#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c0w n ASP 3 N 0.00 0.00 0.01 -5.58 2.03 -1.26 -5.03 116.55 106.73 1c0w n ASP 3 Ca 0.00 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.32 1c0w n ASP 3 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 1c0w n ASP 3 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1c0w n LEU 4 N 0.00 0.03 0.00 -2.67 4.77 -1.26 -4.80 117.00 113.07 1c0w n LEU 4 Ca 0.00 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1c0w n LEU 4 Cb 0.00 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1c0w n LEU 4 CO 0.00 -0.46 0.00 0.52 -1.33 0.00 0.00 177.39 176.12 1c0w n VAL 5 N -1.48 0.00 -3.67 4.08 0.31 -1.26 -4.37 118.33 111.94 1c0w n VAL 5 Ca -0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.07 1c0w n VAL 5 Cb 0.08 0.00 -0.17 0.00 -0.91 0.00 0.00 33.84 32.84 1c0w n VAL 5 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1c0w s ASP 6 N 0.00 2.47 0.06 4.52 -1.08 -1.26 -5.06 116.67 116.32 1c0w s ASP 6 Ca 0.00 -0.63 -0.34 0.00 -0.52 0.00 0.00 52.55 51.06 1c0w s ASP 6 Cb 0.00 -0.39 -0.19 0.00 -1.46 0.00 0.00 42.92 40.88 1c0w s ASP 6 CO 0.00 -0.32 1.57 0.74 0.52 0.00 0.00 175.17 177.68 1c0w h THR 7 N 6.45 0.23 -0.79 1.71 2.02 -1.99 -2.62 112.91 117.93 1c0w h THR 7 Ca -0.16 -0.03 0.14 0.00 0.77 0.00 0.00 66.41 67.13 1c0w h THR 7 Cb 1.14 0.24 -0.09 0.00 -1.74 0.00 0.00 68.15 67.70 1c0w h THR 7 CO 0.30 0.00 0.36 0.74 0.37 0.00 0.00 175.52 177.30 1c0w h THR 8 N -1.05 0.70 0.53 3.16 2.02 -1.97 -0.73 112.91 115.57 1c0w h THR 8 Ca -0.11 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 1c0w h THR 8 Cb 0.79 0.12 0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1c0w h THR 8 CO 0.17 0.10 -0.26 -0.33 0.37 0.00 0.00 175.52 175.57 1c0w h GLU 9 N 0.53 -0.69 0.00 6.66 5.08 -1.94 -0.92 114.58 123.30 1c0w h GLU 9 Ca 0.43 0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.84 1c0w h GLU 9 Cb 0.62 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.03 1c0w h GLU 9 CO -0.38 -0.46 -0.01 0.52 -1.00 0.00 0.00 179.01 177.69 1c0w h MET 10 N -0.73 0.00 0.17 2.33 2.86 -1.05 0.32 114.93 118.84 1c0w h MET 10 Ca -0.07 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 1c0w h MET 10 Cb 0.55 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1c0w h MET 10 CO 0.12 0.01 -0.08 1.88 1.06 0.00 0.00 176.91 179.90 1c0w h TYR 11 N 0.00 -0.22 -0.63 -0.22 -1.99 -0.66 -1.73 116.97 111.52 1c0w h TYR 11 Ca -0.00 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 1c0w h TYR 11 Cb 0.03 0.07 -0.03 0.00 2.00 0.00 0.00 36.73 38.80 1c0w h TYR 11 CO 0.00 0.21 0.32 -0.07 -0.00 0.00 0.00 178.16 178.62 1c0w h LEU 12 N -0.79 0.81 -1.49 3.88 3.38 -0.52 -0.99 115.31 119.59 1c0w h LEU 12 Ca -0.02 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1c0w h LEU 12 Cb 0.52 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1c0w h LEU 12 CO 0.04 0.70 0.32 -0.09 0.09 0.00 0.00 178.44 179.50 1c0w h ARG 13 N 0.86 0.66 -0.16 1.13 2.43 -0.44 -0.40 114.38 118.46 1c0w h ARG 13 Ca 0.22 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.24 1c0w h ARG 13 Cb 0.09 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.49 1c0w h ARG 13 CO -0.03 0.45 -0.31 1.15 -1.51 0.00 0.00 179.97 179.71 1c0w h THR 14 N 0.68 1.35 -0.41 0.20 2.02 -0.44 0.47 112.91 116.79 1c0w h THR 14 Ca 0.18 -1.56 0.06 0.00 0.77 0.00 0.00 66.41 65.86 1c0w h THR 14 Cb -0.06 1.95 -0.05 0.00 -1.74 0.00 0.00 68.15 68.25 1c0w h THR 14 CO -0.04 0.47 0.10 0.40 0.37 0.00 0.00 175.52 176.83 1c0w h ILE 15 N 0.13 0.81 0.01 3.11 2.04 -0.73 0.15 117.51 123.03 1c0w h ILE 15 Ca 0.01 -0.08 0.03 0.00 1.00 0.00 0.00 64.86 65.81 1c0w h ILE 15 Cb 0.91 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 1c0w h ILE 15 CO 0.07 0.04 -0.39 0.22 0.00 0.00 0.00 178.15 178.10 1c0w h TYR 16 N 0.24 -1.09 -0.68 1.37 5.03 -0.93 -1.19 116.97 119.73 1c0w h TYR 16 Ca 0.20 0.03 0.13 0.00 2.58 0.00 0.00 58.73 61.68 1c0w h TYR 16 Cb 0.22 0.48 -0.10 0.00 1.55 0.00 0.00 36.73 38.89 1c0w h TYR 16 CO -0.19 -0.47 0.18 1.49 -1.32 0.00 0.00 178.16 177.85 1c0w h GLU 17 N -0.55 0.29 -0.45 1.82 4.81 -0.04 -0.53 114.58 119.94 1c0w h GLU 17 Ca 0.05 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1c0w h GLU 17 Cb 0.63 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.91 1c0w h GLU 17 CO -0.30 0.19 0.25 -0.07 -0.73 0.00 0.00 179.01 178.36 1c0w h LEU 18 N 0.30 0.40 -0.63 1.64 3.38 -0.01 0.10 115.31 120.49 1c0w h LEU 18 Ca 0.37 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.41 1c0w h LEU 18 Cb 0.58 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.20 1c0w h LEU 18 CO -0.44 0.28 0.33 -0.33 0.09 0.00 0.00 178.44 178.37 1c0w h GLU 19 N 0.51 0.59 0.10 1.13 5.08 -0.03 0.11 114.58 122.06 1c0w h GLU 19 Ca 0.18 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1c0w h GLU 19 Cb 0.04 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 1c0w h GLU 19 CO -0.10 0.39 -0.30 0.93 -1.00 0.00 0.00 179.01 178.93 1c0w h GLU 20 N 0.60 -0.49 0.00 2.33 5.08 0.05 -0.17 114.58 121.99 1c0w h GLU 20 Ca 0.29 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1c0w h GLU 20 Cb 0.22 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1c0w h GLU 20 CO -0.20 -0.33 0.00 0.39 -1.00 0.00 0.00 179.01 177.87 1c0w n GLU 21 N -5.41 0.30 -1.02 2.33 1.02 -0.09 -4.83 120.64 112.93 1c0w n GLU 21 Ca -0.06 0.09 -0.01 0.00 -0.02 0.00 0.00 57.16 57.16 1c0w n GLU 21 Cb 0.32 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.23 1c0w n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1c0w n GLY 22 N -0.10 0.48 3.89 0.62 0.00 -0.07 -4.97 105.19 105.04 1c0w n GLY 22 Ca 0.08 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.27 1c0w n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c0w s VAL 23 N -1.99 4.95 -0.19 1.61 1.01 0.22 -4.97 120.40 121.02 1c0w s VAL 23 Ca 0.00 0.31 -0.28 0.00 0.00 0.00 0.00 61.98 62.01 1c0w s VAL 23 Cb 0.00 -3.69 -0.00 0.00 0.00 0.00 0.00 36.38 32.69 1c0w s VAL 23 CO 0.00 -0.26 0.97 -0.89 0.00 0.00 0.00 175.10 174.92 1c0w s THR 24 N -2.03 4.76 -0.23 3.92 2.01 -1.26 -3.93 115.64 118.87 