#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 0.00 4.39 2.03 -1.26 -5.02 116.55 116.69 1c0w n ASP 3 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1c0w n ASP 3 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 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 0.00 0.00 -2.67 4.77 -1.26 -4.80 117.00 113.04 1c0w n LEU 4 Ca 0.00 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1c0w n LEU 4 Cb 0.00 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 1c0w n LEU 4 CO 0.00 -0.36 0.00 0.52 -1.33 0.00 0.00 177.39 176.22 1c0w n VAL 5 N -1.35 0.00 -3.72 4.08 0.31 -1.26 -4.39 118.33 112.00 1c0w n VAL 5 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 64.34 64.05 1c0w n VAL 5 Cb 0.01 0.00 -0.16 0.00 -0.91 0.00 0.00 33.84 32.78 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 3.16 0.09 4.52 -1.08 -1.26 -5.05 116.67 117.05 1c0w s ASP 6 Ca 0.00 -1.00 -0.29 0.00 -0.52 0.00 0.00 52.55 50.73 1c0w s ASP 6 Cb 0.00 -0.63 -0.14 0.00 -1.46 0.00 0.00 42.92 40.69 1c0w s ASP 6 CO 0.00 -0.34 1.64 0.74 0.52 0.00 0.00 175.17 177.74 1c0w h THR 7 N 6.50 0.45 -0.86 1.71 2.02 -1.98 -2.29 112.91 118.47 1c0w h THR 7 Ca -0.16 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.17 1c0w h THR 7 Cb 1.09 0.45 -0.10 0.00 -1.74 0.00 0.00 68.15 67.86 1c0w h THR 7 CO 0.37 0.00 0.44 0.74 0.37 0.00 0.00 175.52 177.44 1c0w h THR 8 N -0.62 0.71 0.04 3.16 2.02 -1.96 -1.15 112.91 115.11 1c0w h THR 8 Ca -0.03 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 1c0w h THR 8 Cb 0.53 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1c0w h THR 8 CO 0.01 0.11 -0.02 -0.33 0.37 0.00 0.00 175.52 175.66 1c0w h GLU 9 N 0.61 -0.06 0.00 6.66 5.08 -1.92 -1.98 114.58 122.98 1c0w h GLU 9 Ca 0.47 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.82 1c0w h GLU 9 Cb 0.68 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.95 1c0w h GLU 9 CO -0.37 0.17 -0.05 0.52 -1.00 0.00 0.00 179.01 178.27 1c0w h MET 10 N -0.28 0.00 -0.07 2.33 2.86 -0.82 0.21 114.93 119.17 1c0w h MET 10 Ca -0.01 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 1c0w h MET 10 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1c0w h MET 10 CO 0.01 0.05 -0.15 1.88 1.06 0.00 0.00 176.91 179.76 1c0w h TYR 11 N 0.00 0.28 -0.57 -0.22 -1.99 -0.94 -1.67 116.97 111.87 1c0w h TYR 11 Ca -0.00 -0.10 -0.11 0.00 2.00 0.00 0.00 58.73 60.52 1c0w h TYR 11 Cb 0.12 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 38.78 1c0w h TYR 11 CO 0.00 0.76 -0.06 -0.07 -0.00 0.00 0.00 178.16 178.79 1c0w h LEU 12 N -0.28 1.03 -1.00 3.88 3.38 -0.67 -0.88 115.31 120.77 1c0w h LEU 12 Ca -0.00 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1c0w h LEU 12 Cb 0.75 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1c0w h LEU 12 CO 0.03 1.11 0.30 -0.09 0.09 0.00 0.00 178.44 179.88 1c0w h ARG 13 N 0.94 1.01 -0.12 1.13 2.43 -0.64 -0.62 114.38 118.51 1c0w h ARG 13 Ca 0.15 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1c0w h ARG 13 Cb 0.62 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1c0w h ARG 13 CO 0.04 0.81 0.05 1.15 -1.51 0.00 0.00 179.97 180.51 1c0w h THR 14 N 1.00 1.13 -0.25 0.20 2.02 -0.70 0.18 112.91 116.49 1c0w h THR 14 Ca 0.24 -0.39 0.05 0.00 0.77 0.00 0.00 66.41 67.07 1c0w h THR 14 Cb 0.16 1.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.71 1c0w h THR 14 CO -0.02 0.12 -0.03 0.40 0.37 0.00 0.00 175.52 176.36 1c0w h ILE 15 N 0.05 0.78 -0.25 3.11 2.04 -0.81 0.12 117.51 122.55 1c0w h ILE 15 Ca 0.04 -0.01 0.06 0.00 1.00 0.00 0.00 64.86 65.95 1c0w h ILE 15 Cb 0.14 0.74 -0.08 0.00 -0.74 0.00 0.00 36.82 36.89 1c0w h ILE 15 CO -0.00 0.01 -0.35 0.22 0.00 0.00 0.00 178.15 178.03 1c0w h TYR 16 N 0.04 -0.97 -0.31 1.37 5.03 -0.69 -0.82 116.97 120.62 1c0w h TYR 16 Ca 0.12 0.05 0.07 0.00 2.58 0.00 0.00 58.73 61.55 1c0w h TYR 16 Cb 0.17 0.46 -0.08 0.00 1.55 0.00 0.00 36.73 38.84 1c0w h TYR 16 CO -0.23 -0.41 -0.21 1.49 -1.32 0.00 0.00 178.16 177.48 1c0w h GLU 17 N -0.35 -0.17 -0.61 1.82 4.81 0.16 0.43 114.58 120.67 1c0w h GLU 17 Ca 0.12 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.47 1c0w h GLU 17 Cb 0.56 0.04 -0.08 0.00 0.63 0.00 0.00 28.75 29.90 1c0w h GLU 17 CO -0.44 -0.12 0.17 -0.07 -0.73 0.00 0.00 179.01 177.83 1c0w h LEU 18 N -0.18 0.10 -0.66 1.64 3.38 -0.05 0.18 115.31 119.72 1c0w h LEU 18 Ca 0.16 0.10 0.05 0.00 0.09 0.00 0.00 57.88 58.28 1c0w h LEU 18 Cb 0.43 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.24 1c0w h LEU 18 CO -0.42 0.06 0.38 -0.33 0.09 0.00 0.00 178.44 178.22 1c0w h GLU 19 N 0.32 0.70 0.28 1.13 5.08 0.22 0.56 114.58 122.88 1c0w h GLU 19 Ca 0.31 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1c0w h GLU 19 Cb 0.44 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1c0w h GLU 19 CO -0.36 0.47 -0.31 0.93 -1.00 0.00 0.00 179.01 178.74 1c0w h GLU 20 N 0.73 -0.61 0.00 2.33 5.08 0.13 -1.02 114.58 121.22 1c0w h GLU 20 Ca 0.28 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1c0w h GLU 20 Cb 0.12 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1c0w h GLU 20 CO -0.15 -0.41 0.00 0.39 -1.00 0.00 0.00 179.01 177.84 1c0w n GLU 21 N -5.42 0.29 -1.06 2.33 1.02 0.31 -4.83 120.64 113.28 1c0w n GLU 21 Ca -0.09 0.06 -0.02 0.00 -0.02 0.00 0.00 57.16 57.09 1c0w n GLU 21 Cb 0.33 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.24 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 -0.30 0.55 3.90 0.62 0.00 -0.30 -5.00 105.19 104.66 1c0w n GLY 22 Ca 0.08 -0.38 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.95 4.96 -0.18 1.61 1.01 0.03 -4.98 120.40 120.89 1c0w s VAL 23 Ca 0.00 0.14 -0.25 0.00 0.00 0.00 0.00 61.98 61.87 1c0w s VAL 23 Cb 0.00 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1c0w s VAL 23 CO 0.00 -0.52 0.84 -0.89 0.00 0.00 0.00 175.10 174.53 1c0w s THR 24 N -2.33 4.86 -0.27 3.92 2.01 -1.26 -4.05 115.64 118.52 1c0w s THR 24 Ca 0.46 1.64 -0.28 0.00 0.31 0.00 0.00 61.69 63.82 