#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wwp h GLU 3 N 0.00 0.06 0.09 0.00 3.07 -1.97 -0.32 114.58 115.50 1wwp h GLU 3 Ca 0.00 -0.05 -0.26 0.00 -0.50 0.00 0.00 59.36 58.56 1wwp h GLU 3 Cb 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1wwp h GLU 3 CO 0.00 0.70 -1.14 0.87 -1.40 0.00 0.00 179.01 178.03 1wwp h LYS 4 N 0.04 0.30 -0.14 2.33 1.57 -2.03 -0.27 116.57 118.37 1wwp h LYS 4 Ca -0.01 -0.44 -0.02 0.00 -1.87 0.00 0.00 60.65 58.31 1wwp h LYS 4 Cb 1.17 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.63 1wwp h LYS 4 CO 0.09 1.17 -0.01 0.00 -0.57 0.00 0.00 179.45 180.14 1wwp h ALA 5 N 0.65 0.19 -0.37 3.86 0.00 -1.94 -2.75 119.26 118.90 1wwp h ALA 5 Ca -0.11 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.62 1wwp h ALA 5 Cb 1.84 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.56 1wwp h ALA 5 CO 0.19 -0.10 0.24 1.25 0.00 0.00 0.00 179.25 180.83 1wwp h LEU 6 N -0.02 0.34 -0.68 0.00 5.85 -1.02 -1.35 115.31 118.43 1wwp h LEU 6 Ca 0.04 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1wwp h LEU 6 Cb 0.39 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.30 1wwp h LEU 6 CO 0.01 0.24 0.44 0.00 -0.34 0.00 0.00 178.44 178.78 1wwp h ALA 7 N 1.79 0.86 0.00 1.25 0.00 -0.75 -1.51 119.26 120.90 1wwp h ALA 7 Ca 0.15 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1wwp h ALA 7 Cb 0.10 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1wwp h ALA 7 CO -0.03 0.30 -0.30 1.79 0.00 0.00 0.00 179.25 181.00 1wwp h THR 8 N 0.92 0.73 -0.24 0.00 1.35 -1.10 -2.72 112.91 111.84 1wwp h THR 8 Ca 0.25 -1.31 -0.17 0.00 -0.55 0.00 0.00 66.41 64.62 1wwp h THR 8 Cb -0.09 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1wwp h THR 8 CO -0.05 0.29 -0.52 0.25 -0.25 0.00 0.00 175.52 175.25 1wwp h LEU 9 N 0.00 0.87 -2.16 3.87 5.85 -1.10 -3.04 115.31 119.61 1wwp h LEU 9 Ca -0.00 -0.55 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 1wwp h LEU 9 Cb 0.82 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 1wwp h LEU 9 CO 0.04 1.26 -0.04 0.11 -0.34 0.00 0.00 178.44 179.47 1wwp h LYS 10 N 0.51 0.00 0.00 1.25 1.57 -0.98 0.80 116.57 119.72 1wwp h LYS 10 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1wwp h LYS 10 Cb 1.13 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.44 1wwp h LYS 10 CO 0.11 0.04 -0.04 0.93 -0.57 0.00 0.00 179.45 179.92 1wwp h GLU 11 N 0.00 0.00 0.00 3.15 5.08 -1.40 -3.29 114.58 118.12 1wwp h GLU 11 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1wwp h GLU 11 Cb 0.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1wwp h GLU 11 CO 0.00 0.04 -1.16 1.28 -1.00 0.00 0.00 179.01 178.17 1wwp n LEU 12 N -3.86 0.00 -0.23 1.33 4.77 -0.46 -4.79 117.00 113.76 1wwp n LEU 12 Ca -0.03 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.05 1wwp n LEU 12 Cb 0.13 0.03 0.36 0.00 -2.33 0.00 0.00 43.42 41.62 1wwp n LEU 12 CO 0.29 0.03 1.22 0.00 -1.33 0.00 0.00 177.39 177.60 1wwp h ALA 13 N 0.21 1.77 -0.39 -1.18 0.00 -0.97 -2.93 119.26 115.77 1wwp h ALA 13 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1wwp h ALA 13 Cb 0.64 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1wwp h ALA 13 CO 0.00 0.05 0.00 1.19 0.00 0.00 0.00 179.25 180.49 1wwp n PHE 14 N -4.52 0.88 -2.39 0.00 3.72 -1.26 -4.17 117.46 109.73 1wwp n PHE 14 Ca 0.14 -0.35 -0.42 0.00 -0.05 0.00 0.00 57.45 56.77 1wwp n PHE 14 Cb 0.35 -0.16 -0.03 0.00 -0.94 0.00 0.00 39.48 38.70 1wwp n PHE 14 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1wwp s LEU 15 N -1.29 4.36 0.11 4.37 1.43 -1.11 -4.94 118.68 121.62 1wwp s LEU 15 Ca 0.30 2.04 -0.13 0.00 -1.03 0.00 0.00 54.13 55.32 1wwp s LEU 15 Cb 0.19 -3.58 -0.10 0.00 0.03 0.00 0.00 46.19 42.74 1wwp s LEU 15 CO 0.15 -0.51 1.39 -0.08 0.23 0.00 0.00 176.35 177.53 1wwp h GLU 16 N 6.90 0.83 -2.44 1.70 4.81 -1.92 -3.39 114.58 121.06 1wwp h GLU 16 Ca -0.41 -0.53 -0.59 0.00 -0.13 0.00 0.00 59.36 57.70 1wwp h GLU 16 Cb 1.21 0.06 -0.38 0.00 0.63 0.00 0.00 28.75 30.27 1wwp h GLU 16 CO 0.83 1.16 -0.93 0.34 -0.73 0.00 0.00 179.01 179.67 1wwp s ASP 17 