1c0w s THR 24 Ca 0.46 1.91 -0.28 0.00 0.31 0.00 0.00 61.69 64.09 1c0w s THR 24 Cb -0.11 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.10 1c0w s THR 24 CO 0.27 -0.09 1.98 -2.16 -0.69 0.00 0.00 174.62 173.93 1c0w s PRO 25 N 2.71 3.39 0.01 4.92 0.04 -1.26 -4.91 135.00 139.90 1c0w s PRO 25 Ca 0.43 1.86 0.04 0.00 0.04 0.00 0.00 61.00 63.37 1c0w s PRO 25 Cb -0.16 -4.25 -0.01 0.00 0.04 0.00 0.00 34.50 30.11 1c0w s PRO 25 CO 0.10 -1.80 -0.13 -0.51 0.04 0.00 0.00 177.00 174.69 1c0w s LEU 26 N 7.06 2.08 0.32 -3.56 1.43 -1.26 -0.70 118.68 124.04 1c0w s LEU 26 Ca 0.89 -0.32 0.10 0.00 -1.03 0.00 0.00 54.13 53.77 1c0w s LEU 26 Cb -0.30 -0.65 0.94 0.00 0.03 0.00 0.00 46.19 46.22 1c0w s LEU 26 CO 0.35 0.11 1.67 0.03 0.23 0.00 0.00 176.35 178.74 1c0w h ARG 27 N 5.49 0.34 -0.99 1.70 -0.00 -1.93 0.45 114.38 119.45 1c0w h ARG 27 Ca -0.35 -0.02 0.12 0.00 -0.50 0.00 0.00 59.98 59.23 1c0w h ARG 27 Cb 1.17 -0.08 -0.08 0.00 0.00 0.00 0.00 29.97 30.98 1c0w h ARG 27 CO 0.47 0.23 0.62 0.00 0.00 0.00 0.00 179.97 181.29 1c0w h ALA 28 N 1.80 1.57 0.63 0.04 0.00 -1.95 -1.42 119.26 119.93 1c0w h ALA 28 Ca 0.66 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.56 1c0w h ALA 28 Cb 1.42 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 19.02 1c0w h ALA 28 CO -0.59 0.19 -0.30 0.00 0.00 0.00 0.00 179.25 178.55 1c0w h ARG 29 N 0.95 -0.81 -0.70 0.00 2.47 -0.45 -2.24 114.38 113.59 1c0w h ARG 29 Ca 0.49 0.06 0.16 0.00 -1.26 0.00 0.00 59.98 59.42 1c0w h ARG 29 Cb 0.52 0.19 -0.12 0.00 -1.65 0.00 0.00 29.97 28.91 1c0w h ARG 29 CO -0.25 -0.51 0.02 0.82 0.56 0.00 0.00 179.97 180.61 1c0w h ILE 30 N -0.96 0.41 0.26 2.04 2.04 -1.23 0.25 117.51 120.31 1c0w h ILE 30 Ca -0.09 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1c0w h ILE 30 Cb 0.68 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 37.00 1c0w h ILE 30 CO 0.14 0.02 -0.51 0.00 0.00 0.00 0.00 178.15 177.81 1c0w h ALA 31 N 1.65 -1.01 -0.34 1.87 0.00 -1.11 0.58 119.26 120.89 1c0w h ALA 31 Ca 0.38 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1c0w h ALA 31 Cb 0.65 0.81 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1c0w h ALA 31 CO -0.60 -1.13 0.10 1.05 0.00 0.00 0.00 179.25 178.67 1c0w h GLU 32 N -0.83 0.54 -0.82 0.00 4.11 -0.71 0.31 114.58 117.17 1c0w h GLU 32 Ca -0.02 -0.12 0.01 0.00 0.07 0.00 0.00 59.36 59.31 1c0w h GLU 32 Cb 0.79 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.92 1c0w h GLU 32 CO -0.20 0.57 0.54 0.00 0.07 0.00 0.00 179.01 179.99 1c0w h ARG 33 N 0.40 1.06 -0.49 1.06 3.08 -0.38 -2.48 114.38 116.62 1c0w h ARG 33 Ca 0.11 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1c0w h ARG 33 Cb 0.26 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1c0w h ARG 33 CO -0.00 0.70 0.00 1.28 -1.07 0.00 0.00 179.97 180.88 1c0w n LEU 34 N -4.53 3.23 -3.89 3.04 4.77 0.20 -4.98 117.00 114.85 1c0w n LEU 34 Ca 0.09 -1.51 -0.38 0.00 -0.03 0.00 0.00 56.01 54.18 1c0w n LEU 34 Cb 0.03 -0.32 0.03 0.00 -2.33 0.00 0.00 43.42 40.83 1c0w n LEU 34 CO 0.36 0.75 -0.13 -0.62 -1.33 0.00 0.00 177.39 176.42 1c0w n GLU 35 N 1.30 -0.85 -4.21 3.23 1.02 0.96 -4.98 120.64 117.11 1c0w n GLU 35 Ca 0.20 0.27 -0.17 0.00 -0.02 0.00 0.00 57.16 57.43 1c0w n GLU 35 Cb 0.54 -3.39 -0.12 0.00 -0.02 0.00 0.00 31.44 28.44 1c0w n GLU 35 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1c0w s GLN 36 N -6.71 0.76 0.73 3.49 -0.21 -0.39 -5.03 119.66 112.30 1c0w s GLN 36 Ca 0.45 -0.79 -0.16 0.00 0.02 0.00 0.00 55.36 54.89 1c0w s GLN 36 Cb -0.21 -0.71 0.00 0.00 1.00 0.00 0.00 33.01 33.10 1c0w s GLN 36 CO 0.92 0.16 0.87 0.45 -2.12 0.00 0.00 175.29 175.57 1c0w n SER 37 N 1.65 0.08 0.48 5.90 2.88 -1.26 -4.59 113.62 118.76 1c0w n SER 37 Ca -0.20 0.64 -0.20 0.00 -1.33 0.00 0.00 58.87 57.77 1c0w n SER 37 Cb 0.55 -1.37 -0.10 0.00 -0.75 0.00 0.00 64.21 62.54 1c0w n SER 37 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1c0w h GLY 38 N -0.36 -1.35 0.19 0.46 0.00 -1.98 -2.37 103.07 97.65 1c0w h GLY 38 Ca -0.47 0.52 0.16 0.00 0.00 0.00 0.00 47.33 47.55 1c0w h GLY 38 CO 0.45 -0.48 0.51 -2.55 0.00 0.00 0.00 176.54 174.47 1c0w h PRO 39 N -1.27 0.67 0.23 4.80 0.11 -1.99 -1.64 132.00 132.92 1c0w h PRO 39 Ca -0.12 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1c0w h PRO 39 Cb 0.99 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.91 1c0w h PRO 39 CO 0.17 0.44 -0.47 1.15 -0.21 0.00 0.00 178.00 179.08 1c0w h THR 40 N 0.69 0.00 -0.90 -1.15 2.02 -1.86 -1.39 112.91 110.32 1c0w h THR 40 Ca 0.51 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.69 1c0w h THR 40 Cb 0.74 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 1c0w h THR 40 CO -0.37 0.00 0.55 -0.37 0.37 0.00 0.00 175.52 175.70 1c0w h VAL 41 N -0.76 1.25 -0.08 3.16 -1.51 -0.97 0.05 116.25 117.39 1c0w h VAL 41 Ca -0.02 -0.53 -0.01 0.00 -1.23 0.00 0.00 66.70 64.91 1c0w h VAL 41 Cb 0.72 -0.03 -0.00 0.00 -2.13 0.00 0.00 31.29 29.85 1c0w h VAL 41 CO -0.19 0.26 0.01 0.28 -1.23 0.00 0.00 177.57 176.70 1c0w h SER 42 N 1.24 0.09 0.00 4.19 0.02 -1.07 -0.25 113.55 117.77 1c0w h SER 42 Ca 0.32 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1c0w h SER 42 Cb -0.06 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.45 1c0w h SER 42 CO -0.06 0.11 -0.00 -0.61 -1.14 0.00 0.00 176.83 175.12 1c0w h GLN 43 N 0.11 -0.00 -0.81 3.45 4.15 -0.41 -2.47 115.11 119.13 1c0w h GLN 43 Ca 0.03 0.00 0.14 0.00 0.77 0.00 0.00 58.65 59.59 1c0w h GLN 43 Cb 0.06 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 27.65 1c0w h GLN 43 CO -0.00 0.88 0.38 1.15 -1.93 0.00 0.00 178.83 179.31 1c0w h THR 44 N -1.00 0.70 -0.81 2.39 2.02 -0.87 0.13 112.91 115.48 1c0w h THR 44 Ca -0.00 -0.19 -0.04 0.00 0.77 0.00 0.00 66.41 66.95 1c0w h THR 44 Cb 0.88 0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 1c0w h THR 44 CO 0.00 0.10 0.33 0.58 0.37 0.00 0.00 175.52 176.90 1c0w h VAL 45 N 0.55 1.26 -0.63 3.16 2.07 -1.12 -1.82 116.25 119.72 1c0w h VAL 45 Ca 0.44 -0.81 0.05 0.00 0.82 0.00 0.00 66.70 67.20 1c0w h VAL 45 Cb 0.64 0.28 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 