1c0w s THR 24 Cb -0.10 -4.14 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 1c0w s THR 24 CO 0.34 0.00 1.96 -2.16 -0.69 0.00 0.00 174.62 174.08 1c0w s PRO 25 N 2.29 3.31 0.05 4.92 0.04 -1.26 -4.90 135.00 139.45 1c0w s PRO 25 Ca 0.38 1.72 0.05 0.00 0.04 0.00 0.00 61.00 63.20 1c0w s PRO 25 Cb -0.16 -4.25 -0.02 0.00 0.04 0.00 0.00 34.50 30.10 1c0w s PRO 25 CO 0.11 -1.89 -0.15 -0.51 0.04 0.00 0.00 177.00 174.60 1c0w s LEU 26 N 7.25 2.19 0.34 -3.56 1.43 -1.26 -0.95 118.68 124.13 1c0w s LEU 26 Ca 0.88 -0.50 0.12 0.00 -1.03 0.00 0.00 54.13 53.59 1c0w s LEU 26 Cb -0.27 -0.66 0.93 0.00 0.03 0.00 0.00 46.19 46.21 1c0w s LEU 26 CO 0.34 0.04 1.75 0.03 0.23 0.00 0.00 176.35 178.74 1c0w h ARG 27 N 4.78 0.54 -0.83 1.70 -0.00 -1.93 0.31 114.38 118.94 1c0w h ARG 27 Ca -0.40 -0.03 0.06 0.00 -0.50 0.00 0.00 59.98 59.11 1c0w h ARG 27 Cb 1.18 -0.12 -0.06 0.00 0.00 0.00 0.00 29.97 30.97 1c0w h ARG 27 CO 0.43 0.35 0.51 0.00 0.00 0.00 0.00 179.97 181.27 1c0w h ALA 28 N 1.69 1.15 0.23 0.04 0.00 -1.95 -0.85 119.26 119.56 1c0w h ALA 28 Ca 0.62 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.52 1c0w h ALA 28 Cb 1.26 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1c0w h ALA 28 CO -0.41 0.25 -0.18 0.00 0.00 0.00 0.00 179.25 178.91 1c0w h ARG 29 N 0.93 -0.38 -0.97 0.00 2.47 -0.73 -1.84 114.38 113.87 1c0w h ARG 29 Ca 0.37 0.03 0.31 0.00 -1.26 0.00 0.00 59.98 59.42 1c0w h ARG 29 Cb 0.18 0.09 -0.16 0.00 -1.65 0.00 0.00 29.97 28.42 1c0w h ARG 29 CO -0.17 -0.25 0.42 0.82 0.56 0.00 0.00 179.97 181.34 1c0w h ILE 30 N -0.39 0.21 0.41 2.04 2.04 -1.26 0.84 117.51 121.41 1c0w h ILE 30 Ca -0.03 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1c0w h ILE 30 Cb 0.33 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1c0w h ILE 30 CO 0.00 0.04 -0.38 0.00 0.00 0.00 0.00 178.15 177.81 1c0w h ALA 31 N 1.88 -1.07 -0.32 1.87 0.00 -0.59 0.15 119.26 121.17 1c0w h ALA 31 Ca 0.69 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.44 1c0w h ALA 31 Cb 1.59 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 19.97 1c0w h ALA 31 CO -0.69 -1.09 0.14 1.05 0.00 0.00 0.00 179.25 178.66 1c0w h GLU 32 N -0.78 0.47 -0.37 0.00 4.11 -0.40 0.19 114.58 117.81 1c0w h GLU 32 Ca -0.05 -0.08 0.04 0.00 0.07 0.00 0.00 59.36 59.34 1c0w h GLU 32 Cb 0.67 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 1c0w h GLU 32 CO -0.03 0.47 0.14 0.00 0.07 0.00 0.00 179.01 179.65 1c0w h ARG 33 N 0.37 0.29 -0.55 1.06 3.08 -0.86 -2.29 114.38 115.47 1c0w h ARG 33 Ca 0.11 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1c0w h ARG 33 Cb 0.16 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1c0w h ARG 33 CO -0.01 0.19 0.00 1.28 -1.07 0.00 0.00 179.97 180.36 1c0w n LEU 34 N -5.01 3.01 -3.96 3.04 4.77 0.53 -4.96 117.00 114.43 1c0w n LEU 34 Ca 0.01 -1.51 -0.40 0.00 -0.03 0.00 0.00 56.01 54.09 1c0w n LEU 34 Cb 0.13 -0.38 0.02 0.00 -2.33 0.00 0.00 43.42 40.85 1c0w n LEU 34 CO 0.28 0.70 -0.16 -0.62 -1.33 0.00 0.00 177.39 176.26 1c0w n GLU 35 N 1.02 -0.79 -4.25 3.23 1.02 0.56 -4.98 120.64 116.45 1c0w n GLU 35 Ca 0.18 0.22 -0.21 0.00 -0.02 0.00 0.00 57.16 57.33 1c0w n GLU 35 Cb 0.50 -3.23 -0.12 0.00 -0.02 0.00 0.00 31.44 28.56 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 -6.92 0.96 0.70 3.49 -0.21 -0.51 -5.04 119.66 112.14 1c0w s GLN 36 Ca 0.42 -1.01 -0.16 0.00 0.02 0.00 0.00 55.36 54.64 1c0w s GLN 36 Cb -0.20 -1.07 0.02 0.00 1.00 0.00 0.00 33.01 32.76 1c0w s GLN 36 CO 0.93 0.25 1.24 -1.54 -2.12 0.00 0.00 175.29 174.05 1c0w s SER 37 N -1.71 4.34 0.07 5.90 1.04 -1.26 -4.59 113.70 117.50 1c0w s SER 37 Ca 0.02 2.47 -0.26 0.00 0.48 0.00 0.00 55.95 58.66 1c0w s SER 37 Cb -0.10 -2.60 -0.11 0.00 0.10 0.00 0.00 66.02 63.31 1c0w s SER 37 CO 0.03 -2.17 1.40 1.23 0.98 0.00 0.00 173.24 174.71 1c0w h GLY 38 N 0.04 -1.15 -0.29 7.32 0.00 -1.97 -2.01 103.07 105.00 1c0w h GLY 38 Ca -0.49 0.57 0.16 0.00 0.00 0.00 0.00 47.33 47.57 1c0w h GLY 38 CO 0.51 -0.33 -0.02 -2.55 0.00 0.00 0.00 176.54 174.14 1c0w h PRO 39 N -0.63 0.09 -0.06 4.80 0.11 -1.99 -1.60 132.00 132.71 1c0w h PRO 39 Ca -0.02 -0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.10 1c0w h PRO 39 Cb 0.59 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 31.63 1c0w h PRO 39 CO -0.14 0.06 -0.45 1.15 -0.21 0.00 0.00 178.00 178.41 1c0w h THR 40 N 0.09 0.00 -0.72 -1.15 2.02 -1.81 -0.46 112.91 110.89 1c0w h THR 40 Ca 0.38 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.54 1c0w h THR 40 Cb 0.64 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1c0w h THR 40 CO -0.64 0.00 0.39 1.62 0.37 0.00 0.00 175.52 177.26 1c0w h VAL 41 N -0.52 1.21 -0.65 3.16 3.04 -0.95 -0.83 116.25 120.71 1c0w h VAL 41 Ca 0.02 -0.53 0.01 0.00 -1.01 0.00 0.00 66.70 65.19 1c0w h VAL 41 Cb 0.59 0.24 -0.03 0.00 -2.01 0.00 0.00 31.29 30.08 1c0w h VAL 41 CO -0.33 0.24 0.43 0.28 -1.01 0.00 0.00 177.57 177.17 1c0w h SER 42 N 1.00 0.73 0.14 3.17 0.02 -0.61 0.44 113.55 118.43 1c0w h SER 42 Ca 0.25 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 1c0w h SER 42 Cb 0.02 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1c0w h SER 42 CO -0.04 0.52 -0.07 -0.61 -1.14 0.00 0.00 176.83 175.49 1c0w h GLN 43 N 0.86 -0.18 -0.95 3.45 4.15 -0.06 -1.80 115.11 120.57 1c0w h GLN 43 Ca 0.24 0.01 0.12 0.00 0.77 0.00 0.00 58.65 59.79 1c0w h GLN 43 Cb -0.06 0.04 -0.08 0.00 0.21 0.00 0.00 27.48 27.59 1c0w h GLN 43 CO -0.06 0.28 0.61 1.15 -1.93 0.00 0.00 178.83 178.88 1c0w h THR 44 N -0.81 0.92 -0.51 2.39 2.02 -1.06 0.12 112.91 115.99 1c0w h THR 44 Ca -0.02 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.80 1c0w h THR 44 Cb 0.54 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 1c0w h THR 44 CO 0.03 0.17 0.12 0.58 0.37 0.00 0.00 175.52 176.79 1c0w h VAL 45 N 0.91 1.24 -0.31 3.16 2.07 -0.90 -1.69 116.25 120.73 1c0w h VAL 45 Ca 0.46 -0.86 0.06 0.00 0.82 0.00 0.00 66.70 67.18 1c0w h VAL 45 Cb 0.50 0.82 