N -6.88 1.80 0.60 1.04 -1.08 -1.26 -5.13 116.67 105.76 1wwp s ASP 17 Ca -0.11 -3.08 -0.17 0.00 -0.52 0.00 0.00 52.55 48.67 1wwp s ASP 17 Cb 0.09 -0.54 -0.03 0.00 -1.46 0.00 0.00 42.92 40.99 1wwp s ASP 17 CO 0.88 -0.17 1.09 -2.16 0.52 0.00 0.00 175.17 175.33 1wwp s PRO 18 N -0.01 3.16 0.87 4.34 0.04 -1.26 -5.03 135.00 137.12 1wwp s PRO 18 Ca 0.31 1.38 -0.12 0.00 0.04 0.00 0.00 61.00 62.61 1wwp s PRO 18 Cb 0.01 -2.00 0.11 0.00 0.04 0.00 0.00 34.50 32.67 1wwp s PRO 18 CO -0.18 -0.96 1.14 -1.54 0.04 0.00 0.00 177.00 175.49 1wwp s SER 19 N -2.41 3.92 0.49 6.66 1.04 -1.26 -4.75 113.70 117.38 1wwp s SER 19 Ca 0.67 1.00 0.14 0.00 0.48 0.00 0.00 55.95 58.25 1wwp s SER 19 Cb -0.19 -1.60 1.16 0.00 0.10 0.00 0.00 66.02 65.48 1wwp s SER 19 CO 0.35 -2.30 2.11 -0.65 0.98 0.00 0.00 173.24 173.73 1wwp h PRO 20 N -1.32 0.11 -0.11 4.02 0.11 -1.99 -0.72 132.00 132.08 1wwp h PRO 20 Ca -0.49 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 65.39 1wwp h PRO 20 Cb 1.32 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 32.41 1wwp h PRO 20 CO 0.62 0.09 -0.82 0.28 -0.21 0.00 0.00 178.00 177.96 1wwp h VAL 21 N 0.11 1.29 -0.33 3.15 2.07 -1.99 -2.49 116.25 118.05 1wwp h VAL 21 Ca 0.03 -2.06 -0.09 0.00 0.82 0.00 0.00 66.70 65.40 1wwp h VAL 21 Cb 0.03 2.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1wwp h VAL 21 CO -0.00 0.64 -0.18 -0.33 0.02 0.00 0.00 177.57 177.72 1wwp h GLU 22 N 0.47 0.61 -0.24 1.57 5.08 -1.74 -1.57 114.58 118.77 1wwp h GLU 22 Ca -0.06 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 57.95 1wwp h GLU 22 Cb 1.45 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.65 1wwp h GLU 22 CO 0.16 0.76 -0.37 -0.09 -1.00 0.00 0.00 179.01 178.48 1wwp h ARG 23 N 0.55 0.67 -0.31 2.33 2.43 -1.12 -1.58 114.38 117.35 1wwp h ARG 23 Ca 0.09 -0.40 -0.11 0.00 -0.81 0.00 0.00 59.98 58.75 1wwp h ARG 23 Cb 0.62 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 1wwp h ARG 23 CO 0.04 1.02 -0.27 -0.44 -1.51 0.00 0.00 179.97 178.81 1wwp h ASP 24 N 0.38 0.63 -0.29 -3.80 3.45 -1.42 -1.93 116.42 113.44 1wwp h ASP 24 Ca 0.02 -0.23 -0.11 0.00 0.43 0.00 0.00 57.03 57.14 1wwp h ASP 24 Cb 0.95 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 39.54 1wwp h ASP 24 CO 0.08 0.87 -0.21 0.00 -1.57 0.00 0.00 179.24 178.42 1wwp h ALA 25 N 1.17 0.91 -0.31 3.45 0.00 -1.23 -1.41 119.26 121.84 1wwp h ALA 25 Ca 0.07 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1wwp h ALA 25 Cb 0.74 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1wwp h ALA 25 CO 0.06 0.62 -0.19 0.00 0.00 0.00 0.00 179.25 179.73 1wwp h ALA 26 N 1.10 1.08 -0.22 0.00 0.00 -1.05 -1.30 119.26 118.87 1wwp h ALA 26 Ca 0.10 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.50 1wwp h ALA 26 Cb 0.71 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1wwp h ALA 26 CO 0.05 0.56 -0.57 0.82 0.00 0.00 0.00 179.25 180.12 1wwp h ILE 27 N 0.52 1.30 -0.64 0.00 2.04 -1.05 -2.01 117.51 117.67 1wwp h ILE 27 Ca 0.08 -1.79 -0.02 0.00 1.00 0.00 0.00 64.86 64.13 1wwp h ILE 27 Cb 0.63 1.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.41 1wwp h ILE 27 CO 0.04 0.57 0.33 -0.61 0.00 0.00 0.00 178.15 178.48 1wwp h GLN 28 N 0.53 0.90 0.00 2.37 5.75 -0.92 -2.22 115.11 121.53 1wwp h GLN 28 Ca 0.01 -0.12 -0.05 0.00 -0.15 0.00 0.00 58.65 58.34 1wwp h GLN 28 Cb 1.15 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 29.52 1wwp h GLN 28 CO 0.12 0.70 -0.25 0.00 -2.65 0.00 0.00 178.83 176.75 1wwp h ARG 29 N 0.87 0.00 -0.17 1.69 3.08 -1.15 -1.90 114.38 116.80 1wwp h ARG 29 Ca 0.22 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.20 1wwp h ARG 29 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1wwp h ARG 29 CO -0.03 0.25 -0.16 0.35 -1.07 0.00 0.00 179.97 179.30 1wwp h PHE 30 N 0.00 0.50 0.09 3.04 3.57 -0.98 -1.21 116.94 121.94 1wwp h PHE 30 Ca -0.00 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.36 1wwp h PHE 30 Cb 0.72 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.35 1wwp h PHE 30 CO 0.00 0.79 -0.10 0.93 -2.23 0.00 0.00 178.31 177.69 1wwp