1c0w h VAL 45 CO -0.38 0.33 0.35 0.00 0.02 0.00 0.00 177.57 177.89 1c0w h ALA 46 N 1.19 0.83 -0.12 1.67 0.00 -0.29 0.13 119.26 122.66 1c0w h ALA 46 Ca 0.27 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.24 1c0w h ALA 46 Cb 0.20 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 1c0w h ALA 46 CO -0.02 0.03 -0.18 -0.09 0.00 0.00 0.00 179.25 178.98 1c0w h ARG 47 N 0.65 -0.22 -0.15 0.00 2.43 -0.67 0.11 114.38 116.53 1c0w h ARG 47 Ca 0.28 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.51 1c0w h ARG 47 Cb 0.15 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.69 1c0w h ARG 47 CO -0.17 -0.15 -0.31 0.52 -1.51 0.00 0.00 179.97 178.36 1c0w h MET 48 N -0.23 -0.36 -0.95 0.20 2.86 -0.42 -0.28 114.93 115.75 1c0w h MET 48 Ca 0.09 0.02 0.11 0.00 -2.06 0.00 0.00 59.70 57.87 1c0w h MET 48 Cb 0.37 0.08 -0.07 0.00 0.06 0.00 0.00 31.60 32.03 1c0w h MET 48 CO -0.25 -0.24 0.61 1.49 1.06 0.00 0.00 176.91 179.57 1c0w h GLU 49 N -0.37 0.90 0.00 1.72 4.81 -0.20 0.27 114.58 121.71 1c0w h GLU 49 Ca 0.10 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1c0w h GLU 49 Cb 0.53 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 1c0w h GLU 49 CO -0.36 0.60 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.33 1c0w h ARG 50 N 0.93 0.00 -0.78 1.92 2.43 0.86 -0.31 114.38 119.43 1c0w h ARG 50 Ca 0.45 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 59.38 1c0w h ARG 50 Cb 0.46 0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 29.87 1c0w h ARG 50 CO -0.21 0.10 0.31 -0.25 -1.51 0.00 0.00 179.97 178.40 1c0w n ASP 51 N -3.98 4.82 -4.19 -3.80 8.00 0.88 -4.94 116.55 113.35 1c0w n ASP 51 Ca -0.02 -3.25 -0.36 0.00 0.71 0.00 0.00 54.79 51.87 1c0w n ASP 51 Cb 0.19 -0.76 -0.05 0.00 -0.02 0.00 0.00 41.12 40.48 1c0w n ASP 51 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1c0w n GLY 52 N -0.20 -0.43 0.03 0.44 0.00 -0.13 -4.80 105.19 100.10 1c0w n GLY 52 Ca 0.43 0.09 0.11 0.00 0.00 0.00 0.00 46.02 46.65 1c0w n GLY 52 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1c0w n LEU 53 N -4.05 0.24 -3.56 0.99 4.77 -0.84 -4.40 117.00 110.16 1c0w n LEU 53 Ca 0.09 0.04 -0.06 0.00 -0.03 0.00 0.00 56.01 56.05 1c0w n LEU 53 Cb 0.48 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1c0w n LEU 53 CO 0.82 -0.03 0.79 0.54 -1.33 0.00 0.00 177.39 178.19 1c0w s VAL 54 N -3.45 0.00 -0.00 4.08 0.11 -1.26 -2.36 120.40 117.52 1c0w s VAL 54 Ca -0.05 -0.07 0.01 0.00 -2.93 0.00 0.00 61.98 58.93 1c0w s VAL 54 Cb 0.13 -1.14 -0.00 0.00 -1.53 0.00 0.00 36.38 33.84 1c0w s VAL 54 CO 0.88 0.00 -0.03 0.68 -3.33 0.00 0.00 175.10 173.30 1c0w s VAL 55 N -2.92 0.23 -0.39 2.04 -7.23 -0.55 -3.75 120.40 107.82 1c0w s VAL 55 Ca 0.07 -0.11 -0.24 0.00 -1.81 0.00 0.00 61.98 59.89 1c0w s VAL 55 Cb -0.01 -0.20 0.02 0.00 0.56 0.00 0.00 36.38 36.75 1c0w s VAL 55 CO -0.07 0.07 0.82 -0.69 -0.31 0.00 0.00 175.10 174.92 1c0w s VAL 56 N -0.02 4.66 1.03 1.32 1.01 -1.26 -1.14 120.40 126.00 1c0w s VAL 56 Ca 0.01 0.83 -0.13 0.00 0.00 0.00 0.00 61.98 62.69 1c0w s VAL 56 Cb -0.02 -4.28 0.14 0.00 0.00 0.00 0.00 36.38 32.23 1c0w s VAL 56 CO -0.00 -0.55 0.67 0.00 0.00 0.00 0.00 175.10 175.21 1c0w n ALA 57 N 6.62 -2.52 0.30 5.51 0.00 0.22 -4.79 120.51 125.85 1c0w n ALA 57 Ca 0.04 -0.87 0.16 0.00 0.00 0.00 0.00 53.44 52.76 1c0w n ALA 57 Cb 0.48 -1.90 0.95 0.00 0.00 0.00 0.00 19.45 18.99 1c0w n ALA 57 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1c0w h SER 58 N -2.03 0.00 -0.63 0.00 4.64 -1.95 0.59 113.55 114.17 1c0w h SER 58 Ca -0.50 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.73 1c0w h SER 58 Cb 1.31 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.34 1c0w h SER 58 CO 0.40 0.01 0.11 -0.90 -0.87 0.00 0.00 176.83 175.58 1c0w n ASP 59 N -3.74 5.28 0.00 4.97 5.68 -1.26 -4.92 116.55 122.56 1c0w n ASP 59 Ca -0.03 -3.07 0.00 0.00 -0.50 0.00 0.00 54.79 51.19 1c0w n ASP 59 Cb 0.09 -0.71 0.00 0.00 -1.14 0.00 0.00 41.12 39.36 1c0w n ASP 59 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1c0w n ARG 60 N 0.23 -0.20 -2.64 0.11 1.74 0.20 -4.99 116.66 111.12 1c0w n ARG 60 Ca 0.33 0.05 -0.31 0.00 -0.77 0.00 0.00 57.85 57.15 1c0w n ARG 60 Cb 1.27 -3.65 -0.03 0.00 -1.02 0.00 0.00 32.46 29.03 1c0w n ARG 60 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1c0w s SER 61 N -2.38 6.59 -0.38 0.55 1.04 -1.26 -4.45 113.70 113.40 1c0w s SER 61 Ca 0.00 1.36 -0.15 0.00 0.48 0.00 0.00 55.95 57.64 1c0w s SER 61 Cb 0.00 -2.42 0.01 0.00 0.10 0.00 0.00 66.02 63.71 1c0w s SER 61 CO 0.00 -0.48 0.34 -0.76 0.98 0.00 0.00 173.24 173.32 1c0w s LEU 62 N -3.92 4.77 -0.43 2.42 1.43 0.12 0.73 118.68 123.80 1c0w s LEU 62 Ca 0.55 -0.59 -0.09 0.00 -1.03 0.00 0.00 54.13 52.97 1c0w s LEU 62 Cb -0.10 -2.26 0.09 0.00 0.03 0.00 0.00 46.19 43.95 1c0w s LEU 62 CO 0.31 -0.42 0.29 -1.10 0.23 0.00 0.00 176.35 175.65 1c0w s GLN 63 N 1.89 2.59 0.31 1.70 -0.21 -0.30 -4.79 119.66 120.86 1c0w s GLN 63 Ca 0.09 -1.53 -0.29 0.00 0.02 0.00 0.00 55.36 53.65 1c0w s GLN 63 Cb -0.18 -3.83 -0.12 0.00 1.00 0.00 0.00 33.01 29.88 1c0w s GLN 63 CO 0.11 -1.01 1.43 -1.33 -2.12 0.00 0.00 175.29 172.37 1c0w n MET 64 N 4.93 2.34 -1.33 2.91 2.81 -1.26 -1.48 117.12 126.03 1c0w n MET 64 Ca -0.10 0.83 -0.29 0.00 -1.81 0.00 0.00 57.70 56.33 1c0w n MET 64 Cb 0.42 -2.50 0.16 0.00 -0.71 0.00 0.00 33.22 30.59 1c0w n MET 64 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1c0w s THR 65 N -0.56 2.11 0.15 2.03 -4.23 -0.99 -4.59 115.64 109.55 1c0w s THR 65 Ca 0.60 0.04 -0.19 0.00 -1.18 0.00 0.00 61.69 60.96 1c0w s THR 65 Cb -0.56 -2.64 0.04 0.00 1.34 0.00 0.00 72.50 70.69 1c0w s THR 65 CO 0.56 -0.05 1.67 1.55 -0.54 0.00 0.00 174.62 177.82 1c0w h PRO 66 N -1.70 -0.04 -0.84 3.99 0.13 -1.90 0.68 132.00 132.31 1c0w h PRO 66 Ca -0.53 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.60 1c0w h PRO 66 Cb 1.33 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.43 1c0w h PRO 66 CO 0.59 -0.03 0.51 0.00 -0.23 0.00 0.00 178.00 178.84 1c0w h THR 67 N -0.04 1.24 -0.35 1.56 1.03 -1.91 0.17 112.91 114.60 1c0w h THR 67 Ca 0.15 -0.52 -0.05 0.00 -0.01 0.00 0.00 66.41 65.98 1c0w h THR 67 Cb 0.27 0.06 -0.01 0.00 -1.07 0.00 0.00 68.15 67.40 1c0w h THR 67 CO -0.34 0.25 0.01 1.23 -0.01 0.00 0.00 175.52 176.66 1c0w h GLY 68 N 1.16 0.66 0.39 2.99 0.00 -1.30 -2.70 103.07 104.27 1c0w h GLY 68 Ca 0.30 -0.48 0.06 0.00 0.00 0.00 0.00 47.33 47.21 1c0w h GLY 68 CO -0.06 0.44 -0.09 -0.09 0.00 0.00 0.00 176.54 176.74 1c0w h ARG 69 N 0.42 -0.04 -0.48 4.80 9.65 0.85 -0.22 114.38 129.37 1c0w h ARG 69 Ca 0.10 0.00 0.10 0.00 -1.10 0.00 0.00 59.98 59.08 1c0w h ARG 69 Cb 0.44 0.01 -0.09 0.00 -1.39 0.00 0.00 29.97 28.94 1c0w h ARG 69 CO 0.02 -0.02 -0.10 1.15 2.80 0.00 0.00 179.97 183.81 1c0w h THR 70 N -0.04 0.54 -0.27 0.20 2.02 -0.52 -0.87 112.91 113.96 1c0w h THR 70 Ca 0.14 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 67.27 1c0w h THR 70 Cb 0.25 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1c0w h THR 70 CO -0.31 0.00 -0.02 0.25 0.37 0.00 0.00 175.52 175.82 1c0w h LEU 71 N 0.02 0.49 -0.61 2.58 5.85 -1.13 -1.88 115.31 120.63 1c0w h LEU 71 Ca 0.23 -0.32 0.13 0.00 0.84 0.00 0.00 57.88 58.75 1c0w h LEU 71 Cb 0.35 -0.13 -0.11 0.00 0.37 0.00 0.00 40.66 41.15 1c0w h LEU 71 CO -0.48 0.69 -0.07 0.00 -0.34 0.00 0.00 178.44 178.25 1c0w h ALA 72 N 0.81 0.51 0.09 1.25 0.00 -0.46 -0.00 119.26 121.45 1c0w h ALA 72 Ca 0.08 0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.20 1c0w h ALA 72 Cb 0.45 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1c0w h ALA 72 CO 0.02 -0.41 -0.10 1.15 0.00 0.00 0.00 179.25 179.90 1c0w h THR 73 N 0.06 0.76 -0.95 0.00 2.02 -1.01 -1.95 112.91 111.84 1c0w h THR 73 Ca 0.31 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.62 1c0w h THR 73 Cb 0.49 0.76 -0.08 0.00 -1.74 0.00 0.00 68.15 67.58 1c0w h THR 73 CO -0.57 0.00 0.60 0.00 0.37 0.00 0.00 175.52 175.92 1c0w h ALA 74 N 0.68 1.69 0.10 6.16 0.00 -0.36 0.17 119.26 127.70 1c0w h ALA 74 Ca 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1c0w h ALA 74 Cb 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1c0w h ALA 74 CO -0.04 0.05 -0.05 0.28 0.00 0.00 0.00 179.25 179.49 1c0w h VAL 75 N 0.82 1.09 -0.74 0.00 2.07 -0.67 0.59 116.25 119.40 1c0w h VAL 75 Ca 0.48 -0.73 0.07 0.00 0.82 0.00 0.00 66.70 67.34 1c0w h VAL 75 Cb 0.64 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.91 1c0w h VAL 75 CO -0.24 0.18 0.42 -0.03 0.02 0.00 0.00 177.57 177.92 1c0w h MET 76 N -0.47 0.73 0.31 1.57 4.05 -0.59 0.21 114.93 120.75 1c0w h MET 76 Ca -0.01 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1c0w h MET 76 Cb 0.39 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 31.00 1c0w h MET 76 CO 0.02 0.48 -0.37 -0.09 0.23 0.00 0.00 176.91 177.18 1c0w h ARG 77 N 0.75 -0.70 -0.93 0.39 2.43 -0.52 -1.30 114.38 114.50 1c0w h ARG 77 Ca 0.34 0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.72 1c0w h ARG 77 Cb 0.24 0.16 -0.10 0.00 -0.42 0.00 0.00 29.97 29.85 1c0w h ARG 77 CO -0.20 -0.47 0.53 0.87 -1.51 0.00 0.00 179.97 179.18 1c0w h LYS 78 N -0.73 0.69 0.26 0.20 6.56 0.01 -0.40 116.57 123.16 1c0w h LYS 78 Ca -0.01 -0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.52 1c0w h LYS 78 Cb 0.67 -0.16 -0.00 0.00 -0.57 0.00 0.00 32.23 32.18 1c0w h LYS 78 CO -0.10 0.46 -0.18 1.25 -2.06 0.00 0.00 179.45 178.82 1c0w h HIS 79 N 0.71 -0.48 -0.98 -1.35 2.76 0.36 -0.44 115.15 115.73 1c0w h HIS 79 Ca 0.52 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.77 1c0w h HIS 79 Cb 0.75 0.17 -0.07 0.00 1.55 0.00 0.00 27.41 29.81 1c0w h HIS 79 CO -0.05 -0.26 0.63 0.00 -1.30 0.00 0.00 177.93 176.95 1c0w h ARG 80 N -0.41 1.05 -0.49 5.26 3.08 -1.03 -0.42 114.38 121.41 1c0w h ARG 80 Ca -0.03 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 59.97 1c0w h ARG 80 Cb 0.34 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1c0w h ARG 80 CO 0.02 0.69 0.30 -0.07 -1.07 0.00 0.00 179.97 179.85 1c0w h LEU 81 N 1.08 0.51 -0.60 3.04 4.07 -0.99 -1.10 115.31 121.32 1c0w h LEU 81 Ca 0.44 -0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.39 1c0w h LEU 81 Cb 0.28 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 41.88 1c0w h LEU 81 CO -0.19 0.36 0.33 0.00 -1.08 0.00 0.00 178.44 177.87 1c0w h ALA 82 N 1.20 0.77 -0.20 1.53 0.00 0.14 -2.05 119.26 120.65 1c0w h ALA 82 Ca 0.19 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1c0w h ALA 82 Cb -0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 1c0w h ALA 82 CO -0.07 0.28 -0.04 0.93 0.00 0.00 0.00 179.25 180.35 1c0w h GLU 83 N 0.81 0.01 -0.19 0.00 5.08 -0.42 0.23 114.58 120.09 1c0w h GLU 83 Ca 0.21 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.61 1c0w h GLU 83 Cb 0.03 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.24 1c0w h GLU 83 CO -0.03 0.01 -0.08 0.00 -1.00 0.00 0.00 179.01 177.90 1c0w h ARG 84 N 0.01 -0.06 -0.38 2.33 2.47 -0.95 -0.21 114.38 117.59 1c0w h ARG 84 Ca 0.10 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 1c0w h ARG 84 Cb 0.14 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.46 1c0w h ARG 84 CO -0.20 -0.04 0.24 1.25 0.56 0.00 0.00 179.97 181.78 1c0w h LEU 85 N -0.06 0.45 -0.76 3.04 5.85 -0.98 0.51 115.31 123.36 1c0w h LEU 85 Ca 0.10 -0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.86 1c0w h LEU 85 Cb 0.21 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 1c0w h LEU 85 CO -0.23 0.34 0.44 -0.07 -0.34 0.00 0.00 178.44 178.59 1c0w h LEU 86 N 0.51 0.67 0.00 2.25 3.38 0.16 -0.15 115.31 122.12 1c0w h LEU 86 Ca 0.14 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1c0w h LEU 86 Cb -0.03 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1c0w h LEU 86 CO -0.03 0.42 -0.14 0.71 0.09 0.00 0.00 178.44 179.49 1c0w h THR 87 N 0.80 0.15 -0.10 0.22 1.35 -0.78 0.69 112.91 115.24 1c0w h THR 87 Ca 0.34 -1.13 0.03 0.00 -0.55 0.00 0.00 66.41 65.11 1c0w h THR 87 Cb 0.22 0.30 -0.04 0.00 -1.73 0.00 0.00 68.15 66.90 1c0w h THR 87 CO -0.19 0.05 -0.11 0.44 -0.25 0.00 0.00 175.52 175.46 1c0w h ASP 88 N -1.00 -0.35 0.00 5.36 3.32 -0.03 -2.48 116.42 121.24 1c0w h ASP 88 Ca -0.01 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1c0w h ASP 