#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h5n s THR 12 N 0.00 5.05 -0.03 1.12 -4.23 -1.26 -5.07 115.64 111.22 2h5n s THR 12 Ca 0.00 -0.05 -0.02 0.00 -1.18 0.00 0.00 61.69 60.43 2h5n s THR 12 Cb 0.00 -3.75 0.01 0.00 1.34 0.00 0.00 72.50 70.10 2h5n s THR 12 CO 0.00 -0.34 0.08 -0.36 -0.54 0.00 0.00 174.62 173.46 2h5n s PHE 13 N -2.10 -0.08 0.89 3.99 0.08 -1.26 -5.12 117.98 114.37 2h5n s PHE 13 Ca 0.43 0.23 -0.12 0.00 0.12 0.00 0.00 56.93 57.59 2h5n s PHE 13 Cb -0.11 -0.01 0.12 0.00 -0.57 0.00 0.00 43.02 42.46 2h5n s PHE 13 CO 0.31 -0.06 1.11 -1.54 -0.10 0.00 0.00 175.22 174.94 2h5n s SER 14 N 0.26 3.66 0.22 1.36 1.04 -1.26 -4.81 113.70 114.17 2h5n s SER 14 Ca -0.02 1.23 -0.08 0.00 0.48 0.00 0.00 55.95 57.56 2h5n s SER 14 Cb -0.03 -1.90 0.26 0.00 0.10 0.00 0.00 66.02 64.45 2h5n s SER 14 CO -0.01 -2.49 1.85 1.23 0.98 0.00 0.00 173.24 174.80 2h5n h GLY 15 N -1.45 1.14 0.98 7.32 0.00 -2.02 -0.21 103.07 108.83 2h5n h GLY 15 Ca -0.50 -0.35 0.01 0.00 0.00 0.00 0.00 47.33 46.48 2h5n h GLY 15 CO 0.59 0.27 0.24 1.46 0.00 0.00 0.00 176.54 179.09 2h5n h GLN 16 N 0.91 0.47 -0.53 4.80 7.50 -1.99 -0.58 115.11 125.68 2h5n h GLN 16 Ca 0.33 -0.03 -0.06 0.00 0.50 0.00 0.00 58.65 59.39 2h5n h GLN 16 Cb 0.09 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.49 2h5n h GLN 16 CO -0.14 0.31 0.10 0.93 -1.50 0.00 0.00 178.83 178.52 2h5n h GLU 17 N 0.48 0.88 -0.30 1.46 5.08 -1.78 -0.87 114.58 119.53 2h5n h GLU 17 Ca 0.14 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.22 2h5n h GLU 17 Cb -0.04 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 2h5n h GLU 17 CO -0.04 0.85 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.72 2h5n h LEU 18 N 0.76 0.44 -0.45 1.33 3.38 -0.93 -0.90 115.31 118.95 2h5n h LEU 18 Ca 0.16 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 2h5n h LEU 18 Cb 0.39 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2h5n h LEU 18 CO 0.01 0.52 -0.29 0.74 0.09 0.00 0.00 178.44 179.52 2h5n h THR 19 N 0.45 1.27 0.13 0.22 2.02 -0.77 -2.01 112.91 114.22 2h5n h THR 19 Ca 0.10 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.82 2h5n h THR 19 Cb 0.34 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.96 2h5n h THR 19 CO 0.01 0.50 -0.13 0.00 0.37 0.00 0.00 175.52 176.27 2h5n h ALA 20 N 0.83 -0.26 0.06 6.16 0.00 -0.78 -1.24 119.26 124.03 2h5n h ALA 20 Ca 0.09 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2h5n h ALA 20 Cb 0.88 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2h5n h ALA 20 CO 0.08 -0.67 -0.15 0.82 0.00 0.00 0.00 179.25 179.34 2h5n h ILE 21 N -0.29 0.66 -0.09 0.00 2.04 -1.12 -1.62 117.51 117.08 2h5n h ILE 21 Ca 0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 2h5n h ILE 21 Cb 0.28 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2h5n h ILE 21 CO -0.04 0.00 0.04 -0.29 0.00 0.00 0.00 178.15 177.86 2h5n h ILE 22 N -0.27 1.04 -0.84 -0.67 6.09 -1.41 -1.75 117.51 119.70 2h5n h ILE 22 Ca 0.03 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 2h5n h ILE 22 Cb 0.30 0.93 -0.04 0.00 0.47 0.00 0.00 36.82 38.48 2h5n h ILE 22 CO -0.10 0.05 0.53 0.50 -3.07 0.00 0.00 178.15 176.05 2h5n h LYS 23 N 0.13 1.12 -0.14 2.19 1.63 -0.48 0.11 116.57 121.12 2h5n h LYS 23 Ca 0.03 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 59.72 2h5n h LYS 23 Cb 0.03 -0.24 -0.00 0.00 -0.60 0.00 0.00 32.23 31.41 2h5n h LYS 23 CO -0.00 0.76 -0.03 0.52 -3.45 0.00 0.00 179.45 177.25 2h5n h MET 24 N 1.14 0.26 -0.14 1.90 2.86 -0.63 -0.61 114.93 119.72 2h5n h MET 24 Ca 0.30 -0.10 0.03 0.00 -2.06 0.00 0.00 59.70 57.88 2h5n h MET 24 Cb -0.09 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.52 2h5n h MET 24 CO -0.06 0.54 -0.08 0.00 1.06 0.00 0.00 176.91 178.38 2h5n h ALA 25 N 0.71 0.04 -0.66 6.32 0.00 -1.24 -1.17 119.26 123.26 2h5n h ALA 25 Ca 0.04 0.06 0.07 0.00 0.00 0.00 0.00 54.91 55.07 2h5n h ALA 25 Cb 0.44 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 2h5n h ALA 25 CO 0.01 -0.52 0.35 -0.22 0.00 0.00 0.00 179.25 178.86 2h5n h LYS 26 N -0.07 0.61 -0.47 0.00 3.64 -0.72 -0.70 116.57 118.86 2h5n h LYS 26 Ca 0.08 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2h5n h LYS 26 Cb 0.19 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2h5n h LYS 26 CO -0.18 0.40 0.24 0.77 -2.27 0.00 0.00 179.45 178.42 2h5n h SER 27 N 0.63 0.60 0.17 4.20 0.02 -0.81 -1.40 113.55 116.95 2h5n h SER 27 Ca 0.30 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2h5n h SER 27 Cb 0.24 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.62 2h5n h SER 27 CO -0.21 0.54 -0.08 -0.03 -1.14 0.00 0.00 176.83 175.91 2h5n h MET 28 N 0.62 -0.22 0.00 3.45 1.85 -0.90 -2.90 114.93 116.83 2h5n h MET 28 Ca 0.16 0.01 -0.07 0.00 -0.61 0.00 0.00 59.70 59.20 2h5n h MET 28 Cb 0.08 0.05 -0.01 0.00 0.43 0.00 0.00 31.60 32.15 2h5n h MET 28 CO -0.02 -0.03 -0.32 -0.39 -0.40 0.00 0.00 176.91 175.75 2h5n h VAL 29 N -0.38 0.95 0.00 -5.77 -1.51 -1.06 -2.96 116.25 105.52 2h5n h VAL 29 Ca -0.02 -1.22 0.00 0.00 -1.23 0.00 0.00 66.70 64.23 2h5n h VAL 29 Cb 0.29 1.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 2h5n h VAL 29 CO 0.04 0.31 0.00 0.23 -1.23 0.00 0.00 177.57 176.92 2h5n n MET 30 N -3.75 0.25 -0.29 5.19 2.00 -0.53 -4.19 117.12 115.79 2h5n n MET 30 Ca -0.01 0.23 0.07 0.00 0.00 0.00 0.00 57.70 57.99 2h5n n MET 30 Cb 0.41 -1.81 0.22 0.00 0.00 0.00 0.00 33.22 32.04 2h5n n MET 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2h5n h ALA 31 N 2.50 1.25 -0.01 3.04 0.00 -1.33 -2.15 119.26 122.56 2h5n h ALA 31 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2h5n h ALA 31 Cb 0.70 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2h5n h ALA 31 CO 0.00 -0.10 -0.29 -0.40 0.00 0.00 0.00 179.25 178.45 2h5n n ASP 32 N -4.89 0.81 -0.05 0.00 5.68 -1.26 -4.95 116.55 111.89 2h5n n ASP 32 Ca 0.17 -0.67 -0.01 0.00 -0.50 0.00 0.00 54.79 53.78 2h5n n ASP 32 Cb 0.43 0.13 -0.00 0.00 -1.14 0.00 0.00 41.12 40.53 2h5n n ASP 32 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2h5n n GLY 33 N 1.38 0.42 3.90 6.12 0.00 -0.81 -5.00 105.19 111.19 2h5n n GLY 33 Ca 0.11 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 2h5n n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2h5n s LYS 34 N -0.78 3.06 -0.38 1.61 1.02 -1.26 -5.08 119.74 117.93 2h5n s LYS 34 Ca 0.00 -1.01 -0.16 0.00 0.02 0.00 0.00 55.97 54.81 2h5n s LYS 34 Cb 0.00 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.63 2h5n s LYS 34 CO 0.00 0.29 0.41 0.42 -0.92 0.00 0.00 175.35 175.55 2h5n s ILE 35 N -2.13 5.11 -0.58 2.17 1.09 -1.26 -4.98 121.20 120.62 2h5n s ILE 35 Ca 0.37 -0.11 0.04 0.00 -1.10 0.00 0.00 60.65 59.86 2h5n s ILE 35 Cb -0.08 -3.94 0.17 0.00 -1.06 0.00 0.00 42.46 37.55 2h5n s ILE 35 CO 0.27 -0.26 0.42 -0.54 -0.10 0.00 0.00 174.94 174.74 2h5n s LYS 36 N 2.12 1.81 0.20 2.79 1.02 -1.26 -4.98 119.74 121.43 2h5n s LYS 36 Ca 0.13 -2.81 -0.11 0.00 0.02 0.00 0.00 55.97 53.20 2h5n s LYS 36 Cb -0.17 -2.60 0.21 0.00 -0.52 0.00 0.00 37.83 34.75 2h5n s LYS 36 CO 0.13 -1.32 1.78 -1.35 -0.92 0.00 0.00 175.35 173.67 2h5n h PRO 37 N 5.55 0.50 -0.38 -1.68 0.11 -2.00 -1.15 132.00 132.95 2h5n h PRO 37 Ca 0.19 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.11 2h5n h PRO 37 Cb 0.82 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.81 2h5n h PRO 37 CO 0.57 0.33 -0.37 0.00 -0.21 0.00 0.00 178.00 178.32 2h5n h ALA 38 N 1.34 0.61 -0.34 -0.75 0.00 -1.99 -2.04 119.26 116.10 2h5n h ALA 38 Ca 0.27 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2h5n h ALA 38 Cb 0.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2h5n h ALA 38 CO -0.21 0.68 0.16 1.49 0.00 0.00 0.00 179.25 181.36 2h5n h GLU 39 N 0.75 0.50 -0.99 0.00 4.81 -1.79 -0.34 114.58 117.52 2h5n h GLU 39 Ca 0.06 -0.08 0.07 0.00 -0.13 0.00 0.00 59.36 59.29 2h5n h GLU 39 Cb 0.96 -0.09 -0.07 0.00 0.63 0.00 0.00 28.75 30.18 2h5n h GLU 39 CO 0.09 0.46 0.64 0.82 -0.73 0.00 0.00 179.01 180.30 2h5n h ILE 40 N 0.41 1.06 -0.29 2.32 1.08 -1.14 -1.36 117.51 119.59 2h5n h ILE 40 Ca 0.12 -0.39 -0.11 0.00 -0.39 0.00 0.00 64.86 64.09 2h5n h ILE 40 Cb 0.14 -0.17 -0.01 0.00 -3.07 0.00 0.00 36.82 33.70 2h5n h ILE 40 CO -0.01 0.21 -0.27 0.00 -0.69 0.00 0.00 178.15 177.38 2h5n h ALA 41 N 1.47 0.99 0.07 1.87 0.00 -0.98 -0.97 119.26 121.71 2h5n h ALA 41 Ca 0.44 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 2h5n h ALA 41 Cb 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2h5n h ALA 41 CO -0.18 0.60 -0.03 0.28 0.00 0.00 0.00 179.25 179.91 2h5n h VAL 42 N 0.51 1.08 -0.66 0.00 2.07 -0.70 -0.03 116.25 118.52 2h5n h