h GLU 31 N 0.07 -0.21 0.00 1.11 5.08 -0.86 0.15 114.58 119.92 1wwp h GLU 31 Ca 0.03 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1wwp h GLU 31 Cb 0.70 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1wwp h GLU 31 CO 0.04 -0.14 0.00 0.10 -1.00 0.00 0.00 179.01 178.01 1wwp h TYR 32 N -0.22 0.00 0.23 4.33 -0.00 -1.43 -2.26 116.97 117.62 1wwp h TYR 32 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 58.73 58.41 1wwp h TYR 32 Cb 0.22 0.00 0.03 0.00 0.00 0.00 0.00 36.73 36.98 1wwp h TYR 32 CO -0.12 0.00 -1.46 1.15 -0.00 0.00 0.00 178.16 177.72 1wwp h THR 33 N 0.00 1.30 -0.51 -0.90 2.02 -0.75 -2.78 112.91 111.28 1wwp h THR 33 Ca 0.00 -2.76 -0.08 0.00 0.77 0.00 0.00 66.41 64.35 1wwp h THR 33 Cb 0.69 3.01 -0.02 0.00 -1.74 0.00 0.00 68.15 70.09 1wwp h THR 33 CO 0.00 0.83 0.01 0.15 0.37 0.00 0.00 175.52 176.88 1wwp h PHE 34 N 0.13 0.98 -0.24 3.16 3.04 -0.64 0.22 116.94 123.59 1wwp h PHE 34 Ca -0.24 -0.16 0.05 0.00 3.98 0.00 0.00 57.97 61.59 1wwp h PHE 34 Cb 2.14 -0.26 -0.04 0.00 2.56 0.00 0.00 35.95 40.35 1wwp h PHE 34 CO 0.12 0.90 -0.04 1.49 -2.02 0.00 0.00 178.31 178.76 1wwp h GLU 35 N 0.77 0.03 -0.41 1.11 4.57 -1.48 0.11 114.58 119.27 1wwp h GLU 35 Ca 0.15 -0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.28 1wwp h GLU 35 Cb 0.50 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.07 1wwp h GLU 35 CO 0.02 0.02 0.08 0.00 -1.18 0.00 0.00 179.01 177.95 1wwp h ALA 36 N 1.23 1.37 0.26 2.92 0.00 -1.21 -2.62 119.26 121.21 1wwp h ALA 36 Ca 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1wwp h ALA 36 Cb 0.17 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1wwp h ALA 36 CO -0.23 0.45 -0.13 0.35 0.00 0.00 0.00 179.25 179.69 1wwp h PHE 37 N 0.60 -0.32 -0.04 0.00 3.57 0.59 -2.01 116.94 119.33 1wwp h PHE 37 Ca 0.14 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 1wwp h PHE 37 Cb 0.26 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.10 1wwp h PHE 37 CO 0.01 0.02 -0.38 0.11 -2.23 0.00 0.00 178.31 175.84 1wwp h TRP 38 N -0.72 0.09 -0.80 0.41 5.08 -0.82 -1.90 115.95 117.29 1wwp h TRP 38 Ca -0.04 -0.02 -0.05 0.00 1.08 0.00 0.00 58.89 59.87 1wwp h TRP 38 Cb 0.49 -0.02 -0.04 0.00 -3.00 0.00 0.00 29.16 26.59 1wwp h TRP 38 CO 0.03 0.45 0.32 0.87 -1.28 0.00 0.00 178.44 178.83 1wwp h LYS 39 N 0.07 1.20 -0.64 0.12 1.79 -1.47 0.15 116.57 117.78 1wwp h LYS 39 Ca 0.01 -0.22 -0.08 0.00 -2.18 0.00 0.00 60.65 58.18 1wwp h LYS 39 Cb 0.70 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 31.13 1wwp h LYS 39 CO 0.05 0.97 0.08 0.00 -1.08 0.00 0.00 179.45 179.48 1wwp h ALA 40 N 1.17 0.85 -0.20 3.86 0.00 -0.92 0.48 119.26 124.51 1wwp h ALA 40 Ca 0.27 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1wwp h ALA 40 Cb 0.22 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1wwp h ALA 40 CO -0.02 0.63 0.08 1.25 0.00 0.00 0.00 179.25 181.19 1wwp h LEU 41 N 0.98 0.27 -0.21 0.00 5.85 -0.97 -0.54 115.31 120.70 1wwp h LEU 41 Ca 0.19 -0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.78 1wwp h LEU 41 Cb 0.46 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1wwp h LEU 41 CO 0.02 0.37 -0.02 -0.61 -0.34 0.00 0.00 178.44 177.85 1wwp h GLN 42 N 0.17 0.04 -0.40 1.25 4.15 -0.42 -0.36 115.11 119.53 1wwp h GLN 42 Ca 0.07 -0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.48 1wwp h GLN 42 Cb 0.18 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 1wwp h GLN 42 CO -0.01 0.03 0.25 0.00 -1.93 0.00 0.00 178.83 177.17 1wwp h ALA 43 N 1.19 0.51 -0.87 3.38 0.00 -0.76 -1.83 119.26 120.89 1wwp h ALA 43 Ca 0.10 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wwp h ALA 43 Cb 0.14 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1wwp h ALA 43 CO -0.18 -0.01 0.53 -0.92 0.00 0.00 0.00 179.25 178.66 1wwp h TYR 44 N 0.53 1.14 -0.36 0.00 3.20 -0.67 -0.96 116.97 119.85 1wwp h TYR 44 Ca 0.14 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.85 1wwp h TYR 44 Cb -0.02 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 37.87 1wwp h TYR 44 CO -0.04 0.76 -0.41 -0.07 -1.64 0.00 0.00 