#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o4x n GLU 6 N 0.00 0.52 -1.16 5.31 2.13 -1.26 -5.01 120.64 121.16 1o4x n GLU 6 Ca 0.00 0.17 -0.32 0.00 0.66 0.00 0.00 57.16 57.67 1o4x n GLU 6 Cb 0.00 -1.38 0.11 0.00 0.27 0.00 0.00 31.44 30.45 1o4x n GLU 6 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1o4x s PRO 7 N -2.43 1.83 0.26 5.31 0.04 -1.26 -4.92 135.00 133.83 1o4x s PRO 7 Ca -0.31 1.51 -0.31 0.00 0.04 0.00 0.00 61.00 61.93 1o4x s PRO 7 Cb 0.10 -1.82 -0.13 0.00 0.04 0.00 0.00 34.50 32.69 1o4x s PRO 7 CO 0.45 -2.02 1.51 0.45 0.04 0.00 0.00 177.00 177.43 1o4x n SER 8 N -3.42 3.28 -4.42 6.66 2.88 -1.26 -5.00 113.62 112.34 1o4x n SER 8 Ca 0.12 1.14 -0.26 0.00 -1.33 0.00 0.00 58.87 58.53 1o4x n SER 8 Cb 0.52 -1.50 0.15 0.00 -0.75 0.00 0.00 64.21 62.62 1o4x n SER 8 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 1o4x s ASP 9 N 0.45 3.76 0.20 -3.46 1.47 -1.26 -4.79 116.67 113.03 1o4x s ASP 9 Ca 0.67 -0.18 -0.11 0.00 1.18 0.00 0.00 52.55 54.11 1o4x s ASP 9 Cb -0.58 -0.02 0.20 0.00 -0.34 0.00 0.00 42.92 42.18 1o4x s ASP 9 CO 0.48 -2.28 1.79 0.25 0.68 0.00 0.00 175.17 176.09 1o4x h LEU 10 N -1.01 0.44 -0.90 2.11 6.46 -1.99 -0.61 115.31 119.80 1o4x h LEU 10 Ca -0.39 0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 57.34 1o4x h LEU 10 Cb 1.25 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 41.10 1o4x h LEU 10 CO 0.37 0.29 0.10 -0.33 -0.62 0.00 0.00 178.44 178.25 1o4x h GLU 11 N 0.58 0.91 -0.32 1.25 5.08 -1.99 -1.38 114.58 118.70 1o4x h GLU 11 Ca 0.27 -0.22 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 1o4x h GLU 11 Cb 0.18 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1o4x h GLU 11 CO -0.18 0.84 -0.36 0.93 -1.00 0.00 0.00 179.01 179.24 1o4x h GLU 12 N 0.86 0.74 -0.53 2.33 5.08 -1.77 -2.32 114.58 118.97 1o4x h GLU 12 Ca 0.18 -0.36 -0.09 0.00 -1.00 0.00 0.00 59.36 58.09 1o4x h GLU 12 Cb 0.37 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 1o4x h GLU 12 CO 0.01 0.98 -0.02 1.25 -1.00 0.00 0.00 179.01 180.22 1o4x h LEU 13 N 0.61 0.90 -1.13 1.33 5.85 -0.86 -0.01 115.31 122.01 1o4x h LEU 13 Ca 0.06 -0.25 -0.04 0.00 0.84 0.00 0.00 57.88 58.49 1o4x h LEU 13 Cb 0.89 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1o4x h LEU 13 CO 0.08 0.97 0.16 -0.33 -0.34 0.00 0.00 178.44 178.98 1o4x h GLU 14 N 0.85 0.77 -0.18 1.25 5.08 -1.09 0.17 114.58 121.43 1o4x h GLU 14 Ca 0.15 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.24 1o4x h GLU 14 Cb 0.53 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1o4x h GLU 14 CO 0.03 0.67 -0.42 0.37 -1.00 0.00 0.00 179.01 178.66 1o4x h GLN 15 N 0.76 0.60 -0.72 2.33 5.75 -0.84 -2.09 115.11 120.90 1o4x h GLN 15 Ca 0.17 -0.41 0.02 0.00 -0.15 0.00 0.00 58.65 58.28 1o4x h GLN 15 Cb 0.23 0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.80 1o4x h GLN 15 CO -0.01 1.03 0.47 0.35 -2.65 0.00 0.00 178.83 178.02 1o4x h PHE 16 N 0.27 0.88 -0.80 3.99 3.57 -0.73 0.33 116.94 124.45 1o4x h PHE 16 Ca -0.00 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1o4x h PHE 16 Cb 1.03 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.44 1o4x h PHE 16 CO 0.09 0.54 0.48 0.00 -2.23 0.00 0.00 178.31 177.20 1o4x h ALA 17 N 1.28 1.01 0.37 2.41 0.00 -0.91 0.31 119.26 123.73 1o4x h ALA 17 Ca 0.27 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1o4x h ALA 17 Cb -0.07 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.41 1o4x h ALA 17 CO -0.08 0.48 -0.18 -0.22 0.00 0.00 0.00 179.25 179.25 1o4x h LYS 18 N 1.09 -0.48 -0.27 0.00 1.63 -0.87 -2.01 116.57 115.66 1o4x h LYS 18 Ca 0.29 0.03 0.01 0.00 -0.85 0.00 0.00 60.65 60.13 1o4x h LYS 18 Cb -0.05 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 1o4x h LYS 18 CO -0.05 -0.31 0.15 1.15 -3.45 0.00 0.00 179.45 176.94 1o4x h THR 19 N -0.52 1.02 -0.36 1.00 2.02 -0.42 -1.53 112.91 114.13 1o4x h THR 19 Ca -0.05 -0.11 0.05 0.00 0.77 0.00 0.00 66.41 67.07 1o4x h THR 19 Cb 0.39 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.44 1o4x h THR 19 CO 0.08 0.06 0.07 0.15 0.37 0.00 0.00 175.52 176.25 1o4x h PHE 20 N 0.31 0.12 -0.48 3.16 3.04 -0.40 -0.90 116.94 121.80 1o4x h PHE 20 Ca 0.10 0.02 -0.08 0.00 3.98 0.00 0.00 57.97 62.00 1o4x h PHE 20 Cb 0.00 -0.00 -0.02 0.00 2.56 0.00 0.00 35.95 38.49 1o4x h PHE 20 CO -0.08 0.02 -0.02 -0.22 -2.02 0.00 0.00 178.31 175.99 1o4x h LYS 21 N 0.20 0.81 -0.27 1.11 3.64 -1.12 -0.81 116.57 120.13 1o4x h LYS 21 Ca 0.17 -0.23 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1o4x h LYS 21 Cb 