VAL 42 Ca 0.07 -0.51 0.13 0.00 0.82 0.00 0.00 66.70 67.21 2h5n h VAL 42 Cb 0.73 1.41 -0.12 0.00 -1.52 0.00 0.00 31.29 31.79 2h5n h VAL 42 CO 0.06 0.13 -0.14 -0.03 0.02 0.00 0.00 177.57 177.61 2h5n h MET 43 N -0.32 0.02 -0.10 1.57 -1.53 -0.91 -0.31 114.93 113.35 2h5n h MET 43 Ca -0.01 -0.00 -0.05 0.00 -3.44 0.00 0.00 59.70 56.20 2h5n h MET 43 Cb 0.28 -0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.32 2h5n h MET 43 CO 0.02 0.01 -0.14 1.79 0.14 0.00 0.00 176.91 178.72 2h5n h THR 44 N 0.02 1.38 -0.12 -0.77 1.35 -1.13 -2.98 112.91 110.66 2h5n h THR 44 Ca 0.32 -1.37 -0.01 0.00 -0.55 0.00 0.00 66.41 64.80 2h5n h THR 44 Cb 0.50 2.05 -0.01 0.00 -1.73 0.00 0.00 68.15 68.96 2h5n h THR 44 CO -0.66 0.39 0.04 -0.09 -0.25 0.00 0.00 175.52 174.95 2h5n h ARG 45 N -0.16 0.18 -0.02 4.72 2.43 -0.61 -3.10 114.38 117.83 2h5n h ARG 45 Ca 0.01 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 2h5n h ARG 45 Cb 0.70 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 2h5n h ARG 45 CO 0.03 0.32 -0.33 0.93 -1.51 0.00 0.00 179.97 179.41 2h5n h GLU 46 N 0.01 0.04 0.00 0.20 4.39 -1.19 -2.20 114.58 115.84 2h5n h GLU 46 Ca 0.04 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.70 2h5n h GLU 46 Cb 0.21 -0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2h5n h GLU 46 CO -0.00 0.37 -0.12 0.35 -1.16 0.00 0.00 179.01 178.45 2h5n h PHE 47 N 0.04 0.00 0.00 4.33 3.57 -1.44 0.84 116.94 124.28 2h5n h PHE 47 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2h5n h PHE 47 Cb 0.60 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.34 2h5n h PHE 47 CO 0.00 0.12 0.00 0.52 -2.23 0.00 0.00 178.31 176.72 2h5n h MET 48 N 0.00 0.00 0.00 1.11 2.86 -1.42 -1.97 114.93 115.50 2h5n h MET 48 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2h5n h MET 48 Cb 0.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.89 2h5n h MET 48 CO 0.02 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.99 2h5n h ARG 49 N 0.00 0.00 0.00 1.72 2.47 -0.95 0.40 114.38 118.02 2h5n h ARG 49 Ca 0.00 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 58.68 2h5n h ARG 49 Cb 0.31 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.63 2h5n h ARG 49 CO 0.00 0.00 -0.20 0.74 0.56 0.00 0.00 179.97 181.07 2h5n h PHE 50 N 0.00 0.00 0.00 3.04 0.04 -1.49 -3.47 116.94 115.06 2h5n h PHE 50 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2h5n h PHE 50 Cb 0.36 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.51 2h5n h PHE 50 CO 0.00 0.20 0.00 0.41 -0.60 0.00 0.00 178.31 178.32 2h5n n GLY 51 N -0.12 0.74 3.75 -1.45 0.00 0.14 -5.01 105.19 103.24 2h5n n GLY 51 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 2h5n n GLY 51 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2h5n s ILE 52 N -0.98 2.02 0.53 -0.61 -4.36 -1.20 -5.10 121.20 111.50 2h5n s ILE 52 Ca 0.00 -1.75 -0.01 0.00 -0.26 0.00 0.00 60.65 58.64 2h5n s ILE 52 Cb 0.00 -2.77 0.02 0.00 1.25 0.00 0.00 42.46 40.96 2h5n s ILE 52 CO 0.00 0.00 0.77 -0.76 0.24 0.00 0.00 174.94 175.19 2h5n s LEU 53 N -3.93 3.38 0.23 0.37 1.02 -1.26 -4.52 118.68 113.97 2h5n s LEU 53 Ca 0.35 0.24 -0.06 0.00 0.02 0.00 0.00 54.13 54.67 2h5n s LEU 53 Cb 0.03 -3.09 0.34 0.00 0.02 0.00 0.00 46.19 43.49 2h5n s LEU 53 CO 0.19 -0.99 1.81 -0.61 0.02 0.00 0.00 176.35 176.77 2h5n h GLN 54 N 0.12 0.73 -0.21 1.70 4.15 -1.97 -2.15 115.11 117.48 2h5n h GLN 54 Ca -0.44 -0.04 -0.10 0.00 0.77 0.00 0.00 58.65 58.83 2h5n h GLN 54 Cb 1.28 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.79 2h5n h GLN 54 CO 0.56 0.49 -0.31 -0.44 -1.93 0.00 0.00 178.83 177.20 2h5n h ASP 55 N 0.76 0.42 0.28 -0.69 5.19 -2.00 -2.06 116.42 118.33 2h5n h ASP 55 Ca 0.36 -0.16 -0.09 0.00 -0.62 0.00 0.00 57.03 56.52 2h5n h ASP 55 Cb 0.29 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 2h5n h ASP 55 CO -0.22 0.72 -0.37 1.56 -3.12 0.00 0.00 179.24 177.81 2h5n h GLN 56 N 0.36 0.13 -0.20 3.56 4.20 -1.80 -0.99 115.11 120.38 2h5n h GLN 56 Ca 0.05 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 2h5n h GLN 56 Cb 0.73 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 2h5n h GLN 56 CO 0.06 0.49 0.01 0.28 -0.67 0.00 0.00 178.83 179.00 2h5n h VAL 57 N 0.11 1.24 -0.53 -0.54 2.07 -0.79 -0.62 116.25 117.19 2h5n h VAL 57 Ca 0.01 