178.16 176.75 1wwp h LEU 45 N 1.20 0.96 0.11 2.82 3.38 -0.84 0.10 115.31 123.03 1wwp h LEU 45 Ca 0.31 -0.45 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 1wwp h LEU 45 Cb -0.06 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.42 1wwp h LEU 45 CO -0.06 1.24 -0.05 -0.09 0.09 0.00 0.00 178.44 179.57 1wwp h ARG 46 N 0.72 -0.14 0.08 1.13 2.43 -0.98 -0.53 114.38 117.10 1wwp h ARG 46 Ca 0.05 0.01 -0.26 0.00 -0.81 0.00 0.00 59.98 58.97 1wwp h ARG 46 Cb 1.00 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 30.59 1wwp h ARG 46 CO 0.10 0.00 -1.13 0.93 -1.51 0.00 0.00 179.97 178.37 1wwp h GLU 47 N -0.25 0.41 0.00 0.20 5.08 -1.21 -3.12 114.58 115.69 1wwp h GLU 47 Ca -0.01 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 1wwp h GLU 47 Cb 0.20 0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1wwp h GLU 47 CO 0.02 1.21 -1.16 1.63 -1.00 0.00 0.00 179.01 179.72 1wwp n LYS 48 N -3.68 0.70 0.00 2.33 4.76 0.34 -4.57 118.16 118.04 1wwp n LYS 48 Ca -0.09 -0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.30 1wwp n LYS 48 Cb 0.94 -1.41 0.00 0.00 -1.84 0.00 0.00 35.03 32.72 1wwp n LYS 48 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1wwp n GLU 49 N -1.64 1.06 -2.48 1.97 -0.58 -0.29 -5.01 120.64 113.67 1wwp n GLU 49 Ca 0.02 -0.83 -0.16 0.00 -0.42 0.00 0.00 57.16 55.76 1wwp n GLU 49 Cb 0.35 -0.71 -0.01 0.00 -0.57 0.00 0.00 31.44 30.50 1wwp n GLU 49 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1wwp n GLY 50 N -0.19 -0.50 3.13 0.62 0.00 -0.83 -4.95 105.19 102.48 1wwp n GLY 50 Ca 0.00 0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1wwp n GLY 50 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wwp s LEU 51 N -5.85 3.37 -0.55 0.99 1.43 -0.73 -4.97 118.68 112.37 1wwp s LEU 51 Ca 0.03 -1.16 -0.20 0.00 -1.03 0.00 0.00 54.13 51.77 1wwp s LEU 51 Cb -0.01 -1.61 0.07 0.00 0.03 0.00 0.00 46.19 44.67 1wwp s LEU 51 CO 0.03 -0.17 0.69 -1.61 0.23 0.00 0.00 176.35 175.52 1wwp s GLU 52 N 1.21 3.10 0.11 1.70 2.02 -1.26 -2.63 118.70 122.95 1wwp s GLU 52 Ca -0.04 -1.01 -0.03 0.00 0.02 0.00 0.00 54.97 53.90 1wwp s GLU 52 Cb -0.18 -4.17 -0.05 0.00 0.10 0.00 0.00 34.13 29.83 1wwp s GLU 52 CO -0.05 -1.39 0.31 0.20 0.02 0.00 0.00 175.26 174.36 1wwp s GLY 53 N 3.10 2.22 0.00 -1.39 0.00 -1.26 -5.02 107.32 104.97 1wwp s GLY 53 Ca 0.15 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.22 1wwp s GLY 53 CO 0.10 -0.58 0.64 0.00 0.00 0.00 0.00 173.10 173.26 1wwp n ALA 54 N 0.24 2.06 -2.37 3.20 0.00 -1.26 -4.91 120.51 117.46 1wwp n ALA 54 Ca -0.04 -0.64 -0.08 0.00 0.00 0.00 0.00 53.44 52.68 1wwp n ALA 54 Cb 0.52 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.88 1wwp n ALA 54 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1wwp s SER 55 N -0.35 0.31 0.18 0.00 1.04 -1.26 -5.02 113.70 108.60 1wwp s SER 55 Ca 0.00 -0.79 -0.13 0.00 0.48 0.00 0.00 55.95 55.50 1wwp s SER 55 Cb 0.00 0.25 0.11 0.00 0.10 0.00 0.00 66.02 66.47 1wwp s SER 55 CO 0.00 -0.62 1.82 -0.65 0.98 0.00 0.00 173.24 174.77 1wwp h PRO 56 N 3.14 0.64 -0.06 4.02 0.11 -1.96 0.21 132.00 138.10 1wwp h PRO 56 Ca -0.34 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 65.58 1wwp h PRO 56 Cb 1.17 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1wwp h PRO 56 CO 0.60 0.42 -0.66 0.87 -0.21 0.00 0.00 178.00 179.01 1wwp h LYS 57 N 0.66 0.26 -0.53 1.05 1.57 -1.97 -1.46 116.57 116.15 1wwp h LYS 57 Ca 0.22 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.73 1wwp h LYS 57 Cb 0.01 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1wwp h LYS 57 CO -0.09 0.83 0.05 0.78 -0.57 0.00 0.00 179.45 180.44 1wwp h GLY 58 N 1.51 0.97 1.37 3.86 0.00 -1.86 -1.16 103.07 107.76 1wwp h GLY 58 Ca -0.01 -0.68 -0.11 0.00 0.00 0.00 0.00 47.33 46.52 1wwp h GLY 58 CO 0.10 0.63 -0.24 -2.08 0.00 0.00 0.00 176.54 174.95 1wwp h VAL 59 N 0.78 1.27 -0.23 4.60 2.07 -0.45 -2.29 116.25 121.99 1wwp h VAL 59 Ca 0.15 -1.34 -0.04 0.00 0.82 0.00 0.00 66.70 66.29 1wwp h VAL 59 Cb 0.46 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 1wwp h VAL 59 CO 