88 Cb 0.22 0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1c0w h ASP 88 CO -0.01 -0.15 -0.55 -0.38 -1.72 0.00 0.00 179.24 176.44 1c0w n ILE 89 N -5.25 1.12 0.03 0.35 -0.00 -0.18 -4.56 119.36 110.88 1c0w n ILE 89 Ca -0.04 0.26 0.00 0.00 -0.00 0.00 0.00 62.75 62.97 1c0w n ILE 89 Cb 0.18 -2.18 0.31 0.00 -0.00 0.00 0.00 39.64 37.95 1c0w n ILE 89 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 1c0w h ILE 90 N -0.77 1.20 -3.66 1.39 1.08 -1.21 -3.47 117.51 112.07 1c0w h ILE 90 Ca 0.00 -0.85 -0.22 0.00 -0.39 0.00 0.00 64.86 63.39 1c0w h ILE 90 Cb 0.55 1.07 0.08 0.00 -3.07 0.00 0.00 36.82 35.45 1c0w h ILE 90 CO 0.00 0.28 -0.38 0.61 -0.69 0.00 0.00 178.15 177.97 1c0w n GLY 91 N -0.81 0.11 3.78 5.37 0.00 0.22 -4.97 105.19 108.89 1c0w n GLY 91 Ca 0.01 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.50 1c0w n GLY 91 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1c0w s LEU 92 N -4.52 4.25 0.05 0.99 2.96 -0.03 -4.94 118.68 117.45 1c0w s LEU 92 Ca 0.32 1.88 -0.37 0.00 -0.22 0.00 0.00 54.13 55.74 1c0w s LEU 92 Cb -0.14 -4.11 -0.19 0.00 0.50 0.00 0.00 46.19 42.25 1c0w s LEU 92 CO 0.40 -0.21 1.02 -0.67 -1.32 0.00 0.00 176.35 175.56 1c0w n ASP 93 N 0.28 0.05 0.20 3.68 -0.08 -1.26 -4.64 116.55 114.78 1c0w n ASP 93 Ca 0.03 1.15 0.16 0.00 -1.51 0.00 0.00 54.79 54.62 1c0w n ASP 93 Cb 0.50 -0.97 0.79 0.00 2.34 0.00 0.00 41.12 43.79 1c0w n ASP 93 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1c0w h ILE 94 N 2.71 0.60 0.07 5.18 6.09 -1.98 -1.94 117.51 128.24 1c0w h ILE 94 Ca -0.47 0.00 -0.17 0.00 -1.37 0.00 0.00 64.86 62.86 1c0w h ILE 94 Cb 1.42 0.87 0.02 0.00 0.47 0.00 0.00 36.82 39.60 1c0w h ILE 94 CO 0.65 0.00 -0.70 -0.55 -3.07 0.00 0.00 178.15 174.49 1c0w h ASN 95 N 0.00 0.49 0.54 2.19 -1.07 -1.99 -3.25 115.58 112.49 1c0w h ASN 95 Ca 0.08 -0.86 -0.02 0.00 0.07 0.00 0.00 56.30 55.57 1c0w h ASN 95 Cb 0.41 -0.15 -0.00 0.00 -2.07 0.00 0.00 38.32 36.50 1c0w h ASN 95 CO -0.00 1.30 -0.08 0.11 0.07 0.00 0.00 177.43 178.83 1c0w h LYS 96 N -0.26 0.00 -0.36 4.14 1.79 -1.83 -3.29 116.57 116.76 1c0w h LYS 96 Ca -0.11 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.44 1c0w h LYS 96 Cb 1.47 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 32.04 1c0w h LYS 96 CO 0.13 0.08 -0.22 0.28 -1.08 0.00 0.00 179.45 178.65 1c0w h VAL 97 N 0.00 0.39 -0.60 0.50 2.07 -1.40 -1.99 116.25 115.23 1c0w h VAL 97 Ca -0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1c0w h VAL 97 Cb 0.38 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1c0w h VAL 97 CO 0.01 0.00 0.39 -0.74 0.02 0.00 0.00 177.57 177.25 1c0w h HIS 98 N -0.17 0.74 0.21 1.57 -0.00 -1.76 -2.19 115.15 113.55 1c0w h HIS 98 Ca 0.18 0.02 -0.01 0.00 -0.00 0.00 0.00 60.37 60.56 1c0w h HIS 98 Cb 0.44 -0.25 0.00 0.00 -0.00 0.00 0.00 27.41 27.61 1c0w h HIS 98 CO -0.43 0.46 -0.10 -0.44 -0.00 0.00 0.00 177.93 177.41 1c0w h ASP 99 N 0.79 -0.23 -0.61 3.26 3.32 -1.69 0.28 116.42 121.54 1c0w h ASP 99 Ca 0.22 -0.06 0.12 0.00 0.02 0.00 0.00 57.03 57.34 1c0w h ASP 99 Cb -0.07 0.06 -0.10 0.00 0.22 0.00 0.00 39.33 39.44 1c0w h ASP 99 CO -0.06 -0.09 0.06 -0.08 -1.72 0.00 0.00 179.24 177.35 1c0w h GLU 100 N -0.36 0.18 -0.66 3.56 4.57 -1.29 -0.16 114.58 120.41 1c0w h GLU 100 Ca -0.03 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.10 1c0w h GLU 100 Cb 0.28 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 1c0w h GLU 100 CO 0.05 0.12 0.25 0.00 -1.18 0.00 0.00 179.01 178.24 1c0w h ALA 101 N 1.52 1.18 0.00 2.92 0.00 -1.10 -0.91 119.26 122.87 1c0w h ALA 101 Ca 0.32 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1c0w h ALA 101 Cb 0.50 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1c0w h ALA 101 CO -0.47 0.58 0.17 0.00 0.00 0.00 0.00 179.25 179.54 1c0w n ARG 103 N -2.78 0.51 -0.22 0.00 1.74 -0.60 -4.55 116.66 110.76 1c0w n ARG 103 Ca -0.02 0.36 0.13 0.00 -0.77 0.00 0.00 57.85 57.55 1c0w n ARG 103 Cb 0.22 -1.55 0.43 0.00 -1.02 0.00 0.00 32.46 30.54 1c0w n ARG 103 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1c0w h TRP 104 N -1.00 0.66 -1.19 -1.55 4.06 -0.67 -1.98 115.95 114.28 1c0w h TRP 104 Ca -0.10 0.02 0.34 0.00 2.06 0.00 0.00 58.89 61.21 1c0w h TRP 104 Cb 0.91 -0.21 -0.05 0.00 -1.00 0.00 0.00 29.16 28.82 1c0w h TRP 104 CO -0.28 0.25 0.86 1.05 -3.56 0.00 0.00 178.44 176.77 1c0w h GLU 105 N 0.57 0.00 -0.00 0.49 4.11 -1.18 0.37 114.58 118.93 1c0w h GLU 105 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.84 1c0w h GLU 105 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1c0w h GLU 105 CO -0.16 0.00 -0.45 0.72 0.07 0.00 0.00 179.01 179.19 1c0w n HIS 106 N -4.15 0.00 -1.03 2.06 8.25 -0.74 -4.21 115.22 115.40 1c0w n HIS 106 Ca 0.26 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.76 1c0w n HIS 106 Cb 1.25 -0.20 0.06 0.00 1.12 0.00 0.00 29.99 32.22 1c0w n HIS 106 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1c0w n VAL 107 N -1.24 1.02 -3.75 1.59 0.24 0.12 -4.99 118.33 111.32 1c0w n VAL 107 Ca 0.07 -1.18 -0.36 0.00 -2.04 0.00 0.00 64.34 60.84 1c0w n VAL 107 Cb 0.34 0.25 -0.09 0.00 -1.47 0.00 0.00 33.84 32.87 1c0w n VAL 107 CO 0.00 0.00 0.00 -0.32 -2.14 0.00 0.00 176.83 174.37 1c0w s MET 108 N -1.43 4.09 0.78 7.34 0.00 -0.73 -5.07 119.30 124.27 1c0w s MET 108 Ca 0.13 -0.27 -0.11 0.00 0.00 0.00 0.00 55.69 55.44 1c0w s MET 108 Cb 0.12 -3.43 0.06 0.00 0.00 0.00 0.00 34.83 31.57 1c0w s MET 108 CO 0.01 0.18 1.10 -1.54 0.00 0.00 0.00 175.02 174.77 1c0w s SER 109 N 0.68 4.72 0.27 1.11 1.04 -1.26 -4.95 113.70 115.31 1c0w s SER 109 Ca 0.07 1.26 -0.01 0.00 0.48 0.00 0.00 55.95 57.75 1c0w s SER 109 Cb -0.12 -2.01 0.37 0.00 0.10 0.00 0.00 66.02 64.35 1c0w s SER 109 CO 0.01 -1.82 1.77 0.44 0.98 0.00 0.00 173.24 174.62 1c0w h ASP 110 N -0.99 0.71 0.91 7.02 5.19 -1.99 -2.66 116.42 124.61 1c0w h ASP 110 Ca -0.46 -0.17 -0.04 0.00 -0.62 0.00 0.00 57.03 55.73 1c0w h ASP 110 Cb 1.26 -0.19 0.01 0.00 0.18 0.00 0.00 39.33 40.59 1c0w h ASP 110 CO 0.60 0.79 -0.44 -0.33 -3.12 0.00 0.00 179.24 176.75 1c0w h GLU 111 N 0.70 -1.17 -1.05 3.56 3.07 -1.98 -1.59 114.58 116.12 