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 1c0w h VAL 45 CO -0.22 0.31 -0.07 0.00 0.02 0.00 0.00 177.57 177.60 1c0w h ALA 46 N 1.00 0.21 -0.58 1.67 0.00 0.09 0.12 119.26 121.77 1c0w h ALA 46 Ca 0.16 0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.31 1c0w h ALA 46 Cb 0.34 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.26 1c0w h ALA 46 CO 0.00 -0.46 -0.07 -0.09 0.00 0.00 0.00 179.25 178.63 1c0w h ARG 47 N 0.01 0.06 -0.12 0.00 2.43 -0.75 0.17 114.38 116.17 1c0w h ARG 47 Ca 0.15 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.35 1c0w h ARG 47 Cb 0.23 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 1c0w h ARG 47 CO -0.32 0.04 -0.12 0.52 -1.51 0.00 0.00 179.97 178.58 1c0w h MET 48 N 0.06 -0.14 -0.89 0.20 2.86 -0.13 -1.54 114.93 115.34 1c0w h MET 48 Ca 0.29 0.01 0.06 0.00 -2.06 0.00 0.00 59.70 58.00 1c0w h MET 48 Cb 0.46 0.03 -0.06 0.00 0.06 0.00 0.00 31.60 32.09 1c0w h MET 48 CO -0.54 -0.09 0.58 1.49 1.06 0.00 0.00 176.91 179.41 1c0w h GLU 49 N -0.14 1.01 0.00 1.72 4.81 0.60 0.27 114.58 122.85 1c0w h GLU 49 Ca 0.08 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1c0w h GLU 49 Cb 0.26 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 1c0w h GLU 49 CO -0.21 0.67 -0.10 -0.09 -0.73 0.00 0.00 179.01 178.56 1c0w h ARG 50 N 1.05 0.00 -0.84 1.92 2.43 0.21 -0.43 114.38 118.71 1c0w h ARG 50 Ca 0.38 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 59.25 1c0w h ARG 50 Cb 0.15 0.00 -0.18 0.00 -0.42 0.00 0.00 29.97 29.52 1c0w h ARG 50 CO -0.13 0.10 0.38 -0.25 -1.51 0.00 0.00 179.97 178.55 1c0w n ASP 51 N -4.39 4.41 -4.39 -3.80 8.00 -0.01 -4.93 116.55 111.45 1c0w n ASP 51 Ca -0.03 -3.26 -0.39 0.00 0.71 0.00 0.00 54.79 51.82 1c0w n ASP 51 Cb 0.18 -0.76 -0.06 0.00 -0.02 0.00 0.00 41.12 40.45 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 -0.40 -0.38 0.07 0.44 0.00 -0.17 -4.81 105.19 99.94 1c0w n GLY 52 Ca 0.44 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.57 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 -4.24 0.18 -3.53 0.99 4.77 -0.64 -4.41 117.00 110.11 1c0w n LEU 53 Ca 0.04 0.08 -0.10 0.00 -0.03 0.00 0.00 56.01 56.00 1c0w n LEU 53 Cb 0.50 0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.79 1c0w n LEU 53 CO 0.91 0.23 0.51 0.54 -1.33 0.00 0.00 177.39 178.25 1c0w s VAL 54 N -2.98 0.00 -0.02 4.08 0.11 -1.26 -1.88 120.40 118.46 1c0w s VAL 54 Ca -0.08 -0.19 0.01 0.00 -2.93 0.00 0.00 61.98 58.79 1c0w s VAL 54 Cb 0.10 -1.22 0.02 0.00 -1.53 0.00 0.00 36.38 33.74 1c0w s VAL 54 CO 0.86 0.00 -0.01 0.68 -3.33 0.00 0.00 175.10 173.29 1c0w s VAL 55 N -3.57 0.20 -0.40 2.04 -7.23 -0.24 -3.75 120.40 107.46 1c0w s VAL 55 Ca 0.04 0.00 -0.28 0.00 -1.81 0.00 0.00 61.98 59.94 1c0w s VAL 55 Cb -0.02 -0.24 0.02 0.00 0.56 0.00 0.00 36.38 36.70 1c0w s VAL 55 CO -0.08 0.11 1.04 -0.69 -0.31 0.00 0.00 175.10 175.17 1c0w s VAL 56 N 0.58 4.43 1.23 1.32 1.01 -1.26 -1.11 120.40 126.61 1c0w s VAL 56 Ca -0.06 1.31 -0.14 0.00 0.00 0.00 0.00 61.98 63.09 1c0w s VAL 56 Cb -0.09 -4.45 0.31 0.00 0.00 0.00 0.00 36.38 32.15 1c0w s VAL 56 CO -0.01 -0.70 0.96 0.00 0.00 0.00 0.00 175.10 175.35 1c0w n ALA 57 N 7.18 -3.39 0.28 5.51 0.00 0.19 -4.80 120.51 125.48 1c0w n ALA 57 Ca 0.10 -1.33 0.13 0.00 0.00 0.00 0.00 53.44 52.34 1c0w n ALA 57 Cb 0.48 -1.93 0.80 0.00 0.00 0.00 0.00 19.45 18.80 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 -2.86 0.00 -0.60 0.00 4.64 -1.95 -0.90 113.55 111.88 1c0w h SER 58 Ca -0.61 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.68 1c0w h SER 58 Cb 1.34 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.41 1c0w h SER 58 CO 0.47 0.06 0.04 -0.90 -0.87 0.00 0.00 176.83 175.63 1c0w n ASP 59 N -3.87 5.64 0.00 4.97 5.68 -1.26 -4.92 116.55 122.79 1c0w n ASP 59 Ca -0.03 -2.97 0.00 0.00 -0.50 0.00 0.00 54.79 51.29 1c0w n ASP 59 Cb 0.15 -0.70 0.00 0.00 -1.14 0.00 0.00 41.12 39.43 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 0.52 -0.00 -2.60 0.11 1.74 -0.34 -5.00 116.66 111.09 1c0w n ARG 60 Ca 0.30 0.00 -0.33 0.00 -0.77 0.00 0.00 57.85 57.05 1c0w n ARG 60 Cb 1.23 -3.21 -0.05 0.00 -1.02 0.00 0.00 32.46 29.41 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 -2.64 6.75 -0.41 0.55 1.04 -1.26 -4.49 113.70 113.23 1c0w s SER 61 Ca 0.00 1.64 -0.17 0.00 0.48 0.00 0.00 55.95 57.91 1c0w s SER 61 Cb 0.00 -2.53 0.02 0.00 0.10 0.00 0.00 66.02 63.61 1c0w s SER 61 CO 0.00 -0.50 0.41 -0.76 0.98 0.00 0.00 173.24 173.37 1c0w s LEU 62 N -3.63 4.88 -0.42 2.42 1.43 -0.12 0.56 118.68 123.80 1c0w s LEU 62 Ca 0.61 -0.68 -0.13 0.00 -1.03 0.00 0.00 54.13 52.89 1c0w s LEU 62 Cb -0.10 -2.34 0.04 0.00 0.03 0.00 0.00 46.19 43.82 1c0w s LEU 62 CO 0.22 -0.54 0.29 -1.10 0.23 0.00 0.00 176.35 175.45 1c0w s GLN 63 N 2.04 2.89 0.27 1.70 -0.21 -0.27 -4.82 119.66 121.27 1c0w s GLN 63 Ca 0.11 -1.16 -0.30 0.00 0.02 0.00 0.00 55.36 54.02 1c0w s GLN 63 Cb -0.17 -3.92 -0.11 0.00 1.00 0.00 0.00 33.01 29.80 1c0w s GLN 63 CO 0.13 -0.82 1.54 -1.64 -2.12 0.00 0.00 175.29 172.38 1c0w s MET 64 N 1.61 4.17 0.95 2.91 -1.94 -1.26 -1.08 119.30 124.66 1c0w s MET 64 Ca 0.04 2.48 -0.12 0.00 -1.71 0.00 0.00 55.69 56.38 1c0w s MET 64 Cb -0.21 -3.06 0.16 0.00 2.01 0.00 0.00 34.83 33.73 1c0w s MET 64 CO 0.07 -0.56 1.09 0.95 -0.01 0.00 0.00 175.02 176.57 1c0w s THR 65 N 0.05 2.39 0.17 2.05 -4.23 -0.78 -4.61 115.64 110.68 1c0w s THR 65 Ca 0.62 0.13 -0.16 0.00 -1.18 0.00 0.00 61.69 61.10 1c0w s THR 65 Cb -0.46 -2.60 0.10 0.00 1.34 0.00 0.00 72.50 70.88 1c0w s THR 65 CO 0.46 -0.17 1.68 1.55 -0.54 0.00 0.00 174.62 177.60 1c0w h PRO 66 N -1.73 0.06 -0.86 3.99 0.13 -1.89 0.27 132.00 131.98 1c0w h PRO 66 Ca -0.52 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.60 1c0w h PRO 66 Cb 1.30 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.38 1c0w h PRO 66 CO 0.56 0.04 0.50 0.00 -0.23 0.00 0.00 178.00 178.87 1c0w h THR 67 N 0.06 1.24 -0.52 1.56 1.03 -1.89 0.21 112.91 114.60 1c0w h THR 67 Ca 0.21 -0.55 -0.12 0.00 -0.01 0.00 0.00 66.41 65.93 1c0w h THR 67 Cb 0.31 0.06 -0.02 0.00 -1.07 0.00 0.00 68.15 67.43 1c0w h THR 67 CO -0.39 0.26 -0.15 1.23 -0.01 0.00 0.00 175.52 176.47 1c0w h GLY 68 N 1.18 1.10 0.92 2.99 0.00 -1.33 -2.72 103.07 105.21 1c0w h GLY 68 Ca 0.31 -0.92 0.01 0.00 0.00 0.00 0.00 47.33 46.72 1c0w h GLY 68 CO -0.05 0.84 0.03 -0.09 0.00 0.00 0.00 176.54 177.26 1c0w h ARG 69 N 0.88 0.07 -0.46 4.80 9.65 -0.04 -0.17 114.38 129.11 1c0w h ARG 69 Ca 0.13 -0.00 0.09 0.00 -1.10 0.00 0.00 59.98 59.10 1c0w h ARG 69 Cb 0.72 -0.02 -0.09 0.00 -1.39 0.00 0.00 29.97 29.20 1c0w h ARG 69 CO 0.06 0.05 -0.10 1.15 2.80 0.00 0.00 179.97 183.92 1c0w h THR 70 N 0.07 0.55 -0.11 0.20 2.02 -0.82 -0.64 112.91 114.19 1c0w h THR 70 Ca 0.04 -0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 1c0w h THR 70 Cb 0.02 0.54 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1c0w h THR 70 CO -0.05 0.00 0.03 0.25 0.37 0.00 0.00 175.52 176.13 1c0w h LEU 71 N 0.01 0.16 -0.67 2.58 5.85 -1.21 -1.04 115.31 120.99 1c0w h LEU 71 Ca 0.22 -0.21 0.14 0.00 0.84 0.00 0.00 57.88 58.87 1c0w h LEU 71 Cb 0.34 -0.04 -0.11 0.00 0.37 0.00 0.00 40.66 41.22 1c0w h LEU 71 CO -0.46 0.33 0.01 0.00 -0.34 0.00 0.00 178.44 177.98 1c0w h ALA 72 N 0.83 0.68 0.36 1.25 0.00 -0.38 0.12 119.26 122.12 1c0w h ALA 72 Ca 0.03 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1c0w h ALA 72 Cb 0.23 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1c0w h ALA 72 CO -0.00 -0.40 -0.17 1.15 0.00 0.00 0.00 179.25 179.83 1c0w h THR 73 N 0.12 0.65 -0.97 0.00 2.02 -0.92 -1.67 112.91 112.14 1c0w h THR 73 Ca 0.35 -0.04 0.21 0.00 0.77 0.00 0.00 66.41 67.70 1c0w h THR 73 Cb 0.59 0.67 -0.09 0.00 -1.74 0.00 0.00 68.15 67.59 1c0w h THR 73 CO -0.57 0.01 0.62 0.00 0.37 0.00 0.00 175.52 175.95 1c0w h ALA 74 N 0.15 1.97 -0.09 6.16 0.00 0.01 0.16 119.26 127.62 1c0w h ALA 74 Ca -0.05 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1c0w h ALA 74 Cb 0.38 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1c0w h ALA 74 CO 0.08 -0.31 -0.07 0.28 0.00 0.00 0.00 179.25 179.22 1c0w h VAL 75 N 0.57 1.35 -0.55 0.00 2.07 -0.59 -0.84 116.25 118.26 1c0w h VAL 75 Ca 0.54 -1.18 0.07 0.00 0.82 0.00 0.00 66.70 66.94 1c0w h VAL 75 Cb 1.10 1.95 -0.06 0.00 -1.52 0.00 0.00 31.29 32.75 1c0w h VAL 75 CO -0.28 0.33 0.22 -0.03 0.02 0.00 0.00 177.57 177.83 1c0w h MET 76 N -0.20 0.41 0.16 1.57 4.05 -0.20 0.94 114.93 121.67 1c0w h MET 76 Ca 0.02 -0.02 0.01 0.00 -0.28 0.00 0.00 59.70 59.42 1c0w h MET 76 Cb 0.56 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.25 1c0w h MET 76 CO 0.02 0.27 -0.22 -0.09 0.23 0.00 0.00 176.91 177.12 1c0w h ARG 77 N 0.42 -0.43 -0.79 0.39 2.43 -0.66 -1.60 114.38 114.14 1c0w h ARG 77 Ca 0.26 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.58 1c0w h ARG 77 Cb 0.27 0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 29.83 1c0w h ARG 77 CO -0.24 -0.28 0.41 0.87 -1.51 0.00 0.00 179.97 179.21 1c0w h LYS 78 N -0.44 0.62 0.56 0.20 6.56 -0.50 -0.22 116.57 123.35 1c0w h LYS 78 Ca 0.02 -0.04 -0.02 0.00 -1.06 0.00 0.00 60.65 59.55 1c0w h LYS 78 Cb 0.44 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 31.96 1c0w h LYS 78 CO -0.10 0.41 -0.38 1.25 -2.06 0.00 0.00 179.45 178.58 1c0w h HIS 79 N 0.64 -1.01 -0.83 -1.35 2.76 -0.27 -0.63 115.15 114.45 1c0w h HIS 79 Ca 0.41 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.64 1c0w h HIS 79 Cb 0.50 0.37 -0.06 0.00 1.55 0.00 0.00 27.41 29.77 1c0w h HIS 79 CO -0.10 -0.55 0.51 0.00 -1.30 0.00 0.00 177.93 176.49 1c0w h ARG 80 N -0.89 0.89 -0.59 5.26 3.08 -1.06 -0.87 114.38 120.20 1c0w h ARG 80 Ca -0.07 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.93 1c0w h ARG 80 Cb 0.72 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 1c0w h ARG 80 CO 0.05 0.59 0.38 -0.07 -1.07 0.00 0.00 179.97 179.86 1c0w h LEU 81 N 0.92 0.65 -0.37 3.04 4.07 -0.95 -1.14 115.31 121.53 1c0w h LEU 81 Ca 0.37 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 58.30 1c0w h LEU 81 Cb 0.20 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 41.77 1c0w h LEU 81 CO -0.18 0.46 0.16 0.00 -1.08 0.00 0.00 178.44 177.80 1c0w h ALA 82 N 1.23 0.48 -0.45 1.53 0.00 -0.42 -1.71 119.26 119.92 1c0w h ALA 82 Ca 0.22 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.09 1c0w h ALA 82 Cb -0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.53 1c0w h ALA 82 CO -0.06 0.06 0.08 0.93 0.00 0.00 0.00 179.25 180.25 1c0w h GLU 83 N 0.45 0.21 0.09 0.00 5.08 -0.73 0.46 114.58 120.15 1c0w h GLU 83 Ca 0.12 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1c0w h GLU 83 Cb 0.15 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1c0w h GLU 83 CO -0.01 0.14 -0.16 0.00 -1.00 0.00 0.00 179.01 177.97 1c0w h ARG 84 N 0.21 -0.31 -0.35 2.33 2.47 -0.96 -0.71 114.38 117.07 1c0w h ARG 84 Ca 0.22 0.02 0.01 0.00 -1.26 0.00 0.00 59.98 58.97 1c0w h ARG 84 Cb 0.29 0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 1c0w h ARG 84 CO -0.30 -0.21 0.23 1.25 0.56 0.00 0.00 179.97 181.50 1c0w h LEU 85 N -0.32 0.39 -1.00 3.04 5.85 -0.70 0.48 115.31 123.05 1c0w h LEU 85 Ca 0.02 -0.01 0.11 0.00 0.84 0.00 0.00 57.88 58.85 1c0w h LEU 85 Cb 0.34 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.19 1c0w h LEU 85 CO -0.09 0.28 0.63 -0.07 -0.34 0.00 0.00 178.44 178.85 1c0w h LEU 86 N 0.46 0.93 0.00 2.25 3.38 0.32 -0.02 115.31 122.63 1c0w h LEU 86 Ca 0.13 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1c0w h LEU 86 Cb -0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1c0w h LEU 86 CO -0.03 0.50 -0.58 0.71 0.09 0.00 0.00 178.44 179.13 1c0w h THR 87 N 1.01 0.31 -0.37 0.22 1.35 -0.81 0.14 112.91 114.76 1c0w h THR 87 Ca 0.49 -1.35 0.04 0.00 -0.55 0.00 0.00 66.41 65.04 1c0w h THR 87 Cb 0.46 0.71 -0.04 0.00 -1.73 0.00 0.00 68.15 67.55 1c0w h THR 87 CO -0.26 0.11 0.15 0.44 -0.25 0.00 0.00 175.52 175.71 1c0w h ASP 88 N -1.00 0.19 0.00 5.36 3.32 -0.07 -2.62 