0.19 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1o4x h LYS 21 CO -0.22 0.83 0.10 1.96 -2.27 0.00 0.00 179.45 179.85 1o4x h GLN 22 N 0.75 0.41 -0.53 1.90 4.20 -0.79 -1.92 115.11 119.13 1o4x h GLN 22 Ca 0.14 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.73 1o4x h GLN 22 Cb 0.49 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 1o4x h GLN 22 CO 0.02 0.45 0.17 -0.09 -0.67 0.00 0.00 178.83 178.72 1o4x h ARG 23 N 0.28 0.83 -0.19 1.46 9.65 -1.01 0.20 114.38 125.60 1o4x h ARG 23 Ca 0.09 -0.17 0.03 0.00 -1.10 0.00 0.00 59.98 58.82 1o4x h ARG 23 Cb 0.20 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.63 1o4x h ARG 23 CO -0.01 0.75 0.03 -0.09 2.80 0.00 0.00 179.97 183.46 1o4x h ARG 24 N 0.73 0.10 -0.40 0.20 2.43 -1.06 0.55 114.38 116.93 1o4x h ARG 24 Ca 0.17 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.24 1o4x h ARG 24 Cb 0.27 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1o4x h ARG 24 CO -0.01 0.06 -0.13 0.82 -1.51 0.00 0.00 179.97 179.21 1o4x h ILE 25 N 0.10 1.28 -0.85 1.20 2.04 -1.15 -1.36 117.51 118.77 1o4x h ILE 25 Ca 0.08 -1.24 0.07 0.00 1.00 0.00 0.00 64.86 64.77 1o4x h ILE 25 Cb 0.08 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.35 1o4x h ILE 25 CO -0.12 0.41 0.52 0.11 0.00 0.00 0.00 178.15 179.07 1o4x h LYS 26 N 0.59 0.91 0.00 2.37 1.57 -0.26 -1.15 116.57 120.61 1o4x h LYS 26 Ca 0.10 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1o4x h LYS 26 Cb 0.66 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1o4x h LYS 26 CO 0.05 0.60 0.00 1.28 -0.57 0.00 0.00 179.45 180.81 1o4x n LEU 27 N -4.64 0.00 0.00 2.94 4.32 0.15 -4.92 117.00 114.85 1o4x n LEU 27 Ca 0.12 0.25 0.00 0.00 -0.02 0.00 0.00 56.01 56.37 1o4x n LEU 27 Cb 0.19 -0.25 0.00 0.00 -1.62 0.00 0.00 43.42 41.74 1o4x n LEU 27 CO 0.30 -0.02 0.00 0.61 -1.22 0.00 0.00 177.39 177.06 1o4x n GLY 28 N 1.04 0.40 3.89 -0.72 0.00 -0.44 -5.06 105.19 104.30 1o4x n GLY 28 Ca 0.14 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.78 1o4x n GLY 28 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1o4x s PHE 29 N -2.00 3.56 0.66 1.61 0.08 -0.57 -5.03 117.98 116.30 1o4x s PHE 29 Ca 0.00 0.51 -0.05 0.00 0.12 0.00 0.00 56.93 57.51 1o4x s PHE 29 Cb 0.00 -1.95 0.05 0.00 -0.57 0.00 0.00 43.02 40.55 1o4x s PHE 29 CO 0.00 0.61 0.96 0.95 -0.10 0.00 0.00 175.22 177.64 1o4x s THR 30 N -1.33 2.56 0.29 0.64 -4.23 -1.26 -4.45 115.64 107.86 1o4x s THR 30 Ca 0.28 -0.28 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1o4x s THR 30 Cb -0.13 -3.08 0.16 0.00 1.34 0.00 0.00 72.50 70.79 1o4x s THR 30 CO 0.17 -0.08 1.83 -0.61 -0.54 0.00 0.00 174.62 175.40 1o4x h GLN 31 N -0.43 0.80 -0.46 3.99 4.15 -1.98 -2.45 115.11 118.73 1o4x h GLN 31 Ca -0.44 -0.16 -0.01 0.00 0.77 0.00 0.00 58.65 58.81 1o4x h GLN 31 Cb 1.30 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.85 1o4x h GLN 31 CO 0.59 0.72 0.24 0.78 -1.93 0.00 0.00 178.83 179.24 1o4x h GLY 32 N 0.95 0.69 0.36 2.39 0.00 -1.91 -1.71 103.07 103.84 1o4x h GLY 32 Ca 0.17 -0.32 0.07 0.00 0.00 0.00 0.00 47.33 47.25 1o4x h GLY 32 CO -0.00 0.31 0.02 -0.55 0.00 0.00 0.00 176.54 176.31 1o4x h ASP 33 N 0.60 -0.14 -0.57 0.19 3.32 -1.84 -0.25 116.42 117.74 1o4x h ASP 33 Ca 0.16 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 1o4x h ASP 33 Cb 0.08 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 1o4x h ASP 33 CO -0.02 -0.03 0.31 0.58 -1.72 0.00 0.00 179.24 178.36 1o4x h VAL 34 N 0.13 1.19 -0.94 -1.35 2.07 -1.17 -0.07 116.25 116.09 1o4x h VAL 34 Ca 0.20 -0.48 0.01 0.00 0.82 0.00 0.00 66.70 67.26 1o4x h VAL 34 Cb 0.29 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 1o4x h VAL 34 CO -0.33 0.20 0.63 1.23 0.02 0.00 0.00 177.57 179.32 1o4x h GLY 35 N 0.77 1.33 0.96 2.17 0.00 -0.53 -0.79 103.07 106.98 1o4x h GLY 35 Ca 0.20 -0.49 -0.09 0.00 0.00 0.00 0.00 47.33 46.95 1o4x h GLY 35 CO -0.03 0.48 -0.13 1.41 0.00 0.00 0.00 176.54 178.27 1o4x h LEU 36 N 1.28 0.73 -1.36 3.11 3.38 -0.72 -2.28 115.31 119.44 1o4x h LEU 36 Ca 0.35 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1o4x h LEU 36 Cb -0.14 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 1o4x h LEU 36 CO -0.08 0.95 0.26 0.00 0.09 0.00 0.00 178.44 179.67 1o4x h ALA 37 N 0.80 1.51 -0.56 1.53 0.00 -0.35 -1.37 119.26 120.81 1o4x h ALA 37 Ca 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1o4x h ALA 37 Cb 0.66 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1o4x h ALA 37 CO 0.04 0.40 0.31 0.52 0.00 0.00 0.00 179.25 180.53 1o4x h