0.02 0.44 -0.03 0.40 0.02 0.00 0.00 177.57 178.43 1wwp h ILE 60 N 0.63 1.27 -0.52 4.57 2.04 -0.98 -1.19 117.51 123.32 1wwp h ILE 60 Ca 0.09 -0.97 0.04 0.00 1.00 0.00 0.00 64.86 65.01 1wwp h ILE 60 Cb 0.74 1.44 -0.04 0.00 -0.74 0.00 0.00 36.82 38.22 1wwp h ILE 60 CO 0.06 0.30 0.29 0.03 0.00 0.00 0.00 178.15 178.82 1wwp h ARG 61 N 0.18 0.54 -0.90 2.37 3.08 -1.14 -1.45 114.38 117.07 1wwp h ARG 61 Ca 0.06 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.09 1wwp h ARG 61 Cb 0.46 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.34 1wwp h ARG 61 CO 0.02 0.36 0.59 -0.07 -1.07 0.00 0.00 179.97 179.79 1wwp h LEU 62 N 0.56 1.04 -1.12 3.04 3.38 -1.29 -0.15 115.31 120.77 1wwp h LEU 62 Ca 0.22 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.09 1wwp h LEU 62 Cb 0.09 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1wwp h LEU 62 CO -0.13 0.76 -0.15 0.00 0.09 0.00 0.00 178.44 179.00 1wwp h ALA 63 N 1.43 1.27 0.08 1.53 0.00 -0.62 -2.15 119.26 120.80 1wwp h ALA 63 Ca 0.33 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1wwp h ALA 63 Cb -0.13 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.54 1wwp h ALA 63 CO -0.07 0.48 -0.04 -0.09 0.00 0.00 0.00 179.25 179.53 1wwp h ARG 64 N 0.40 -0.11 0.00 0.00 2.43 -0.30 -0.59 114.38 116.22 1wwp h ARG 64 Ca 0.07 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1wwp h ARG 64 Cb 0.51 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1wwp h ARG 64 CO 0.03 0.27 0.00 0.39 -1.51 0.00 0.00 179.97 179.15 1wwp n GLU 65 N -4.96 0.09 0.00 0.20 -0.58 -0.16 -1.12 120.64 114.11 1wwp n GLU 65 Ca -0.08 0.19 0.04 0.00 -0.42 0.00 0.00 57.16 56.89 1wwp n GLU 65 Cb 0.22 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.60 1wwp n GLU 65 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1wwp n VAL 66 N -1.23 0.00 -0.26 2.62 0.31 -0.82 -5.00 118.33 113.95 1wwp n VAL 66 Ca 0.03 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 1wwp n VAL 66 Cb 0.04 1.12 0.00 0.00 -0.91 0.00 0.00 33.84 34.09 1wwp n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wwp n GLY 67 N 0.71 0.74 0.17 2.92 0.00 -0.28 -4.94 105.19 104.52 1wwp n GLY 67 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 1wwp n GLY 67 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1wwp h LEU 68 N 0.00 0.14 -8.20 0.99 3.38 -1.32 -3.43 115.31 106.87 1wwp h LEU 68 Ca 0.00 -0.07 -0.63 0.00 0.09 0.00 0.00 57.88 57.27 1wwp h LEU 68 Cb 0.00 -0.04 -0.33 0.00 0.09 0.00 0.00 40.66 40.37 1wwp h LEU 68 CO 0.00 0.65 -0.86 -0.76 0.09 0.00 0.00 178.44 177.56 1wwp s LEU 69 N -7.94 1.95 0.86 1.67 1.02 -1.16 -4.93 118.68 110.15 1wwp s LEU 69 Ca -0.03 -0.49 -0.11 0.00 0.02 0.00 0.00 54.13 53.52 1wwp s LEU 69 Cb 0.13 -1.24 0.11 0.00 0.02 0.00 0.00 46.19 45.20 1wwp s LEU 69 CO 0.77 0.10 1.09 -0.13 0.02 0.00 0.00 176.35 178.21 1wwp s ARG 70 N 0.55 1.58 0.45 1.70 0.52 -1.26 -4.47 118.95 118.02 1wwp s ARG 70 Ca -0.15 0.91 0.14 0.00 -0.52 0.00 0.00 55.73 56.12 1wwp s ARG 70 Cb -0.17 -1.84 1.08 0.00 0.52 0.00 0.00 34.95 34.54 1wwp s ARG 70 CO 0.05 -2.04 2.02 -0.44 0.02 0.00 0.00 175.30 174.91 1wwp h ASP 71 N -1.41 0.29 -0.03 0.23 5.19 -2.00 -1.47 116.42 117.23 1wwp h ASP 71 Ca -0.48 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 55.93 1wwp h ASP 71 Cb 1.27 -0.06 -0.00 0.00 0.18 0.00 0.00 39.33 40.72 1wwp h ASP 71 CO 0.54 0.18 -0.02 -0.33 -3.12 0.00 0.00 179.24 176.49 1wwp h GLU 72 N 0.33 0.06 -0.88 3.56 3.07 -2.00 -2.60 114.58 116.12 1wwp h GLU 72 Ca 0.22 -0.03 0.05 0.00 -0.50 0.00 0.00 59.36 59.10 1wwp h GLU 72 Cb 0.43 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.28 1wwp h GLU 72 CO -0.05 0.51 0.55 0.93 -1.40 0.00 0.00 179.01 179.56 1wwp h GLU 73 N -0.39 1.00 -0.91 2.33 5.08 -1.79 -1.96 114.58 117.94 1wwp h GLU 73 Ca 0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1wwp h GLU 73 Cb 0.50 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 1wwp h GLU 73 CO 0.01 0.66 0.54 0.00 -1.00 0.00 0.00 179.01 179.22 1wwp h ALA 74 N 1.39 1.16 -0.38 3.43 0.00 -1.25 0.16 119.26 123.78 1wwp h ALA 