116.42 121.60 1c0w h ASP 88 Ca -0.08 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1c0w h ASP 88 Cb 0.64 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 1c0w h ASP 88 CO -0.05 0.14 -0.94 -0.38 -1.72 0.00 0.00 179.24 176.29 1c0w n ILE 89 N -4.99 1.49 0.19 0.35 -0.00 -0.11 -4.60 119.36 111.70 1c0w n ILE 89 Ca 0.01 0.14 0.04 0.00 -0.00 0.00 0.00 62.75 62.94 1c0w n ILE 89 Cb 0.12 -2.35 0.39 0.00 -0.00 0.00 0.00 39.64 37.80 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 -1.00 1.17 -4.20 1.39 1.08 -1.35 -3.47 117.51 111.14 1c0w h ILE 90 Ca -0.01 -1.22 -0.26 0.00 -0.39 0.00 0.00 64.86 62.98 1c0w h ILE 90 Cb 0.93 1.67 0.09 0.00 -3.07 0.00 0.00 36.82 36.44 1c0w h ILE 90 CO -0.01 0.34 -0.45 0.61 -0.69 0.00 0.00 178.15 177.95 1c0w n GLY 91 N -0.44 -0.03 3.79 5.37 0.00 0.24 -4.97 105.19 109.15 1c0w n GLY 91 Ca -0.02 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 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 -5.11 4.10 0.06 0.99 2.96 0.25 -4.93 118.68 117.00 1c0w s LEU 92 Ca 0.35 1.92 -0.38 0.00 -0.22 0.00 0.00 54.13 55.80 1c0w s LEU 92 Cb -0.15 -4.27 -0.18 0.00 0.50 0.00 0.00 46.19 42.08 1c0w s LEU 92 CO 0.48 -0.42 1.15 -0.67 -1.32 0.00 0.00 176.35 175.56 1c0w n ASP 93 N -0.18 0.64 0.09 3.68 2.03 -1.26 -4.66 116.55 116.89 1c0w n ASP 93 Ca 0.05 1.14 0.18 0.00 0.52 0.00 0.00 54.79 56.68 1c0w n ASP 93 Cb 0.51 -1.05 0.72 0.00 -0.72 0.00 0.00 41.12 40.58 1c0w n ASP 93 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1c0w h ILE 94 N 2.98 0.68 0.04 5.18 6.09 -1.97 -2.21 117.51 128.29 1c0w h ILE 94 Ca -0.48 0.00 -0.17 0.00 -1.37 0.00 0.00 64.86 62.84 1c0w h ILE 94 Cb 1.39 0.79 0.02 0.00 0.47 0.00 0.00 36.82 39.48 1c0w h ILE 94 CO 0.70 0.00 -0.69 -0.55 -3.07 0.00 0.00 178.15 174.54 1c0w h ASN 95 N 0.00 0.54 0.51 2.19 -1.07 -2.00 -3.26 115.58 112.48 1c0w h ASN 95 Ca 0.17 -0.81 -0.02 0.00 0.07 0.00 0.00 56.30 55.72 1c0w h ASN 95 Cb 0.76 -0.17 -0.00 0.00 -2.07 0.00 0.00 38.32 36.84 1c0w h ASN 95 CO -0.00 1.28 -0.08 0.11 0.07 0.00 0.00 177.43 178.82 1c0w h LYS 96 N -0.15 0.00 -0.33 4.14 1.79 -1.84 -3.28 116.57 116.91 1c0w h LYS 96 Ca -0.10 0.00 0.07 0.00 -2.18 0.00 0.00 60.65 58.45 1c0w h LYS 96 Cb 1.42 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.99 1c0w h LYS 96 CO 0.13 0.08 -0.25 0.28 -1.08 0.00 0.00 179.45 178.61 1c0w h VAL 97 N 0.00 0.36 -0.24 0.50 2.07 -1.45 -1.80 116.25 115.70 1c0w h VAL 97 Ca -0.00 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.56 1c0w h VAL 97 Cb 0.35 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1c0w h VAL 97 CO 0.01 0.00 0.02 -0.74 0.02 0.00 0.00 177.57 176.88 1c0w h HIS 98 N -0.21 0.02 0.21 1.57 -0.00 -1.76 -1.62 115.15 113.35 1c0w h HIS 98 Ca 0.16 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.55 1c0w h HIS 98 Cb 0.47 0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.89 1c0w h HIS 98 CO -0.44 -0.01 -0.19 -0.44 -0.00 0.00 0.00 177.93 176.85 1c0w h ASP 99 N 0.10 -0.49 -0.67 3.26 3.32 -1.69 0.13 116.42 120.38 1c0w h ASP 99 Ca 0.11 0.04 0.13 0.00 0.02 0.00 0.00 57.03 57.34 1c0w h ASP 99 Cb 0.13 0.17 -0.10 0.00 0.22 0.00 0.00 39.33 39.75 1c0w h ASP 99 CO -0.17 -0.28 0.16 -0.08 -1.72 0.00 0.00 179.24 177.15 1c0w h GLU 100 N -0.42 0.27 -0.66 3.56 4.57 -1.23 0.52 114.58 121.20 1c0w h GLU 100 Ca -0.00 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.10 1c0w h GLU 100 Cb 0.38 -0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 1c0w h GLU 100 CO -0.03 0.18 0.17 0.00 -1.18 0.00 0.00 179.01 178.15 1c0w h ALA 101 N 1.54 1.05 -0.06 2.92 0.00 -0.81 -1.35 119.26 122.55 1c0w h ALA 101 Ca 0.36 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1c0w h ALA 101 Cb 0.57 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1c0w h ALA 101 CO -0.45 0.63 0.29 0.00 0.00 0.00 0.00 179.25 179.72 1c0w n ARG 103 N -3.09 0.53 -0.01 0.00 1.74 -0.80 -4.50 116.66 110.54 1c0w n ARG 103 Ca -0.01 0.41 0.09 0.00 -0.77 0.00 0.00 57.85 57.58 1c0w n ARG 103 Cb 0.36 -1.61 0.50 0.00 -1.02 0.00 0.00 32.46 30.70 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 0.39 -1.02 -1.55 4.06 -0.64 -2.31 115.95 113.87 1c0w h TRP 104 Ca -0.27 0.01 0.28 0.00 2.06 0.00 0.00 58.89 60.97 1c0w h TRP 104 Cb 1.10 -0.13 -0.06 0.00 -1.00 0.00 0.00 29.16 29.08 1c0w h TRP 104 CO -0.14 0.21 0.71 1.05 -3.56 0.00 0.00 178.44 176.71 1c0w h GLU 105 N 0.39 0.14 0.00 0.49 4.11 -1.15 0.18 114.58 118.73 1c0w h GLU 105 Ca 0.20 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.62 1c0w h GLU 105 Cb 0.28 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1c0w h GLU 105 CO -0.05 0.09 -0.34 0.72 0.07 0.00 0.00 179.01 179.50 1c0w n HIS 106 N -4.35 0.44 -0.76 2.06 8.25 -0.87 -4.16 115.22 115.83 1c0w n HIS 106 Ca 0.22 0.13 0.04 0.00 -0.26 0.00 0.00 57.72 57.85 1c0w n HIS 106 Cb 1.00 -0.62 0.05 0.00 1.12 0.00 0.00 29.99 31.55 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 -1.92 1.10 -3.56 1.59 0.24 0.55 -5.01 118.33 111.32 1c0w n VAL 107 Ca 0.05 -1.25 -0.37 0.00 -2.04 0.00 0.00 64.34 60.73 1c0w n VAL 107 Cb 0.40 0.28 -0.08 0.00 -1.47 0.00 0.00 33.84 32.96 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 -1.48 4.14 0.79 7.34 0.00 -0.81 -5.08 119.30 124.20 1c0w s MET 108 Ca 0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 55.69 55.64 1c0w s MET 108 Cb 0.11 -3.52 0.06 0.00 0.00 0.00 0.00 34.83 31.48 1c0w s MET 108 CO 0.01 0.06 1.10 -1.54 0.00 0.00 0.00 175.02 174.65 1c0w s SER 109 N 0.93 4.59 0.31 1.11 1.04 -1.26 -4.93 113.70 115.48 1c0w s SER 109 Ca 0.13 1.30 0.04 0.00 0.48 0.00 0.00 55.95 57.90 1c0w s SER 109 Cb -0.14 -2.04 0.50 0.00 0.10 0.00 0.00 66.02 64.44 1c0w s SER 109 CO 0.05 -1.91 1.77 0.44 0.98 0.00 0.00 173.24 174.58 1c0w h ASP 110 N -1.05 0.42 0.66 7.02 5.19 -1.99 -2.48 116.42 124.19 1c0w h ASP 110 Ca -0.47 -0.13 -0.03 0.00 -0.62 0.00 0.00 57.03 55.78 1c0w h ASP 110 Cb 1.27 -0.11 0.01 0.00 0.18 0.00 0.00 39.33 40.67 1c0w h ASP 110 CO 0.60 