MET 38 N 0.71 0.77 0.00 0.00 2.86 -1.08 0.46 114.93 118.65 1o4x h MET 38 Ca 0.18 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.63 1o4x h MET 38 Cb 0.04 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 31.55 1o4x h MET 38 CO -0.03 0.56 -0.47 0.78 1.06 0.00 0.00 176.91 178.82 1o4x h GLY 39 N 0.84 0.35 1.06 8.32 0.00 -1.24 -1.86 103.07 110.53 1o4x h GLY 39 Ca 0.20 -0.62 -0.07 0.00 0.00 0.00 0.00 47.33 46.84 1o4x h GLY 39 CO -0.03 0.55 0.12 0.50 0.00 0.00 0.00 176.54 177.67 1o4x h LYS 40 N -0.27 1.07 0.03 4.80 1.57 -0.90 -1.80 116.57 121.06 1o4x h LYS 40 Ca -0.06 -0.28 -0.33 0.00 -1.87 0.00 0.00 60.65 58.11 1o4x h LYS 40 Cb 1.21 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 33.34 1o4x h LYS 40 CO 0.09 0.98 -1.92 1.28 -0.57 0.00 0.00 179.45 179.32 1o4x n LEU 41 N -4.25 1.23 -0.04 2.94 4.77 0.16 -4.58 117.00 117.22 1o4x n LEU 41 Ca 0.04 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1o4x n LEU 41 Cb 0.28 -0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1o4x n LEU 41 CO 0.43 0.54 0.33 -1.22 -1.33 0.00 0.00 177.39 176.13 1o4x n TYR 42 N -3.10 0.01 -0.87 -1.77 4.01 -0.74 -5.02 117.16 109.68 1o4x n TYR 42 Ca -0.24 -0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.36 1o4x n TYR 42 Cb 1.06 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 40.08 1o4x n TYR 42 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1o4x n GLY 43 N -0.08 0.58 2.69 2.72 0.00 -0.68 -4.96 105.19 105.46 1o4x n GLY 43 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1o4x n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o4x s ASN 44 N -2.03 1.73 0.62 1.61 4.22 -0.98 -4.93 114.94 115.18 1o4x s ASN 44 Ca 0.00 -1.59 -0.15 0.00 -2.14 0.00 0.00 52.86 48.97 1o4x s ASN 44 Cb 0.00 0.30 -0.02 0.00 1.28 0.00 0.00 41.25 42.81 1o4x s ASN 44 CO 0.00 -0.29 1.07 1.51 -2.04 0.00 0.00 177.10 177.35 1o4x s ASP 45 N 1.50 5.55 0.11 3.54 -4.77 -1.26 -3.47 116.67 117.87 1o4x s ASP 45 Ca 0.16 1.86 0.06 0.00 -3.30 0.00 0.00 52.55 51.33 1o4x s ASP 45 Cb -0.17 -2.54 -0.03 0.00 -1.09 0.00 0.00 42.92 39.09 1o4x s ASP 45 CO -0.08 -1.33 -0.15 -0.36 0.70 0.00 0.00 175.17 173.95 1o4x s PHE 46 N -2.46 1.43 0.67 2.11 0.08 -0.87 -4.83 117.98 114.11 1o4x s PHE 46 Ca 0.64 -0.50 -0.10 0.00 0.12 0.00 0.00 56.93 57.09 1o4x s PHE 46 Cb -0.17 -0.77 0.00 0.00 -0.57 0.00 0.00 43.02 41.51 1o4x s PHE 46 CO 0.40 0.14 1.05 -1.54 -0.10 0.00 0.00 175.22 175.17 1o4x s SER 47 N -2.16 5.62 0.26 1.36 1.04 -1.26 -4.09 113.70 114.47 1o4x s SER 47 Ca 0.06 1.12 -0.03 0.00 0.48 0.00 0.00 55.95 57.57 1o4x s SER 47 Cb -0.07 -2.00 0.37 0.00 0.10 0.00 0.00 66.02 64.42 1o4x s SER 47 CO 0.03 -1.20 1.89 -0.61 0.98 0.00 0.00 173.24 174.33 1o4x h GLN 48 N -0.51 1.17 -0.52 4.02 -0.00 -1.88 -2.10 115.11 115.30 1o4x h GLN 48 Ca -0.45 -0.07 0.06 0.00 -0.00 0.00 0.00 58.65 58.19 1o4x h GLN 48 Cb 1.24 -0.26 -0.05 0.00 0.00 0.00 0.00 27.48 28.40 1o4x h GLN 48 CO 0.63 0.77 0.21 1.15 0.00 0.00 0.00 178.83 181.60 1o4x h THR 49 N 1.21 0.86 -0.57 2.39 2.02 -1.94 0.16 112.91 117.04 1o4x h THR 49 Ca 0.42 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 67.35 1o4x h THR 49 Cb 0.10 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 1o4x h THR 49 CO -0.16 0.07 -0.08 0.74 0.37 0.00 0.00 175.52 176.47 1o4x h THR 50 N 0.41 1.27 -0.45 3.16 2.02 -1.78 0.07 112.91 117.61 1o4x h THR 50 Ca 0.24 -1.24 -0.04 0.00 0.77 0.00 0.00 66.41 66.14 1o4x h THR 50 Cb 0.23 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 1o4x h THR 50 CO -0.22 0.44 0.13 0.40 0.37 0.00 0.00 175.52 176.64 1o4x h ILE 51 N 0.94 1.23 -0.37 3.11 1.08 -0.96 0.60 117.51 123.14 1o4x h ILE 51 Ca 0.15 -0.76 0.02 0.00 -0.39 0.00 0.00 64.86 63.88 1o4x h ILE 51 Cb 0.65 0.87 -0.03 0.00 -3.07 0.00 0.00 36.82 35.24 1o4x h ILE 51 CO 0.05 0.27 0.21 0.28 -0.69 0.00 0.00 178.15 178.27 1o4x h SER 52 N 0.59 0.34 -0.60 1.72 0.02 -0.43 -1.09 113.55 114.10 1o4x h SER 52 Ca 0.14 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.04 1o4x h SER 52 Cb 0.28 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 1o4x h SER 52 CO -0.00 0.25 0.13 0.03 -1.14 0.00 0.00 176.83 176.09 1o4x h ARG 53 N 0.43 0.98 0.01 3.45 3.08 -0.74 -2.10 114.38 119.49 1o4x h ARG 53 Ca 0.15 -0.24 0.01 0.00 0.07 0.00 0.00 59.98 59.96 1o4x h ARG 53 Cb 0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1o4x h ARG 53 CO -0.07 0.90 -0.04 0.35 -1.07 0.00 0.00 179.97 180.04 1o4x h PHE 54 N 0.89 -0.10 0.00 3.04 3.57 -0.66 0.27 116.94 123.94 1o4x h PHE 54 Ca 0.19 