#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uj4 h PRO 4 N 0.00 0.86 0.00 2.89 0.11 -2.09 -3.01 132.00 130.76 1uj4 h PRO 4 Ca 0.00 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1uj4 h PRO 4 Cb 0.00 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 30.92 1uj4 h PRO 4 CO 0.00 0.57 0.00 -0.07 -0.21 0.00 0.00 178.00 178.29 1uj4 h LEU 5 N 0.89 0.00 -0.83 2.35 3.38 -2.03 -3.34 115.31 115.72 1uj4 h LEU 5 Ca 0.53 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.65 1uj4 h LEU 5 Cb 0.67 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.33 1uj4 h LEU 5 CO -0.31 0.00 0.42 -0.33 0.09 0.00 0.00 178.44 178.30 1uj4 h GLU 6 N 0.00 0.57 -0.91 1.13 4.39 -1.97 -1.24 114.58 116.56 1uj4 h GLU 6 Ca 0.00 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.71 1uj4 h GLU 6 Cb 0.64 -0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 29.11 1uj4 h GLU 6 CO 0.00 0.38 0.59 0.66 -1.16 0.00 0.00 179.01 179.48 1uj4 h SER 7 N 0.59 0.96 -0.52 1.42 4.64 -1.81 -1.15 113.55 117.67 1uj4 h SER 7 Ca 0.46 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.68 1uj4 h SER 7 Cb 0.66 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 1uj4 h SER 7 CO -0.37 0.64 -0.03 1.88 -0.87 0.00 0.00 176.83 178.08 1uj4 h TYR 8 N 1.10 1.03 -0.68 4.77 0.99 -1.49 -1.64 116.97 121.05 1uj4 h TYR 8 Ca 0.37 -0.19 0.01 0.00 2.00 0.00 0.00 58.73 60.92 1uj4 h TYR 8 Cb 0.08 -0.26 -0.03 0.00 1.00 0.00 0.00 36.73 37.51 1uj4 h TYR 8 CO -0.00 0.96 0.45 0.87 -0.00 0.00 0.00 178.16 180.43 1uj4 h LYS 9 N 0.81 0.88 -0.58 4.88 1.57 -0.81 -1.25 116.57 122.08 1uj4 h LYS 9 Ca 0.14 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.78 1uj4 h LYS 9 Cb 0.56 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 1uj4 h LYS 9 CO 0.03 0.59 -0.02 -0.22 -0.57 0.00 0.00 179.45 179.26 1uj4 h LYS 10 N 0.91 1.03 -0.21 3.15 3.64 -1.06 -1.52 116.57 122.52 1uj4 h LYS 10 Ca 0.25 -0.34 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1uj4 h LYS 10 Cb -0.10 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 1uj4 h LYS 10 CO -0.06 1.03 0.10 0.93 -2.27 0.00 0.00 179.45 179.18 1uj4 h GLU 11 N 0.92 0.30 -0.37 1.90 5.08 -0.95 -0.09 114.58 121.37 1uj4 h GLU 11 Ca 0.16 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1uj4 h GLU 11 Cb 0.57 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1uj4 h GLU 11 CO 0.03 0.32 0.24 0.00 -1.00 0.00 0.00 179.01 178.60 1uj4 h ALA 12 N 0.97 0.47 0.29 3.43 0.00 -1.16 -1.28 119.26 121.98 1uj4 h ALA 12 Ca 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1uj4 h ALA 12 Cb 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1uj4 h ALA 12 CO -0.01 -0.08 -0.22 0.00 0.00 0.00 0.00 179.25 178.94 1uj4 h ALA 13 N 1.14 -0.50 -0.13 0.00 0.00 -1.07 -2.53 119.26 116.17 1uj4 h ALA 13 Ca 0.14 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.99 1uj4 h ALA 13 Cb -0.04 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1uj4 h ALA 13 CO -0.04 -0.80 0.09 0.45 0.00 0.00 0.00 179.25 178.95 1uj4 h HIS 14 N -0.52 0.05 -0.53 0.00 -0.00 -0.85 -1.73 115.15 111.58 1uj4 h HIS 14 Ca -0.02 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.27 1uj4 h HIS 14 Cb 0.45 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.82 1uj4 h HIS 14 CO -0.12 0.03 -0.01 0.00 -0.00 0.00 0.00 177.93 177.83 1uj4 h ALA 15 N 1.93 0.98 -0.03 2.45 0.00 -0.82 -2.87 119.26 120.90 1uj4 h ALA 15 Ca 0.06 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1uj4 h ALA 15 Cb 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1uj4 h ALA 15 CO -0.01 0.62 -0.40 0.00 0.00 0.00 0.00 179.25 179.46 1uj4 h ALA 16 N 1.14 1.27 0.00 0.00 0.00 -1.02 -2.60 119.26 118.05 1uj4 h ALA 16 Ca 0.16 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1uj4 h ALA 16 Cb 0.51 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1uj4 h ALA 16 CO 0.03 0.53 -0.01 0.82 0.00 0.00 0.00 179.25 180.62 1uj4 h ILE 17 N 0.06 0.08 0.00 0.00 1.08 -1.33 -1.11 117.51 116.29 1uj4 h ILE 17 Ca 0.00 -0.19 -0.03 0.00 -0.39 0.00 0.00 64.86 64.26 1uj4 h ILE 17 Cb 0.74 1.17 -0.00 0.00 -3.07 0.00 0.00 36.82 35.66 1uj4 h ILE 17 CO 0.06 0.01 -0.12 0.00 -0.69 0.00 0.00 178.15 177.41 1uj4 h ALA 18 N 1.99 1.22 -0.00 1.87 0.00 -1.53 -2.27 119.26 120.54 1uj4 h ALA 18 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1uj4 h ALA 18 Cb 0.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1uj4 h ALA 18 CO 0.00 0.15 -0.12 0.66 0.00 0.00 0.00 179.25 179.94 1uj4 n TYR 19 N -3.56 0.00 -2.61 0.00 4.02 -0.42 -4.86 117.16 109.73 1uj4 n TYR 19 Ca -0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.47 1uj4 n TYR 19 Cb 0.26 -0.36 -0.04 0.00 -0.02 0.00 0.00 39.34 39.18 1uj4 n TYR 19 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1uj4 s VAL 20 N -2.84 4.04 0.23 -0.72 1.01 -0.86 -5.05 120.40 116.21 1uj4 s VAL 20 Ca 0.18 1.80 0.11 0.00 0.00 0.00 0.00 61.98 64.08 1uj4 s VAL 20 Cb 0.19 -4.15 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1uj4 s VAL 20 CO 0.54 0.33 -0.22 -1.10 0.00 0.00 0.00 175.10 174.66 1uj4 s GLN 21 N -0.48 1.57 0.42 2.72 -0.21 -1.26 -5.09 119.66 117.34 1uj4 s GLN 21 Ca 0.47 -1.63 -0.25 0.00 0.02 0.00 0.00 55.36 53.97 1uj4 s GLN 21 Cb -0.27 -1.76 -0.10 0.00 1.00 0.00 0.00 33.01 31.88 1uj4 s GLN 21 CO 0.34 0.35 1.13 -0.25 -2.12 0.00 0.00 175.29 174.74 1uj4 n ASP 22 N -0.16 1.83 -2.07 5.90 8.00 -1.26 -4.85 116.55 123.93 1uj4 n ASP 22 Ca -0.09 1.07 -0.02 0.00 0.71 0.00 0.00 54.79 56.46 1uj4 n ASP 22 Cb 0.58 -1.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.26 1uj4 n ASP 22 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1uj4 n GLY 23 N 1.02 -0.84 2.71 0.44 0.00 -0.17 -4.94 105.19 103.41 1uj4 n GLY 23 Ca 0.08 0.30 -0.19 0.00 0.00 0.00 0.00 46.02 46.21 1uj4 n GLY 23 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uj4 s VAL 25 N -2.17 -0.15 -0.12 1.61 1.01 -1.26 -4.80 120.40 114.51 1uj4 s VAL 25 Ca 0.06 0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.45 1uj4 s VAL 25 Cb -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 36.38 36.15 1uj4 s VAL 25 CO 0.31 0.16 -0.18 -0.69 0.00 0.00 0.00 175.10 174.69 1uj4 s VAL 26 N 2.20 2.63 -0.08 2.92 1.01 0.32 -1.12 120.40 128.29 1uj4 s VAL 26 Ca 0.04 -0.81 -0.28 0.00 0.00 0.00 0.00 61.98 60.93 1uj4 s VAL 26 Cb -0.12 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.17 1uj4 s VAL 26 CO -0.04 0.54 0.94 -0.83 0.00 0.00 0.00 175.10 175.71 1uj4 s GLY 27 N 0.36 2.51 -0.35 4.51 0.00 0.12 -0.37 107.32 114.11 1uj4 s GLY 27 Ca -0.14 0.34 -0.13 0.00 0.00 0.00 0.00 44.72 44.80 1uj4 s GLY 27 CO 0.07 1.73 0.23 1.08 0.00 0.00 0.00 173.10 176.21 1uj4 s LEU 28 N 1.60 4.56 1.39 0.66 1.43 0.03 -1.56 118.68 126.79 1uj4 s LEU 28 Ca 0.47 -0.55 -0.21 0.00 -1.03 0.00 0.00 54.13 52.80 1uj4 s LEU 28 Cb -0.19 -2.11 0.35 0.00 0.03 0.00 0.00 46.19 44.28 1uj4 s LEU 28 CO 0.20 -0.27 0.95 -0.83 0.23 0.00 0.00 176.35 176.62 1uj4 s GLY 29 N 1.69 1.43 0.05 -3.19 0.00 0.10 -2.14 107.32 105.26 1uj4 s GLY 29 Ca 0.05 -0.73 0.07 0.00 0.00 0.00 0.00 44.72 44.11 1uj4 s GLY 29 CO 0.09 0.24 -0.18 -1.59 0.00 0.00 0.00 173.10 171.66 1uj4 s THR 30 N -2.32 1.48 0.00 0.90 2.01 -1.26 -4.70 115.64 111.75 1uj4 s THR 30 Ca 0.69 -1.17 0.00 0.00 0.31 0.00 0.00 61.69 61.51 1uj4 s THR 30 Cb -0.15 -1.31 0.00 0.00 0.01 0.00 0.00 72.50 71.05 1uj4 s THR 30 CO 0.59 0.10 0.00 0.61 -0.69 0.00 0.00 174.62 175.23 1uj4 n GLY 31 N 1.77 3.07 0.33 4.40 0.00 -1.26 -4.49 105.19 109.01 1uj4 n GLY 31 Ca -0.18 -2.02 0.04 0.00 0.00 0.00 0.00 46.02 43.87 1uj4 n GLY 31 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1uj4 h SER 32 