0.64 -0.32 -0.33 -3.12 0.00 0.00 179.24 176.71 1c0w h GLU 111 N 0.39 -0.86 -0.98 3.56 3.07 -1.97 -0.99 114.58 116.81 1c0w h GLU 111 Ca 0.06 0.06 0.33 0.00 -0.50 0.00 0.00 59.36 59.31 1c0w h GLU 111 Cb 0.58 0.19 -0.16 0.00 -0.84 0.00 0.00 28.75 28.53 1c0w h GLU 111 CO 0.04 -0.57 0.44 0.28 -1.40 0.00 0.00 179.01 177.80 1c0w h VAL 112 N -0.92 0.19 0.30 3.13 2.07 -1.94 0.70 116.25 119.77 1c0w h VAL 112 Ca -0.09 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 1c0w h VAL 112 Cb 0.68 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1c0w h VAL 112 CO 0.15 0.03 -0.23 -0.33 0.02 0.00 0.00 177.57 177.21 1c0w h GLU 113 N 0.18 -0.52 -0.67 1.57 5.08 -0.97 -0.32 114.58 118.94 1c0w h GLU 113 Ca 0.72 0.04 0.07 0.00 -1.00 0.00 0.00 59.36 59.18 1c0w h GLU 113 Cb 1.68 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 30.99 1c0w h GLU 113 CO -0.69 -0.34 0.36 0.00 -1.00 0.00 0.00 179.01 177.33 1c0w h ARG 114 N -0.54 0.63 -0.62 2.33 3.08 0.16 -0.93 114.38 118.49 1c0w h ARG 114 Ca -0.02 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.05 1c0w h ARG 114 Cb 0.47 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.33 1c0w h ARG 114 CO -0.01 0.41 0.34 0.00 -1.07 0.00 0.00 179.97 179.65 1c0w h ARG 115 N 0.65 0.62 -0.79 0.04 2.47 -0.63 -1.75 114.38 114.99 1c0w h ARG 115 Ca 0.31 -0.04 0.01 0.00 -1.26 0.00 0.00 59.98 59.00 1c0w h ARG 115 Cb 0.24 -0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 28.38 1c0w h ARG 115 CO -0.21 0.41 0.52 -0.07 0.56 0.00 0.00 179.97 181.19 1c0w h LEU 116 N 0.64 0.90 -0.52 3.04 3.38 0.16 -0.64 115.31 122.27 1c0w h LEU 116 Ca 0.28 -0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.33 1c0w h LEU 116 Cb 0.16 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.60 1c0w h LEU 116 CO -0.17 0.65 0.01 0.58 0.09 0.00 0.00 178.44 179.60 1c0w h VAL 117 N 1.07 0.60 0.80 1.22 2.07 -0.32 0.33 116.25 122.02 1c0w h VAL 117 Ca 0.29 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 67.73 1c0w h VAL 117 Cb -0.11 0.46 0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1c0w h VAL 117 CO -0.07 0.02 -0.39 0.11 0.02 0.00 0.00 177.57 177.27 1c0w h LYS 118 N 0.13 -1.04 -0.02 1.57 1.79 -1.02 -3.17 116.57 114.81 1c0w h LYS 118 Ca 0.26 0.07 0.01 0.00 -2.18 0.00 0.00 60.65 58.81 1c0w h LYS 118 Cb 0.40 0.24 -0.00 0.00 -1.58 0.00 0.00 32.23 31.29 1c0w h LYS 118 CO -0.43 -0.68 0.03 0.28 -1.08 0.00 0.00 179.45 177.57 1c0w h VAL 119 N -1.24 0.34 -3.22 0.50 2.07 -0.85 -3.43 116.25 110.42 1c0w h VAL 119 Ca -0.11 0.00 -0.57 0.00 0.82 0.00 0.00 66.70 66.84 1c0w h VAL 119 Cb 0.84 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.54 1c0w h VAL 119 CO 0.18 0.00 -0.19 -0.76 0.02 0.00 0.00 177.57 176.82 1c0w s LEU 120 N -7.13 4.31 0.00 2.57 1.43 0.11 -5.06 118.68 114.91 1c0w s LEU 120 Ca -0.05 0.87 0.00 0.00 -1.03 0.00 0.00 54.13 53.92 1c0w s LEU 120 Cb 0.14 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 43.17 1c0w s LEU 120 CO 0.50 0.11 0.00 2.29 0.23 0.00 0.00 176.35 179.47 1c0w n LYS 121 N 0.66 0.00 -3.48 1.70 -0.00 -1.26 -4.81 118.16 110.97 1c0w n LYS 121 Ca -0.06 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.92 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 -2.05 6.66 -0.19 -5.58 -4.77 -1.26 -4.99 116.67 104.49 1c0w s ASP 122 Ca 0.00 0.88 0.13 0.00 -3.30 0.00 0.00 52.55 50.26 1c0w s ASP 122 Cb 0.00 -2.21 0.43 0.00 -1.09 0.00 0.00 42.92 40.05 1c0w s ASP 122 CO 0.00 0.05 1.20 1.33 0.70 0.00 0.00 175.17 178.45 1c0w n VAL 123 N 0.38 1.87 0.19 2.11 0.24 -1.26 -4.82 118.33 117.04 1c0w n VAL 123 Ca -0.03 -3.02 -0.14 0.00 -2.04 0.00 0.00 64.34 59.11 1c0w n VAL 123 Cb 0.52 -0.12 -0.08 0.00 -1.47 0.00 0.00 33.84 32.69 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 1.24 -0.42 -4.51 -1.34 0.02 -1.94 -3.40 113.55 103.21 1c0w h SER 124 Ca 0.01 -0.13 -0.38 0.00 -0.84 0.00 0.00 61.79 60.45 1c0w h SER 124 Cb 1.24 0.11 -0.14 0.00 0.14 0.00 0.00 62.40 63.74 1c0w h SER 124 CO 0.14 -0.08 -0.59 0.00 -1.14 0.00 0.00 176.83 175.16 1c0w s ARG 125 N -4.85 1.50 0.84 3.45 1.70 -1.26 -0.82 118.95 119.52 1c0w s ARG 125 Ca -0.14 -1.83 -0.13 0.00 -0.47 0.00 0.00 55.73 53.16 1c0w s ARG 125 Cb 0.02 -0.23 0.10 0.00 -0.57 0.00 0.00 34.95 34.28 1c0w s ARG 125 CO 0.54 -0.36 1.20 -1.54 -1.08 0.00 0.00 175.30 174.07 1c0w s SER 126 N -3.35 4.20 0.66 -2.89 1.04 0.20 -4.77 113.70 108.78 1c0w s SER 126 Ca 0.36 0.72 0.36 0.00 0.48 0.00 0.00 55.95 57.87 1c0w s SER 126 Cb 0.07 -1.15 1.98 0.00 0.10 0.00 0.00 66.02 67.02 1c0w s SER 126 CO 0.15 -2.10 2.14 -0.65 0.98 0.00 0.00 173.24 173.76 1c0w h PRO 127 N -1.19 0.00 -0.54 4.02 0.11 -1.88 0.15 132.00 132.67 1c0w h PRO 127 Ca -0.46 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 1c0w h PRO 127 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 1c0w h PRO 127 CO 0.61 0.00 0.03 1.19 -0.21 0.00 0.00 178.00 179.62 1c0w n PHE 128 N -3.09 1.95 -0.94 0.65 3.01 -1.26 -4.92 117.46 112.85 1c0w n PHE 128 Ca -0.02 -0.80 0.00 0.00 1.01 0.00 0.00 57.45 57.64 1c0w n PHE 128 Cb 0.24 -0.50 0.00 0.00 -0.01 0.00 0.00 39.48 39.21 1c0w n PHE 128 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1c0w n GLY 129 N 0.36 0.84 3.67 1.37 0.00 0.54 -1.88 105.19 110.09 1c0w n GLY 129 Ca 0.28 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.82 7.04 0.05 1.61 -0.87 -1.26 -4.62 114.94 114.07 1c0w s ASN 130 Ca 0.00 1.61 -0.33 0.00 -1.57 0.00 0.00 52.86 52.56 1c0w s ASN 130 Cb 0.00 -2.54 -0.12 0.00 -0.02 0.00 0.00 41.25 38.56 1c0w s ASN 130 CO 0.00 -0.67 1.75 -0.81 -2.57 0.00 0.00 177.10 174.80 1c0w n PRO 131 N 6.13 2.29 -2.43 -0.60 -0.04 -1.26 0.60 135.00 139.68 1c0w n PRO 131 Ca 0.12 0.83 -0.43 0.00 -0.04 0.00 0.00 63.50 63.99 1c0w n PRO 131 Cb 0.46 -2.66 -0.02 0.00 -0.04 0.00 0.00 33.50 31.23 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 2.57 4.25 0.76 0.52 1.01 0.00 -4.85 121.20 125.47 1c0w s ILE 132 Ca 0.85 1.48 -0.08 0.00 0.00 0.00 0.00 60.65 62.90 