#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4b s SER 2 N 0.00 -0.15 0.13 1.61 0.15 -1.26 -5.18 113.70 109.00 1x4b s SER 2 Ca 0.00 0.17 -0.05 0.00 0.70 0.00 0.00 55.95 56.78 1x4b s SER 2 Cb 0.00 1.16 -0.03 0.00 -1.71 0.00 0.00 66.02 65.44 1x4b s SER 2 CO 0.00 -0.03 0.14 -0.55 1.20 0.00 0.00 173.24 174.00 1x4b s SER 3 N 2.32 0.21 0.00 5.45 0.15 -1.26 -5.17 113.70 115.41 1x4b s SER 3 Ca -0.02 -1.02 0.00 0.00 0.70 0.00 0.00 55.95 55.61 1x4b s SER 3 Cb -0.03 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1x4b s SER 3 CO -0.14 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.13 1x4b n GLY 4 N -0.11 1.92 3.57 9.45 0.00 -1.26 -5.19 105.19 113.57 1x4b n GLY 4 Ca -0.08 -0.86 0.04 0.00 0.00 0.00 0.00 46.02 45.11 1x4b n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x4b s SER 5 N 0.16 -0.01 0.07 1.61 0.01 -1.26 -5.19 113.70 109.10 1x4b s SER 5 Ca 0.00 -0.01 -0.27 0.00 1.31 0.00 0.00 55.95 56.97 1x4b s SER 5 Cb 0.00 0.02 0.08 0.00 0.21 0.00 0.00 66.02 66.33 1x4b s SER 5 CO 0.00 -0.03 0.99 -0.55 0.41 0.00 0.00 173.24 174.06 1x4b s SER 6 N -3.02 -0.21 0.00 2.44 0.15 -1.26 -5.17 113.70 106.63 1x4b s SER 6 Ca 0.15 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1x4b s SER 6 Cb 0.07 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 1x4b s SER 6 CO -0.07 -0.72 0.00 0.61 1.20 0.00 0.00 173.24 174.26 1x4b n GLY 7 N -0.40 3.08 3.63 9.45 0.00 -1.26 -5.17 105.19 114.53 1x4b n GLY 7 Ca -0.07 -1.60 -0.03 0.00 0.00 0.00 0.00 46.02 44.33 1x4b n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1x4b s MET 8 N -4.74 0.12 0.05 1.61 1.75 -1.26 -5.18 119.30 111.65 1x4b s MET 8 Ca 0.00 -0.00 0.04 0.00 -1.25 0.00 0.00 55.69 54.48 1x4b s MET 8 Cb 0.00 0.05 -0.02 0.00 2.84 0.00 0.00 34.83 37.70 1x4b s MET 8 CO 0.00 -0.04 -0.12 -1.83 -0.65 0.00 0.00 175.02 172.38 1x4b s GLU 9 N -1.45 0.74 -0.01 4.11 -1.05 -1.26 -5.15 118.70 114.63 1x4b s GLU 9 Ca 0.09 -0.78 0.00 0.00 -0.15 0.00 0.00 54.97 54.13 1x4b s GLU 9 Cb -0.01 -0.68 0.01 0.00 -0.44 0.00 0.00 34.13 33.02 1x4b s GLU 9 CO -0.06 0.16 0.01 0.15 0.95 0.00 0.00 175.26 176.47 1x4b s LYS 10 N -1.38 0.02 0.25 -4.83 1.02 -1.26 -5.05 119.74 108.51 1x4b s LYS 10 Ca -0.03 0.07 0.00 0.00 0.02 0.00 0.00 55.97 56.03 1x4b s LYS 10 Cb -0.09 -0.15 0.00 0.00 -0.52 0.00 0.00 37.83 37.07 1x4b s LYS 10 CO 0.01 -0.07 0.00 2.41 -0.92 0.00 0.00 175.35 176.78 1x4b n THR 11 N 3.59-10.46 -4.57 2.17 -1.04 -1.26 -5.06 114.28 97.65 1x4b n THR 11 Ca -0.19 2.98 -0.30 0.00 -2.04 0.00 0.00 64.05 64.50 1x4b n THR 11 Cb 0.55 -4.66 -0.09 0.00 -1.82 0.00 0.00 70.33 64.31 1x4b n THR 11 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1x4b s LEU 12 N -0.96 2.65 0.23 -4.42 2.01 -1.26 -5.06 118.68 111.87 1x4b s LEU 12 Ca 0.00 -1.44 0.00 0.00 0.01 0.00 0.00 54.13 52.70 1x4b s LEU 12 Cb 0.00 -0.91 0.00 0.00 0.01 0.00 0.00 46.19 45.29 1x4b s LEU 12 CO 0.00 -0.67 0.00 1.21 1.01 0.00 0.00 176.35 177.90 1x4b n GLU 13 N -1.17 0.00 -3.31 1.70 4.07 -1.26 -5.10 120.64 