N 0.00 0.79 -0.16 1.61 4.64 -1.99 0.11 113.55 118.56 1uj4 h SER 32 Ca 0.00 0.04 -0.10 0.00 -0.47 0.00 0.00 61.79 61.26 1uj4 h SER 32 Cb 0.00 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1uj4 h SER 32 CO 0.00 0.45 -0.31 0.74 -0.87 0.00 0.00 176.83 176.84 1uj4 h THR 33 N 0.90 1.35 0.00 2.95 2.02 -1.92 -3.02 112.91 115.19 1uj4 h THR 33 Ca 0.44 -1.56 -0.04 0.00 0.77 0.00 0.00 66.41 66.02 1uj4 h THR 33 Cb 0.39 1.96 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 1uj4 h THR 33 CO -0.25 0.47 -0.17 0.00 0.37 0.00 0.00 175.52 175.94 1uj4 h ALA 34 N 0.57 1.58 -1.00 6.16 0.00 -1.72 -2.46 119.26 122.38 1uj4 h ALA 34 Ca 0.01 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.78 1uj4 h ALA 34 Cb 0.90 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.61 1uj4 h ALA 34 CO 0.07 0.21 0.67 -0.09 0.00 0.00 0.00 179.25 180.10 1uj4 h ARG 35 N 0.00 1.32 -0.36 0.00 2.43 -0.65 -0.25 114.38 116.88 1uj4 h ARG 35 Ca -0.00 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 1uj4 h ARG 35 Cb 0.32 -0.30 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 1uj4 h ARG 35 CO 0.02 0.87 -0.05 1.88 -1.51 0.00 0.00 179.97 181.18 1uj4 h TYR 36 N 1.36 0.62 -0.21 2.20 -1.99 -1.45 -0.74 116.97 116.76 1uj4 h TYR 36 Ca 0.37 -0.08 -0.03 0.00 2.00 0.00 0.00 58.73 60.99 1uj4 h TYR 36 Cb -0.16 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 38.39 1uj4 h TYR 36 CO -0.00 0.63 0.02 0.00 -0.00 0.00 0.00 178.16 178.80 1uj4 h ALA 37 N 1.40 0.28 -0.89 3.88 0.00 -1.22 -0.01 119.26 122.70 1uj4 h ALA 37 Ca 0.11 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1uj4 h ALA 37 Cb 0.43 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1uj4 h ALA 37 CO 0.02 -0.03 0.59 0.28 0.00 0.00 0.00 179.25 180.11 1uj4 h VAL 38 N 0.13 1.22 -0.33 0.00 2.07 -0.79 0.34 116.25 118.88 1uj4 h VAL 38 Ca 0.06 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 1uj4 h VAL 38 Cb 0.36 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 1uj4 h VAL 38 CO 0.01 0.22 0.05 -0.07 0.02 0.00 0.00 177.57 177.80 1uj4 h LEU 39 N 1.20 0.52 -0.45 2.57 3.38 -0.93 -1.55 115.31 120.05 1uj4 h LEU 39 Ca 0.33 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1uj4 h LEU 39 Cb -0.12 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1uj4 h LEU 39 CO -0.08 0.65 -0.14 -0.08 0.09 0.00 0.00 178.44 178.89 1uj4 h GLU 40 N 0.37 0.88 -0.22 1.13 4.57 -0.61 -1.60 114.58 119.11 1uj4 h GLU 40 Ca 0.10 -0.35 -0.00 0.00 -1.18 0.00 0.00 59.36 57.93 1uj4 h GLU 40 Cb 0.35 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 1uj4 h GLU 40 CO 0.01 1.00 0.13 1.25 -1.18 0.00 0.00 179.01 180.21 1uj4 h LEU 41 N 0.72 0.26 -0.84 1.64 5.85 -0.92 -1.59 115.31 120.43 1uj4 h LEU 41 Ca 0.11 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.84 1uj4 h LEU 41 Cb 0.69 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 1uj4 h LEU 41 CO 0.05 0.24 0.51 0.00 -0.34 0.00 0.00 178.44 178.90 1uj4 h ALA 42 N 1.04 1.15 0.03 1.25 0.00 -1.16 -0.59 119.26 120.97 1uj4 h ALA 42 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1uj4 h ALA 42 Cb 0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1uj4 h ALA 42 CO -0.01 0.24 -0.02 -0.09 0.00 0.00 0.00 179.25 179.36 1uj4 h ARG 43 N 0.92 -0.06 -0.15 0.00 2.43 -0.75 0.15 114.38 116.93 1uj4 h ARG 43 Ca 0.37 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.53 1uj4 h ARG 43 Cb 0.19 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1uj4 h ARG 43 CO -0.18 -0.04 0.01 0.00 -1.51 0.00 0.00 179.97 178.25 1uj4 h ARG 44 N -0.06 0.21 -0.16 0.20 3.08 -0.75 0.23 114.38 117.12 1uj4 h ARG 44 Ca -0.00 -0.03 -0.22 0.00 0.07 0.00 0.00 59.98 59.80 1uj4 h ARG 44 Cb 0.05 -0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.07 1uj4 h ARG 44 CO -0.00 0.22 -0.77 -0.07 -1.07 0.00 0.00 179.97 178.28 1uj4 h LEU 45 N 0.21 0.95 -0.73 3.04 3.38 -0.56 0.42 115.31 122.02 1uj4 h LEU 45 Ca 0.05 -0.62 -0.13 0.00 0.09 0.00 0.00 57.88 57.28 1uj4 h LEU 45 Cb 0.13 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1uj4 h LEU 45 CO 0.00 1.42 -0.40 0.03 0.09 0.00 0.00 178.44 179.58 1uj4 h ARG 46 N 0.55 0.50 -0.01 1.13 3.08 0.17 -2.80 114.38 117.01 1uj4 h ARG 46 Ca -0.05 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1uj4 h ARG 46 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.45 1uj4 h ARG 46 CO 0.16 0.82 -0.10 0.39 -1.07 0.00 0.00 179.97 180.16 1uj4 n GLU 47 N -4.03 1.01 -1.19 0.04 -0.58 0.73 -4.92 120.64 111.70 1uj4 n GLU 47 Ca -0.02 -0.45 -0.06 0.00 -0.42 0.00 0.00 57.16 56.21 1uj4 n GLU 47 Cb 0.50 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.86 1uj4 n GLU 47 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uj4 n GLY 48 N 1.23 0.87 0.24 0.62 0.00 -0.52 -4.87 105.19 102.78 1uj4 n GLY 48 Ca 0.16 -0.65 0.14 0.00 0.00 0.00 0.00 46.02 45.67 1uj4 n GLY 48 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1uj4 h GLU 49 N 0.07 0.00 -4.64 1.61 5.08 -0.50 -3.44 114.58 112.76 1uj4 h GLU 49 Ca -0.13 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.99 1uj4 h GLU 49 Cb 0.46 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.56 1uj4 h GLU 49 CO 0.19 0.06 -0.67 -0.51 -1.00 0.00 0.00 179.01 177.09 1uj4 s LEU 50 N -6.29 2.18 0.10 1.33 1.43 -0.89 -5.00 118.68 111.54 1uj4 s LEU 50 Ca 0.03 -1.12 -0.22 0.00 -1.03 0.00 0.00 54.13 51.79 1uj4 s LEU 50 Cb 0.08 0.03 0.06 0.00 0.03 0.00 0.00 46.19 46.39 1uj4 s LEU 50 CO 0.61 -0.58 0.54 -1.59 0.23 0.00 0.00 176.35 175.56 1uj4 s LYS 51 N -3.92 1.14 0.00 1.70 -2.85 -1.26 -4.48 119.74 110.08 1uj4 s LYS 51 Ca 0.19 -0.40 0.00 0.00 -1.00 0.00 0.00 55.97 54.76 1uj4 s LYS 51 Cb 0.06 0.52 0.00 0.00 -2.06 0.00 0.00 37.83 36.35 1uj4 s LYS 51 CO -0.00 -0.46 0.00 0.41 0.10 0.00 0.00 175.35 175.40 1uj4 n GLY 52 N -0.01 0.24 3.75 0.59 0.00 -1.26 -1.00 105.19 107.49 1uj4 n GLY 52 Ca -0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 1uj4 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uj4 s VAL 53 N -1.49 4.78 0.10 1.61 1.01 -1.26 -3.45 120.40 121.70 1uj4 s VAL 53 Ca 0.00 1.48 0.08 0.00 0.00 0.00 0.00 61.98 63.54 1uj4 s VAL 53 Cb 0.00 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 1uj4 s VAL 53 CO 0.00 0.40 -0.19 0.68 0.00 0.00 0.00 175.10 175.98 1uj4 s VAL 54 N -0.18 1.60 0.31 2.92 -7.23 -1.26 -4.48 120.40 112.07 1uj4 s VAL 54 Ca 0.35 -1.53 0.10 0.00 -1.81 0.00 0.00 61.98 59.10 1uj4 s VAL 54 Cb -0.20 -1.48 -0.06 0.00 0.56 0.00 0.00 36.38 35.20 1uj4 s VAL 54 CO 0.21 -0.12 -0.13 -0.83 -0.31 0.00 0.00 175.10 173.92 1uj4 s GLY 55 N -1.94 2.03 -0.24 2.32 0.00 -0.27 -0.52 107.32 108.71 1uj4 s GLY 55 Ca 0.05 -1.98 0.02 0.00 0.00 0.00 0.00 44.72 42.81 1uj4 s GLY 55 CO 0.04 -1.99 -0.11 0.14 0.00 0.00 0.00 173.10 171.18 1uj4 s VAL 56 N -2.61 1.99 0.11 1.40 1.01 0.50 -1.61 120.40 121.20 1uj4 s VAL 56 Ca 0.31 -1.39 -0.30 0.00 0.00 0.00 0.00 61.98 60.59 1uj4 s VAL 56 Cb -0.00 -2.08 -0.07 0.00 0.00 0.00 0.00 36.38 34.23 1uj4 s VAL 56 CO 0.15 0.07 1.22 -2.16 0.00 0.00 0.00 175.10 174.38 1uj4 s PRO 57 N 1.21 4.45 0.00 2.72 0.04 -1.26 -0.79 135.00 141.37 1uj4 s PRO 57 Ca -0.05 1.84 0.14 0.00 0.04 0.00 0.00 61.00 62.97 1uj4 s PRO 57 Cb -0.18 -3.30 0.53 0.00 0.04 0.00 0.00 34.50 31.59 1uj4 s PRO 57 CO -0.07 -0.21 1.39 0.25 0.04 0.00 0.00 177.00 178.41 1uj4 n THR 58 N 3.38 0.28 -3.52 1.26 -2.24 -0.91 -4.87 114.28 107.65 1uj4 n THR 58 Ca 0.07 -0.33 -0.10 0.00 -2.27 0.00 0.00 64.05 61.42 1uj4 n THR 58 Cb 0.45 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.87 1uj4 n THR 58 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1uj4 s SER 59 N -1.27 -0.40 0.37 