1c0w s ILE 132 Cb -0.64 -4.06 0.09 0.00 0.01 0.00 0.00 42.46 37.85 1c0w s ILE 132 CO 0.43 -0.25 1.09 -2.16 0.00 0.00 0.00 174.94 174.05 1c0w s PRO 133 N 3.71 1.87 -1.64 2.79 0.04 -1.26 -4.58 135.00 135.94 1c0w s PRO 133 Ca 0.55 -0.30 -0.15 0.00 0.04 0.00 0.00 61.00 61.14 1c0w s PRO 133 Cb -0.20 -2.10 0.15 0.00 0.04 0.00 0.00 34.50 32.39 1c0w s PRO 133 CO 0.17 -1.49 0.37 0.41 0.04 0.00 0.00 177.00 176.50 1c0w n GLY 134 N -3.10 -0.28 0.06 0.56 0.00 -1.26 -4.56 105.19 96.60 1c0w n GLY 134 Ca 0.10 0.10 -0.07 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.05 0.00 0.01 0.99 3.38 -1.99 -3.15 115.31 113.50 1c0w h LEU 135 Ca -0.57 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.43 1c0w h LEU 135 Cb 1.28 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.98 1c0w h LEU 135 CO 0.77 0.98 -0.46 0.44 0.09 0.00 0.00 178.44 180.26 1c0w h ASP 136 N 0.00 -1.41 -0.31 -0.43 3.45 -1.96 -0.48 116.42 115.29 1c0w h ASP 136 Ca -0.02 0.16 0.09 0.00 0.43 0.00 0.00 57.03 57.69 1c0w h ASP 136 Cb 1.77 0.54 -0.01 0.00 -0.56 0.00 0.00 39.33 41.06 1c0w h ASP 136 CO 0.13 -0.49 0.23 1.05 -1.57 0.00 0.00 179.24 178.59 1c0w h GLU 137 N -0.62 0.00 0.00 3.56 9.09 -1.95 -2.51 114.58 122.14 1c0w h GLU 137 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 1c0w h GLU 137 Cb 0.69 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.79 1c0w h GLU 137 CO -0.33 0.00 0.21 -0.11 0.05 0.00 0.00 179.01 178.83 1c0w n LEU 138 N -4.32 0.12 -0.52 3.06 7.94 -0.19 -4.75 117.00 118.35 1c0w n LEU 138 Ca 0.04 0.41 -0.05 0.00 -1.11 0.00 0.00 56.01 55.30 1c0w n LEU 138 Cb 0.40 -0.39 -0.00 0.00 0.53 0.00 0.00 43.42 43.95 1c0w n LEU 138 CO 0.34 -0.45 -0.06 0.61 -1.11 0.00 0.00 177.39 176.73 1c0w n GLY 139 N -1.31 0.26 0.00 -3.96 0.00 -0.94 -4.91 105.19 94.33 1c0w n GLY 139 Ca -0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.83 0.00 0.00 1.61 3.14 -1.26 -5.14 118.33 112.84 1c0w n VAL 140 Ca -0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 1c0w n VAL 140 Cb 0.49 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.27 1c0w n VAL 140 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1c0w n ILE 165 N 0.00 0.00 -0.05 1.55 3.06 -1.26 -5.10 119.36 117.56 1c0w n ILE 165 Ca 0.00 0.00 -0.18 0.00 -2.50 0.00 0.00 62.75 60.07 1c0w n ILE 165 Cb 0.00 0.00 -0.13 0.00 0.54 0.00 0.00 39.64 40.05 1c0w n ILE 165 CO 0.00 0.00 0.00 0.58 -2.50 0.00 0.00 176.55 174.63 1c0w h VAL 166 N 0.00 1.39 -1.30 9.51 2.07 -1.88 -3.50 116.25 122.55 1c0w h VAL 166 Ca 0.00 -2.34 0.16 0.00 0.82 0.00 0.00 66.70 65.34 1c0w h VAL 166 Cb 0.00 2.94 -0.27 0.00 -1.52 0.00 0.00 31.29 32.44 1c0w h VAL 166 CO 0.00 0.56 0.74 0.00 0.02 0.00 0.00 177.57 178.89 1c0w s GLN 167 N -2.33 0.30 -0.43 1.57 -2.07 -1.07 -4.59 119.66 111.04 1c0w s GLN 167 Ca -0.21 0.14 -0.13 0.00 -1.82 0.00 0.00 55.36 53.34 1c0w s GLN 167 Cb 0.01 0.14 0.05 0.00 -1.09 0.00 0.00 33.01 32.13 1c0w s GLN 167 CO 0.70 -0.08 0.31 0.42 -1.32 0.00 0.00 175.29 175.32 1c0w s ILE 168 N -0.71 4.91 0.63 3.63 1.01 -0.79 -0.89 121.20 129.00 1c0w s ILE 168 Ca 0.04 -1.00 -0.17 0.00 0.00 0.00 0.00 60.65 59.52 1c0w s ILE 168 Cb -0.02 -3.86 -0.10 0.00 0.01 0.00 0.00 42.46 38.48 1c0w s ILE 168 CO -0.06 -0.44 0.15 0.59 0.00 0.00 0.00 174.94 175.19 1c0w n ASN 169 N 5.10 -2.55 0.08 3.58 5.03 -0.31 -4.64 115.26 121.55 1c0w n ASN 169 Ca -0.12 0.61 0.17 0.00 0.87 0.00 0.00 54.58 56.12 1c0w n ASN 169 Cb 0.45 -1.02 0.69 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 -0.14 0.00 -0.00 3.52 4.39 -1.96 0.15 114.58 120.54 1c0w h GLU 170 Ca -0.44 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.16 1c0w h GLU 170 Cb 1.39 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.03 1c0w h GLU 170 CO 0.41 0.00 -0.47 0.97 -1.16 0.00 0.00 179.01 178.76 1c0w h ILE 171 N 0.00 1.34 -0.08 3.13 -0.00 -1.92 -3.00 117.51 116.98 1c0w h ILE 171 Ca 0.18 -1.63 -0.19 0.00 -0.00 0.00 0.00 64.86 63.22 1c0w h ILE 171 Cb 0.73 1.87 0.01 0.00 -0.00 0.00 0.00 36.82 39.43 1c0w h ILE 171 CO -0.00 0.46 -0.70 0.15 -0.00 0.00 0.00 178.15 178.07 1c0w h PHE 172 N 0.00 0.85 -0.69 2.19 3.04 -1.27 -3.11 116.94 117.95 1c0w h PHE 172 Ca -0.00 -0.41 0.20 0.00 3.98 0.00 0.00 57.97 61.74 1c0w h PHE 172 Cb 0.84 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 39.20 1c0w h PHE 172 CO 0.00 1.22 0.63 1.96 -2.02 0.00 0.00 178.31 180.10 1c0w h GLN 173 N 0.24 0.00 0.11 1.11 4.20 -1.34 0.20 115.11 119.63 1c0w h GLN 173 Ca -0.06 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.37 1c0w h GLN 173 Cb 1.35 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.13 1c0w h GLN 173 CO 0.14 0.00 -1.32 0.28 -0.67 0.00 0.00 178.83 177.26 1c0w h VAL 174 N 0.00 1.39 -0.31 -0.54 2.07 -1.53 -3.41 116.25 113.92 1c0w h VAL 174 Ca 0.33 -3.01 -0.12 0.00 0.82 0.00 0.00 66.70 64.72 1c0w h VAL 174 Cb 1.59 2.86 -0.02 0.00 -1.52 0.00 0.00 31.29 34.20 1c0w h VAL 174 CO -0.00 0.87 0.36 -0.70 0.02 0.00 0.00 177.57 178.11 1c0w s GLU 175 N -2.65 1.72 0.04 1.57 2.56 0.69 -4.80 118.70 117.83 1c0w s GLU 175 Ca -0.05 -0.39 -0.13 0.00 0.00 0.00 0.00 54.97 54.40 1c0w s GLU 175 Cb 0.07 -5.01 -0.05 0.00 2.00 0.00 0.00 34.13 31.14 1c0w s GLU 175 CO 0.87 -4.70 1.20 1.79 -0.56 0.00 0.00 175.26 173.86 1c0w h THR 176 N 6.86 0.00 -0.31 -1.70 1.35 -1.80 0.28 112.91 117.59 1c0w h THR 176 Ca 0.07 0.00 0.07 0.00 -0.55 0.00 0.00 66.41 65.99 1c0w h THR 176 Cb 0.99 0.00 -0.08 0.00 -1.73 0.00 0.00 68.15 67.32 1c0w h THR 176 CO 1.08 0.00 -0.35 0.44 -0.25 0.00 0.00 175.52 176.44 1c0w h ASP 177 N -0.29 -1.15 0.81 5.36 5.19 -1.97 0.20 116.42 124.58 1c0w h ASP 177 Ca -0.01 0.18 -0.03 0.00 -0.62 0.00 0.00 57.03 56.56 1c0w h ASP 177 Cb 0.28 0.51 -0.00 0.00 0.18 0.00 0.00 39.33 40.30 1c0w h ASP 177 CO -0.09 -0.35 -0.14 -0.61 -3.12 0.00 0.00 179.24 174.93 1c0w h GLN 178 N -0.32 0.00 0.23 3.56 5.75 -1.94 -2.46 115.11 119.92 1c0w h GLN 178 Ca 0.14 0.00 -0.30 0.00 -0.15 0.00 0.00 58.65 58.34 1c0w h GLN 178 Cb 0.56 