115.57 1x4b n GLU 13 Ca -0.10 0.00 -0.24 0.00 -0.06 0.00 0.00 57.16 56.76 1x4b n GLU 13 Cb 0.67 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 32.07 1x4b n GLU 13 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1x4b n THR 14 N -3.09 -4.83 -3.65 6.31 -1.04 -1.26 -5.01 114.28 101.70 1x4b n THR 14 Ca 0.00 0.39 -0.14 0.00 -2.04 0.00 0.00 64.05 62.25 1x4b n THR 14 Cb 0.00 -4.08 -0.08 0.00 -1.82 0.00 0.00 70.33 64.35 1x4b n THR 14 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1x4b s VAL 15 N -1.51 0.00 0.37 12.58 0.11 -1.26 -5.05 120.40 125.65 1x4b s VAL 15 Ca 0.25 -0.04 -0.25 0.00 -2.93 0.00 0.00 61.98 59.01 1x4b s VAL 15 Cb -0.03 -0.84 -0.09 0.00 -1.53 0.00 0.00 36.38 33.89 1x4b s VAL 15 CO 0.65 -0.02 1.06 -2.16 -3.33 0.00 0.00 175.10 171.30 1x4b s PRO 16 N -0.05 4.28 -0.20 1.54 0.04 -1.26 -4.79 135.00 134.57 1x4b s PRO 16 Ca -0.03 1.59 -0.26 0.00 0.04 0.00 0.00 61.00 62.34 1x4b s PRO 16 Cb -0.04 -2.71 0.07 0.00 0.04 0.00 0.00 34.50 31.86 1x4b s PRO 16 CO 0.03 -0.05 0.68 -1.17 0.04 0.00 0.00 177.00 176.53 1x4b s LEU 17 N -2.33 -0.63 -0.37 -3.56 0.20 -1.26 -5.12 118.68 105.60 1x4b s LEU 17 Ca 0.54 1.19 0.00 0.00 0.69 0.00 0.00 54.13 56.55 1x4b s LEU 17 Cb -0.25 2.41 0.14 0.00 -0.43 0.00 0.00 46.19 48.06 1x4b s LEU 17 CO 0.31 -0.35 0.21 -0.70 -0.29 0.00 0.00 176.35 175.53 1x4b s GLU 18 N -0.10 0.73 -0.13 1.98 2.12 -1.26 -4.99 118.70 117.06 1x4b s GLU 18 Ca -0.03 -1.46 -0.09 0.00 0.36 0.00 0.00 54.97 53.74 1x4b s GLU 18 Cb -0.03 -1.60 -0.07 0.00 0.26 0.00 0.00 34.13 32.69 1x4b s GLU 18 CO 0.04 -1.18 0.13 -0.09 -0.54 0.00 0.00 175.26 173.61 1x4b h ARG 19 N 7.05 0.00 -1.86 4.30 9.65 -2.05 -3.46 114.38 128.01 1x4b h ARG 19 Ca 0.02 0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.68 1x4b h ARG 19 Cb 0.96 0.00 -0.30 0.00 -1.39 0.00 0.00 29.97 29.24 1x4b h ARG 19 CO 0.34 0.28 -0.55 0.15 2.80 0.00 0.00 179.97 182.99 1x4b s LYS 20 N -1.90 0.37 0.20 0.20 1.02 -1.26 -5.15 119.74 113.23 1x4b s LYS 20 Ca -0.09 0.15 0.09 0.00 0.02 0.00 0.00 55.97 56.13 1x4b s LYS 20 Cb 0.00 -0.44 -0.04 0.00 -0.52 0.00 0.00 37.83 36.83 1x4b s LYS 20 CO 0.23 -0.95 -0.05 0.21 -0.92 0.00 0.00 175.35 173.88 1x4b s LYS 21 N 2.50 2.21 -0.05 1.68 2.20 -1.26 -5.14 119.74 121.88 1x4b s LYS 21 Ca 0.10 -1.27 -0.13 0.00 -0.36 0.00 0.00 55.97 54.32 1x4b s LYS 21 Cb -0.13 -2.21 0.02 0.00 -1.51 0.00 0.00 37.83 34.00 1x4b s LYS 21 CO -0.28 0.42 0.29 0.50 -0.36 0.00 0.00 175.35 175.93 1x4b s ARG 22 N -3.09 0.53 -0.15 4.03 3.52 -1.26 -5.08 118.95 117.46 1x4b s ARG 22 Ca 0.27 0.03 -0.11 0.00 -0.13 0.00 0.00 55.73 55.80 1x4b s ARG 22 Cb -0.08 0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.51 1x4b s ARG 22 CO 0.17 -0.12 -0.18 0.39 -0.81 0.00 0.00 175.30 174.75 1x4b n GLU 23 N 1.93 0.47 -0.61 5.12 1.02 -1.26 -2.69 120.64 124.61 1x4b n GLU 23 Ca -0.18 0.49 0.49 0.00 -0.02 0.00 0.00 57.16 57.94 1x4b n GLU 23 Cb 0.57 -1.67 0.78 0.00 -0.02 0.00 0.00 31.44 31.10 1x4b n GLU 23 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1x4b