3.42 1.04 -1.26 -4.09 113.70 111.50 1uj4 s SER 59 Ca 0.25 0.15 0.10 0.00 0.48 0.00 0.00 55.95 56.94 1uj4 s SER 59 Cb 0.13 0.39 0.73 0.00 0.10 0.00 0.00 66.02 67.37 1uj4 s SER 59 CO 0.19 -0.57 1.86 0.03 0.98 0.00 0.00 173.24 175.73 1uj4 h ARG 60 N 2.21 0.15 -0.70 4.02 3.08 -1.99 -0.81 114.38 120.35 1uj4 h ARG 60 Ca -0.22 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.73 1uj4 h ARG 60 Cb 1.22 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 31.22 1uj4 h ARG 60 CO 0.32 0.40 0.24 0.00 -1.07 0.00 0.00 179.97 179.86 1uj4 h ALA 61 N 1.61 0.91 -0.14 0.04 0.00 -1.99 -1.29 119.26 118.40 1uj4 h ALA 61 Ca 0.02 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1uj4 h ALA 61 Cb 0.53 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1uj4 h ALA 61 CO 0.04 0.57 -0.59 1.15 0.00 0.00 0.00 179.25 180.42 1uj4 h THR 62 N 1.01 1.35 -0.41 0.00 2.02 -1.77 -2.28 112.91 112.83 1uj4 h THR 62 Ca 0.23 -1.88 0.02 0.00 0.77 0.00 0.00 66.41 65.54 1uj4 h THR 62 Cb 0.27 1.88 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 1uj4 h THR 62 CO -0.01 0.57 0.23 -0.08 0.37 0.00 0.00 175.52 176.60 1uj4 h GLU 63 N 0.33 0.45 -0.40 6.66 4.81 -0.64 0.14 114.58 125.94 1uj4 h GLU 63 Ca -0.00 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.10 1uj4 h GLU 63 Cb 1.12 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 1uj4 h GLU 63 CO 0.10 0.30 -0.15 0.93 -0.73 0.00 0.00 179.01 179.47 1uj4 h GLU 64 N 0.47 0.81 0.02 1.92 5.08 -1.19 -1.60 114.58 120.09 1uj4 h GLU 64 Ca 0.16 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1uj4 h GLU 64 Cb 0.02 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1uj4 h GLU 64 CO -0.08 0.96 -0.01 1.25 -1.00 0.00 0.00 179.01 180.13 1uj4 h LEU 65 N 0.62 -0.03 -0.24 1.33 5.85 -1.15 -1.14 115.31 120.55 1uj4 h LEU 65 Ca 0.10 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.70 1uj4 h LEU 65 Cb 0.69 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.68 1uj4 h LEU 65 CO 0.05 0.15 -0.07 0.00 -0.34 0.00 0.00 178.44 178.23 1uj4 h ALA 66 N 0.78 0.15 -0.35 1.25 0.00 -0.70 -0.20 119.26 120.18 1uj4 h ALA 66 Ca -0.00 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1uj4 h ALA 66 Cb 0.19 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1uj4 h ALA 66 CO 0.01 -0.48 0.17 0.87 0.00 0.00 0.00 179.25 179.81 1uj4 h LYS 67 N -0.01 0.51 -0.44 0.00 1.57 -1.25 -0.72 116.57 116.22 1uj4 h LYS 67 Ca 0.12 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 58.87 1uj4 h LYS 67 Cb 0.19 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1uj4 h LYS 67 CO -0.25 0.47 0.30 -0.09 -0.57 0.00 0.00 179.45 179.30 1uj4 h ARG 68 N 0.43 0.36 -0.05 3.15 2.43 -0.85 -0.86 114.38 118.99 1uj4 h ARG 68 Ca 0.12 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1uj4 h ARG 68 Cb 0.13 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1uj4 h ARG 68 CO -0.01 0.24 0.00 0.39 -1.51 0.00 0.00 179.97 179.08 1uj4 n GLU 69 N -4.48 1.51 -0.29 0.20 -0.58 -0.12 -4.94 120.64 111.95 1uj4 n GLU 69 Ca 0.06 -0.74 0.00 0.00 -0.42 0.00 0.00 57.16 56.05 1uj4 n GLU 69 Cb 0.23 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 1uj4 n GLU 69 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1uj4 n GLY 70 N 1.10 0.74 3.61 0.62 0.00 -0.33 -4.77 105.19 106.16 1uj4 n GLY 70 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1uj4 n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1uj4 s ILE 71 N -2.32 4.81 0.20 -0.61 1.01 -0.35 -4.96 121.20 118.97 1uj4 s ILE 71 Ca 0.00 1.17 -0.30 0.00 0.00 0.00 0.00 60.65 61.52 1uj4 s ILE 71 Cb 0.00 -4.13 -0.09 0.00 0.01 0.00 0.00 42.46 38.25 1uj4 s ILE 71 CO 0.00 -0.23 1.32 -2.16 0.00 0.00 0.00 174.94 173.87 1uj4 s PRO 72 N 2.92 4.38 0.20 2.79 0.04 -1.26 -4.09 135.00 139.98 1uj4 s PRO 72 Ca 0.32 2.07 0.08 0.00 0.04 0.00 0.00 61.00 63.50 1uj4 s PRO 72 Cb -0.14 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 1uj4 s PRO 72 CO 0.12 -0.27 0.03 -0.51 0.04 0.00 0.00 177.00 176.41 1uj4 s LEU 73 N -0.07 3.38 0.17 -3.56 1.43 -1.26 -1.12 118.68 117.65 1uj4 s LEU 73 Ca 0.57 -0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 53.25 1uj4 s LEU 73 Cb -0.37 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 1uj4 s LEU 73 CO 0.38 0.05 0.10 0.68 0.23 0.00 0.00 176.35 177.79 1uj4 s VAL 74 N -1.91 0.05 0.61 -1.59 -7.23 -0.63 -4.88 120.40 104.82 1uj4 s VAL 74 Ca 0.29 -1.96 -0.13 0.00 -1.81 0.00 0.00 61.98 58.37 1uj4 s VAL 74 Cb -0.09 -2.30 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 1uj4 s VAL 74 CO 0.20 -0.21 1.04 -1.81 -0.31 0.00 0.00 175.10 174.01 1uj4 s ASP 75 N -3.11 5.96 0.03 4.85 1.01 -1.26 -4.52 116.67 119.63 1uj4 s ASP 75 Ca 0.32 1.60 -0.30 0.00 0.71 0.00 0.00 52.55 54.88 1uj4 s ASP 75 Cb 0.07 -2.50 -0.08 0.00 1.01 0.00 0.00 42.92 41.42 1uj4 s ASP 75 CO 0.07 -1.04 1.85 -0.22 0.21 0.00 0.00 175.17 176.04 1uj4 s LEU 76 N -4.89 4.40 0.66 1.23 2.96 -1.26 -4.95 118.68 116.83 1uj4 s LEU 76 Ca 0.59 2.56 -0.14 0.00 -0.22 0.00 0.00 54.13 56.92 1uj4 s LEU 76 Cb -0.13 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.03 1uj4 s LEU 76 CO 0.45 -1.01 1.09 -2.84 -1.32 0.00 0.00 176.35 172.73 1uj4 s PRO 77 N 4.03 2.83 0.31 0.98 0.02 -1.26 -4.92 135.00 136.99 1uj4 s PRO 77 Ca 0.83 1.30 0.03 0.00 0.02 0.00 0.00 61.00 63.18 1uj4 s PRO 77 Cb -0.41 -1.96 0.62 0.00 0.02 0.00 0.00 34.50 32.78 1uj4 s PRO 77 CO 0.37 -1.21 1.89 -1.35 -0.33 0.00 0.00 177.00 176.37 1uj4 h PRO 78 N -0.10 0.89 0.00 5.54 0.11 -2.03 -0.61 132.00 135.81 1uj4 h PRO 78 Ca -0.46 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1uj4 h PRO 78 Cb 1.24 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1uj4 h PRO 78 CO 0.54 0.59 0.00 -0.85 -0.21 0.00 0.00 178.00 178.07 1uj4 n GLU 79 N -4.54 0.01 0.00 1.05 0.00 -1.26 -5.02 120.64 110.89 1uj4 n GLU 79 Ca 0.16 0.10 0.00 0.00 0.00 0.00 0.00 57.16 57.42 1uj4 n GLU 79 Cb 0.31 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.25 1uj4 n GLU 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1uj4 n GLY 80 N 0.87 -1.17 3.51 -1.84 0.00 -0.24 -4.93 105.19 101.40 1uj4 n GLY 80 Ca 0.06 -1.75 -0.25 0.00 0.00 0.00 0.00 46.02 44.08 1uj4 n GLY 80 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1uj4 s VAL 81 N 0.00 2.44 0.07 1.61 -7.23 -0.59 -4.27 120.40 112.43 1uj4 s VAL 81 Ca 0.00 -2.29 -0.12 0.00 -1.81 0.00 0.00 61.98 57.77 1uj4 s VAL 81 Cb 0.00 -2.48 -0.28 0.00 0.56 0.00 0.00 36.38 34.18 1uj4 s VAL 81 CO 0.00 -0.31 1.13 0.44 -0.31 0.00 0.00 175.10 176.05 1uj4 h ASP 82 N 2.13 0.76 -4.35 4.85 3.32 -1.42 -1.92 116.42 119.79 1uj4 h ASP 82 Ca -0.41 -0.71 -0.14 0.00 0.02 0.00 0.00 57.03 55.79 1uj4 h ASP 82 Cb 1.26 -0.24 -0.23 0.00 0.22 0.00 0.00 39.33 40.34 1uj4 h ASP 82 CO 0.64 1.52 -0.34 -0.22 -1.72 0.00 0.00 179.24 179.12 1uj4 s LEU 83 N -7.72 0.90 -0.05 1.55 2.96 -1.14 -2.35 118.68 112.82 1uj4 s LEU 83 Ca -0.08 0.36 0.02 0.00 -0.22 0.00 0.00 54.13 54.21 1uj4 s LEU 83 Cb 0.06 1.09 0.01 0.00 0.50 0.00 0.00 46.19 47.85 1uj4 s LEU 83 CO 0.92 -0.25 -0.11 0.00 -1.32 0.00 0.00 176.35 175.59 1uj4 s ALA 84 N -0.50 1.13 -0.09 5.97 0.00 0.05 0.16 121.76 128.48 1uj4 s ALA 84 Ca -0.06 -0.37 0.03 0.00 0.00 0.00 0.00 51.96 51.56 1uj4 s ALA 84 Cb -0.04 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1uj4 s ALA 84 CO 0.02 0.12 -0.20 0.42 0.00 0.00 0.00 175.76 176.11 1uj4 s ILE 85 N 0.56 1.78 0.18 0.00 1.01 -0.60 -0.51 121.20 123.61 1uj4 s ILE 85 Ca -0.11 -0.85 -0.24 0.00 0.00 0.00 0.00 60.65 59.45 1uj4 s ILE 85 Cb -0.14 -1.56 0.05 0.00 0.01 0.00 0.00 42.46 40.83 1uj4 s ILE 85 CO 0.03 0.50 0.80 -0.62 0.00 0.00 0.00 174.94 