0.00 0.03 0.00 1.07 0.00 0.00 27.48 29.14 1c0w h GLN 178 CO -0.49 0.14 -1.32 0.35 -2.65 0.00 0.00 178.83 174.87 1c0w h PHE 179 N 0.00 0.87 0.00 3.99 3.57 0.80 -2.89 116.94 123.28 1c0w h PHE 179 Ca -0.00 -0.64 -0.05 0.00 3.53 0.00 0.00 57.97 60.81 1c0w h PHE 179 Cb 0.59 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 1c0w h PHE 179 CO 0.00 1.50 -0.25 1.79 -2.23 0.00 0.00 178.31 179.12 1c0w h THR 180 N 0.01 0.73 0.00 4.41 1.35 -0.58 0.14 112.91 118.97 1c0w h THR 180 Ca -0.23 -1.06 -0.09 0.00 -0.55 0.00 0.00 66.41 64.48 1c0w h THR 180 Cb 2.03 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 70.11 1c0w h THR 180 CO 0.24 0.25 -0.42 1.56 -0.25 0.00 0.00 175.52 176.89 1c0w h GLN 181 N 0.00 0.00 0.03 4.72 7.50 -1.47 0.20 115.11 126.09 1c0w h GLN 181 Ca -0.00 0.00 -0.22 0.00 0.50 0.00 0.00 58.65 58.93 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 0.03 0.42 -1.02 1.25 -1.50 0.00 0.00 178.83 178.01 1c0w h LEU 182 N 0.00 0.11 0.00 1.46 7.12 -0.77 -3.22 115.31 120.02 1c0w h LEU 182 Ca -0.00 -0.12 -0.22 0.00 0.13 0.00 0.00 57.88 57.67 1c0w h LEU 182 Cb 0.94 -0.04 -0.03 0.00 -0.53 0.00 0.00 40.66 41.00 1c0w h LEU 182 CO 0.06 1.06 -1.07 -0.07 -0.13 0.00 0.00 178.44 178.28 1c0w h LEU 183 N 0.03 0.00 0.00 2.25 -0.00 -0.39 -3.04 115.31 114.16 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 1.76 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.42 1c0w h LEU 183 CO 0.14 1.00 0.00 -0.90 -0.00 0.00 0.00 178.44 178.69 1c0w n ASP 184 N -3.32 0.00 -0.93 -0.43 5.68 0.65 -0.80 116.55 117.39 1c0w n ASP 184 Ca -0.02 0.39 0.11 0.00 -0.50 0.00 0.00 54.79 54.77 1c0w n ASP 184 Cb 0.95 -0.44 0.13 0.00 -1.14 0.00 0.00 41.12 40.62 1c0w n ASP 184 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1c0w n ALA 185 N -1.44 2.44 -3.16 2.12 0.00 -1.15 -4.99 120.51 114.33 1c0w n ALA 185 Ca 0.03 -0.78 -0.14 0.00 0.00 0.00 0.00 53.44 52.55 1c0w n ALA 185 Cb 0.12 -0.75 0.07 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 1.26 -6.23 -4.27 0.00 3.85 0.02 -5.00 116.55 106.17 1c0w n ASP 186 Ca 0.14 -0.67 -0.35 0.00 -0.71 0.00 0.00 54.79 53.20 1c0w n ASP 186 Cb 0.55 -4.96 -0.14 0.00 -1.35 0.00 0.00 41.12 35.22 1c0w n ASP 186 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 1c0w s ILE 187 N -3.37 3.28 -0.13 2.12 -1.09 -1.21 -5.07 121.20 115.73 1c0w s ILE 187 Ca 0.42 -0.74 0.16 0.00 -2.23 0.00 0.00 60.65 58.25 1c0w s ILE 187 Cb -0.05 -2.60 0.30 0.00 -1.58 0.00 0.00 42.46 38.53 1c0w s ILE 187 CO 0.70 0.27 1.15 0.54 -1.23 0.00 0.00 174.94 176.37 1c0w n ARG 188 N 4.76 1.19 -0.06 2.79 3.00 -1.26 -4.83 116.66 122.25 1c0w n ARG 188 Ca -0.17 -2.59 0.00 0.00 -0.01 0.00 0.00 57.85 55.09 1c0w n ARG 188 Cb 0.49 -1.38 0.00 0.00 0.00 0.00 0.00 32.46 31.57 1c0w n ARG 188 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 1c0w n VAL 211 N -1.16 -0.26 -3.45 1.55 3.14 -1.26 -4.30 118.33 112.60 1c0w n VAL 211 Ca 0.15 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.16 1c0w n VAL 211 Cb 0.68 -0.26 -0.07 0.00 -1.06 0.00 0.00 33.84 33.13 1c0w n VAL 211 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1c0w s GLU 212 N -3.43 4.24 -0.06 1.45 2.02 -1.26 -5.08 118.70 116.58 1c0w s GLU 212 Ca 0.00 0.18 -0.09 0.00 0.02 0.00 0.00 54.97 55.08 1c0w s GLU 212 Cb 0.00 -3.47 -0.05 0.00 0.10 0.00 0.00 34.13 30.71 1c0w s GLU 212 CO 0.00 0.11 0.23 -0.48 0.02 0.00 0.00 175.26 175.15 1c0w s LEU 213 N 0.83 4.41 0.28 1.80 2.34 -1.26 -5.05 118.68 122.03 1c0w s LEU 213 Ca 0.19 0.62 -0.29 0.00 0.06 0.00 0.00 54.13 54.71 1c0w s LEU 213 Cb -0.14 -2.32 -0.14 0.00 -0.56 0.00 0.00 46.19 43.03 1c0w s LEU 213 CO 0.06 0.36 1.08 0.18 -1.06 0.00 0.00 176.35 176.98 1c0w n LEU 214 N 1.77 2.05 -0.35 1.48 4.77 -1.26 -4.66 117.00 120.80 1c0w n LEU 214 Ca -0.17 1.18 0.31 0.00 -0.03 0.00 0.00 56.01 57.30 1c0w n LEU 214 Cb 0.54 -1.31 0.63 0.00 -2.33 0.00 0.00 43.42 40.95 1c0w n LEU 214 CO 0.35 -1.22 1.27 -2.24 -1.33 0.00 0.00 177.39 174.22 1c0w h ASP 215 N 2.35 0.23 -0.31 -1.43 3.04 -2.00 0.44 116.42 118.74 1c0w h ASP 215 Ca -0.41 0.06 -0.14 0.00 -3.24 0.00 0.00 57.03 53.30 1c0w h ASP 215 Cb 1.33 0.02 -0.00 0.00 -1.04 0.00 0.00 39.33 39.64 1c0w h ASP 215 CO 0.63 0.01 -0.34 -2.24 -2.04 0.00 0.00 179.24 175.26 1c0w h ASP 216 N 0.18 0.83 0.00 4.15 2.03 -2.05 -2.88 116.42 118.69 1c0w h ASP 216 Ca 0.63 -0.48 0.00 0.00 -0.73 0.00 0.00 57.03 56.45 1c0w h ASP 216 Cb 2.03 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 40.30 1c0w h ASP 216 CO -0.19 1.14 0.00 0.18 -1.03 0.00 0.00 179.24 179.34 1c0w n LEU 217 N -4.19 0.00 0.27 0.15 4.77 0.14 -4.14 117.00 114.01 1c0w n LEU 217 Ca -0.04 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.79 1c0w n LEU 217 Cb 0.51 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.52 1c0w n LEU 217 CO 0.46 0.00 0.52 0.00 -1.33 0.00 0.00 177.39 177.04 1c0w h ALA 218 N 3.79 -1.12 0.00 -1.18 0.00 -0.94 -1.87 119.26 117.93 1c0w h ALA 218 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1c0w h ALA 218 Cb 0.00 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1c0w h ALA 218 CO 0.00 -1.12 0.00 -2.39 0.00 0.00 0.00 179.25 175.74 1c0w n HIS 219 N -4.89 0.00 0.06 0.00 1.44 -1.26 -3.58 115.22 106.99 1c0w n HIS 219 Ca -0.10 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.39 1c0w n HIS 219 Cb 0.38 -0.02 -0.15 0.00 0.12 0.00 0.00 29.99 30.33 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 1.20 -3.41 0.61 2.02 -1.59 -3.44 112.91 108.31 1c0w h THR 220 Ca 0.00 -2.51 -0.70 0.00 0.77 0.00 0.00 66.41 63.97 1c0w h THR 220 Cb 0.08 2.93 -0.19 0.00 -1.74 0.00 0.00 68.15 69.22 1c0w h THR 220 CO 0.00 0.75 -0.13 -0.63 0.37 0.00 0.00 175.52 175.88 1c0w s ILE 221 N -2.50 5.03 -2.19 3.11 1.01 -1.24 -1.17 121.20 123.26 1c0w s ILE 221 Ca -0.15 -0.50 0.30 0.00 0.00 0.00 0.00 60.65 60.30 1c0w s ILE 221 Cb 0.03 -4.15 0.77 0.00 0.01 0.00 0.00 42.46 39.13 1c0w s ILE 221 CO 0.83 -0.58 2.04 -2.11 0.00 0.00 0.00 174.94 175.12