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1o4x h PHE 54 Cb 0.38 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.16 1o4x h PHE 54 CO 0.03 -0.06 -0.05 0.93 -2.23 0.00 0.00 178.31 176.92 1o4x h GLU 55 N -0.07 0.00 -0.02 1.11 5.08 -0.95 -1.44 114.58 118.28 1o4x h GLU 55 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1o4x h GLU 55 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1o4x h GLU 55 CO -0.04 0.05 -0.15 0.00 -1.00 0.00 0.00 179.01 177.88 1o4x n ALA 56 N -2.28 2.82 -2.94 3.43 0.00 -0.81 -4.80 120.51 115.92 1o4x n ALA 56 Ca -0.02 -0.64 -0.20 0.00 0.00 0.00 0.00 53.44 52.57 1o4x n ALA 56 Cb 0.15 -0.86 0.01 0.00 0.00 0.00 0.00 19.45 18.76 1o4x n ALA 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1o4x n LEU 57 N 0.74 -1.90 -2.21 0.00 4.32 -0.15 -4.89 117.00 112.92 1o4x n LEU 57 Ca 0.13 -0.19 -0.18 0.00 -0.02 0.00 0.00 56.01 55.75 1o4x n LEU 57 Cb 0.53 -2.51 -0.13 0.00 -1.62 0.00 0.00 43.42 39.69 1o4x n LEU 57 CO 0.20 0.08 1.62 0.59 -1.22 0.00 0.00 177.39 178.66 1o4x n ASN 58 N -2.24 5.75 -3.98 -1.43 3.02 0.76 -4.80 115.26 112.34 1o4x n ASN 58 Ca -0.10 -2.76 -0.10 0.00 -0.03 0.00 0.00 54.58 51.59 1o4x n ASN 58 Cb 0.60 -1.35 -0.07 0.00 -0.61 0.00 0.00 39.78 38.35 1o4x n ASN 58 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1o4x s LEU 59 N -0.85 1.05 0.79 3.41 1.43 -1.26 -4.85 118.68 118.40 1o4x s LEU 59 Ca 0.64 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 1o4x s LEU 59 Cb 0.34 1.10 0.07 0.00 0.03 0.00 0.00 46.19 47.73 1o4x s LEU 59 CO -0.09 -0.88 1.09 -0.94 0.23 0.00 0.00 176.35 175.76 1o4x s SER 60 N -2.98 4.40 0.30 2.29 1.04 -1.26 -4.82 113.70 112.67 1o4x s SER 60 Ca 0.18 1.61 0.01 0.00 0.48 0.00 0.00 55.95 58.23 1o4x s SER 60 Cb 0.04 -2.34 0.47 0.00 0.10 0.00 0.00 66.02 64.28 1o4x s SER 60 CO 0.00 -2.07 1.83 0.15 0.98 0.00 0.00 173.24 174.14 1o4x h PHE 61 N -1.15 0.73 -0.55 5.02 3.57 -1.99 -1.17 116.94 121.40 1o4x h PHE 61 Ca -0.46 -0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.00 1o4x h PHE 61 Cb 1.25 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.73 1o4x h PHE 61 CO 0.53 0.66 0.32 -0.22 -2.23 0.00 0.00 178.31 177.36 1o4x h LYS 62 N 0.68 0.60 -0.11 1.11 3.64 -2.00 -1.52 116.57 118.97 1o4x h LYS 62 Ca 0.15 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.29 1o4x h LYS 62 Cb 0.33 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1o4x h LYS 62 CO 0.01 0.40 -0.71 -0.97 -2.27 0.00 0.00 179.45 175.90 1o4x h ASN 63 N 0.62 0.81 -0.87 4.20 -1.24 -1.83 -2.86 115.58 114.42 1o4x h ASN 63 Ca 0.23 -0.65 0.07 0.00 0.71 0.00 0.00 56.30 56.66 1o4x h ASN 63 Cb 0.07 -0.24 -0.06 0.00 0.73 0.00 0.00 38.32 38.82 1o4x h ASN 63 CO -0.12 1.34 0.57 0.24 -1.29 0.00 0.00 177.43 178.17 1o4x h MET 64 N 0.35 0.93 -0.44 6.67 2.86 -1.14 -1.46 114.93 122.70 1o4x h MET 64 Ca -0.06 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.44 1o4x h MET 64 Cb 1.35 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.79 1o4x h MET 64 CO 0.15 0.61 -0.08 0.00 1.06 0.00 0.00 176.91 178.65 1o4x h ALA 65 N 1.53 1.04 -0.02 6.32 0.00 -1.16 -0.68 119.26 126.29 1o4x h ALA 65 Ca 0.38 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1o4x h ALA 65 Cb 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1o4x h ALA 65 CO -0.15 0.59 -0.00 -0.22 0.00 0.00 0.00 179.25 179.47 1o4x h LYS 66 N 0.70 0.03 -0.05 0.00 3.64 -1.14 -3.30 116.57 116.45 1o4x h LYS 66 Ca 0.12 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1o4x h LYS 66 Cb 0.55 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 1o4x h LYS 66 CO 0.03 0.40 -0.35 -0.07 -2.27 0.00 0.00 179.45 177.19 1o4x h LEU 67 N -0.34 0.10 -0.21 5.20 3.38 -1.18 -3.35 115.31 118.92 1o4x h LEU 67 Ca 0.00 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 57.96 1o4x h LEU 67 Cb 0.39 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1o4x h LEU 67 CO 0.00 0.45 0.06 0.50 0.09 0.00 0.00 178.44 179.55 1o4x h LYS 68 N 0.09 0.15 -0.92 1.13 3.64 -1.19 -0.10 116.57 119.37 1o4x h LYS 68 Ca 0.01 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.47 1o4x h LYS 68 Cb 0.67 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.38 1o4x h LYS 68 CO 0.05 0.10 0.57 -1.35 -2.27 0.00 0.00 179.45 176.55 1o4x h PRO 69 N 0.16 0.96 -0.23 1.90 0.11 -1.74 0.65 132.00 133.81 1o4x h PRO 69 Ca 0.09 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 66.10 1o4x h PRO 69 Cb 0.07 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 30.96 1o4x h PRO 69 CO -0.11 0.63 -0.06 -0.07 -0.21 0.00 0.00 178.00 