175.64 1uj4 s ASP 86 N 0.47 -0.31 0.23 3.58 2.15 -0.99 0.00 116.67 121.81 1uj4 s ASP 86 Ca -0.17 -0.34 0.00 0.00 0.43 0.00 0.00 52.55 52.47 1uj4 s ASP 86 Cb -0.17 0.58 0.00 0.00 -0.30 0.00 0.00 42.92 43.03 1uj4 s ASP 86 CO 0.07 -1.03 0.00 0.61 -0.17 0.00 0.00 175.17 174.64 1uj4 n GLY 87 N -0.42 0.94 3.48 2.66 0.00 -1.26 -1.05 105.19 109.53 1uj4 n GLY 87 Ca -0.08 -1.95 -0.17 0.00 0.00 0.00 0.00 46.02 43.82 1uj4 n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uj4 s ALA 88 N -2.67 -1.63 0.03 4.61 0.00 -1.26 -4.79 121.76 116.06 1uj4 s ALA 88 Ca 0.00 1.12 0.05 0.00 0.00 0.00 0.00 51.96 53.14 1uj4 s ALA 88 Cb 0.00 0.08 -0.24 0.00 0.00 0.00 0.00 23.12 22.96 1uj4 s ALA 88 CO 0.00 -0.39 0.96 -0.44 0.00 0.00 0.00 175.76 175.89 1uj4 h ASP 89 N 3.03 0.12 -3.77 0.00 3.32 -0.84 -3.47 116.42 114.82 1uj4 h ASP 89 Ca -0.28 -0.17 -0.17 0.00 0.02 0.00 0.00 57.03 56.43 1uj4 h ASP 89 Cb 1.16 -0.04 -0.26 0.00 0.22 0.00 0.00 39.33 40.41 1uj4 h ASP 89 CO 0.39 1.14 -0.44 -1.61 -1.72 0.00 0.00 179.24 177.00 1uj4 s GLU 90 N -2.65 0.27 -0.18 3.56 2.02 -0.94 -4.80 118.70 115.99 1uj4 s GLU 90 Ca -0.04 0.36 -0.00 0.00 0.02 0.00 0.00 54.97 55.30 1uj4 s GLU 90 Cb 0.08 0.11 0.05 0.00 0.10 0.00 0.00 34.13 34.47 1uj4 s GLU 90 CO 0.83 -0.05 -0.05 0.42 0.02 0.00 0.00 175.26 176.43 1uj4 s ILE 91 N 0.25 1.17 0.41 -1.63 1.01 0.43 -2.20 121.20 120.64 1uj4 s ILE 91 Ca -0.01 -0.74 0.08 0.00 0.00 0.00 0.00 60.65 59.98 1uj4 s ILE 91 Cb -0.03 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 1uj4 s ILE 91 CO -0.01 0.07 0.28 0.00 0.00 0.00 0.00 174.94 175.28 1uj4 s ALA 92 N 1.60 3.81 0.30 9.38 0.00 -0.57 -1.04 121.76 135.25 1uj4 s ALA 92 Ca -0.01 -1.99 -0.28 0.00 0.00 0.00 0.00 51.96 49.68 1uj4 s ALA 92 Cb -0.16 -0.70 -0.13 0.00 0.00 0.00 0.00 23.12 22.12 1uj4 s ALA 92 CO -0.08 -0.19 1.13 -2.30 0.00 0.00 0.00 175.76 174.33 1uj4 n PRO 93 N -1.39 1.65 -0.51 0.00 -0.02 -1.26 -0.19 135.00 133.28 1uj4 n PRO 93 Ca 0.01 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1uj4 n PRO 93 Cb 0.63 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 1uj4 n PRO 93 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uj4 n GLY 94 N 1.12 0.94 3.25 -1.23 0.00 -1.25 -3.93 105.19 104.08 1uj4 n GLY 94 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 1uj4 n GLY 94 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uj4 n LEU 95 N 0.00 -3.03 -4.77 0.99 4.77 0.73 -4.65 117.00 111.03 1uj4 n LEU 95 Ca 0.00 -0.41 -0.38 0.00 -0.03 0.00 0.00 56.01 55.19 1uj4 n LEU 95 Cb 0.00 -2.87 -0.04 0.00 -2.33 0.00 0.00 43.42 38.17 1uj4 n LEU 95 CO 0.00 0.45 0.74 0.00 -1.33 0.00 0.00 177.39 177.25 1uj4 s ALA 96 N -3.24 3.23 0.19 -1.18 0.00 -1.12 -4.50 121.76 115.14 1uj4 s ALA 96 Ca 0.44 0.75 0.03 0.00 0.00 0.00 0.00 51.96 53.18 1uj4 s ALA 96 Cb -0.19 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 1uj4 s ALA 96 CO 0.55 -0.13 -0.01 -0.51 0.00 0.00 0.00 175.76 175.65 1uj4 s LEU 97 N -2.05 2.20 -0.11 0.00 1.43 0.54 -1.51 118.68 119.18 1uj4 s LEU 97 Ca 0.51 -1.17 0.02 0.00 -1.03 0.00 0.00 54.13 52.46 1uj4 s LEU 97 Cb -0.26 -0.17 0.01 0.00 0.03 0.00 0.00 46.19 45.81 1uj4 s LEU 97 CO 0.33 -0.52 -0.15 -0.63 0.23 0.00 0.00 176.35 175.61 1uj4 s ILE 98 N -3.53 1.48 0.23 -0.59 1.01 -0.93 -0.60 121.20 118.27 1uj4 s ILE 98 Ca 0.24 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.27 1uj4 s ILE 98 Cb 0.05 -1.36 -0.05 0.00 0.01 0.00 0.00 42.46 41.12 1uj4 s ILE 98 CO 0.05 0.44 0.09 -0.54 0.00 0.00 0.00 174.94 174.98 1uj4 s LYS 99 N 0.98 1.32 0.00 2.79 1.02 0.90 -0.05 119.74 126.69 1uj4 s LYS 99 Ca -0.07 -1.70 0.00 0.00 0.02 0.00 0.00 55.97 54.22 1uj4 s LYS 99 Cb -0.15 -0.13 0.00 0.00 -0.52 0.00 0.00 37.83 37.03 1uj4 s LYS 99 CO -0.01 -0.30 0.00 0.41 -0.92 0.00 0.00 175.35 174.53 1uj4 n GLY 100 N -0.39 0.76 0.01 -3.33 0.00 -1.26 -4.20 105.19 96.77 1uj4 n GLY 100 Ca -0.00 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1uj4 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uj4 n GLY 102 N 0.00 0.00 1.14 -0.02 0.00 -1.26 -4.36 105.19 100.69 1uj4 n GLY 102 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1uj4 n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uj4 n GLY 103 N 0.00 0.74 0.86 -0.02 0.00 -1.26 -4.97 105.19 100.54 1uj4 n GLY 103 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1uj4 n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uj4 n ALA 104 N -0.38 3.77 -0.12 4.61 0.00 -1.26 -4.64 120.51 122.48 1uj4 n ALA 104 Ca 0.00 -3.05 0.05 0.00 0.00 0.00 0.00 53.44 50.45 1uj4 n ALA 104 Cb 0.00 -0.59 0.37 0.00 0.00 0.00 0.00 19.45 19.23 1uj4 n ALA 104 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1uj4 h LEU 105 N 0.98 0.61 0.68 0.00 8.10 -1.89 -2.28 115.31 121.50 1uj4 h LEU 105 Ca 0.11 -0.01 -0.03 0.00 0.11 0.00 0.00 57.88 58.06 1uj4 h LEU 105 Cb 1.38 -0.14 0.01 0.00 -0.44 0.00 0.00 40.66 41.47 1uj4 h LEU 105 CO 0.22 0.41 -0.32 0.25 -4.11 0.00 0.00 178.44 174.89 1uj4 h LEU 106 N 0.70 -0.77 -1.11 0.17 5.85 -1.92 -0.31 115.31 117.93 1uj4 h LEU 106 Ca 0.25 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.90 1uj4 h LEU 106 Cb 0.12 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1uj4 h LEU 106 CO -0.07 -0.45 -0.10 0.03 -0.34 0.00 0.00 178.44 177.52 1uj4 h ARG 107 N -1.08 0.51 -0.29 1.25 3.08 -1.79 -1.15 114.38 114.92 1uj4 h ARG 107 Ca -0.09 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 59.83 1uj4 h ARG 107 Cb 0.73 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 1uj4 h ARG 107 CO 0.15 0.61 0.16 0.93 -1.07 0.00 0.00 179.97 180.75 1uj4 h GLU 108 N 0.48 0.32 -0.46 0.04 5.08 -1.35 -1.38 114.58 117.30 1uj4 h GLU 108 Ca 0.09 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 1uj4 h GLU 108 Cb 0.46 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1uj4 h GLU 108 CO 0.03 0.21 -0.23 -0.22 -1.00 0.00 0.00 179.01 177.79 1uj4 h LYS 109 N 0.33 0.97 -0.46 2.33 3.64 -0.67 0.71 116.57 123.41 1uj4 h LYS 109 Ca 0.12 -0.42 0.02 0.00 -1.27 0.00 0.00 60.65 59.10 1uj4 h LYS 109 Cb 0.02 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1uj4 h LYS 109 CO -0.07 1.09 0.27 0.82 -2.27 0.00 0.00 179.45 179.29 1uj4 h ILE 110 N 0.83 1.04 -0.06 2.00 2.04 -0.96 0.15 117.51 122.54 1uj4 h ILE 110 Ca 0.10 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.72 1uj4 h ILE 110 Cb 0.81 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1uj4 h ILE 110 CO 0.07 0.10 -0.20 0.58 0.00 0.00 0.00 178.15 178.69 1uj4 h VAL 111 N 0.54 1.44 0.00 1.67 2.07 -1.16 -3.31 116.25 117.50 1uj4 h VAL 111 Ca 0.19 -1.61 -0.05 0.00 0.82 0.00 0.00 66.70 66.05 1uj4 h VAL 111 Cb 0.03 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1uj4 h VAL 111 CO -0.09 0.45 -0.23 -0.33 0.02 0.00 0.00 177.57 177.39 1uj4 h GLU 112 N -0.28 0.00 0.00 1.57 5.08 -0.74 -2.72 114.58 117.50 1uj4 h GLU 112 Ca -0.01 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1uj4 h GLU 112 Cb 0.84 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 1uj4 h GLU 112 CO 0.04 0.23 -0.23 -0.09 -1.00 0.00 0.00 179.01 177.95 1uj4 h ARG 113 N 0.00 0.00 -0.47 2.33 9.65 -0.79 -3.01 114.38 122.09 1uj4 h ARG 113 Ca -0.00 0.00 -0.28 0.00 -1.10 0.00 0.00 59.98 58.60 1uj4 h ARG 113 Cb 0.68 0.00 -0.17 0.00 -1.39 0.00 0.00 29.97 29.09 1uj4 h ARG 113 CO 0.03 0.23 -0.09 1.33 2.80 0.00 0.00 179.97 184.27 1uj4 n VAL 114 N -3.86 2.66 -3.77 0.20 0.24 -1.03 -4.97 118.33 107.80 1uj4 n VAL 114 Ca -0.02 -2.96 -0.35 0.00 -2.04 0.00 0.00 64.34 58.97 1uj4 n VAL 114 Cb 0.32 -0.50 -0.09 0.00 -1.47 0.00 0.00 33.84 32.11 1uj4 n VAL 114 