74 Ca 0.37 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 1wwp h ALA 74 Cb 0.12 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1wwp h ALA 74 CO -0.15 0.62 -0.12 -0.09 0.00 0.00 0.00 179.25 179.51 1wwp h ARG 75 N 1.25 0.66 -0.01 0.00 2.43 -0.97 -1.23 114.38 116.52 1wwp h ARG 75 Ca 0.32 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1wwp h ARG 75 Cb -0.04 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1wwp h ARG 75 CO -0.06 0.76 -0.00 1.25 -1.51 0.00 0.00 179.97 180.41 1wwp h LEU 76 N 0.60 0.01 -0.89 3.80 6.46 -0.69 -2.36 115.31 122.24 1wwp h LEU 76 Ca 0.11 -0.35 0.16 0.00 -0.12 0.00 0.00 57.88 57.67 1wwp h LEU 76 Cb 0.56 -0.00 -0.10 0.00 -0.73 0.00 0.00 40.66 40.39 1wwp h LEU 76 CO 0.03 0.36 0.49 0.00 -0.62 0.00 0.00 178.44 178.70 1wwp h ALA 77 N 0.65 1.38 -0.32 1.25 0.00 -0.52 0.11 119.26 121.81 1wwp h ALA 77 Ca 0.00 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1wwp h ALA 77 Cb 0.36 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1wwp h ALA 77 CO 0.00 -0.07 -0.11 -0.07 0.00 0.00 0.00 179.25 179.00 1wwp h LEU 78 N 0.67 0.52 -3.38 0.00 3.38 -1.02 -2.56 115.31 112.91 1wwp h LEU 78 Ca 0.49 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1wwp h LEU 78 Cb 0.71 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1wwp h LEU 78 CO -0.37 0.67 0.00 0.61 0.09 0.00 0.00 178.44 179.44 1wwp n GLY 79 N -0.63 1.10 2.29 0.83 0.00 0.38 -2.64 105.19 106.51 1wwp n GLY 79 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1wwp n GLY 79 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wwp n VAL 81 N 1.66 0.00 -0.09 1.61 0.31 -0.97 -1.67 118.33 119.18 1wwp n VAL 81 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 1wwp n VAL 81 Cb 0.17 0.00 0.08 0.00 -0.91 0.00 0.00 33.84 33.18 1wwp n VAL 81 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1wwp h ASP 82 N 0.00 0.79 -0.26 4.52 3.32 -1.82 -3.19 116.42 119.79 1wwp h ASP 82 Ca 0.00 -0.29 -0.13 0.00 0.02 0.00 0.00 57.03 56.63 1wwp h ASP 82 Cb 0.00 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 1wwp h ASP 82 CO 0.00 1.00 -0.35 0.44 -1.72 0.00 0.00 179.24 178.60 1wwp h ASP 83 N 0.68 0.76 0.00 6.45 3.32 -1.62 -2.49 116.42 123.52 1wwp h ASP 83 Ca 0.09 -0.51 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1wwp h ASP 83 Cb 0.74 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1wwp h ASP 83 CO 0.06 1.12 0.10 -0.09 -1.72 0.00 0.00 179.24 178.71 1wwp h ARG 84 N 0.42 0.00 0.00 3.56 1.12 -1.82 -0.39 114.38 117.28 1wwp h ARG 84 Ca 0.03 0.00 -0.23 0.00 -1.11 0.00 0.00 59.98 58.67 1wwp h ARG 84 Cb 0.94 0.00 -0.04 0.00 -0.01 0.00 0.00 29.97 30.86 1wwp h ARG 84 CO 0.08 0.00 -2.18 0.43 -3.11 0.00 0.00 179.97 175.19 1wwp n SER 85 N -2.58 0.31 0.01 -3.80 7.64 -1.12 -4.04 113.62 110.04 1wwp n SER 85 Ca -0.02 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.98 1wwp n SER 85 Cb 0.15 1.29 0.50 0.00 -1.01 0.00 0.00 64.21 65.13 1wwp n SER 85 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1wwp n LEU 86 N -2.54 0.08 -0.07 -3.43 4.77 -0.27 -2.66 117.00 112.87 1wwp n LEU 86 Ca -0.22 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1wwp n LEU 86 Cb 0.93 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1wwp n LEU 86 CO 0.41 -0.12 0.21 0.41 -1.33 0.00 0.00 177.39 176.97 1wwp n THR 87 N -1.58 0.00 0.00 -5.08 -1.04 -0.50 -3.62 114.28 102.46 1wwp n THR 87 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1wwp n THR 87 Cb 0.28 -0.27 0.00 0.00 -1.82 0.00 0.00 70.33 68.52 1wwp n THR 87 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1wwp n VAL 88 N -0.40 0.00 -1.18 12.58 0.31 -1.09 -4.31 118.33 124.24 1wwp n VAL 88 Ca 0.00 0.13 -0.25 0.00 -0.01 0.00 0.00 64.34 64.21 1wwp n VAL 88 Cb 0.01 -0.46 -0.10 0.00 -0.91 0.00 0.00 33.84 32.39 1wwp n VAL 88 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1wwp n HIS 89 N -0.97 1.21 0.49 3.52 1.44 -1.24 -4.68 115.22 114.99 1wwp n HIS 89 Ca 0.00 -2.27 0.11 0.00 -2.01 0.00 0.00 57.72 53.55 1wwp n HIS 89 Cb 0.00 -2.00 0.45 0.00 0.12 0.00 0.00 29.99 28.56 1wwp n HIS 89 CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 1wwp n THR 90 N 2.91 0.78 0.61 0.61 -1.04 -1.26 -3.35 114.28 113.54 1wwp n THR 90 Ca 0.60 0.14 0.00 0.00 -2.04 0.00 0.00 64.05 62.75 1wwp n THR 90 Cb 0.58 -1.