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.73 2h5n h VAL 57 Cb 0.72 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 2h5n h VAL 57 CO 0.05 0.25 0.34 0.44 0.02 0.00 0.00 177.57 178.67 2h5n h ASP 58 N 0.12 0.58 0.11 0.57 5.19 -1.17 0.13 116.42 121.95 2h5n h ASP 58 Ca 0.06 -0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.47 2h5n h ASP 58 Cb 0.36 -0.14 -0.02 0.00 0.18 0.00 0.00 39.33 39.71 2h5n h ASP 58 CO 0.01 0.41 -0.17 0.25 -3.12 0.00 0.00 179.24 176.62 2h5n h LEU 59 N 0.69 -0.46 -0.80 1.55 6.46 -1.12 -2.14 115.31 119.49 2h5n h LEU 59 Ca 0.20 0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 57.98 2h5n h LEU 59 Cb -0.04 0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 40.02 2h5n h LEU 59 CO -0.06 -0.24 0.37 -0.07 -0.62 0.00 0.00 178.44 177.81 2h5n h LEU 60 N -0.33 1.06 -0.46 2.25 3.38 -0.80 0.21 115.31 120.62 2h5n h LEU 60 Ca 0.02 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.86 2h5n h LEU 60 Cb 0.34 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2h5n h LEU 60 CO -0.09 0.91 0.28 0.25 0.09 0.00 0.00 178.44 179.89 2h5n h LEU 61 N 1.14 0.47 -0.60 1.67 5.85 -0.94 -0.67 115.31 122.23 2h5n h LEU 61 Ca 0.27 -0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.87 2h5n h LEU 61 Cb 0.15 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2h5n h LEU 61 CO -0.03 0.33 -0.18 0.50 -0.34 0.00 0.00 178.44 178.72 2h5n h LYS 62 N 0.57 0.92 -0.92 1.25 3.64 -0.67 -2.61 116.57 118.75 2h5n h LYS 62 Ca 0.18 -0.37 0.09 0.00 -1.27 0.00 0.00 60.65 59.29 2h5n h LYS 62 Cb -0.01 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 31.69 2h5n h LYS 62 CO -0.07 1.02 0.56 0.00 -2.27 0.00 0.00 179.45 178.70 2h5n h ALA 63 N 0.98 1.33 -0.30 5.00 0.00 -0.26 -2.44 119.26 123.56 2h5n h ALA 63 Ca 0.12 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.13 2h5n h ALA 63 Cb 0.73 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2h5n h ALA 63 CO 0.06 0.22 0.30 0.66 0.00 0.00 0.00 179.25 180.49 2h5n h SER 64 N 0.95 0.00 0.01 0.00 4.64 -0.72 0.44 113.55 118.86 2h5n h SER 64 Ca 0.43 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2h5n h SER 64 Cb 0.35 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2h5n h SER 64 CO -0.23 0.00 -0.00 0.44 -0.87 0.00 0.00 176.83 176.17 2h5n h ASP 65 N 0.00 0.00 -0.37 4.97 3.32 -1.49 -2.27 116.42 120.59 2h5n h ASP 65 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2h5n h ASP 65 Cb 0.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.29 2h5n h ASP 65 CO -0.00 0.00 0.00 -1.20 -1.72 0.00 0.00 179.24 176.32 2h5n n SER 66 N -3.26 3.12 -4.39 6.45 7.64 0.14 -4.93 113.62 118.40 2h5n n SER 66 Ca -0.03 -1.95 -0.25 0.00 1.01 0.00 0.00 58.87 57.66 2h5n n SER 66 Cb 0.08 -0.24 -0.11 0.00 -1.01 0.00 0.00 64.21 62.92 2h5n n SER 66 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2h5n s ILE 67 N -1.53 2.17 0.20 0.44 -4.36 -0.86 -5.12 121.20 112.14 2h5n s ILE 67 Ca 0.38 -2.03 -0.30 0.00 -0.26 0.00 0.00 60.65 58.44 2h5n s ILE 67 Cb 0.22 -2.04 -0.08 0.00 1.25 0.00 0.00 42.46 41.81 2h5n s ILE 67 CO 0.30 -0.22 0.99 -1.61 0.24 0.00 0.00 174.94 174.64 2h5n s GLU 68 N -2.81 4.75 0.38 0.37 0.41 -1.26 -4.95 118.70 115.58 2h5n s GLU 68 Ca 0.20 1.55 0.07 0.00 -0.41 0.00 0.00 54.97 56.38 2h5n s GLU 68 Cb -0.07 -3.30 0.80 0.00 -1.78 0.00 0.00 34.13 29.78 2h5n s GLU 68 CO 0.09 0.33 1.96 0.00 -0.49 0.00 0.00 175.26 177.16 2h5n h ALA 69 N 4.65 1.76 -0.40 5.21 0.00 -1.95 -2.11 119.26 126.42 2h5n h ALA 69 Ca -0.44 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 2h5n h ALA 69 Cb 1.21 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2h5n h ALA 69 CO 0.70 0.13 0.13 0.66 0.00 0.00 0.00 179.25 180.87 2h5n h SER 70 N 0.69 0.51 -0.53 0.00 4.64 -2.00 -1.13 113.55 115.73 2h5n h SER 70 Ca 0.30 -0.06 -0.07 0.00 -0.47 0.00 0.00 61.79 61.49 2h5n h SER 70 Cb 0.30 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 2h5n h SER 70 CO -0.10 0.49 0.04 1.56 -0.87 0.00 0.00 176.83 177.95 2h5n h GLN 71 N 0.56 0.90 -0.58 4.77 4.20 -1.79 -2.42 115.11 120.76 2h5n h GLN 71 Ca 0.14 -0.27 0.03 0.00 0.06 0.00 0.00 58.65 58.61 2h5n h GLN 71 Cb 0.16 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 2h5n h GLN 71 CO -0.01 0.91 0.34 0.00 -0.67 0.00 0.00 178.83 179.40 2h5n h ALA 72 N 0.96 0.75 -0.23 3.87 0.00 -0.99 -1.46 119.26 122.16 2h5n h ALA 72 Ca 0.15 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2h5n h ALA 72 Cb 0.47 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 2h5n h ALA 72 CO 0.02 0.06 -0.14 0.28 0.00 0.00 0.00 179.25 179.47 2h5n h VAL 73 N 0.68 0.58 -0.52 0.00 2.07 -1.04 -1.18 116.25 116.84 2h5n h VAL 73 Ca 0.24 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.78 2h5n h VAL 73 Cb 0.04 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 2h5n h VAL 73 CO -0.11 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.78 2h5n h ALA 74 N 1.04 0.67 -0.74 1.67 0.00 -1.19 0.12 119.26 120.84 2h5n h ALA 74 Ca 0.13 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 2h5n h ALA 74 Cb 0.32 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2h5n h ALA 74 CO -0.31 -0.00 0.22 -0.07 0.00 0.00 0.00 179.25 179.09 2h5n h LEU 75 N 0.60 1.08 -0.19 0.00 4.07 -0.92 -2.95 115.31 116.99 2h5n h LEU 75 Ca 0.21 -0.21 -0.11 0.00 0.08 0.00 0.00 57.88 57.86 2h5n h LEU 75 Cb 0.05 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 41.51 2h5n h LEU 75 CO -0.11 1.00 -0.32 0.40 -1.08 0.00 0.00 178.44 178.33 2h5n h ILE 76 N 1.10 1.34 0.00 1.22 2.04 -0.87 -3.32 117.51 119.01 2h5n h ILE 76 Ca 0.24 -1.54 -0.01 0.00 1.00 0.00 0.00 64.86 64.54 2h5n h ILE 76 Cb 0.31 1.86 -0.00 0.00 -0.74 0.00 0.00 36.82 38.26 2h5n h ILE 76 CO -0.01 0.47 -0.07 0.00 0.00 0.00 0.00 178.15 178.55 2h5n h ALA 77 N 0.60 1.10 -0.01 1.87 0.00 -0.61 -1.06 119.26 121.16 2h5n h ALA 77 Ca 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2h5n h ALA 77 Cb 0.91 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2h5n h ALA 77 CO 0.07 0.09 -0.08 2.89 0.00 0.00 0.00 179.25 182.22 2h5n n ARG 78 N -3.32 1.19 -1.53 0.00 1.85 -1.14 -4.94 116.66 108.77 2h5n n ARG 78 Ca -0.01 -0.58 -0.34 0.00 -1.00 0.00 0.00 57.85 55.93 2h5n n ARG 78 Cb 0.25 -1.49 0.08 0.00 -1.05 0.00 0.00 32.46 30.25 2h5n n ARG 78 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 2h5n s MET 79 N -2.21 2.34 0.78 2.89 -1.94 -0.40 -5.02 119.30 115.74 2h5n s MET 79 Ca 0.34 1.62 -0.10 0.00 -1.71 0.00 0.00 55.69 55.84 2h5n s MET 79 Cb 0.21 -1.87 0.06 0.00 2.01 0.00 0.00 34.83 35.23 2h5n s MET 79 CO 0.41 -1.65 1.09 0.16 -0.01 0.00 0.00 175.02 175.02 2h5n s ASP 80 N -2.24 4.42 0.31 3.03 1.47 -1.26 -4.81 116.67 117.59 2h5n s ASP 80 Ca 0.71 1.84 -0.00 0.00 1.18 0.00 0.00 52.55 56.28 2h5n s ASP 80 Cb -0.26 -2.52 0.52 0.00 -0.34 0.00 0.00 42.92 40.32 2h5n s ASP 80 CO 0.44 -2.09 1.95 -0.33 0.68 0.00 0.00 175.17 175.82 2h5n h GLU 81 N -1.17 1.01 0.14 2.11 4.39 -1.98 -1.76 114.58 117.31 2h5n h GLU 81 Ca -0.44 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.20 2h5n h GLU 81 Cb 1.23 -0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 29.65 2h5n h GLU 81 CO 0.51 0.67 -0.09 0.93 -1.16 0.00 0.00 179.01 179.87 2h5n h GLU 82 N 1.04 -0.21 -0.68 2.33 4.39 -2.00 -0.22 114.58 119.22 2h5n h GLU 82 Ca 0.33 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.05 2h5n h GLU 82 Cb 0.02 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 2h5n h GLU 82 CO -0.09 -0.14 0.44 0.00 -1.16 0.00 0.00 179.01 178.05 2h5n h ARG 83 N -0.22 0.90 -0.75 2.33 3.08 -1.88 -2.61 114.38 115.23 2h5n h ARG 83 Ca -0.01 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 2h5n h ARG 83 Cb 0.19 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 2h5n h ARG 83 CO 0.01 0.61 0.45 0.87 -1.07 0.00 0.00 179.97 180.85 2h5n h LYS 84 N 0.92 1.01 -0.66 0.04 1.57 -1.18 -2.60 116.57 115.67 2h5n h LYS 84 Ca 0.25 -0.08 0.05 0.00 -1.87 0.00 0.00 60.65 58.99 2h5n h LYS 84 Cb -0.08 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 31.97 2h5n h LYS 84 CO -0.05 0.70 0.38 -0.22 -0.57 0.00 0.00 179.45 179.69 2h5n h LYS 85 N 1.03 0.70 0.00 3.15 3.64 -0.65 -1.55 116.57 122.88 2h5n h LYS 85 Ca 0.27 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.50 2h5n h LYS 85 Cb -0.05 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 2h5n h LYS 85 CO -0.05 0.46 -0.50 1.88 -2.27 0.00 0.00 179.45 178.96 2h5n h TYR 86 N 0.72 0.00 -0.42 1.91 0.05 -1.36 -1.75 116.97 116.11 2h5n h TYR 86 Ca 0.29 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 59.00 2h5n h TYR 86 Cb 0.13 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.86 2h5n h TYR 86 CO -0.07 