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1uj4 s ALA 115 N -3.35 3.61 0.33 2.33 0.00 -1.14 -1.55 121.76 122.00 1uj4 s ALA 115 Ca 0.47 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.71 1uj4 s ALA 115 Cb 0.42 -2.16 0.61 0.00 0.00 0.00 0.00 23.12 21.99 1uj4 s ALA 115 CO 0.00 0.08 1.96 0.87 0.00 0.00 0.00 175.76 178.68 1uj4 h LYS 116 N 6.87 0.89 -4.09 0.00 1.57 -1.35 -3.39 116.57 117.07 1uj4 h LYS 116 Ca -0.40 -0.05 -0.46 0.00 -1.87 0.00 0.00 60.65 57.87 1uj4 h LYS 116 Cb 1.16 -0.20 -0.35 0.00 0.08 0.00 0.00 32.23 32.91 1uj4 h LYS 116 CO 0.73 0.59 -0.79 -2.00 -0.57 0.00 0.00 179.45 177.41 1uj4 s GLU 117 N -5.79 1.09 -0.27 3.15 2.56 -0.99 -5.02 118.70 113.42 1uj4 s GLU 117 Ca -0.11 -0.15 0.03 0.00 0.00 0.00 0.00 54.97 54.74 1uj4 s GLU 117 Cb 0.19 -1.12 0.07 0.00 2.00 0.00 0.00 34.13 35.26 1uj4 s GLU 117 CO 0.78 -0.15 -0.07 0.12 -0.56 0.00 0.00 175.26 175.38 1uj4 s PHE 118 N 1.25 3.18 -0.24 5.30 5.36 -1.26 -0.77 117.98 130.81 1uj4 s PHE 118 Ca -0.05 -2.34 -0.08 0.00 -0.96 0.00 0.00 56.93 53.50 1uj4 s PHE 118 Cb -0.14 -2.03 -0.04 0.00 -0.34 0.00 0.00 43.02 40.47 1uj4 s PHE 118 CO -0.02 -0.87 0.10 0.42 -1.46 0.00 0.00 175.22 173.39 1uj4 s ILE 119 N 1.12 4.74 -0.00 3.12 1.01 0.33 -1.38 121.20 130.15 1uj4 s ILE 119 Ca -0.05 -0.03 -0.16 0.00 0.00 0.00 0.00 60.65 60.40 1uj4 s ILE 119 Cb -0.20 -3.20 -0.06 0.00 0.01 0.00 0.00 42.46 39.01 1uj4 s ILE 119 CO -0.06 0.35 0.46 -0.69 0.00 0.00 0.00 174.94 175.00 1uj4 s VAL 120 N 1.26 4.98 -0.02 2.92 1.01 -0.51 -2.35 120.40 127.69 1uj4 s VAL 120 Ca 0.06 0.95 0.05 0.00 0.00 0.00 0.00 61.98 63.03 1uj4 s VAL 120 Cb -0.14 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 1uj4 s VAL 120 CO 0.05 0.53 -0.17 0.27 0.00 0.00 0.00 175.10 175.78 1uj4 s ILE 121 N -0.82 1.40 -0.05 2.22 -4.36 -0.22 -0.31 121.20 119.05 1uj4 s ILE 121 Ca 0.25 -0.74 -0.31 0.00 -0.26 0.00 0.00 60.65 59.59 1uj4 s ILE 121 Cb -0.17 -1.17 0.12 0.00 1.25 0.00 0.00 42.46 42.49 1uj4 s ILE 121 CO 0.14 0.40 1.23 0.00 0.24 0.00 0.00 174.94 176.95 1uj4 s ALA 122 N -0.29 -2.13 0.50 2.27 0.00 -1.04 -4.16 121.76 116.91 1uj4 s ALA 122 Ca 0.04 0.91 -0.07 0.00 0.00 0.00 0.00 51.96 52.83 1uj4 s ALA 122 Cb -0.08 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.25 1uj4 s ALA 122 CO 0.00 -0.92 0.84 0.16 0.00 0.00 0.00 175.76 175.85 1uj4 s ASP 123 N -2.74 6.30 0.60 0.00 1.47 -1.26 -1.61 116.67 119.42 1uj4 s ASP 123 Ca 0.12 1.08 0.29 0.00 1.18 0.00 0.00 52.55 55.22 1uj4 s ASP 123 Cb 0.03 -2.31 1.47 0.00 -0.34 0.00 0.00 42.92 41.76 1uj4 s ASP 123 CO -0.04 -0.62 1.88 1.12 0.68 0.00 0.00 175.17 178.19 1uj4 h HIS 124 N 0.27 0.00 0.00 2.11 2.07 -0.94 -2.40 115.15 116.26 1uj4 h HIS 124 Ca -0.46 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.06 1uj4 h HIS 124 Cb 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 1uj4 h HIS 124 CO 0.61 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.72 1uj4 n THR 125 N -3.62 1.20 0.38 6.12 -2.24 -1.26 -1.97 114.28 112.89 1uj4 n THR 125 Ca 0.08 0.30 0.13 0.00 -2.27 0.00 0.00 64.05 62.29 1uj4 n THR 125 Cb 0.67 -1.14 0.34 0.00 -2.10 0.00 0.00 70.33 68.09 1uj4 n THR 125 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1uj4 h LYS 126 N 0.00 0.00 -6.68 -0.78 6.56 -1.74 -3.45 116.57 110.48 1uj4 h LYS 126 Ca 0.00 0.00 -0.52 0.00 -1.06 0.00 0.00 60.65 59.07 1uj4 h LYS 126 Cb 0.14 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 31.83 1uj4 h LYS 126 CO 0.00 0.00 0.62 0.15 -2.06 0.00 0.00 179.45 178.16 1uj4 s LYS 127 N -3.23 4.42 0.03 3.15 1.02 -0.83 -0.43 119.74 123.86 1uj4 s LYS 127 Ca 0.07 2.01 0.01 0.00 0.02 0.00 0.00 55.97 58.08 1uj4 s LYS 127 Cb 0.08 -3.20 -0.02 0.00 -0.52 0.00 0.00 37.83 34.17 1uj4 s LYS 127 CO 0.61 -0.21 -0.04 0.14 -0.92 0.00 0.00 175.35 174.93 1uj4 s VAL 128 N 0.04 0.22 0.25 3.17 -7.23 -0.21 -4.87 120.40 111.78 1uj4 s VAL 128 Ca 0.55 -0.97 0.14 0.00 -1.81 0.00 0.00 61.98 59.89 1uj4 s VAL 128 Cb -0.35 -0.37 0.04 0.00 0.56 0.00 0.00 36.38 36.26 1uj4 s VAL 128 CO 0.38 -0.48 1.68 -0.65 -0.31 0.00 0.00 175.10 175.73 1uj4 h PRO 129 N 4.59 0.00 -2.41 4.82 0.11 -1.96 -3.37 132.00 133.78 1uj4 h PRO 129 Ca -0.33 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.70 1uj4 h PRO 129 Cb 1.21 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.09 1uj4 h PRO 129 CO 0.41 0.50 -0.08 0.54 -0.21 0.00 0.00 178.00 179.16 1uj4 s VAL 130 N -3.69 -0.00 0.57 3.15 0.11 -1.26 -4.59 120.40 114.69 1uj4 s VAL 130 Ca -0.01 0.01 -0.21 0.00 -2.93 0.00 0.00 61.98 58.84 1uj4 s VAL 130 Cb 0.12 -0.77 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 1uj4 s VAL 130 CO 0.73 0.00 1.32 -0.76 -3.33 0.00 0.00 175.10 173.07 1uj4 s LEU 131 N 0.41 3.77 0.00 2.54 1.43 -1.26 -4.14 118.68 121.43 1uj4 s LEU 131 Ca -0.01 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 55.77 1uj4 s LEU 131 Cb -0.04 -4.39 0.00 0.00 0.03 0.00 0.00 46.19 41.79 1uj4 s LEU 131 CO -0.01 -1.66 0.00 0.61 0.23 0.00 0.00 176.35 175.52 1uj4 n GLY 132 N 0.74 1.42 0.31 -3.19 0.00 -1.26 -0.70 105.19 102.52 1uj4 n GLY 132 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 1uj4 n GLY 132 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1uj4 h ARG 133 N 0.68 0.82 0.00 1.61 2.43 -1.83 -3.29 114.38 114.80 1uj4 h ARG 133 Ca 0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1uj4 h ARG 133 Cb 0.00 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1uj4 h ARG 133 CO 0.00 0.66 0.00 0.41 -1.51 0.00 0.00 179.97 179.53 1uj4 n GLY 134 N -1.09 6.62 3.90 2.80 0.00 -1.26 -5.01 105.19 111.16 1uj4 n GLY 134 Ca 0.05 -2.03 -0.29 0.00 0.00 0.00 0.00 46.02 43.75 1uj4 n GLY 134 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uj4 s PRO 135 N 0.12 2.41 -0.28 1.61 0.04 -1.26 -4.64 135.00 132.99 1uj4 s PRO 135 Ca 0.00 0.16 -0.06 0.00 0.04 0.00 0.00 61.00 61.14 1uj4 s PRO 135 Cb 0.00 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.51 1uj4 s PRO 135 CO 0.00 -1.25 0.05 0.08 0.04 0.00 0.00 177.00 175.92 1uj4 s VAL 136 N -3.39 3.74 0.28 -0.36 1.01 0.95 -4.81 120.40 117.81 1uj4 s VAL 136 Ca 0.60 -0.76 -0.29 0.00 0.00 0.00 0.00 61.98 61.53 1uj4 s VAL 136 Cb -0.11 -2.92 -0.10 0.00 0.00 0.00 0.00 36.38 33.26 1uj4 s VAL 136 CO 0.49 0.11 1.23 -2.84 0.00 0.00 0.00 175.10 174.09 1uj4 s PRO 137 N 1.46 4.47 -0.05 2.72 0.02 -1.26 -0.96 135.00 141.41 1uj4 s PRO 137 Ca 0.02 2.02 0.01 0.00 0.02 0.00 0.00 61.00 63.07 1uj4 s PRO 137 Cb -0.17 -3.15 0.02 0.00 0.02 0.00 0.00 34.50 31.23 1uj4 s PRO 137 CO 0.01 -0.06 -0.04 0.08 -0.33 0.00 0.00 177.00 176.66 1uj4 s VAL 138 N -0.84 0.54 -0.05 3.83 1.01 0.46 -0.64 120.40 124.72 1uj4 s VAL 138 Ca 0.49 -0.11 -0.22 0.00 0.00 0.00 0.00 61.98 62.14 1uj4 s VAL 138 Cb -0.36 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 1uj4 s VAL 138 CO 0.45 0.23 0.66 -0.70 0.00 0.00 0.00 175.10 175.74 1uj4 s GLU 139 N 1.03 4.41 0.04 2.72 2.12 -0.57 -0.67 118.70 127.78 1uj4 s GLU 139 Ca -0.09 0.82 0.08 0.00 0.36 0.00 0.00 54.97 56.14 1uj4 s GLU 139 Cb -0.14 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 30.81 1uj4 s GLU 139 CO -0.01 0.15 -0.23 0.42 -0.54 0.00 0.00 175.26 175.06 1uj4 s ILE 140 N 0.51 1.83 0.09 -3.70 1.01 0.12 -0.68 121.20 120.38 1uj4 s ILE 140 Ca 0.35 -1.25 -0.31 0.00 0.00 0.00 0.00 60.65 59.44 1uj4 s ILE 140 Cb -0.18 -1.58 -0.07 0.00 0.01 0.00 0.00 42.46 40.64 1uj4 s ILE 140 CO 0.18 0.27 1.38 -0.69 0.00 0.00 0.00 174.94 176.08 1uj4 s VAL 141 N -0.79 3.46 0.12 2.92 1.01 0.47 -0.69 120.40 126.90 1uj4 s VAL 141 Ca 0.09 1.01 -0.23 0.00 0.00 0.00 0.00 61.98 62.86 1uj4 s VAL 141 Cb -0.09 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1uj4 