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.09 1wwp n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wwp n TYR 91 N -2.04 0.00 -3.09 -1.42 9.36 -1.26 -3.97 117.16 114.74 1wwp n TYR 91 Ca 0.03 -0.24 -0.44 0.00 3.32 0.00 0.00 57.90 60.57 1wwp n TYR 91 Cb 0.26 -0.16 0.00 0.00 -0.63 0.00 0.00 39.34 38.81 1wwp n TYR 91 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1wwp n ASN 92 N 0.58 5.73 -0.09 2.98 5.15 -1.21 -4.91 115.26 123.49 1wwp n ASN 92 Ca 0.00 -3.15 0.01 0.00 -0.60 0.00 0.00 54.58 50.83 1wwp n ASN 92 Cb 0.27 -1.38 0.02 0.00 -0.53 0.00 0.00 39.78 38.16 1wwp n ASN 92 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1wwp n GLU 93 N 2.79 -0.04 -0.13 1.20 -0.58 -1.25 0.19 120.64 122.82 1wwp n GLU 93 Ca 0.28 0.37 -0.04 0.00 -0.42 0.00 0.00 57.16 57.35 1wwp n GLU 93 Cb 0.37 -0.55 0.03 0.00 -0.57 0.00 0.00 31.44 30.72 1wwp n GLU 93 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1wwp h PRO 94 N 0.00 0.04 0.23 3.49 0.11 -1.91 0.45 132.00 134.42 1wwp h PRO 94 Ca 0.10 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.19 1wwp h PRO 94 Cb 0.16 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.26 1wwp h PRO 94 CO -0.24 0.03 -0.11 1.25 -0.21 0.00 0.00 178.00 178.72 1wwp h LEU 95 N 0.04 -0.26 -0.70 2.35 5.85 0.18 0.02 115.31 122.80 1wwp h LEU 95 Ca 0.21 -0.18 0.11 0.00 0.84 0.00 0.00 57.88 58.86 1wwp h LEU 95 Cb 0.32 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.34 1wwp h LEU 95 CO -0.41 0.04 0.31 0.00 -0.34 0.00 0.00 178.44 178.05 1wwp h ALA 96 N 0.10 0.95 -0.55 1.25 0.00 -1.24 0.19 119.26 119.96 1wwp h ALA 96 Ca -0.03 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1wwp h ALA 96 Cb 0.43 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1wwp h ALA 96 CO 0.05 -0.13 0.06 0.00 0.00 0.00 0.00 179.25 179.23 1wwp h ARG 97 N 0.51 0.90 -0.16 0.00 3.08 -0.80 -0.13 114.38 117.78 1wwp h ARG 97 Ca 0.36 -0.23 -0.10 0.00 0.07 0.00 0.00 59.98 60.08 1wwp h ARG 97 Cb 0.44 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1wwp h ARG 97 CO -0.31 0.86 -0.33 0.00 -1.07 0.00 0.00 179.97 179.11 1wwp h ALA 98 N 1.21 1.14 -0.04 0.04 0.00 0.33 -1.75 119.26 120.19 1wwp h ALA 98 Ca 0.17 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 1wwp h ALA 98 Cb 0.42 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.12 1wwp h ALA 98 CO 0.01 0.55 -0.37 0.82 0.00 0.00 0.00 179.25 180.27 1wwp h ILE 99 N 0.28 1.45 -0.88 0.00 1.08 -0.61 -3.12 117.51 115.72 1wwp h ILE 99 Ca 0.04 -1.85 0.12 0.00 -0.39 0.00 0.00 64.86 62.77 1wwp h ILE 99 Cb 0.72 2.49 -0.08 0.00 -3.07 0.00 0.00 36.82 36.88 1wwp h ILE 99 CO 0.06 0.53 0.50 0.15 -0.69 0.00 0.00 178.15 178.70 1wwp h PHE 100 N -0.22 0.91 0.00 1.37 3.57 -0.92 0.11 116.94 121.76 1wwp h PHE 100 Ca -0.03 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 1wwp h PHE 100 Cb 1.05 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 1wwp h PHE 100 CO 0.14 0.32 -0.00 -0.09 -2.23 0.00 0.00 178.31 176.46 1wwp h ARG 101 N 0.79 0.00 0.00 1.11 2.43 -1.30 -1.37 114.38 116.04 1wwp h ARG 101 Ca 0.44 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.61 1wwp h ARG 101 Cb 0.49 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1wwp h ARG 101 CO -0.29 0.00 -0.61 0.54 -1.51 0.00 0.00 179.97 178.10 1wwp n ARG 102 N -4.09 0.07 -0.33 0.20 1.74 0.35 -4.35 116.66 110.26 1wwp n ARG 102 Ca -0.03 0.01 0.06 0.00 -0.77 0.00 0.00 57.85 57.12 1wwp n ARG 102 Cb 0.08 -1.54 0.25 0.00 -1.02 0.00 0.00 32.46 30.24 1wwp n ARG 102 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1wwp h LEU 103 N 0.00 0.90 -0.74 0.55 3.38 -0.70 -1.83 115.31 116.86 1wwp h LEU 103 Ca 0.00 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.05 1wwp h LEU 103 Cb 0.56 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.09 1wwp h LEU 103 CO 0.00 0.53 0.45 -0.65 0.09 