1c0w h GLU 111 Ca 0.14 0.08 0.27 0.00 -0.50 0.00 0.00 59.36 59.35 1c0w h GLU 111 Cb 0.45 0.27 -0.10 0.00 -0.84 0.00 0.00 28.75 28.52 1c0w h GLU 111 CO 0.02 -0.78 0.66 0.28 -1.40 0.00 0.00 179.01 177.79 1c0w h VAL 112 N -1.27 0.50 0.38 3.13 2.07 -1.95 0.34 116.25 119.44 1c0w h VAL 112 Ca -0.12 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1c0w h VAL 112 Cb 0.93 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1c0w h VAL 112 CO 0.20 0.08 -0.25 -0.33 0.02 0.00 0.00 177.57 177.29 1c0w h GLU 113 N 0.42 -0.58 -0.50 1.57 5.08 -1.09 0.31 114.58 119.79 1c0w h GLU 113 Ca 0.62 0.04 0.08 0.00 -1.00 0.00 0.00 59.36 59.10 1c0w h GLU 113 Cb 1.50 0.13 -0.06 0.00 0.50 0.00 0.00 28.75 30.82 1c0w h GLU 113 CO -0.36 -0.39 0.15 0.00 -1.00 0.00 0.00 179.01 177.42 1c0w h ARG 114 N -0.61 0.31 -0.97 2.33 3.08 0.54 0.25 114.38 119.30 1c0w h ARG 114 Ca -0.04 -0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.08 1c0w h ARG 114 Cb 0.51 -0.07 -0.07 0.00 0.08 0.00 0.00 29.97 30.42 1c0w h ARG 114 CO 0.03 0.20 0.62 0.00 -1.07 0.00 0.00 179.97 179.75 1c0w h ARG 115 N 0.32 1.04 -0.33 0.04 2.47 -0.64 -1.62 114.38 115.65 1c0w h ARG 115 Ca 0.25 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 58.90 1c0w h ARG 115 Cb 0.29 -0.23 -0.02 0.00 -1.65 0.00 0.00 29.97 28.36 1c0w h ARG 115 CO -0.27 0.69 0.18 -0.07 0.56 0.00 0.00 179.97 181.05 1c0w h LEU 116 N 1.07 0.40 -0.49 3.04 3.38 1.00 -1.01 115.31 122.69 1c0w h LEU 116 Ca 0.44 -0.08 0.10 0.00 0.09 0.00 0.00 57.88 58.44 1c0w h LEU 116 Cb 0.29 -0.10 -0.10 0.00 0.09 0.00 0.00 40.66 40.83 1c0w h LEU 116 CO -0.21 0.36 -0.20 0.58 0.09 0.00 0.00 178.44 179.06 1c0w h VAL 117 N 0.41 0.37 0.57 1.22 2.07 -0.17 0.23 116.25 120.95 1c0w h VAL 117 Ca 0.12 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 1c0w h VAL 117 Cb 0.05 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1c0w h VAL 117 CO -0.02 0.00 -0.35 0.11 0.02 0.00 0.00 177.57 177.33 1c0w h LYS 118 N -0.09 -0.82 -0.02 1.57 1.79 -1.05 -3.10 116.57 114.85 1c0w h LYS 118 Ca 0.23 0.06 0.01 0.00 -2.18 0.00 0.00 60.65 58.76 1c0w h LYS 118 Cb 0.45 0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1c0w h LYS 118 CO -0.55 -0.55 0.05 0.28 -1.08 0.00 0.00 179.45 177.60 1c0w h VAL 119 N -0.86 0.20 -3.29 0.50 2.07 -0.88 -3.43 116.25 110.56 1c0w h VAL 119 Ca -0.08 0.00 -0.56 0.00 0.82 0.00 0.00 66.70 66.88 1c0w h VAL 119 Cb 0.68 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1c0w h VAL 119 CO 0.08 0.00 -0.14 -0.76 0.02 0.00 0.00 177.57 176.77 1c0w s LEU 120 N -6.70 4.29 0.00 2.57 1.43 0.77 -5.06 118.68 115.98 1c0w s LEU 120 Ca -0.05 0.95 0.00 0.00 -1.03 0.00 0.00 54.13 54.00 1c0w s LEU 120 Cb 0.13 -3.31 0.00 0.00 0.03 0.00 0.00 46.19 43.05 1c0w s LEU 120 CO 0.45 0.07 0.00 2.29 0.23 0.00 0.00 176.35 179.39 1c0w n LYS 121 N 0.56 0.00 -3.66 1.70 -0.00 -1.26 -4.82 118.16 110.68 1c0w n LYS 121 Ca -0.04 0.00 -0.32 0.00 -0.00 0.00 0.00 58.31 57.94 1c0w n LYS 121 Cb 0.52 0.00 -0.05 0.00 -0.00 0.00 0.00 35.03 35.50 1c0w n LYS 121 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1c0w s ASP 122 N -2.08 6.52 -0.22 -5.58 -4.77 -1.26 -5.00 116.67 104.28 1c0w s ASP 122 Ca 0.00 0.63 0.13 0.00 -3.30 0.00 0.00 52.55 50.01 1c0w s ASP 122 Cb 0.00 -2.11 0.45 0.00 -1.09 0.00 0.00 42.92 40.17 1c0w s ASP 122 CO 0.00 0.09 1.19 1.33 0.70 0.00 0.00 175.17 178.48 1c0w n VAL 123 N 0.32 1.91 0.07 2.11 0.24 -1.26 -4.81 118.33 116.91 1c0w n VAL 123 Ca -0.04 -3.28 -0.13 0.00 -2.04 0.00 0.00 64.34 58.86 1c0w n VAL 123 Cb 0.52 -0.20 -0.09 0.00 -1.47 0.00 0.00 33.84 32.60 1c0w n VAL 123 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1c0w h SER 124 N 1.66 -0.17 -4.68 -1.34 0.02 -1.94 -3.41 113.55 103.69 1c0w h SER 124 Ca 0.09 -0.32 -0.31 0.00 -0.84 0.00 0.00 61.79 60.41 1c0w h SER 124 Cb 1.36 0.05 -0.15 0.00 0.14 0.00 0.00 62.40 63.80 1c0w h SER 124 CO 0.32 0.26 -0.63 0.00 -1.14 0.00 0.00 176.83 175.64 1c0w s ARG 125 N -4.32 1.28 0.88 3.45 1.70 -1.26 -0.76 118.95 119.92 1c0w s ARG 125 Ca -0.14 -1.67 -0.12 0.00 -0.47 0.00 0.00 55.73 53.32 1c0w s ARG 125 Cb 0.02 -0.17 0.12 0.00 -0.57 0.00 0.00 34.95 34.34 1c0w s ARG 125 CO 0.58 -0.26 1.13 -1.54 -1.08 0.00 0.00 175.30 174.13 1c0w s SER 126 N -3.24 3.78 0.26 -2.89 1.04 0.25 -4.79 113.70 108.11 1c0w s SER 126 Ca 0.34 1.05 0.17 0.00 0.48 0.00 0.00 55.95 57.99 1c0w s SER 126 Cb 0.07 -1.67 0.92 0.00 0.10 0.00 0.00 66.02 65.44 1c0w s SER 126 CO 0.10 -2.39 1.51 -2.65 0.98 0.00 0.00 173.24 170.79 1c0w n PRO 127 N -3.67 0.11 -0.54 4.02 -0.02 -1.26 -0.36 135.00 133.27 1c0w n PRO 127 Ca 0.07 0.60 0.09 0.00 -2.02 0.00 0.00 63.50 62.24 1c0w n PRO 127 Cb 0.58 -1.89 0.32 0.00 -0.02 0.00 0.00 33.50 32.49 1c0w n PRO 127 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1c0w n PHE 128 N -2.10 1.29 -0.91 6.00 3.72 -1.26 -4.59 117.46 119.61 1c0w n PHE 128 Ca -0.01 -0.65 0.00 0.00 -0.05 0.00 0.00 57.45 56.74 1c0w n PHE 128 Cb 0.05 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.35 1c0w n PHE 128 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1c0w n GLY 129 N 0.72 0.92 3.67 1.37 0.00 0.51 -2.08 105.19 110.31 1c0w n GLY 129 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1c0w n GLY 129 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1c0w s ASN 130 N -2.92 7.03 -0.04 1.61 -0.87 -1.26 -4.62 114.94 113.88 1c0w s ASN 130 Ca 0.00 1.69 -0.31 0.00 -1.57 0.00 0.00 52.86 52.67 1c0w s ASN 130 Cb 0.00 -2.55 -0.09 0.00 -0.02 0.00 0.00 41.25 38.59 1c0w s ASN 130 CO 0.00 -0.65 2.00 -0.81 -2.57 0.00 0.00 177.10 175.06 1c0w n PRO 131 N 5.89 2.55 -2.06 -0.60 -0.04 -1.26 0.87 135.00 140.35 1c0w n PRO 131 Ca 0.12 0.91 -0.43 0.00 -0.04 0.00 0.00 63.50 64.06 1c0w n PRO 131 Cb 0.46 -2.95 -0.03 0.00 -0.04 0.00 0.00 33.50 30.94 1c0w n PRO 131 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1c0w s ILE 132 N 5.01 3.60 0.87 0.52 1.01 0.06 -4.89 121.20 127.38 1c0w s ILE 132 Ca 0.92 0.66 -0.09 0.00 0.00 0.00 0.00 60.65 62.14 1c0w s ILE 132 Cb -0.49 -3.65 0.19 0.00 0.01 0.00 0.00 42.46 38.51 1c0w s ILE 132 CO 0.44 -0.31 1.19 -2.16 0.00 