s VAL 141 CO 0.02 0.06 1.67 -0.65 0.00 0.00 0.00 175.10 176.20 1uj4 h PRO 142 N 7.05 -0.18 -6.60 2.72 0.11 -1.90 -3.35 132.00 129.84 1uj4 h PRO 142 Ca -0.41 0.01 -0.56 0.00 0.11 0.00 0.00 66.00 65.15 1uj4 h PRO 142 Cb 1.20 0.04 0.07 0.00 0.11 0.00 0.00 31.00 32.42 1uj4 h PRO 142 CO 0.87 -0.12 0.81 0.34 -0.21 0.00 0.00 178.00 179.69 1uj4 n PHE 143 N -5.28 2.43 -1.62 0.65 7.35 -1.26 -1.93 117.46 117.80 1uj4 n PHE 143 Ca -0.04 0.26 -0.18 0.00 -0.76 0.00 0.00 57.45 56.73 1uj4 n PHE 143 Cb 0.20 -2.56 -0.07 0.00 0.35 0.00 0.00 39.48 37.40 1uj4 n PHE 143 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1uj4 n GLY 144 N 3.04 1.49 0.38 7.13 0.00 -1.26 -4.89 105.19 111.08 1uj4 n GLY 144 Ca 0.14 -0.16 0.18 0.00 0.00 0.00 0.00 46.02 46.19 1uj4 n GLY 144 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1uj4 h TYR 145 N 0.00 0.22 -1.01 1.61 -0.00 -1.52 -1.66 116.97 114.61 1uj4 h TYR 145 Ca -0.37 0.01 0.01 0.00 0.00 0.00 0.00 58.73 58.37 1uj4 h TYR 145 Cb 1.19 -0.07 -0.05 0.00 0.00 0.00 0.00 36.73 37.80 1uj4 h TYR 145 CO 0.50 0.09 0.67 0.00 -0.00 0.00 0.00 178.16 179.41 1uj4 h ARG 146 N 0.19 1.32 -0.17 0.10 3.08 -1.90 0.19 114.38 117.19 1uj4 h ARG 146 Ca 0.31 -0.08 -0.17 0.00 0.07 0.00 0.00 59.98 60.11 1uj4 h ARG 146 Cb 0.96 -0.30 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 1uj4 h ARG 146 CO -0.06 0.88 -0.59 0.00 -1.07 0.00 0.00 179.97 179.13 1uj4 h ALA 147 N 1.37 0.65 -0.44 0.04 0.00 -1.71 -2.54 119.26 116.62 1uj4 h ALA 147 Ca 0.37 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1uj4 h ALA 147 Cb -0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1uj4 h ALA 147 CO -0.08 0.70 0.07 1.15 0.00 0.00 0.00 179.25 181.09 1uj4 h THR 148 N 0.42 1.24 -0.46 0.00 2.02 -1.08 -1.15 112.91 113.91 1uj4 h THR 148 Ca -0.00 -0.89 -0.01 0.00 0.77 0.00 0.00 66.41 66.28 1uj4 h THR 148 Cb 1.14 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 1uj4 h THR 148 CO 0.11 0.31 0.25 -0.07 0.37 0.00 0.00 175.52 176.50 1uj4 h LEU 149 N 0.59 0.55 -0.38 2.58 3.38 -0.59 -1.30 115.31 120.14 1uj4 h LEU 149 Ca 0.13 -0.03 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 1uj4 h LEU 149 Cb 0.38 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1uj4 h LEU 149 CO 0.01 0.44 -0.33 0.50 0.09 0.00 0.00 178.44 179.15 1uj4 h LYS 150 N 0.63 0.89 -0.54 1.13 1.63 -1.00 -1.14 116.57 118.18 1uj4 h LYS 150 Ca 0.16 -0.45 -0.04 0.00 -0.85 0.00 0.00 60.65 59.47 1uj4 h LYS 150 Cb 0.01 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 1uj4 h LYS 150 CO -0.03 1.10 0.16 0.00 -3.45 0.00 0.00 179.45 177.24 1uj4 h ALA 151 N 0.77 1.28 -0.33 5.00 0.00 -0.43 -0.41 119.26 125.14 1uj4 h ALA 151 Ca 0.07 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.63 1uj4 h ALA 151 Cb 0.92 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1uj4 h ALA 151 CO 0.08 0.51 -0.46 0.82 0.00 0.00 0.00 179.25 180.21 1uj4 h ILE 152 N 0.78 1.28 -0.51 0.00 2.04 -1.10 -2.91 117.51 117.08 1uj4 h ILE 152 Ca 0.18 -1.64 -0.05 0.00 1.00 0.00 0.00 64.86 64.35 1uj4 h ILE 152 Cb 0.23 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 1uj4 h ILE 152 CO -0.01 0.54 0.10 0.00 0.00 0.00 0.00 178.15 178.78 1uj4 h ALA 153 N 0.78 1.22 0.00 1.87 0.00 -0.69 -1.61 119.26 120.83 1uj4 h ALA 153 Ca 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1uj4 h ALA 153 Cb 1.05 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1uj4 h ALA 153 CO 0.10 0.53 0.00 -0.44 0.00 0.00 0.00 179.25 179.45 1uj4 h ASP 154 N 0.76 0.00 0.29 0.00 3.32 -0.89 0.97 116.42 120.87 1uj4 h ASP 154 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1uj4 h ASP 154 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1uj4 h ASP 154 CO 0.00 0.00 -0.24 0.18 -1.72 0.00 0.00 179.24 177.46 1uj4 n LEU 155 N -2.92 0.87 0.00 1.55 4.77 -0.71 -4.91 117.00 115.65 1uj4 n LEU 155 Ca -0.01 -0.18 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1uj4 n LEU 155 Cb 0.19 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1uj4 n LEU 155 CO 0.22 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1uj4 n GLY 156 N 1.34 0.95 0.04 -0.72 0.00 0.34 -5.01 105.19 102.13 1uj4 n GLY 156 Ca 0.12 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.85 1uj4 n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uj4 n GLY 157 N -1.91 -1.23 4.05 -0.02 0.00 -0.69 -4.48 105.19 100.92 1uj4 n GLY 157 Ca 0.00 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 1uj4 n GLY 157 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1uj4 n GLU 158 N -1.31 -0.57 -1.92 1.61 1.02 -1.26 -1.40 120.64 116.81 1uj4 n GLU 158 Ca 0.09 0.01 -0.38 0.00 -0.02 0.00 0.00 57.16 56.86 1uj4 n GLU 158 Cb 0.32 -2.41 0.03 0.00 -0.02 0.00 0.00 31.44 29.35 1uj4 n GLU 158 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1uj4 s PRO 159 N -7.01 3.34 -0.14 3.49 0.04 -1.26 -3.82 135.00 129.63 1uj4 s PRO 159 Ca 0.25 2.11 -0.02 0.00 0.04 0.00 0.00 61.00 63.38 1uj4 s PRO 159 Cb -0.14 -2.32 0.05 0.00 0.04 0.00 0.00 34.50 32.13 1uj4 s PRO 159 CO 0.85 -0.99 0.03 -1.21 0.04 0.00 0.00 177.00 175.71 1uj4 s GLU 160 N -2.83 0.59 0.11 4.56 2.02 -0.85 -4.96 118.70 117.34 1uj4 s GLU 160 Ca 0.69 -0.19 -0.31 0.00 0.02 0.00 0.00 54.97 55.18 1uj4 s GLU 160 Cb -0.37 -1.64 -0.09 0.00 0.10 0.00 0.00 34.13 32.12 1uj4 s GLU 160 CO 0.44 -0.51 1.67 -1.17 0.02 0.00 0.00 175.26 175.72 1uj4 s LEU 161 N 1.92 4.37 1.19 1.80 2.96 -1.26 -1.73 118.68 127.93 1uj4 s LEU 161 Ca 0.02 2.59 -0.18 0.00 -0.22 0.00 0.00 54.13 56.34 1uj4 s LEU 161 Cb -0.15 -3.57 0.28 0.00 0.50 0.00 0.00 46.19 43.24 1uj4 s LEU 161 CO -0.07 -0.90 1.10 -0.60 -1.32 0.00 0.00 176.35 174.56 1uj4 s ARG 162 N 2.22 -1.09 -0.31 1.98 3.52 0.54 -4.95 118.95 120.85 1uj4 s ARG 162 Ca 0.74 0.00 -0.11 0.00 -0.13 0.00 0.00 55.73 56.24 1uj4 s ARG 162 Cb -0.43 -1.61 0.19 0.00 -1.56 0.00 0.00 34.95 31.55 1uj4 s ARG 162 CO 0.33 -3.64 1.11 0.34 -0.81 0.00 0.00 175.30 172.62 1uj4 s ASP 164 N -3.82 -0.17 0.51 -2.12 2.15 0.55 -2.44 116.67 111.33 1uj4 s ASP 164 Ca 0.70 -0.10 0.00 0.00 0.43 0.00 0.00 52.55 53.58 1uj4 s ASP 164 Cb -0.11 0.22 0.00 0.00 -0.30 0.00 0.00 42.92 42.73 1uj4 s ASP 164 CO 0.56 -0.02 0.00 0.61 -0.17 0.00 0.00 175.17 176.16 1uj4 n GLY 165 N 3.47 0.39 1.48 2.66 0.00 -1.26 -2.90 105.19 109.04 1uj4 n GLY 165 Ca 0.06 -0.89 0.08 0.00 0.00 0.00 0.00 46.02 45.27 1uj4 n GLY 165 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1uj4 n ASP 166 N 5.04 4.38 -4.47 1.61 8.00 -1.26 -4.93 116.55 124.91 1uj4 n ASP 166 Ca 0.00 -2.44 -0.23 0.00 0.71 0.00 0.00 54.79 52.83 1uj4 n ASP 166 Cb 0.00 -0.56 -0.10 0.00 -0.02 0.00 0.00 41.12 40.44 1uj4 n ASP 166 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1uj4 s GLU 167 N -1.90 1.72 0.34 -1.24 2.02 -1.14 -5.12 118.70 113.38 1uj4 s GLU 167 Ca 0.46 -1.97 -0.27 0.00 0.02 0.00 0.00 54.97 53.21 1uj4 s GLU 167 Cb 0.30 -0.99 -0.09 0.00 0.10 0.00 0.00 34.13 33.45 1uj4 s GLU 167 CO 0.21 -0.18 1.09 -0.06 0.02 0.00 0.00 175.26 176.33 1uj4 s PHE 168 N -3.19 3.41 0.19 1.61 2.99 -1.26 -0.33 117.98 121.39 1uj4 s PHE 168 Ca 0.35 1.66 -0.28 0.00 0.00 0.00 0.00 56.93 58.67 1uj4 s PHE 168 Cb 0.09 -3.23 -0.08 0.00 0.00 0.00 0.00 43.02 39.79 1uj4 s PHE 168 CO 0.16 -0.66 0.87 -0.47 -0.00 0.00 0.00 175.22 175.12 1uj4 s TYR 169 N -1.38 3.93 -0.06 0.36 5.04 -1.02 -4.55 117.35 119.67 1uj4 s TYR 169 Ca 0.51 1.78 0.05 0.00 -2.44 0.00 0.00 57.07 56.97 1uj4 s TYR 169 Cb -0.28 -2.90 -0.01 0.00 0.35 0.00 0.00 41.96 39.13 1uj4 s TYR 169 CO 0.35 0.45 -0.22 -0.06 -1.34 0.00 0.00 175.55 174.73 1uj4 s PHE 170 N -1.00 2.20 0.97 4.97 0.40 -1.26 -4.27 117.98 119.99 1uj4 s PHE 170 Ca 0.39 -0.68 -0.14 0.00 -0.60 0.00 0.00 56.93 55.90 1uj4 s PHE 170 Cb -0.24 -1.46 0.18 0.00 0.51 0.00 0.00 43.02 42.00 1uj4 s PHE 170 CO 0.29 -0.22 1.17 0.95 0.70 0.00 0.00 175.22 178.11 1uj4 s THR 171 N -0.03 1.92 0.48 0.64 -4.23 0.13 -4.84 115.64 109.72 1uj4 s THR 171 Ca -0.05 0.00 0.17 0.00 -1.18 0.00 0.00 61.69 60.63 1uj4 s THR 171 Cb -0.14 -2.76 0.33 0.00 1.34 0.00 0.00 72.50 71.27 1uj4 s THR 171 CO 0.04 0.00 2.03 0.44 -0.54 0.00 0.00 174.62 176.59 1uj4 h ASP 172 N -1.72 0.18 0.12 3.99 3.32 -1.90 0.92 116.42 121.32 1uj4 h ASP 172 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1uj4 h ASP 172 Cb 1.30 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1uj4 h ASP 172 CO 0.52 0.11 -0.00 0.61 -1.72 0.00 0.00 179.24 178.76 1uj4 n GLY 173 N -1.56 -1.02 1.77 2.75 0.00 -1.26 -4.90 105.19 100.97 1uj4 n GLY 173 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1uj4 n GLY 173 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uj4 n GLY 174 N 1.07 0.50 3.73 -0.02 0.00 0.32 -5.07 105.19 105.73 1uj4 n GLY 174 Ca 0.22 -0.88 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 1uj4 n GLY 174 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1uj4 s HIS 175 N -2.00 2.52 0.47 1.61 3.76 -1.26 -4.72 115.29 115.67 1uj4 s HIS 175 Ca 0.00 -0.63 0.01 0.00 -0.15 0.00 0.00 55.06 54.30 1uj4 s HIS 175 Cb 0.00 -1.92 0.01 0.00 1.11 0.00 0.00 32.58 31.77 1uj4 s HIS 175 CO 0.00 0.18 0.68 -0.51 -0.85 0.00 0.00 174.74 174.25 1uj4 s LEU 176 N -3.90 3.58 -0.02 0.89 1.43 0.13 -0.69 118.68 120.09 1uj4 s LEU 176 Ca 0.39 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.68 1uj4 s LEU 176 Cb 0.04 -3.06 0.00 0.00 0.03 0.00 0.00 46.19 43.21 1uj4 s LEU 176 CO 0.21 -0.79 -0.09 -0.63 0.23 0.00 0.00 176.35 175.27 1uj4 s ILE 177 N -2.58 0.81 -0.10 -0.59 -1.09 -1.26 0.14 121.20 116.53 1uj4 s ILE 177 Ca 0.50 -0.38 0.02 0.00 -2.23 0.00 0.00 60.65 58.56 1uj4 s ILE 177 Cb -0.10 -0.71 0.01 0.00 -1.58 0.00 0.00 42.46 40.08 1uj4 s ILE 177 CO 0.37 0.25 -0.15 0.00 -1.23 0.00 0.00 174.94 174.19 1uj4 s ALA 178 N 0.13 1.60 -0.26 9.38 0.00 0.16 -0.34 121.76 132.43 1uj4 s ALA 178 Ca -0.02 -0.66 -0.20 0.00 0.00 0.00 0.00 51.96 51.08 1uj4 s ALA 178 Cb -0.08 -0.76 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 1uj4 s ALA 178 CO 0.00 -0.01 0.62 -0.51 0.00 0.00 0.00 175.76 175.86 1uj4 s ASP 179 N 0.88 6.55 -0.28 0.00 1.01 -0.71 -0.40 116.67 123.73 1uj4 s ASP 179 Ca -0.09 0.64 -0.06 0.00 0.71 0.00 0.00 52.55 53.75 1uj4 s ASP 179 Cb -0.15 -2.33 0.01 0.00 1.01 0.00 0.00 42.92 41.45 1uj4 s ASP 179 CO 0.00 -0.38 0.05 0.00 0.21 0.00 0.00 175.17 175.05 1uj4 s ARG 181 N 1.49 3.63 0.20 0.00 1.81 -0.49 -0.03 118.95 125.55 1uj4 s ARG 181 Ca 0.03 -1.59 0.24 0.00 -1.72 0.00 0.00 55.73 52.69 1uj4 s ARG 181 Cb -0.17 -5.10 0.34 0.00 -0.45 0.00 0.00 34.95 29.58 1uj4 s ARG 181 CO 0.01 -1.94 1.37 0.74 -0.68 0.00 0.00 175.30 174.80 1uj4 h PHE 182 N 9.04 0.00 0.00 -0.53 -1.00 -1.78 -3.40 116.94 119.27 1uj4 h PHE 182 Ca 0.19 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.97 1uj4 h PHE 182 Cb 1.01 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.57 1uj4 h PHE 182 CO 1.21 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 178.32 1uj4 n GLY 183 N 1.26 -1.79 3.74 -1.45 0.00 -1.26 -4.83 105.19 100.87 1uj4 n GLY 183 Ca 0.03 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 1uj4 n GLY 183 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uj4 s PRO 184 N 0.00 4.13 -0.40 1.61 0.04 -1.24 -4.37 135.00 134.77 1uj4 s PRO 184 Ca 0.00 2.57 -0.14 0.00 0.04 0.00 0.00 61.00 63.48 1uj4 s PRO 184 Cb 0.00 -3.04 0.02 0.00 0.04 0.00 0.00 34.50 31.53 1uj4 s PRO 184 CO 0.00 -0.65 0.27 0.42 0.04 0.00 0.00 177.00 177.08 1uj4 s ILE 185 N 0.23 5.03 0.23 0.56 1.01 0.12 -4.97 121.20 123.42 1uj4 s ILE 185 Ca 0.65 -0.74 -0.00 0.00 0.00 0.00 0.00 60.65 60.57 1uj4 s ILE 185 Cb -0.48 -3.81 0.00 0.00 0.01 0.00 0.00 42.46 38.19 1uj4 s ILE 185 CO 0.45 -0.29 1.61 1.23 0.00 0.00 0.00 174.94 177.93 1uj4 h GLY 186 N 8.57 0.56 -6.66 6.18 0.00 -1.93 -3.39 103.07 106.40 1uj4 h GLY 186 Ca -0.26 -0.56 -0.60 0.00 0.00 0.00 0.00 47.33 45.91 1uj4 h GLY 186 CO 0.71 0.50 -0.83 -0.35 0.00 0.00 0.00 176.54 176.57 1uj4 s ASP 187 N -6.86 2.74 0.18 0.19 2.15 -1.26 -5.02 116.67 108.79 1uj4 s ASP 187 Ca -0.07 -3.10 -0.22 0.00 0.43 0.00 0.00 52.55 49.59 1uj4 s ASP 187 Cb 0.12 -0.81 0.10 0.00 -0.30 0.00 0.00 42.92 42.03 1uj4 s ASP 187 CO 0.82 -0.18 1.59 -0.65 -0.17 0.00 0.00 175.17 176.58 1uj4 h PRO 188 N 5.89 -0.18 -0.65 4.34 0.11 -1.99 0.99 132.00 140.51 1uj4 h PRO 188 Ca 0.17 0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.22 1uj4 h PRO 188 Cb 0.88 0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.01 1uj4 h PRO 188 CO 0.46 -0.12 0.12 1.25 -0.21 0.00 0.00 178.00 179.50 1uj4 h LEU 189 N -0.19 1.00 -0.48 2.35 5.85 -1.97 -0.46 115.31 121.41 1uj4 h LEU 189 Ca 0.21 -0.23 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 1uj4 h LEU 189 Cb 0.55 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1uj4 h LEU 189 CO -0.64 0.99 0.10 1.23 -0.34 0.00 0.00 178.44 179.78 1uj4 h GLY 190 N 1.05 0.84 1.01 3.75 0.00 -1.73 -1.42 103.07 106.58 1uj4 h GLY 190 Ca 0.20 -0.54 -0.07 0.00 0.00 0.00 0.00 47.33 46.91 1uj4 h GLY 190 CO 0.01 0.51 0.04 -2.00 0.00 0.00 0.00 176.54 175.10 1uj4 h LEU 191 N 0.66 0.88 0.01 3.11 5.85 -0.65 -1.40 115.31 123.78 1uj4 h LEU 191 Ca 0.15 -0.28 0.02 0.00 0.84 0.00 0.00 57.88 58.60 1uj4 h LEU 191 Cb 0.36 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1uj4 h LEU 191 CO 0.01 0.94 -0.13 -0.74 -0.34 0.00 0.00 178.44 178.18 1uj4 h HIS 192 N 0.78 -0.32 -0.10 1.25 2.76 -0.88 -0.85 115.15 117.80 1uj4 h HIS 192 Ca 0.15 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.29 1uj4 h HIS 192 Cb 0.47 0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.56 1uj4 h HIS 192 CO 0.03 -0.19 -0.15 0.00 -1.30 0.00 0.00 177.93 176.32 1uj4 h ARG 193 N -0.22 0.15 -0.21 5.26 3.08 -1.16 0.11 114.38 121.39 1uj4 h ARG 193 Ca 0.04 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 59.89 1uj4 h ARG 193 Cb 0.27 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 1uj4 h ARG 193 CO -0.12 0.31 -0.55 0.00 -1.07 0.00 0.00 179.97 178.55 1uj4 h ALA 194 N 1.71 0.64 -0.04 0.04 0.00 -0.74 -2.80 119.26 118.07 1uj4 h ALA 194 Ca 0.03 -0.51 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 1uj4 h ALA 194 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1uj4 h ALA 194 CO 0.02 0.69 -0.29 -0.07 0.00 0.00 0.00 179.25 179.60 1uj4 h LEU 195 N 0.49 0.33 -1.29 0.00 3.38 -0.78 -3.29 115.31 114.14 1uj4 h LEU 195 Ca 0.01 -0.69 0.13 0.00 0.09 0.00 0.00 57.88 57.42 1uj4 h LEU 195 Cb 1.11 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.69 1uj4 h LEU 195 CO 0.11 0.96 0.56 0.25 0.09 0.00 0.00 178.44 180.41 1uj4 h LEU 196 N -0.29 0.66 -2.52 1.67 5.85 -1.01 -0.82 115.31 118.85 1uj4 h LEU 196 Ca -0.03 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1uj4 h LEU 196 Cb 0.97 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 1uj4 h LEU 196 CO 0.06 0.35 -0.02 -0.08 -0.34 0.00 0.00 178.44 178.41 1uj4 h GLU 197 N 0.71 0.00 -6.36 1.25 4.81 -1.56 -3.41 114.58 110.02 1uj4 h GLU 197 Ca 0.43 0.00 -0.54 0.00 -0.13 0.00 0.00 59.36 59.12 1uj4 h GLU 197 Cb 0.65 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.03 1uj4 h GLU 197 CO -0.19 0.02 1.01 0.42 -0.73 0.00 0.00 179.01 179.54 1uj4 s ILE 198 N -4.15 3.37 0.26 2.32 1.01 -0.31 -4.88 121.20 118.82 1uj4 s ILE 198 Ca -0.04 0.66 -0.03 0.00 0.00 0.00 