0.50 0.01 0.28 -1.05 0.00 0.00 178.16 177.84 2h5n h VAL 87 N 0.00 1.26 -0.33 -2.88 2.07 -1.18 -1.20 116.25 113.98 2h5n h VAL 87 Ca -0.01 -1.00 -0.08 0.00 0.82 0.00 0.00 66.70 66.44 2h5n h VAL 87 Cb 1.29 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 2h5n h VAL 87 CO 0.07 0.34 -0.12 0.00 0.02 0.00 0.00 177.57 177.88 2h5n h ALA 88 N 0.90 1.18 -0.02 1.67 0.00 -1.22 -0.99 119.26 120.78 2h5n h ALA 88 Ca 0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2h5n h ALA 88 Cb 0.46 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2h5n h ALA 88 CO 0.02 0.52 -0.01 0.77 0.00 0.00 0.00 179.25 180.55 2h5n h SER 89 N 0.52 0.05 -0.63 0.00 0.02 -1.14 -1.29 113.55 111.08 2h5n h SER 89 Ca 0.09 -0.45 0.13 0.00 -0.84 0.00 0.00 61.79 60.72 2h5n h SER 89 Cb 0.52 -0.01 -0.10 0.00 0.14 0.00 0.00 62.40 62.95 2h5n h SER 89 CO 0.03 0.49 0.10 0.22 -1.14 0.00 0.00 176.83 176.53 2h5n h TYR 90 N -0.39 0.14 -0.22 3.45 3.20 -1.17 -1.56 116.97 120.41 2h5n h TYR 90 Ca 0.00 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.81 2h5n h TYR 90 Cb 0.48 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 2h5n h TYR 90 CO 0.08 -0.08 -0.30 -0.07 -1.64 0.00 0.00 178.16 176.15 2h5n h LEU 91 N 0.22 0.45 -0.74 2.82 3.38 -1.07 -3.05 115.31 117.32 2h5n h LEU 91 Ca 0.34 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 2h5n h LEU 91 Cb 0.53 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2h5n h LEU 91 CO -0.46 0.73 0.28 1.23 0.09 0.00 0.00 178.44 180.31 2h5n h GLY 92 N 1.05 1.20 2.00 0.83 0.00 -0.80 -3.18 103.07 104.18 2h5n h GLY 92 Ca 0.05 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.66 2h5n h GLY 92 CO 0.06 0.63 -0.22 -0.39 0.00 0.00 0.00 176.54 176.61 2h5n h VAL 93 N 1.07 0.46 -0.21 4.60 -1.51 -1.23 -3.33 116.25 116.11 2h5n h VAL 93 Ca 0.24 -1.28 0.04 0.00 -1.23 0.00 0.00 66.70 64.47 2h5n h VAL 93 Cb 0.24 1.93 -0.04 0.00 -2.13 0.00 0.00 31.29 31.30 2h5n h VAL 93 CO -0.02 0.22 -0.03 0.40 -1.23 0.00 0.00 177.57 176.91 2h5n h ILE 94 N 0.00 0.81 -0.06 7.19 2.04 -1.51 -2.71 117.51 123.28 2h5n h ILE 94 Ca -0.00 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2h5n h ILE 94 Cb 0.91 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 2h5n h ILE 94 CO 0.03 0.00 0.00 0.23 0.00 0.00 0.00 178.15 178.41 2h5n n MET 95 N -5.18 1.82 -2.16 2.37 2.81 -1.25 -4.75 117.12 110.78 2h5n n MET 95 Ca -0.02 -1.20 -0.41 0.00 -1.81 0.00 0.00 57.70 54.25 2h5n n MET 95 Cb 0.12 -1.46 -0.03 0.00 -0.71 0.00 0.00 33.22 31.14 2h5n n MET 95 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2h5n s ALA 96 N -1.94 3.54 -0.16 3.04 0.00 -1.02 -4.71 121.76 120.51 2h5n s ALA 96 Ca 0.35 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.50 2h5n s ALA 96 Cb 0.20 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.86 2h5n s ALA 96 CO 0.32 -0.59 -0.10 0.45 0.00 0.00 0.00 175.76 175.83 2h5n s SER 97 N 0.18 2.76 -1.03 0.00 0.15 0.78 -4.71 113.70 111.83 2h5n s SER 97 Ca 0.56 -0.57 -0.03 0.00 0.70 0.00 0.00 55.95 56.61 2h5n s SER 97 Cb -0.38 -1.08 0.02 0.00 -1.71 0.00 0.00 66.02 62.88 2h5n s SER 97 CO 0.42 -0.11 0.17 0.47 1.20 0.00 0.00 173.24 175.38 2h5n n ASP 98 N 4.81 -3.59 0.00 5.45 8.00 -1.26 -0.31 116.55 129.65 2h5n n ASP 98 Ca -0.15 0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.38 2h5n n ASP 98 Cb 0.49 -3.04 0.00 0.00 -0.02 0.00 0.00 41.12 38.55 2h5n n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2h5n n GLY 99 N -0.90 2.46 3.87 0.44 0.00 -1.26 -5.04 105.19 104.75 2h5n n GLY 99 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 2h5n n GLY 99 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2h5n s ASP 100 N -2.29 6.62 0.10 1.61 1.01 0.58 -4.78 116.67 119.52 2h5n s ASP 100 Ca 0.00 0.77 0.10 0.00 0.71 0.00 0.00 52.55 54.13 2h5n s ASP 100 Cb 0.00 -2.17 -0.04 0.00 1.01 0.00 0.00 42.92 41.73 2h5n s ASP 100 CO 0.00 0.13 -0.25 0.27 0.21 0.00 0.00 175.17 175.53 2h5n s ILE 101 N -1.48 2.05 0.90 0.77 -4.36 -1.26 -0.16 121.20 117.66 2h5n s ILE 101 Ca 0.36 -1.59 -0.11 0.00 -0.26 0.00 0.00 60.65 59.05 2h5n s ILE 101 Cb -0.13 -1.81 0.20 0.00 1.25 0.00 0.00 42.46 41.96 2h5n s ILE 101 CO 0.19 0.11 1.23 1.51 0.24 0.00 0.00 174.94 178.23 2h5n s ASP 102 N -1.79 3.33 0.10 4.36 1.47 -1.26 -4.86 116.67 118.02 2h5n s ASP 102 Ca 0.11 -0.10 -0.22 