0.00 0.00 178.44 178.86 1wwp h PRO 104 N 0.99 0.81 -0.24 1.13 0.11 -1.76 0.14 132.00 133.19 1wwp h PRO 104 Ca 0.44 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.40 1wwp h PRO 104 Cb 0.37 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 1wwp h PRO 104 CO -0.20 0.54 -0.27 -0.44 -0.21 0.00 0.00 178.00 177.41 1wwp h ASP 105 N 0.84 0.66 -0.04 -2.05 3.32 -1.72 -1.97 116.42 115.46 1wwp h ASP 105 Ca 0.32 -0.49 0.02 0.00 0.02 0.00 0.00 57.03 56.90 1wwp h ASP 105 Cb 0.13 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1wwp h ASP 105 CO -0.16 1.01 -0.07 1.88 -1.72 0.00 0.00 179.24 180.19 1wwp h TYR 106 N 0.33 -0.16 -0.60 4.55 0.05 -0.97 0.14 116.97 120.30 1wwp h TYR 106 Ca 0.04 0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.87 1wwp h TYR 106 Cb 0.84 0.08 -0.05 0.00 1.01 0.00 0.00 36.73 38.61 1wwp h TYR 106 CO 0.08 -0.10 0.33 0.00 -1.05 0.00 0.00 178.16 177.41 1wwp h ALA 107 N 0.94 0.79 -0.53 3.88 0.00 -0.74 -2.38 119.26 121.21 1wwp h ALA 107 Ca 0.04 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 1wwp h ALA 107 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1wwp h ALA 107 CO -0.10 0.00 -0.08 0.00 0.00 0.00 0.00 179.25 179.07 1wwp h ARG 108 N 0.62 0.97 -0.03 0.00 3.08 -0.97 -2.19 114.38 115.86 1wwp h ARG 108 Ca 0.26 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1wwp h ARG 108 Cb 0.15 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1wwp h ARG 108 CO -0.17 1.00 0.00 -0.11 -1.07 0.00 0.00 179.97 179.63 1wwp n LEU 109 N -4.16 0.03 0.00 3.04 7.94 0.45 -1.76 117.00 122.54 1wwp n LEU 109 Ca 0.02 -0.01 0.00 0.00 -1.11 0.00 0.00 56.01 54.91 1wwp n LEU 109 Cb 0.38 -0.01 0.00 0.00 0.53 0.00 0.00 43.42 44.32 1wwp n LEU 109 CO 0.44 0.01 0.00 1.21 -1.11 0.00 0.00 177.39 177.94 1wwp n GLU 111 N 0.42 0.00 0.41 1.96 0.00 -0.82 -0.92 120.64 121.69 1wwp n GLU 111 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 57.16 56.97 1wwp n GLU 111 Cb 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 31.44 31.35 1wwp n GLU 111 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.13 179.09 1wwp h GLN 112 N 0.00 -1.03 -0.27 5.31 1.08 -1.62 -1.83 115.11 116.76 1wwp h GLN 112 Ca 0.00 0.07 0.06 0.00 -1.45 0.00 0.00 58.65 57.33 1wwp h GLN 112 Cb 0.00 0.23 -0.06 0.00 -0.05 0.00 0.00 27.48 27.61 1wwp h GLN 112 CO 0.00 -0.68 -0.10 0.28 -0.95 0.00 0.00 178.83 177.38 1wwp h VAL 113 N -1.06 0.66 -0.31 -0.54 2.07 -1.30 0.64 116.25 116.40 1wwp h VAL 113 Ca -0.10 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.48 1wwp h VAL 113 Cb 0.83 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1wwp h VAL 113 CO 0.14 0.00 0.21 -0.07 0.02 0.00 0.00 177.57 177.88 1wwp h LEU 114 N -0.05 0.12 -1.63 2.57 3.38 -1.80 0.25 115.31 118.15 1wwp h LEU 114 Ca 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 1wwp h LEU 114 Cb 0.26 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1wwp h LEU 114 CO -0.31 0.08 -0.06 1.23 0.09 0.00 0.00 178.44 179.48 1wwp h GLY 115 N 0.14 0.00 1.05 0.83 0.00 0.02 -2.44 103.07 102.68 1wwp h GLY 115 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1wwp h GLY 115 CO -0.02 0.00 -0.81 3.21 0.00 0.00 0.00 176.54 178.92 1wwp h ARG 116 N 0.00 0.00 0.00 4.80 3.08 -0.62 -2.90 114.38 118.74 1wwp h ARG 116 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1wwp h ARG 116 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1wwp h ARG 116 CO 0.01 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.19 1wwp n LEU 117 N -2.34 0.00 0.03 3.04 4.77 -0.92 -4.37 117.00 117.21 1wwp n LEU 117 Ca 0.02 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1wwp n LEU 117 Cb 0.49 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1wwp n LEU 117 CO 0.38 -0.00 0.00 0.54 -1.33 0.00 0.00 177.39 176.98 1wwp n ARG 118 N -1.11 0.00 0.00 3.23 1.74 -1.24 -5.12 116.66 114.16 1wwp n ARG 118 Ca 0.20 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1wwp n ARG 118 Cb 0.16 -0.21 0.00 0.00 -1.02 0.00 0.00 32.46 31.39 1wwp n ARG 118 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65