0.00 60.65 61.25 1uj4 s ILE 198 Cb 0.13 -3.43 0.28 0.00 0.01 0.00 0.00 42.46 39.45 1uj4 s ILE 198 CO 0.48 -0.03 1.66 -0.65 0.00 0.00 0.00 174.94 176.40 1uj4 h PRO 199 N 8.79 0.20 0.00 2.79 0.11 -1.88 -0.50 132.00 141.51 1uj4 h PRO 199 Ca -0.41 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1uj4 h PRO 199 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1uj4 h PRO 199 CO 0.94 0.13 0.00 0.41 -0.21 0.00 0.00 178.00 179.27 1uj4 n GLY 200 N -1.38 -1.22 3.61 -0.55 0.00 -1.26 -4.68 105.19 99.70 1uj4 n GLY 200 Ca 0.17 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1uj4 n GLY 200 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uj4 s VAL 201 N -3.10 4.82 -0.07 1.61 1.01 -0.20 -0.39 120.40 124.08 1uj4 s VAL 201 Ca 0.08 1.11 -0.24 0.00 0.00 0.00 0.00 61.98 62.93 1uj4 s VAL 201 Cb 0.11 -4.11 -0.30 0.00 0.00 0.00 0.00 36.38 32.08 1uj4 s VAL 201 CO 0.37 -0.23 0.87 0.58 0.00 0.00 0.00 175.10 176.69 1uj4 h VAL 202 N 5.59 1.59 -2.64 2.92 2.07 -1.17 -3.45 116.25 121.15 1uj4 h VAL 202 Ca -0.25 -2.48 0.13 0.00 0.82 0.00 0.00 66.70 64.92 1uj4 h VAL 202 Cb 1.10 3.25 -0.06 0.00 -1.52 0.00 0.00 31.29 34.06 1uj4 h VAL 202 CO 0.87 0.69 0.38 -1.61 0.02 0.00 0.00 177.57 177.91 1uj4 s GLU 203 N -2.39 1.49 0.20 1.57 0.41 -1.23 -5.02 118.70 113.73 1uj4 s GLU 203 Ca -0.15 -0.84 0.06 0.00 -0.41 0.00 0.00 54.97 53.63 1uj4 s GLU 203 Cb -0.00 0.50 -0.05 0.00 -1.78 0.00 0.00 34.13 32.80 1uj4 s GLU 203 CO 0.80 -0.68 -0.10 0.95 -0.49 0.00 0.00 175.26 175.74 1uj4 s THR 204 N -3.42 1.41 -1.96 3.63 -4.23 -1.26 -1.51 115.64 108.30 1uj4 s THR 204 Ca 0.12 -2.12 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 1uj4 s THR 204 Cb -0.03 -2.08 0.06 0.00 1.34 0.00 0.00 72.50 71.78 1uj4 s THR 204 CO 0.05 -0.56 1.03 0.61 -0.54 0.00 0.00 174.62 175.20 1uj4 n GLY 205 N -0.35 -0.60 3.58 3.99 0.00 0.19 -4.77 105.19 107.23 1uj4 n GLY 205 Ca -0.08 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1uj4 n GLY 205 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uj4 s LEU 206 N -0.97 4.03 -0.46 0.99 1.43 -1.26 -0.07 118.68 122.38 1uj4 s LEU 206 Ca 0.04 0.29 -0.07 0.00 -1.03 0.00 0.00 54.13 53.36 1uj4 s LEU 206 Cb 0.02 -3.18 0.12 0.00 0.03 0.00 0.00 46.19 43.18 1uj4 s LEU 206 CO 0.03 -0.94 0.31 -0.36 0.23 0.00 0.00 176.35 175.61 1uj4 s PHE 207 N 3.56 3.48 -0.09 0.29 0.40 0.23 -4.97 117.98 120.88 1uj4 s PHE 207 Ca 0.36 -2.06 0.01 0.00 -0.60 0.00 0.00 56.93 54.64 1uj4 s PHE 207 Cb -0.11 -3.41 -0.03 0.00 0.51 0.00 0.00 43.02 39.98 1uj4 s PHE 207 CO 0.22 -0.99 -0.09 0.08 0.70 0.00 0.00 175.22 175.14 1uj4 s VAL 208 N 1.26 3.45 -0.90 -0.44 1.01 -1.26 -0.34 120.40 123.18 1uj4 s VAL 208 Ca 0.07 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 1uj4 s VAL 208 Cb -0.25 -2.42 -0.06 0.00 0.00 0.00 0.00 36.38 33.65 1uj4 s VAL 208 CO -0.02 0.56 0.79 0.61 0.00 0.00 0.00 175.10 177.05 1uj4 n GLY 209 N 2.72 -0.89 0.00 4.51 0.00 -1.26 -5.06 105.19 105.21 1uj4 n GLY 209 Ca -0.18 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1uj4 n GLY 209 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uj4 n ALA 211 N -2.96 -0.53 0.16 4.61 0.00 -1.26 -5.17 120.51 115.35 1uj4 n ALA 211 Ca -0.06 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1uj4 n ALA 211 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 1uj4 n ALA 211 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1uj4 n THR 212 N 0.00 0.54 -3.61 0.00 -2.24 -0.48 -4.78 114.28 103.72 1uj4 n THR 212 Ca 0.00 -0.51 -0.03 0.00 -2.27 0.00 0.00 64.05 61.24 1uj4 n THR 212 Cb 0.00 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 67.94 1uj4 n THR 212 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uj4 s ARG 213 N -3.35 0.25 -0.01 -0.78 1.70 -1.20 -4.51 118.95 111.04 1uj4 s ARG 213 Ca -0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 55.73 55.16 1uj4 s ARG 213 Cb 0.10 0.11 0.02 0.00 -0.57 0.00 0.00 34.95 34.61 1uj4 s ARG 213 CO 0.79 -0.11 0.01 0.00 -1.08 0.00 0.00 175.30 174.91 1uj4 s ALA 214 N -2.32 0.13 -0.40 7.88 0.00 -0.28 -1.43 121.76 125.35 1uj4 s ALA 214 Ca 0.11 0.12 -0.11 0.00 0.00 0.00 0.00 51.96 52.08 1uj4 s ALA 214 Cb 0.00 -0.16 0.05 0.00 0.00 0.00 0.00 23.12 23.02 1uj4 s ALA 214 CO -0.04 -0.04 0.25 -0.51 0.00 0.00 0.00 175.76 175.42 1uj4 s LEU 215 N 0.56 5.00 -0.19 0.00 1.43 0.57 0.34 118.68 126.38 1uj4 s LEU 215 Ca -0.05 -1.25 -0.03 0.00 -1.03 0.00 0.00 54.13 51.77 1uj4 s LEU 215 Cb -0.07 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.11 1uj4 s LEU 215 CO -0.01 -0.48 -0.05 -0.69 0.23 0.00 0.00 176.35 175.35 1uj4 s VAL 216 N 1.51 3.46 -0.16 -1.59 1.01 0.26 -2.51 120.40 122.39 1uj4 s VAL 216 Ca 0.02 -0.48 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 1uj4 s VAL 216 Cb -0.21 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1uj4 s VAL 216 CO 0.05 0.45 0.09 0.00 0.00 0.00 0.00 175.10 175.69 1uj4 s ALA 217 N 1.06 3.57 0.13 5.51 0.00 -0.64 -0.26 121.76 131.13 1uj4 s ALA 217 Ca 0.01 -0.71 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 1uj4 s ALA 217 Cb -0.15 -1.93 0.01 0.00 0.00 0.00 0.00 23.12 21.06 1uj4 s ALA 217 CO -0.00 0.34 0.23 0.41 0.00 0.00 0.00 175.76 176.74 1uj4 n GLY 218 N 2.95 2.01 0.39 0.00 0.00 -0.20 -0.26 105.19 110.09 1uj4 n GLY 218 Ca -0.18 -1.20 0.18 0.00 0.00 0.00 0.00 46.02 44.82 1uj4 n GLY 218 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1uj4 h PRO 219 N 0.00 0.00 -0.57 1.61 0.13 -2.02 0.48 132.00 131.64 1uj4 h PRO 219 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1uj4 h PRO 219 Cb 0.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.53 1uj4 h PRO 219 CO 0.13 0.00 0.00 1.19 -0.23 0.00 0.00 178.00 179.09 1uj4 n PHE 220 N -3.23 0.75 0.00 1.56 3.01 -1.26 -5.07 117.46 113.21 1uj4 n PHE 220 Ca 0.06 -0.37 0.00 0.00 1.01 0.00 0.00 57.45 58.15 1uj4 n PHE 220 Cb 0.74 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.21 1uj4 n PHE 220 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1uj4 n GLY 221 N 1.57 -1.05 3.65 1.37 0.00 0.17 -4.95 105.19 105.94 1uj4 n GLY 221 Ca 0.22 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.69 1uj4 n GLY 221 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uj4 s VAL 222 N -0.07 5.17 0.08 1.61 1.01 -1.26 -1.03 120.40 125.90 1uj4 s VAL 222 Ca 0.00 0.72 0.08 0.00 0.00 0.00 0.00 61.98 62.77 1uj4 s VAL 222 Cb 0.00 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1uj4 s VAL 222 CO 0.00 0.20 -0.16 -0.70 0.00 0.00 0.00 175.10 174.44 1uj4 s GLU 223 N 1.65 2.00 -0.38 2.72 2.56 0.64 -4.93 118.70 122.96 1uj4 s GLU 223 Ca 0.19 -1.04 -0.13 0.00 0.00 0.00 0.00 54.97 53.98 1uj4 s GLU 223 Cb -0.15 -2.20 0.01 0.00 2.00 0.00 0.00 34.13 33.79 1uj4 s GLU 223 CO 0.09 0.52 0.26 -2.00 -0.56 0.00 0.00 175.26 173.56 1uj4 s GLU 224 N -1.81 3.12 -0.10 4.30 2.12 -1.26 -0.57 118.70 124.49 1uj4 s GLU 224 Ca 0.17 -0.90 -0.11 0.00 0.36 0.00 0.00 54.97 54.49 1uj4 s GLU 224 Cb -0.11 -3.86 -0.05 0.00 0.26 0.00 0.00 34.13 30.38 1uj4 s GLU 224 CO 0.08 -0.63 0.24 -0.51 -0.54 0.00 0.00 175.26 173.90 1uj4 s LEU 225 N 1.67 4.37 0.28 2.70 1.43 0.15 -4.92 118.68 124.35 1uj4 s LEU 225 Ca 0.05 0.58 0.10 0.00 -1.03 0.00 0.00 54.13 53.83 1uj4 s LEU 225 Cb -0.18 -2.27 -0.05 0.00 0.03 0.00 0.00 46.19 43.72 1uj4 s LEU 225 CO 0.09 0.30 -0.06 -0.76 0.23 0.00 0.00 176.35 176.16 1uj4 s LEU 226 N -0.61 2.99 0.00 1.79 1.43 -1.26 -1.12 118.68 121.91 1uj4 s LEU 226 Ca 0.17 -0.79 0.16 0.00 -1.03 0.00 0.00 54.13 52.64 1uj4 s LEU 226 Cb -0.13 -1.50 0.96 0.00 0.03 0.00 0.00 46.19 45.55 1uj4 s LEU 226 CO 0.06 -0.01 1.37 -2.65 0.23 0.00 0.00 176.35 175.35