0.00 1.18 0.00 0.00 52.55 53.52 2h5n s ASP 102 Cb -0.10 0.03 -0.11 0.00 -0.34 0.00 0.00 42.92 42.40 2h5n s ASP 102 CO 0.04 -2.57 1.73 0.44 0.68 0.00 0.00 175.17 175.50 2h5n h ASP 103 N -1.33 -0.05 -0.02 2.11 3.32 -2.01 -1.85 116.42 116.59 2h5n h ASP 103 Ca -0.40 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.61 2h5n h ASP 103 Cb 1.23 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 2h5n h ASP 103 CO 0.34 -0.02 -0.13 -1.13 -1.72 0.00 0.00 179.24 176.58 2h5n h ASN 104 N 0.01 0.29 -0.50 6.45 -1.24 -1.99 -1.59 115.58 117.01 2h5n h ASN 104 Ca 0.03 -0.06 -0.12 0.00 0.71 0.00 0.00 56.30 56.86 2h5n h ASN 104 Cb 0.04 -0.08 -0.02 0.00 0.73 0.00 0.00 38.32 39.00 2h5n h ASN 104 CO -0.06 0.45 -0.14 -0.33 -1.29 0.00 0.00 177.43 176.06 2h5n h GLU 105 N 0.29 0.98 -0.76 6.67 5.08 -1.88 -1.22 114.58 123.74 2h5n h GLU 105 Ca 0.06 -0.39 -0.04 0.00 -1.00 0.00 0.00 59.36 57.99 2h5n h GLU 105 Cb 0.40 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.57 2h5n h GLU 105 CO 0.02 1.06 0.31 1.25 -1.00 0.00 0.00 179.01 180.65 2h5n h LEU 106 N 0.84 1.04 -0.64 1.33 5.85 -1.16 -1.02 115.31 121.56 2h5n h LEU 106 Ca 0.13 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 2h5n h LEU 106 Cb 0.71 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 2h5n h LEU 106 CO 0.05 0.92 0.32 0.00 -0.34 0.00 0.00 178.44 179.39 2h5n h ALA 107 N 1.23 0.82 -0.11 1.25 0.00 -0.88 0.22 119.26 121.79 2h5n h ALA 107 Ca 0.25 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 2h5n h ALA 107 Cb 0.20 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2h5n h ALA 107 CO -0.02 0.37 -0.12 -0.07 0.00 0.00 0.00 179.25 179.41 2h5n h LEU 108 N 0.88 0.30 -0.79 0.00 3.38 -0.95 0.32 115.31 118.44 2h5n h LEU 108 Ca 0.22 -0.48 0.10 0.00 0.09 0.00 0.00 57.88 57.81 2h5n h LEU 108 Cb 0.10 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.69 2h5n h LEU 108 CO -0.03 0.72 0.43 -0.25 0.09 0.00 0.00 178.44 179.40 2h5n h TRP 109 N -0.12 0.77 -0.34 1.13 7.01 -1.03 -2.05 115.95 121.32 2h5n h TRP 109 Ca 0.02 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.03 2h5n h TRP 109 Cb 0.64 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.46 2h5n h TRP 109 CO 0.09 0.29 0.13 1.15 -2.79 0.00 0.00 178.44 177.30 2h5n h THR 110 N 0.71 1.19 -0.03 2.65 2.02 -0.26 -1.74 112.91 117.45 2h5n h THR 110 Ca 0.39 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.98 2h5n h THR 110 Cb 0.41 0.96 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 2h5n h THR 110 CO -0.27 0.21 0.02 0.25 0.37 0.00 0.00 175.52 176.10 2h5n h LEU 111 N 0.39 0.04 -0.62 2.58 5.85 -0.65 -0.79 115.31 122.11 2h5n h LEU 111 Ca 0.11 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.69 2h5n h LEU 111 Cb 0.20 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2h5n h LEU 111 CO -0.01 0.03 -0.40 -0.29 -0.34 0.00 0.00 178.44 177.44 2h5n h ILE 112 N 0.04 1.29 -0.48 4.05 2.10 -1.37 -1.45 117.51 121.69 2h5n h ILE 112 Ca 0.01 -1.56 0.05 0.00 1.08 0.00 0.00 64.86 64.44 2h5n h ILE 112 Cb -0.00 1.51 -0.05 0.00 -1.09 0.00 0.00 36.82 37.20 2h5n h ILE 112 CO -0.00 0.50 0.23 0.28 -1.08 0.00 0.00 178.15 178.07 2h5n h SER 113 N 0.53 0.31 0.15 2.19 0.02 -1.22 -0.36 113.55 115.16 2h5n h SER 113 Ca 0.05 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2h5n h SER 113 Cb 0.92 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.44 2h5n h SER 113 CO 0.08 0.21 -0.07 0.74 -1.14 0.00 0.00 176.83 176.65 2h5n h THR 114 N 0.44 0.92 -0.47 -2.27 2.02 -0.64 0.16 112.91 113.08 2h5n h THR 114 Ca 0.22 -0.31 -0.04 0.00 0.77 0.00 0.00 66.41 67.05 2h5n h THR 114 Cb 0.15 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 2h5n h THR 114 CO -0.17 0.07 0.11 -0.07 0.37 0.00 0.00 175.52 175.83 2h5n h LEU 115 N -0.35 0.65 -0.03 2.58 4.07 -1.17 -2.27 115.31 118.80 2h5n h LEU 115 Ca -0.02 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.83 2h5n h LEU 115 Cb 0.28 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.85 2h5n h LEU 115 CO 0.03 0.65 -0.04 0.00 -1.08 0.00 0.00 178.44 178.01 2h5n n GLY 117 N 1.38 0.19 3.89 0.00 0.00 -0.10 -3.88 105.19 106.67 2h5n n GLY 117 Ca 0.11 -0.70 -0.29 0.00 0.00 0.00 0.00 46.02 45.14 2h5n n GLY 117 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2h5n s LEU 118 N -1.29 3.97 0.53 0.99 1.43 