178.19 1o4x h LEU 70 N 0.99 0.44 -1.47 2.35 -0.00 -1.51 -2.75 115.31 113.36 1o4x h LEU 70 Ca 0.43 -0.37 -0.00 0.00 -0.00 0.00 0.00 57.88 57.94 1o4x h LEU 70 Cb 0.29 -0.12 -0.00 0.00 -0.00 0.00 0.00 40.66 40.83 1o4x h LEU 70 CO -0.21 0.71 -0.00 -0.07 -0.00 0.00 0.00 178.44 178.86 1o4x h LEU 71 N 0.17 0.00 -0.85 1.67 3.38 -0.68 -2.59 115.31 116.42 1o4x h LEU 71 Ca 0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 1o4x h LEU 71 Cb 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1o4x h LEU 71 CO 0.02 0.00 -0.54 -0.08 0.09 0.00 0.00 178.44 177.93 1o4x h GLU 72 N 0.00 0.09 -0.72 1.13 4.81 -0.57 -1.62 114.58 117.69 1o4x h GLU 72 Ca -0.00 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.11 1o4x h GLU 72 Cb 0.51 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 1o4x h GLU 72 CO 0.00 0.61 0.21 0.87 -0.73 0.00 0.00 179.01 179.97 1o4x h LYS 73 N 0.07 1.13 -0.23 1.92 1.57 -1.36 -1.64 116.57 118.03 1o4x h LYS 73 Ca -0.00 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 1o4x h LYS 73 Cb 0.98 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 1o4x h LYS 73 CO 0.08 0.97 0.11 2.35 -0.57 0.00 0.00 179.45 182.39 1o4x h TRP 74 N 1.07 0.34 0.03 -1.35 7.01 -1.49 -2.27 115.95 119.29 1o4x h TRP 74 Ca 0.23 -0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.23 1o4x h TRP 74 Cb 0.33 -0.10 -0.02 0.00 -2.10 0.00 0.00 29.16 27.27 1o4x h TRP 74 CO 0.03 0.33 -0.10 1.25 -2.79 0.00 0.00 178.44 177.17 1o4x h LEU 75 N 0.24 -0.27 0.18 0.65 5.85 -1.09 0.79 115.31 121.66 1o4x h LEU 75 Ca 0.08 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1o4x h LEU 75 Cb 0.13 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1o4x h LEU 75 CO -0.01 -0.14 -0.41 0.78 -0.34 0.00 0.00 178.44 178.32 1o4x h ASN 76 N -0.18 -1.19 -0.46 1.25 2.35 -1.24 -2.88 115.58 113.23 1o4x h ASN 76 Ca 0.03 0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 1o4x h ASN 76 Cb 0.21 0.44 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 1o4x h ASN 76 CO -0.08 -0.50 0.23 -0.78 -1.65 0.00 0.00 177.43 174.66 1o4x h ASP 77 N -0.68 0.62 0.26 5.81 1.82 -1.22 -2.00 116.42 121.02 1o4x h ASP 77 Ca 0.01 -0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.59 1o4x h ASP 77 Cb 0.68 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.54 1o4x h ASP 77 CO -0.20 0.54 0.00 0.00 -1.61 0.00 0.00 179.24 177.96 1o4x h ALA 78 N 1.56 1.00 -0.15 -0.78 0.00 -0.62 -3.51 119.26 116.75 1o4x h ALA 78 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1o4x h ALA 78 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1o4x h ALA 78 CO -0.02 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.62 1o4x n GLU 79 N -2.82 1.46 0.00 0.00 -0.58 -0.76 -5.10 120.64 112.84 1o4x n GLU 79 Ca -0.02 -0.70 0.00 0.00 -0.42 0.00 0.00 57.16 56.02 1o4x n GLU 79 Cb 0.12 -1.26 0.00 0.00 -0.57 0.00 0.00 31.44 29.73 1o4x n GLU 79 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1o4x n SER 110 N -0.01 0.00 -4.73 1.62 2.88 -1.26 -5.65 113.62 106.47 1o4x n SER 110 Ca 0.11 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.24 1o4x n SER 110 Cb 0.20 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.61 1o4x n SER 110 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1o4x s ILE 111 N 0.00 4.26 0.54 2.46 1.01 -1.26 -5.04 121.20 123.17 1o4x s ILE 111 Ca 0.00 1.96 -0.21 0.00 0.00 0.00 0.00 60.65 62.40 1o4x s ILE 111 Cb 0.00 -4.25 -0.05 0.00 0.01 0.00 0.00 42.46 38.17 1o4x s ILE 111 CO 0.00 0.34 1.23 -0.70 0.00 0.00 0.00 174.94 175.81 1o4x s GLU 112 N -0.31 3.29 0.26 2.79 2.56 -1.26 -4.87 118.70 121.16 1o4x s GLU 112 Ca 0.46 1.90 -0.03 0.00 0.00 0.00 0.00 54.97 57.31 1o4x s GLU 112 Cb -0.25 -2.17 0.45 0.00 2.00 0.00 0.00 34.13 34.16 1o4x s GLU 112 CO 0.32 -0.97 1.82 1.15 -0.56 0.00 0.00 175.26 177.01 1o4x h THR 113 N 1.36 0.90 -0.18 -1.70 2.02 -2.00 -1.54 112.91 111.77 1o4x h THR 113 Ca -0.50 -0.29 -0.19 0.00 0.77 0.00 0.00 66.41 66.20 1o4x h THR 113 Cb 1.28 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1o4x h THR 113 CO 0.57 0.15 -0.64 -0.55 0.37 0.00 0.00 175.52 175.42 1o4x h ASN 114 N 0.84 0.75 -0.72 4.18 -1.07 -2.01 -3.05 115.58 114.51 1o4x h ASN 114 Ca 0.43 -0.44 -0.03 0.00 0.07 0.00 0.00 56.30 56.32 1o4x h ASN 114 Cb 0.41 -0.22 -0.03 0.00 -2.07 0.00 0.00 38.32 36.40 1o4x h ASN 114 CO -0.26 1.20 0.33 0.40 0.07 0.00 0.00 177.43 179.17 1o4x h ILE 115 N 0.48 1.24 0.54 6.14 2.04 -1.79 -2.68 117.51 123.48 1o4x h ILE 115 Ca -0.01 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.12 1o4x h