0.00 0.00 174.94 174.10 1c0w s PRO 133 N 4.96 0.93 -0.66 2.79 0.04 -1.26 -4.57 135.00 137.23 1c0w s PRO 133 Ca 0.75 -0.86 -0.08 0.00 0.04 0.00 0.00 61.00 60.84 1c0w s PRO 133 Cb -0.25 -2.07 0.08 0.00 0.04 0.00 0.00 34.50 32.31 1c0w s PRO 133 CO 0.31 -2.09 0.21 0.41 0.04 0.00 0.00 177.00 175.88 1c0w n GLY 134 N -3.39 -0.39 0.15 0.56 0.00 -1.26 -4.67 105.19 96.18 1c0w n GLY 134 Ca 0.17 0.02 0.01 0.00 0.00 0.00 0.00 46.02 46.22 1c0w n GLY 134 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1c0w h LEU 135 N -0.30 0.00 0.20 0.99 3.38 -1.98 -3.09 115.31 114.51 1c0w h LEU 135 Ca -0.21 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1c0w h LEU 135 Cb 1.00 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1c0w h LEU 135 CO 0.31 0.56 -0.28 0.44 0.09 0.00 0.00 178.44 179.57 1c0w h ASP 136 N 0.00 -0.77 -0.27 -0.43 5.19 -1.96 -2.18 116.42 116.01 1c0w h ASP 136 Ca -0.01 0.08 0.06 0.00 -0.62 0.00 0.00 57.03 56.54 1c0w h ASP 136 Cb 1.10 0.28 -0.01 0.00 0.18 0.00 0.00 39.33 40.88 1c0w h ASP 136 CO 0.07 -0.38 0.19 1.05 -3.12 0.00 0.00 179.24 177.05 1c0w h GLU 137 N -0.54 0.10 0.00 3.56 -0.00 -1.93 -2.73 114.58 113.04 1c0w h GLU 137 Ca 0.01 -0.01 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1c0w h GLU 137 Cb 0.53 -0.02 0.00 0.00 -0.00 0.00 0.00 28.75 29.26 1c0w h GLU 137 CO -0.11 0.07 0.36 1.25 -0.00 0.00 0.00 179.01 180.59 1c0w h LEU 138 N 0.10 0.00 0.20 3.06 5.85 -1.31 -3.44 115.31 119.78 1c0w h LEU 138 Ca 0.12 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.80 1c0w h LEU 138 Cb 0.36 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1c0w h LEU 138 CO -0.01 0.00 -0.05 0.61 -0.34 0.00 0.00 178.44 178.65 1c0w n GLY 139 N -1.27 0.42 0.00 3.75 0.00 -1.03 -5.00 105.19 102.06 1c0w n GLY 139 Ca -0.01 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1c0w n GLY 139 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1c0w n VAL 140 N -3.43 0.00 0.03 1.61 3.14 -1.26 -5.17 118.33 113.25 1c0w n VAL 140 Ca -0.02 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.34 1c0w n VAL 140 Cb 0.28 -0.12 -0.01 0.00 -1.06 0.00 0.00 33.84 32.93 1c0w n VAL 140 CO 0.00 0.00 0.00 0.58 -6.46 0.00 0.00 176.83 170.95 1c0w h VAL 166 N 0.00 0.00 -2.09 1.55 2.07 -1.65 -3.51 116.25 112.62 1c0w h VAL 166 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1c0w h VAL 166 Cb 0.00 0.00 -0.20 0.00 -1.52 0.00 0.00 31.29 29.57 1c0w h VAL 166 CO 0.00 0.00 0.12 0.00 0.02 0.00 0.00 177.57 177.71 1c0w s GLN 167 N -3.27 0.91 -0.46 1.57 -2.07 -1.07 -4.61 119.66 110.66 1c0w s GLN 167 Ca -0.02 0.60 -0.13 0.00 -1.82 0.00 0.00 55.36 53.99 1c0w s GLN 167 Cb 0.00 0.44 0.09 0.00 -1.09 0.00 0.00 33.01 32.44 1c0w s GLN 167 CO 0.06 -0.20 0.36 0.42 -1.32 0.00 0.00 175.29 174.60 1c0w s ILE 168 N -0.40 4.83 0.60 3.63 1.01 -0.88 -1.49 121.20 128.50 1c0w s ILE 168 Ca -0.05 -1.28 -0.18 0.00 0.00 0.00 0.00 60.65 59.14 1c0w s ILE 168 Cb -0.03 -3.95 -0.15 0.00 0.01 0.00 0.00 42.46 38.34 1c0w s ILE 168 CO 0.05 -0.61 -0.23 0.59 0.00 0.00 0.00 174.94 174.74 1c0w n ASN 169 N 5.09 -4.04 -0.09 3.58 5.03 -0.29 -4.61 115.26 119.93 1c0w n ASN 169 Ca -0.12 0.56 0.14 0.00 0.87 0.00 0.00 54.58 56.04 1c0w n ASN 169 Cb 0.43 -0.84 0.52 0.00 -1.02 0.00 0.00 39.78 38.87 1c0w n ASN 169 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 1c0w h GLU 170 N -0.20 0.35 -0.04 3.52 4.39 -1.97 -0.96 114.58 119.67 1c0w h GLU 170 Ca -0.42 -0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.19 1c0w h GLU 170 Cb 1.42 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.98 1c0w h GLU 170 CO 0.38 0.23 -0.29 0.97 -1.16 0.00 0.00 179.01 179.15 1c0w h ILE 171 N 0.36 1.22 -0.05 3.13 -0.00 -1.94 -2.90 117.51 117.35 1c0w h ILE 171 Ca 0.30 -1.06 -0.23 0.00 -0.00 0.00 0.00 64.86 63.87 1c0w h ILE 171 Cb 0.67 1.52 0.02 0.00 -0.00 0.00 0.00 36.82 39.02 1c0w h ILE 171 CO -0.08 0.31 -0.86 0.15 -0.00 0.00 0.00 178.15 177.67 1c0w h PHE 172 N 0.06 0.96 -0.47 2.19 3.04 -1.48 -3.13 116.94 118.12 1c0w h PHE 172 Ca 0.01 -0.49 0.14 0.00 3.98 0.00 0.00 57.97 61.61 1c0w h PHE 172 Cb 0.55 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.91 1c0w h PHE 172 CO 0.00 1.32 0.50 1.96 -2.02 0.00 0.00 178.31 180.08 1c0w h GLN 173 N 0.34 0.00 0.21 1.11 4.20 -1.28 0.10 115.11 119.78 1c0w h GLN 173 Ca -0.09 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.29 1c0w h GLN 173 Cb 1.52 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.32 1c0w h GLN 173 CO 0.17 0.00 -1.45 0.28 -0.67 0.00 0.00 178.83 177.16 1c0w h VAL 174 N 0.00 1.30 -0.22 -0.54 2.07 -1.53 -3.41 116.25 113.91 1c0w h VAL 174 Ca 0.22 -2.79 -0.05 0.00 0.82 0.00 0.00 66.70 64.91 1c0w h VAL 174 Cb 1.23 2.97 -0.01 0.00 -1.52 0.00 0.00 31.29 33.97 1c0w h VAL 174 CO -0.00 0.84 0.14 -0.70 0.02 0.00 0.00 177.57 177.87 1c0w s GLU 175 N -2.61 1.41 0.04 1.57 2.56 0.36 -4.80 118.70 117.24 1c0w s GLU 175 Ca -0.08 -0.24 -0.16 0.00 0.00 0.00 0.00 54.97 54.49 1c0w s GLU 175 Cb 0.05 -4.95 -0.07 0.00 2.00 0.00 0.00 34.13 31.16 1c0w s GLU 175 CO 0.92 -5.07 1.25 1.79 -0.56 0.00 0.00 175.26 173.58 1c0w h THR 176 N 6.94 0.00 -0.18 -1.70 1.35 -1.80 0.44 112.91 117.96 1c0w h THR 176 Ca 0.03 0.00 0.04 0.00 -0.55 0.00 0.00 66.41 65.93 1c0w h THR 176 Cb 0.99 0.00 -0.07 0.00 -1.73 0.00 0.00 68.15 67.34 1c0w h THR 176 CO 1.03 0.00 -0.45 0.44 -0.25 0.00 0.00 175.52 176.29 1c0w h ASP 177 N -0.36 -1.43 0.55 5.36 3.32 -1.97 0.31 116.42 122.20 1c0w h ASP 177 Ca -0.01 0.19 -0.04 0.00 0.02 0.00 0.00 57.03 57.19 1c0w h ASP 177 Cb 0.35 0.58 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 1c0w h ASP 177 CO -0.11 -0.43 -0.20 -0.61 -1.72 0.00 0.00 179.24 176.17 1c0w h GLN 178 N -0.48 0.00 0.20 3.56 5.75 -1.94 -2.36 115.11 119.83 1c0w h GLN 178 Ca 0.08 0.00 -0.31 0.00 -0.15 0.00 0.00 58.65 58.26 1c0w h GLN 178 Cb 0.63 0.00 0.03 0.00 1.07 0.00 0.00 27.48 29.21 1c0w h GLN 178 CO -0.44 0.20 -1.38 0.35 -2.65 0.00 0.00 178.83 174.91 1c0w h PHE 179 N 0.00 0.85 0.00 3.99 3.57 0.10 -2.74 116.94 122.71 1c0w h PHE 179 Ca -0.00 -0.60 -0.03 0.00 3.53 0.00 0.00 57.97 60.86 1c0w h PHE 179 Cb 0.52 