0.39 -5.03 118.68 119.66 2h5n s LEU 118 Ca 0.00 0.88 -0.19 0.00 -1.03 0.00 0.00 54.13 53.79 2h5n s LEU 118 Cb -0.00 -3.72 -0.06 0.00 0.03 0.00 0.00 46.19 42.43 2h5n s LEU 118 CO 0.00 -0.27 1.09 -2.16 0.23 0.00 0.00 176.35 175.24 2h5n s PRO 119 N -3.66 3.49 0.15 1.29 0.04 -1.26 -4.69 135.00 130.37 2h5n s PRO 119 Ca 0.47 1.48 -0.30 0.00 0.04 0.00 0.00 61.00 62.69 2h5n s PRO 119 Cb -0.11 -2.04 -0.07 0.00 0.04 0.00 0.00 34.50 32.33 2h5n s PRO 119 CO 0.30 -0.71 0.97 0.99 0.04 0.00 0.00 177.00 178.59 2h5n s THR 120 N -1.92 4.32 0.18 1.26 2.01 -1.26 -4.96 115.64 115.28 2h5n s THR 120 Ca 0.70 2.04 -0.11 0.00 0.31 0.00 0.00 61.69 64.63 2h5n s THR 120 Cb -0.20 -4.30 -0.00 0.00 0.01 0.00 0.00 72.50 68.00 2h5n s THR 120 CO 0.26 0.37 0.35 0.00 -0.69 0.00 0.00 174.62 174.91 2h5n s MET 121 N -0.38 1.26 0.66 4.92 0.23 -1.26 -5.16 119.30 119.57 2h5n s MET 121 Ca 0.45 -1.14 -0.09 0.00 -1.03 0.00 0.00 55.69 53.88 2h5n s MET 121 Cb -0.25 0.42 0.01 0.00 -1.53 0.00 0.00 34.83 33.48 2h5n s MET 121 CO 0.31 -0.49 1.02 0.95 -2.03 0.00 0.00 175.02 174.78 2h5n s THR 122 N -3.96 3.53 0.30 3.16 -4.23 -1.26 -4.96 115.64 108.21 2h5n s THR 122 Ca 0.17 0.28 0.02 0.00 -1.18 0.00 0.00 61.69 60.98 2h5n s THR 122 Cb 0.02 -3.46 0.12 0.00 1.34 0.00 0.00 72.50 70.52 2h5n s THR 122 CO 0.01 -0.55 1.80 1.62 -0.54 0.00 0.00 174.62 176.96 2h5n h VAL 123 N -0.47 1.23 -0.47 2.29 3.04 -1.94 -2.38 116.25 117.56 2h5n h VAL 123 Ca -0.45 -0.99 0.02 0.00 -1.01 0.00 0.00 66.70 64.27 2h5n h VAL 123 Cb 1.26 1.05 -0.03 0.00 -2.01 0.00 0.00 31.29 31.56 2h5n h VAL 123 CO 0.63 0.33 0.29 -0.03 -1.01 0.00 0.00 177.57 177.78 2h5n h MET 124 N 0.54 0.56 -0.75 4.17 1.85 -1.94 -0.94 114.93 118.42 2h5n h MET 124 Ca 0.10 -0.03 -0.02 0.00 -0.61 0.00 0.00 59.70 59.14 2h5n h MET 124 Cb 0.47 -0.13 -0.04 0.00 0.43 0.00 0.00 31.60 32.33 2h5n h MET 124 CO 0.02 0.37 0.40 0.93 -0.40 0.00 0.00 176.91 178.24 2h5n h GLU 125 N 0.58 1.06 0.12 0.39 5.08 -1.89 0.61 114.58 120.54 2h5n h GLU 125 Ca 0.19 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2h5n h GLU 125 Cb -0.01 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.04 2h5n h GLU 125 CO -0.07 0.80 -0.06 0.00 -1.00 0.00 0.00 179.01 178.68 2h5n h ALA 126 N 1.20 -0.17 -0.43 3.43 0.00 -1.09 0.28 119.26 122.49 2h5n h ALA 126 Ca 0.26 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.17 2h5n h ALA 126 Cb 0.06 0.06 -0.07 0.00 0.00 0.00 0.00 17.79 17.84 2h5n h ALA 126 CO -0.04 -0.54 -0.02 0.82 0.00 0.00 0.00 179.25 179.47 2h5n h ILE 127 N -0.27 0.66 -0.69 0.00 2.04 -1.08 -1.68 117.51 116.49 2h5n h ILE 127 Ca -0.02 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.77 2h5n h ILE 127 Cb 0.22 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 2h5n h ILE 127 CO 0.03 0.02 0.26 0.78 0.00 0.00 0.00 178.15 179.23 2h5n h ASN 128 N 0.09 0.95 -0.34 1.72 2.35 -0.52 -2.65 115.58 117.18 2h5n h ASN 128 Ca 0.21 -0.15 0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2h5n h ASN 128 Cb 0.31 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 2h5n h ASN 128 CO -0.37 0.86 0.20 0.78 -1.65 0.00 0.00 177.43 177.25 2h5n h ASN 129 N 1.01 0.32 0.81 5.81 2.35 -0.22 -2.95 115.58 122.71 2h5n h ASN 129 Ca 0.23 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.97 2h5n h ASN 129 Cb 0.22 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 2h5n h ASN 129 CO -0.02 0.23 -0.06 0.24 -1.65 0.00 0.00 177.43 176.17 2h5n h MET 130 N 0.40 0.00 -0.07 0.81 2.86 -1.13 -2.77 114.93 115.04 2h5n h MET 130 Ca 0.13 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.61 2h5n h MET 130 Cb 0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 2h5n h MET 130 CO -0.06 0.06 -0.68 0.87 1.06 0.00 0.00 176.91 178.15 2h5n h LYS 131 N 0.00 0.32 -0.02 1.72 1.79 -1.30 -3.23 116.57 115.84 2h5n h LYS 131 Ca -0.00 -0.25 0.00 0.00 -2.18 0.00 0.00 60.65 58.22 2h5n h LYS 131 Cb 0.48 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.18 2h5n h LYS 131 CO 0.01 0.88 0.00 0.09 -1.08 0.00 0.00 179.45 179.35 2h5n n ASN 132 N -3.84 1.07 -0.64 0.86 5.03 -1.05 -5.13 115.26 111.56 2h5n n ASN 132 Ca -0.03 -1.38 0.13 0.00 0.87 0.00 0.00 54.58 54.17 2h5n n ASN 132 Cb 0.67 -0.01 0.38 0.00 -1.02 0.00 0.00 39.78 39.81 2h5n n ASN 132 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32