ILE 115 Cb 1.23 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 1o4x h ILE 115 CO 0.13 0.29 -0.47 0.03 0.00 0.00 0.00 178.15 178.13 1o4x h ARG 116 N 1.05 -0.96 -0.56 2.37 3.08 -1.23 0.15 114.38 118.28 1o4x h ARG 116 Ca 0.25 0.07 0.11 0.00 0.07 0.00 0.00 59.98 60.48 1o4x h ARG 116 Cb 0.14 0.22 -0.10 0.00 0.08 0.00 0.00 29.97 30.31 1o4x h ARG 116 CO -0.03 -0.64 -0.09 -0.39 -1.07 0.00 0.00 179.97 177.75 1o4x h VAL 117 N -1.00 0.48 -0.54 2.04 -1.51 -1.42 0.32 116.25 114.61 1o4x h VAL 117 Ca -0.06 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.39 1o4x h VAL 117 Cb 0.85 0.43 -0.03 0.00 -2.13 0.00 0.00 31.29 30.42 1o4x h VAL 117 CO -0.02 0.01 0.34 0.00 -1.23 0.00 0.00 177.57 176.66 1o4x h ALA 118 N 1.54 0.69 -0.60 5.19 0.00 -1.27 0.24 119.26 125.05 1o4x h ALA 118 Ca 0.28 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.18 1o4x h ALA 118 Cb 0.43 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1o4x h ALA 118 CO -0.54 0.16 0.32 -0.07 0.00 0.00 0.00 179.25 179.12 1o4x h LEU 119 N 0.73 0.47 -0.67 0.00 3.38 0.13 0.11 115.31 119.46 1o4x h LEU 119 Ca 0.20 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1o4x h LEU 119 Cb -0.04 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1o4x h LEU 119 CO -0.04 0.31 0.42 -0.33 0.09 0.00 0.00 178.44 178.89 1o4x h GLU 120 N 0.60 0.90 -0.24 1.13 4.39 0.41 0.45 114.58 122.23 1o4x h GLU 120 Ca 0.27 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.93 1o4x h GLU 120 Cb 0.17 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.59 1o4x h GLU 120 CO -0.17 0.62 0.03 0.87 -1.16 0.00 0.00 179.01 179.20 1o4x h LYS 121 N 0.91 0.12 0.10 2.33 6.56 0.08 -1.12 116.57 125.56 1o4x h LYS 121 Ca 0.24 -0.01 0.01 0.00 -1.06 0.00 0.00 60.65 59.84 1o4x h LYS 121 Cb -0.06 -0.03 -0.02 0.00 -0.57 0.00 0.00 32.23 31.56 1o4x h LYS 121 CO -0.05 0.08 -0.15 1.03 -2.06 0.00 0.00 179.45 178.30 1o4x h SER 122 N 0.12 -0.42 -0.94 0.86 0.87 -0.16 -1.67 113.55 112.22 1o4x h SER 122 Ca 0.11 0.05 0.24 0.00 -1.23 0.00 0.00 61.79 60.96 1o4x h SER 122 Cb 0.12 0.16 -0.13 0.00 -0.44 0.00 0.00 62.40 62.10 1o4x h SER 122 CO -0.16 -0.22 0.47 0.15 -0.53 0.00 0.00 176.83 176.54 1o4x h PHE 123 N -0.31 0.78 -0.55 2.24 3.57 -0.47 0.37 116.94 122.57 1o4x h PHE 123 Ca 0.02 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.60 1o4x h PHE 123 Cb 0.32 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 1o4x h PHE 123 CO -0.16 -0.05 0.29 -0.07 -2.23 0.00 0.00 178.31 176.10 1o4x h LEU 124 N 0.43 0.44 0.63 0.59 3.38 -0.30 -2.87 115.31 117.60 1o4x h LEU 124 Ca 0.61 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.57 1o4x h LEU 124 Cb 1.21 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.91 1o4x h LEU 124 CO -0.54 0.30 -0.30 -0.33 0.09 0.00 0.00 178.44 177.66 1o4x h GLU 125 N 0.57 -0.82 -4.11 1.13 5.08 0.14 -3.43 114.58 113.14 1o4x h GLU 125 Ca 0.24 0.06 -0.52 0.00 -1.00 0.00 0.00 59.36 58.13 1o4x h GLU 125 Cb 0.12 0.19 -0.37 0.00 0.50 0.00 0.00 28.75 29.18 1o4x h GLU 125 CO -0.15 -0.55 -0.79 1.21 -1.00 0.00 0.00 179.01 177.73 1o4x s ASN 126 N -4.30 2.30 0.22 1.42 3.84 0.02 -5.02 114.94 113.42 1o4x s ASN 126 Ca -0.12 -0.39 0.02 0.00 0.21 0.00 0.00 52.86 52.58 1o4x s ASN 126 Cb 0.01 -0.79 0.22 0.00 -0.55 0.00 0.00 41.25 40.13 1o4x s ASN 126 CO 0.37 -0.15 1.55 1.56 -2.79 0.00 0.00 177.10 177.64 1o4x h GLN 127 N 8.19 0.36 -2.42 0.43 4.20 -1.76 -3.36 115.11 120.74 1o4x h GLN 127 Ca -0.26 -0.23 -0.60 0.00 0.06 0.00 0.00 58.65 57.62 1o4x h GLN 127 Cb 1.12 0.03 -0.41 0.00 0.30 0.00 0.00 27.48 28.52 1o4x h GLN 127 CO 0.38 0.83 -0.70 1.63 -0.67 0.00 0.00 178.83 180.30 1o4x n LYS 128 N -3.92 1.85 -2.14 1.46 5.02 -1.26 -4.88 118.16 114.30 1o4x n LYS 128 Ca -0.03 -4.26 -0.38 0.00 -2.02 0.00 0.00 58.31 51.63 1o4x n LYS 128 Cb 0.60 -2.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 1o4x n LYS 128 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1o4x s PRO 129 N -1.78 3.65 0.85 1.97 0.04 -1.26 -5.02 135.00 133.45 1o4x s PRO 129 Ca 0.34 1.91 -0.12 0.00 0.04 0.00 0.00 61.00 63.17 1o4x s PRO 129 Cb 0.09 -2.41 0.10 0.00 0.04 0.00 0.00 34.50 32.32 1o4x s PRO 129 CO -0.09 -0.68 1.14 0.95 0.04 0.00 0.00 177.00 178.36 1o4x s THR 130 N -1.46 2.32 0.38 1.26 -4.23 -1.26 -4.65 115.64 108.01 1o4x s THR 130 Ca 0.65 0.11 0.15 0.00 -1.18 0.00 0.00 61.69 61.41 1o4x s THR 130 Cb -0.32 -2.93 0.36 0.00 1.34 0.00 0.00 72.50 70.95 1o4x s THR 130 CO 0.39 -0.14 1.81 -1.28 -0.54 0.00 0.00 174.62 174.86 1o4x h SER 131 N -1.25 0.52 0.09 3.99 0.87 -1.98 0.58 113.55 116.38 1o4x h SER 131 Ca -0.48 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1o4x h SER 131 Cb 1.31 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.25 1o4x h SER 131 CO 0.63 0.17 -0.05 -0.33 -0.53 0.00 0.00 176.83 176.72 1o4x h GLU 132 N 0.50 -0.12 -0.46 2.24 3.07 -1.99 -1.00 114.58 116.81 1o4x h GLU 132 Ca 0.54 0.01 0.09 0.00 -0.50 0.00 0.00 59.36 59.50 1o4x h GLU 132 Cb 1.21 0.03 -0.09 0.00 -0.84 0.00 0.00 28.75 29.06 1o4x h GLU 132 CO -0.27 0.37 -0.12 0.93 -1.40 0.00 0.00 179.01 178.53 1o4x h GLU 133 N -0.71 -0.01 -0.15 2.33 5.08 -1.50 -1.78 114.58 117.84 1o4x h GLU 133 Ca -0.01 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1o4x h GLU 133 Cb 0.55 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 1o4x h GLU 133 CO 0.02 -0.00 -0.13 0.82 -1.00 0.00 0.00 179.01 178.72 1o4x h ILE 134 N -0.01 0.64 -0.96 3.13 2.04 0.07 -1.42 117.51 121.00 1o4x h ILE 134 Ca 0.22 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.19 1o4x h ILE 134 Cb 0.35 0.64 -0.08 0.00 -0.74 0.00 0.00 36.82 36.99 1o4x h ILE 134 CO -0.48 0.00 0.59 0.74 0.00 0.00 0.00 178.15 179.00 1o4x h THR 135 N -0.14 0.95 0.85 -0.27 2.02 -0.69 -0.08 112.91 115.54 1o4x h THR 135 Ca 0.10 -0.33 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 1o4x h THR 135 Cb 0.29 -0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.58 1o4x h THR 135 CO -0.24 0.18 -0.50 0.24 0.37 0.00 0.00 175.52 175.57 1o4x h MET 136 N 0.98 -1.21 -1.06 6.66 2.86 -0.80 -2.33 114.93 120.02 1o4x h MET 136 Ca 0.46 0.08 0.28 0.00 -2.06 0.00 0.00 59.70 58.46 1o4x h MET 136 Cb 0.39 0.27 -0.09 0.00 0.06 0.00 0.00 31.60 32.24 1o4x h MET 136 CO -0.24 -0.80 0.69 0.82 1.06 0.00 0.00 176.91 178.44 1o4x h ILE 137 N -1.25 0.49 0.50 -1.22 2.04 -0.61 0.30 117.51 117.75 1o4x h ILE 137 Ca -0.11 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 1o4x h ILE 137 Cb 0.99 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1o4x h ILE 137 CO 0.13 0.06 -0.24 0.00 0.00 0.00 0.00 178.15 178.10 1o4x h ALA 138 N 1.60 -0.92 -0.59 1.87 0.00 -0.76 -1.34 119.26 119.12 1o4x h ALA 138 Ca 0.60 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 55.47 1o4x h ALA 138 Cb 1.64 0.26 -0.08 0.00 0.00 0.00 0.00 17.79 19.60 1o4x h ALA 138 CO -0.27 -0.87 0.12 0.22 0.00 0.00 0.00 179.25 178.45 1o4x h ASP 139 N -0.84 -0.01 -1.01 0.00 1.82 -0.86 1.54 116.42 117.07 1o4x h ASP 139 Ca -0.07 0.11 0.25 0.00 -0.39 0.00 0.00 57.03 56.93 1o4x h ASP 139 Cb 0.51 0.15 -0.12 0.00 0.68 0.00 0.00 39.33 40.55 1o4x h ASP 139 CO 0.11 0.01 0.61 0.06 -1.61 0.00 0.00 179.24 178.42 1o4x h GLN 140 N 0.25 0.55 -0.00 0.28 -0.00 -0.41 0.27 115.11 116.05 1o4x h GLN 140 Ca 0.31 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 58.92 1o4x h GLN 140 Cb 0.45 -0.12 0.00 0.00 -0.00 0.00 0.00 27.48 27.80 1o4x h GLN 140 CO -0.39 0.37 -0.75 1.28 -0.00 0.00 0.00 178.83 179.33 1o4x n LEU 141 N -4.85 1.07 -3.12 0.06 4.77 -0.14 -4.99 117.00 109.79 1o4x n LEU 141 Ca 0.27 -0.42 -0.05 0.00 -0.03 0.00 0.00 56.01 55.78 1o4x n LEU 141 Cb 0.75 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.80 1o4x n LEU 141 CO 0.18 0.24 0.25 -3.20 -1.33 0.00 0.00 177.39 173.52 1o4x n ASN 142 N -1.19 -7.44 -3.89 -1.43 4.05 0.51 -5.04 115.26 100.83 1o4x n ASN 142 Ca 0.06 -0.27 -0.11 0.00 0.45 0.00 0.00 54.58 54.71 1o4x n ASN 142 Cb 0.36 -5.26 -0.10 0.00 1.23 0.00 0.00 39.78 36.00 1o4x n ASN 142 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 177.26 174.17 1o4x s MET 143 N -3.44 0.42 0.43 1.20 -1.94 -0.46 -5.00 119.30 110.51 1o4x s MET 143 Ca 0.14 -0.39 -0.26 0.00 -1.71 0.00 0.00 55.69 53.47 1o4x s MET 143 Cb -0.02 0.17 -0.09 0.00 2.01 0.00 0.00 34.83 36.90 1o4x s MET 143 CO 0.75 -0.09 1.41 -2.00 -0.01 0.00 0.00 175.02 175.08 1o4x s GLU 144 N -1.27 3.79 0.11 2.03 2.12 -1.26 -4.24 118.70 119.97 1o4x s GLU 144 Ca -0.14 2.39 -0.27 0.00 0.36 0.00 0.00 54.97 57.31 1o4x s GLU 144 Cb -0.08 -2.71 -0.09 0.00 0.26 0.00 0.00 34.13 31.52 1o4x s GLU 144 CO 0.01 -0.72 1.64 1.57 -0.54 0.00 0.00 175.26 177.21 1o4x h LYS 145 N 2.47 -0.46 -1.00 4.30 5.09 -1.94 -2.78 116.57 122.25 1o4x h LYS 145 Ca -0.51 0.03 0.15 0.00 0.09 0.00 0.00 60.65 60.42 1o4x h LYS 145 Cb 1.26 0.10 -0.09 0.00 0.10 0.00 0.00 32.23 33.60 1o4x h LYS 145 CO 0.62 -0.30 0.62 1.49 -2.09 0.00 0.00 179.45 179.79 1o4x h GLU 146 N -0.47 0.85 -0.88 0.07 4.57 -1.99 0.40 114.58 117.14 1o4x h GLU 146 Ca 0.03 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 1o4x h GLU 146 Cb 0.50 -0.19 -0.04 0.00 -0.16 