42 0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.55 1wlo h ALA 122 Cb 0.82 0.91 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 1wlo h ALA 122 CO -0.71 -0.66 0.07 1.25 0.00 0.00 0.00 179.25 179.20 1wlo h LEU 123 N -0.08 0.13 -0.65 0.00 5.85 0.26 0.20 115.31 121.02 1wlo h LEU 123 Ca 0.29 -0.04 0.12 0.00 0.84 0.00 0.00 57.88 59.09 1wlo h LEU 123 Cb 0.57 -0.03 -0.09 0.00 0.37 0.00 0.00 40.66 41.48 1wlo h LEU 123 CO -0.84 0.13 0.18 -0.07 -0.34 0.00 0.00 178.44 177.50 1wlo h LEU 124 N 0.12 0.09 0.64 2.25 -0.00 0.56 0.64 115.31 119.62 1wlo h LEU 124 Ca 0.04 0.11 -0.03 0.00 -0.00 0.00 0.00 57.88 58.00 1wlo h LEU 124 Cb 0.02 0.13 0.01 0.00 -0.00 0.00 0.00 40.66 40.82 1wlo h LEU 124 CO -0.01 0.04 -0.31 0.03 -0.00 0.00 0.00 178.44 178.20 1wlo h ARG 125 N 0.32 -0.83 -0.78 1.13 3.08 0.19 -0.40 114.38 117.09 1wlo h ARG 125 Ca 0.35 0.06 0.17 0.00 0.07 0.00 0.00 59.98 60.62 1wlo h ARG 125 Cb 0.51 0.19 -0.11 0.00 0.08 0.00 0.00 29.97 30.64 1wlo h ARG 125 CO -0.40 -0.51 0.25 -0.07 -1.07 0.00 0.00 179.97 178.16 1wlo h LEU 126 N -1.04 0.12 -1.86 3.04 3.38 0.02 1.29 115.31 120.26 1wlo h LEU 126 Ca -0.09 0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1wlo h LEU 126 Cb 0.70 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 1wlo h LEU 126 CO 0.15 -0.01 -0.13 1.56 0.09 0.00 0.00 178.44 180.09 1wlo h GLN 127 N 0.33 0.00 0.00 1.13 4.20 0.43 0.46 115.11 121.66 1wlo h GLN 127 Ca 0.45 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.15 1wlo h GLN 127 Cb 0.78 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.56 1wlo h GLN 127 CO -0.50 0.13 -0.21 0.00 -0.67 0.00 0.00 178.83 177.58 1wlo h ALA 128 N 1.87 0.89 0.04 3.87 0.00 0.33 -3.10 119.26 123.17 1wlo h ALA 128 Ca -0.00 -0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.54 1wlo h ALA 128 Cb 0.35 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1wlo h ALA 128 CO 0.02 0.04 -1.94 1.04 0.00 0.00 0.00 179.25 178.41 1wlo n GLN 129 N -3.03 0.68 0.29 0.00 6.02 0.59 -4.22 117.38 117.71 1wlo n GLN 129 Ca 0.03 0.24 -0.16 0.00 -0.01 0.00 0.00 57.00 57.10 1wlo n GLN 129 Cb 0.55 -1.72 -0.08 0.00 1.02 0.00 0.00 30.24 30.01 1wlo n GLN 129 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1wlo h VAL 130 N 0.03 0.50 -1.42 5.09 2.07 -0.22 -1.44 116.25 120.85 1wlo h VAL 130 Ca -0.38 0.00 0.41 0.00 0.82 0.00 0.00 66.70 67.55 1wlo h VAL 130 Cb 2.04 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 32.25 1wlo h VAL 130 CO 0.06 0.00 1.13 0.03 0.02 0.00 0.00 177.57 178.82 1wlo h ARG 131 N -0.68 0.00 -0.28 1.57 3.08 -1.73 2.15 114.38 118.49 1wlo h ARG 131 Ca -0.07 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.83 1wlo h ARG 131 Cb 0.52 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.57 1wlo h ARG 131 CO 0.11 0.00 -0.40 0.87 -1.07 0.00 0.00 179.97 179.48 1wlo h LYS 132 N 0.00 0.78 -0.51 0.04 1.79 -1.44 -3.09 116.57 114.14 1wlo h LYS 132 Ca 0.68 -0.45 0.03 0.00 -2.18 0.00 0.00 60.65 58.72 1wlo h LYS 132 Cb 2.93 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 33.58 1wlo h LYS 132 CO -0.01 1.08 0.29 0.00 -1.08 0.00 0.00 179.45 179.73 1wlo h ALA 133 N 0.68 0.65 -1.02 3.86 0.00 0.37 1.37 119.26 125.17 1wlo h ALA 133 Ca 0.03 -0.00 0.27 0.00 0.00 0.00 0.00 54.91 55.21 1wlo h ALA 133 Cb 1.00 -0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.54 1wlo h ALA 133 CO 0.09 -0.02 0.61 -0.07 0.00 0.00 0.00 179.25 179.86 1wlo h LEU 134 N 0.57 0.59 -3.15 0.00 4.07 -1.31 0.44 115.31 116.52 1wlo h LEU 134 Ca 0.21 0.14 -0.06 0.00 0.08 0.00 0.00 57.88 58.25 1wlo h LEU 134 Cb 0.06 0.05 -0.04 0.00 1.08 0.00 0.00 40.66 41.81 1wlo h LEU 134 CO -0.11 0.04 -0.20 1.07 -1.08 0.00 0.00 178.44 178.16 1wlo n THR 135 N -4.86 2.27 -0.84 0.22 5.66 -0.34 -5.13 114.28 111.25 1wlo n THR 135 Ca 0.28 -2.73 0.00 0.00 -3.05 0.00 0.00 64.05 58.55 1wlo n THR 135 Cb 0.85 -0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 1wlo n THR 135 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78