h LYS 24 N -1.00 0.00 0.00 3.49 1.63 -2.01 0.76 116.57 119.45 1x4b h LYS 24 Ca -0.03 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.70 1x4b h LYS 24 Cb 0.62 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.24 1x4b h LYS 24 CO -0.02 0.00 -0.41 0.93 -3.45 0.00 0.00 179.45 176.50 1x4b h GLU 25 N 0.00 0.00 -0.94 1.90 4.39 -1.92 -3.27 114.58 114.75 1x4b h GLU 25 Ca 0.85 0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.64 1x4b h GLU 25 Cb 3.51 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 32.05 1x4b h GLU 25 CO -0.01 0.80 -0.59 0.37 -1.16 0.00 0.00 179.01 178.43 1x4b h GLN 26 N -1.00 -0.04 -0.82 2.33 4.15 0.72 0.94 115.11 121.39 1x4b h GLN 26 Ca -0.10 0.00 0.16 0.00 0.77 0.00 0.00 58.65 59.48 1x4b h GLN 26 Cb 0.93 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 28.53 1x4b h GLN 26 CO -0.06 -0.03 0.35 0.74 -1.93 0.00 0.00 178.83 177.90 1x4b h PHE 27 N -0.04 0.59 -0.99 3.99 0.04 -1.48 0.21 116.94 119.26 1x4b h PHE 27 Ca 0.15 0.04 -0.62 0.00 2.80 0.00 0.00 57.97 60.34 1x4b h PHE 27 Cb 0.43 -0.14 -0.30 0.00 2.20 0.00 0.00 35.95 38.15 1x4b h PHE 27 CO -1.00 0.05 0.77 0.54 -0.60 0.00 0.00 178.31 178.07 1x4b n ARG 28 N -4.99 2.57 -3.86 1.51 5.12 0.21 -4.85 116.66 112.36 1x4b n ARG 28 Ca 0.17 -3.22 -0.27 0.00 -1.93 0.00 0.00 57.85 52.60 1x4b n ARG 28 Cb 0.49 -2.25 -0.17 0.00 -1.16 0.00 0.00 32.46 29.37 1x4b n ARG 28 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1x4b s LYS 29 N -3.66 1.23 -0.12 5.56 2.20 0.27 -3.12 119.74 122.09 1x4b s LYS 29 Ca 0.62 -0.38 -0.03 0.00 -0.36 0.00 0.00 55.97 55.83 1x4b s LYS 29 Cb 0.50 -1.81 -0.03 0.00 -1.51 0.00 0.00 37.83 34.98 1x4b s LYS 29 CO 0.03 -0.42 -0.02 -0.51 -0.36 0.00 0.00 175.35 174.07 1x4b s LEU 30 N 1.72 3.39 -0.55 5.43 1.02 -1.06 -1.12 118.68 127.51 1x4b s LEU 30 Ca 0.02 -0.01 -0.19 0.00 0.02 0.00 0.00 54.13 53.97 1x4b s LEU 30 Cb -0.15 -1.80 0.08 0.00 0.02 0.00 0.00 46.19 44.35 1x4b s LEU 30 CO -0.07 0.26 0.67 0.12 0.02 0.00 0.00 176.35 177.35 1x4b s PHE 31 N -0.20 3.01 0.13 0.29 2.19 0.16 -1.33 117.98 122.23 1x4b s PHE 31 Ca 0.04 -0.74 -0.30 0.00 0.33 0.00 0.00 56.93 56.26 1x4b s PHE 31 Cb -0.13 -3.79 -0.07 0.00 -1.31 0.00 0.00 43.02 37.73 1x4b s PHE 31 CO 0.02 -1.18 1.06 0.42 1.83 0.00 0.00 175.22 177.38 1x4b s ILE 32 N 2.69 4.13 -0.10 3.12 -1.09 0.78 0.53 121.20 131.27 1x4b s ILE 32 Ca 0.13 1.76 0.02 0.00 -2.23 0.00 0.00 60.65 60.33 1x4b s ILE 32 Cb -0.22 -4.12 0.01 0.00 -1.58 0.00 0.00 42.46 36.56 1x4b s ILE 32 CO 0.09 0.26 -0.14 -0.83 -1.23 0.00 0.00 174.94 173.09 1x4b s GLY 33 N 0.12 0.97 0.00 6.18 0.00 -0.09 -1.44 107.32 113.06 1x4b s GLY 33 Ca 0.50 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.58 1x4b s GLY 33 CO 0.32 0.21 0.00 0.61 0.00 0.00 0.00 173.10 174.24 1x4b n GLY 34 N 4.10 0.10 0.76 0.20 0.00 0.49 -0.21 105.19 110.63 1x4b n GLY 34 Ca -0.20 -0.41 0.09 0.00 0.00 0.00 0.00 46.02 45.50 1x4b n GLY 34 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x4b n