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 1c0w h PHE 179 CO 0.00 1.47 -0.16 1.79 -2.23 0.00 0.00 178.31 179.18 1c0w h THR 180 N 0.14 0.42 0.00 4.41 1.35 -0.29 0.12 112.91 119.06 1c0w h THR 180 Ca -0.21 -0.91 -0.13 0.00 -0.55 0.00 0.00 66.41 64.61 1c0w h THR 180 Cb 2.08 1.66 -0.02 0.00 -1.73 0.00 0.00 68.15 70.14 1c0w h THR 180 CO 0.25 0.16 -0.60 1.56 -0.25 0.00 0.00 175.52 176.64 1c0w h GLN 181 N 0.00 0.00 0.02 4.72 7.50 -1.41 0.81 115.11 126.74 1c0w h GLN 181 Ca -0.00 0.00 -0.20 0.00 0.50 0.00 0.00 58.65 58.94 1c0w h GLN 181 Cb 0.65 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.16 1c0w h GLN 181 CO 0.02 0.60 -0.95 1.25 -1.50 0.00 0.00 178.83 178.25 1c0w h LEU 182 N 0.00 0.13 0.00 1.46 7.12 -0.72 -3.19 115.31 120.11 1c0w h LEU 182 Ca -0.01 -0.12 -0.18 0.00 0.13 0.00 0.00 57.88 57.70 1c0w h LEU 182 Cb 1.17 -0.04 -0.03 0.00 -0.53 0.00 0.00 40.66 41.23 1c0w h LEU 182 CO 0.08 1.00 -0.89 -0.07 -0.13 0.00 0.00 178.44 178.43 1c0w h LEU 183 N 0.04 0.00 0.00 2.25 -0.00 -0.53 -2.99 115.31 114.08 1c0w h LEU 183 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 1c0w h LEU 183 Cb 1.63 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.29 1c0w h LEU 183 CO 0.13 0.85 0.00 -0.90 -0.00 0.00 0.00 178.44 178.52 1c0w n ASP 184 N -3.29 0.00 -0.99 -0.43 5.75 0.25 -0.94 116.55 116.90 1c0w n ASP 184 Ca -0.00 0.45 0.11 0.00 -0.01 0.00 0.00 54.79 55.33 1c0w n ASP 184 Cb 0.88 -0.47 0.16 0.00 -1.03 0.00 0.00 41.12 40.66 1c0w n ASP 184 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1c0w n ALA 185 N -1.47 2.43 -3.06 2.12 0.00 -1.13 -4.99 120.51 114.40 1c0w n ALA 185 Ca 0.03 -0.86 -0.12 0.00 0.00 0.00 0.00 53.44 52.49 1c0w n ALA 185 Cb 0.14 -0.77 0.06 0.00 0.00 0.00 0.00 19.45 18.88 1c0w n ALA 185 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1c0w n ASP 186 N 1.30 -6.31 -4.20 0.00 5.75 -0.12 -5.02 116.55 107.96 1c0w n ASP 186 Ca 0.16 -0.58 -0.34 0.00 -0.01 0.00 0.00 54.79 54.02 1c0w n ASP 186 Cb 0.56 -4.77 -0.14 0.00 -1.03 0.00 0.00 41.12 35.74 1c0w n ASP 186 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1c0w s ILE 187 N -3.31 2.82 0.43 2.12 -1.09 -1.23 -5.07 121.20 115.87 1c0w s ILE 187 Ca 0.37 -1.00 0.07 0.00 -2.23 0.00 0.00 60.65 57.86 1c0w s ILE 187 Cb -0.05 -2.41 -0.04 0.00 -1.58 0.00 0.00 42.46 38.38 1c0w s ILE 187 CO 0.67 0.24 0.18 -0.13 -1.23 0.00 0.00 174.94 174.67 1c0w s ARG 188 N 1.33 2.21 -0.84 2.79 0.52 -1.26 -4.83 118.95 118.87 1c0w s ARG 188 Ca 0.01 -1.92 -0.25 0.00 -0.52 0.00 0.00 55.73 53.05 1c0w s ARG 188 Cb -0.16 -1.94 -0.20 0.00 0.52 0.00 0.00 34.95 33.17 1c0w s ARG 188 CO -0.05 -0.18 1.91 1.33 0.02 0.00 0.00 175.30 178.32 1c0w n VAL 189 N -1.28 1.05 -1.62 3.52 0.24 -1.26 -4.81 118.33 114.16 1c0w n VAL 189 Ca -0.03 -1.02 0.00 0.00 -2.04 0.00 0.00 64.34 61.25 1c0w n VAL 189 Cb 0.65 -2.13 0.00 0.00 -1.47 0.00 0.00 33.84 30.89 1c0w n VAL 189 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1c0w n VAL 211 N 7.57 0.00 -3.90 3.34 0.24 -1.26 -3.78 118.33 120.55 1c0w n VAL 211 Ca 0.45 0.00 -0.35 0.00 -2.04 0.00 0.00 64.34 62.40 1c0w n VAL 211 Cb 0.44 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.68 1c0w n VAL 211 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1c0w s GLU 212 N 0.00 3.16 -0.06 7.34 1.03 -1.26 -5.10 118.70 123.81 1c0w s GLU 212 Ca 0.00 -0.77 -0.05 0.00 0.03 0.00 0.00 54.97 54.18 1c0w s GLU 212 Cb 0.00 -3.06 -0.04 0.00 -0.80 0.00 0.00 34.13 30.23 1c0w s GLU 212 CO 0.00 -0.30 0.16 -0.48 -1.33 0.00 0.00 175.26 173.31 1c0w s LEU 213 N 1.43 4.36 0.24 1.83 2.34 -1.26 -5.05 118.68 122.58 1c0w s LEU 213 Ca 0.04 0.39 -0.30 0.00 0.06 0.00 0.00 54.13 54.32 1c0w s LEU 213 Cb -0.15 -2.36 -0.14 0.00 -0.56 0.00 0.00 46.19 42.98 1c0w s LEU 213 CO -0.03 0.33 1.18 0.18 -1.06 0.00 0.00 176.35 176.95 1c0w n LEU 214 N 1.42 2.18 -0.38 1.48 4.77 -1.26 -4.65 117.00 120.56 1c0w n LEU 214 Ca -0.15 1.16 0.34 0.00 -0.03 0.00 0.00 56.01 57.33 1c0w n LEU 214 Cb 0.54 -1.32 0.68 0.00 -2.33 0.00 0.00 43.42 40.99 1c0w n LEU 214 CO 0.38 -1.07 1.30 -2.24 -1.33 0.00 0.00 177.39 174.43 1c0w h ASP 215 N 3.02 0.16 -0.13 -1.43 3.04 -2.00 0.79 116.42 119.87 1c0w h ASP 215 Ca -0.43 0.04 -0.18 0.00 -3.24 0.00 0.00 57.03 53.22 1c0w h ASP 215 Cb 1.32 0.02 -0.00 0.00 -1.04 0.00 0.00 39.33 39.63 1c0w h ASP 215 CO 0.67 -0.00 -0.59 -2.24 -2.04 0.00 0.00 179.24 175.04 1c0w h ASP 216 N 0.12 0.83 -0.01 4.15 -0.00 -2.05 -2.90 116.42 116.56 1c0w h ASP 216 Ca 0.65 -0.47 0.00 0.00 -0.00 0.00 0.00 57.03 57.21 1c0w h ASP 216 Cb 2.26 -0.24 0.00 0.00 -0.00 0.00 0.00 39.33 41.35 1c0w h ASP 216 CO -0.15 1.24 0.00 0.18 -0.00 0.00 0.00 179.24 180.51 1c0w n LEU 217 N -3.97 0.24 0.48 0.15 4.77 0.26 -4.21 117.00 114.72 1c0w n LEU 217 Ca -0.04 -0.08 -0.20 0.00 -0.03 0.00 0.00 56.01 55.65 1c0w n LEU 217 Cb 0.64 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.63 1c0w n LEU 217 CO 0.50 0.04 0.55 0.00 -1.33 0.00 0.00 177.39 177.15 1c0w h ALA 218 N 3.96 -1.27 0.00 -1.18 0.00 -0.89 -2.39 119.26 117.49 1c0w h ALA 218 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1c0w h ALA 218 Cb 0.08 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1c0w h ALA 218 CO 0.00 -1.22 0.00 -2.39 0.00 0.00 0.00 179.25 175.64 1c0w n HIS 219 N -5.64 0.00 0.03 0.00 1.44 -1.26 -3.44 115.22 106.35 1c0w n HIS 219 Ca -0.16 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.33 1c0w n HIS 219 Cb 0.51 -0.03 -0.14 0.00 0.12 0.00 0.00 29.99 30.45 1c0w n HIS 219 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 1c0w h THR 220 N 0.00 0.99 -3.24 0.61 2.02 -1.68 -3.45 112.91 108.16 1c0w h THR 220 Ca 0.00 -2.43 -0.72 0.00 0.77 0.00 0.00 66.41 64.03 1c0w h THR 220 Cb 0.14 2.72 -0.21 0.00 -1.74 0.00 0.00 68.15 69.06 1c0w h THR 220 CO 0.00 0.76 -0.18 -0.63 0.37 0.00 0.00 175.52 175.83 1c0w s ILE 221 N -2.51 5.10 -2.54 3.11 1.01 -1.22 -1.14 121.20 123.01 1c0w s ILE 221 Ca -0.19 -0.94 0.28 0.00 0.00 0.00 0.00 60.65 59.80 1c0w s ILE 221 Cb 0.05 -4.22 0.52 0.00 0.01 0.00 0.00 42.46 38.82 1c0w s ILE 221 CO 0.79 -0.71 1.71 0.54 0.00 0.00 0.00 174.94 177.27