0.00 0.00 28.75 28.85 1o4x h GLU 146 CO -0.15 0.56 0.49 0.28 -1.18 0.00 0.00 179.01 179.02 1o4x h VAL 147 N 0.88 1.25 -0.12 0.32 2.07 -1.89 -0.42 116.25 118.34 1o4x h VAL 147 Ca 0.53 -0.62 -0.23 0.00 0.82 0.00 0.00 66.70 67.20 1o4x h VAL 147 Cb 0.68 0.06 0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1o4x h VAL 147 CO -0.31 0.28 -0.83 0.40 0.02 0.00 0.00 177.57 177.13 1o4x h ILE 148 N 1.23 1.28 -0.61 4.57 1.08 -0.88 -1.54 117.51 122.62 1o4x h ILE 148 Ca 0.31 -2.03 0.00 0.00 -0.39 0.00 0.00 64.86 62.76 1o4x h ILE 148 Cb 0.02 2.06 -0.03 0.00 -3.07 0.00 0.00 36.82 35.80 1o4x h ILE 148 CO -0.05 0.64 0.39 -0.09 -0.69 0.00 0.00 178.15 178.35 1o4x h ARG 149 N 0.51 0.82 -0.36 2.37 2.43 -0.66 -2.18 114.38 117.31 1o4x h ARG 149 Ca -0.07 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 58.94 1o4x h ARG 149 Cb 1.47 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.83 1o4x h ARG 149 CO 0.17 0.57 -0.17 0.28 -1.51 0.00 0.00 179.97 179.31 1o4x h VAL 150 N 0.83 1.26 -0.49 0.20 2.07 -1.04 -1.90 116.25 117.18 1o4x h VAL 150 Ca 0.22 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 1o4x h VAL 150 Cb -0.05 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1o4x h VAL 150 CO -0.04 0.40 0.26 -0.25 0.02 0.00 0.00 177.57 177.96 1o4x h TRP 151 N 0.60 0.69 -0.30 1.57 2.91 -0.68 0.14 115.95 120.87 1o4x h TRP 151 Ca 0.10 -0.02 -0.12 0.00 1.13 0.00 0.00 58.89 59.97 1o4x h TRP 151 Cb 0.63 -0.22 -0.01 0.00 -0.51 0.00 0.00 29.16 29.05 1o4x h TRP 151 CO 0.03 0.52 -0.31 0.74 -1.03 0.00 0.00 178.44 178.39 1o4x h PHE 152 N 0.65 0.74 -0.35 2.65 0.04 -1.32 -0.13 116.94 119.22 1o4x h PHE 152 Ca 0.17 -0.19 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 1o4x h PHE 152 Cb 0.07 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.04 1o4x h PHE 152 CO -0.01 0.88 0.17 0.00 -0.60 0.00 0.00 178.31 178.74 1o4x h ASN 154 N 0.43 0.71 -0.39 0.00 2.35 -0.59 -2.04 115.58 116.04 1o4x h ASN 154 Ca 0.12 -0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.62 1o4x h ASN 154 Cb 0.12 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1o4x h ASN 154 CO -0.01 0.70 -0.24 -0.09 -1.65 0.00 0.00 177.43 176.14 1o4x h ARG 155 N 0.74 0.91 -0.40 0.81 9.65 -0.79 -0.90 114.38 124.39 1o4x h ARG 155 Ca 0.17 -0.39 -0.09 0.00 -1.10 0.00 0.00 59.98 58.56 1o4x h ARG 155 Cb 0.28 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.81 1o4x h ARG 155 CO -0.00 1.04 -0.11 0.00 2.80 0.00 0.00 179.97 183.70 1o4x h ARG 156 N 0.78 0.71 -0.30 0.20 3.08 -1.02 -2.04 114.38 115.79 1o4x h ARG 156 Ca 0.10 -0.23 -0.04 0.00 0.07 0.00 0.00 59.98 59.87 1o4x h ARG 156 Cb 0.80 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1o4x h ARG 156 CO 0.07 0.80 0.02 1.96 -1.07 0.00 0.00 179.97 181.75 1o4x h GLN 157 N 0.65 0.52 -0.40 0.04 4.20 -1.10 -2.78 115.11 116.23 1o4x h GLN 157 Ca 0.11 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 1o4x h GLN 157 Cb 0.57 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 1o4x h GLN 157 CO 0.04 0.65 0.14 -0.22 -0.67 0.00 0.00 178.83 178.76 1o4x h LYS 158 N 0.32 0.58 0.00 1.46 3.64 -0.98 -1.55 116.57 120.04 1o4x h LYS 158 Ca 0.09 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1o4x h LYS 158 Cb 0.40 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.11 1o4x h LYS 158 CO 0.01 0.50 -0.20 1.49 -2.27 0.00 0.00 179.45 178.99 1o4x h GLU 159 N 0.57 0.00 -0.00 1.90 4.57 -1.22 -2.27 114.58 118.14 1o4x h GLU 159 Ca 0.14 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.32 1o4x h GLU 159 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1o4x h GLU 159 CO -0.01 0.20 -0.17 1.63 -1.18 0.00 0.00 179.01 179.47 1o4x n LYS 160 N -3.56 0.58 -1.92 1.92 5.02 -0.59 -4.90 118.16 114.71 1o4x n LYS 160 Ca -0.01 -0.24 -0.33 0.00 -2.02 0.00 0.00 58.31 55.71 1o4x n LYS 160 Cb 0.34 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.89 1o4x n LYS 160 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1o4x s ARG 161 N -2.58 3.02 0.02 1.97 0.52 -0.85 -4.97 118.95 116.08 1o4x s ARG 161 Ca 0.25 1.39 -0.26 0.00 -0.52 0.00 0.00 55.73 56.59 1o4x s ARG 161 Cb 0.19 -1.98 -0.17 0.00 0.52 0.00 0.00 34.95 33.52 1o4x s ARG 161 CO 0.51 -1.08 1.36 0.82 0.02 0.00 0.00 175.30 176.94 1o4x h ILE 162 N 0.35 0.75 -0.00 1.52 2.04 -1.90 -3.51 117.51 116.75 1o4x h ILE 162 Ca -0.47 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1o4x h ILE 162 Cb 1.24 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.34 1o4x h ILE 162 CO 0.55 0.10 0.00 0.59 0.00 0.00 0.00 178.15 179.39