LEU 35 N -0.28 2.63 0.00 0.99 4.77 0.39 -4.26 117.00 121.24 1x4b n LEU 35 Ca 0.00 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 1x4b n LEU 35 Cb 0.05 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1x4b n LEU 35 CO 0.00 0.49 0.00 -1.54 -1.33 0.00 0.00 177.39 175.01 1x4b n SER 36 N 1.04 0.00 0.00 -1.43 3.41 -1.26 -2.50 113.62 112.87 1x4b n SER 36 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 1x4b n SER 36 Cb 0.46 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1x4b n SER 36 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1x4b n PHE 37 N -2.00 0.00 -0.03 7.33 3.72 -1.26 -4.78 117.46 120.44 1x4b n PHE 37 Ca 0.00 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.36 1x4b n PHE 37 Cb 0.00 -0.31 -0.01 0.00 -0.94 0.00 0.00 39.48 38.22 1x4b n PHE 37 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1x4b n GLU 38 N -2.00 0.23 -1.38 -1.08 2.13 -1.19 -4.26 120.64 113.09 1x4b n GLU 38 Ca 0.00 0.09 -0.33 0.00 0.66 0.00 0.00 57.16 57.58 1x4b n GLU 38 Cb 0.00 -0.84 -0.16 0.00 0.27 0.00 0.00 31.44 30.71 1x4b n GLU 38 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1x4b n THR 39 N -3.52 0.00 -0.66 6.31 -1.04 -1.04 -4.85 114.28 109.48 1x4b n THR 39 Ca -0.06 -0.11 -0.14 0.00 -2.04 0.00 0.00 64.05 61.69 1x4b n THR 39 Cb 0.22 -0.35 0.12 0.00 -1.82 0.00 0.00 70.33 68.51 1x4b n THR 39 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1x4b n THR 40 N 6.44 0.00 -0.02 12.58 -2.24 -1.26 -4.61 114.28 125.17 1x4b n THR 40 Ca 0.61 -0.19 -0.10 0.00 -2.27 0.00 0.00 64.05 62.10 1x4b n THR 40 Cb 0.05 -1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 67.24 1x4b n THR 40 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1x4b h GLU 41 N 0.00 0.03 0.68 -0.78 5.08 -1.91 -0.24 114.58 117.44 1x4b h GLU 41 Ca -0.19 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.13 1x4b h GLU 41 Cb 0.60 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.85 1x4b h GLU 41 CO 0.13 0.02 -0.33 1.49 -1.00 0.00 0.00 179.01 179.32 1x4b h GLU 42 N 0.03 -0.88 -1.54 2.33 4.81 -1.93 0.20 114.58 117.60 1x4b h GLU 42 Ca 0.07 0.06 0.45 0.00 -0.13 0.00 0.00 59.36 59.80 1x4b h GLU 42 Cb 0.09 0.20 -0.06 0.00 0.63 0.00 0.00 28.75 29.61 1x4b h GLU 42 CO -0.12 -0.59 1.15 0.77 -0.73 0.00 0.00 179.01 179.49 1x4b h SER 43 N -1.17 0.00 0.17 1.04 0.02 -1.89 1.66 113.55 113.38 1x4b h SER 43 Ca -0.09 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.64 1x4b h SER 43 Cb 0.70 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.26 1x4b h SER 43 CO 0.15 0.00 -0.97 0.25 -1.14 0.00 0.00 176.83 175.12 1x4b h LEU 44 N 0.00 0.55 -0.44 5.07 5.85 -0.75 -3.32 115.31 122.27 1x4b h LEU 44 Ca 0.73 -0.95 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1x4b h LEU 44 Cb 3.02 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 43.85 1x4b h LEU 44 CO -0.01 1.47 0.21 0.03 -0.34 0.00 0.00 178.44 179.80 1x4b h ARG 45 N -0.26 0.64 -0.90 1.25 3.08 0.42 -0.06 114.38 118.56 1x4b h ARG 45 Ca -0.17 -0.09 0.26 0.00 0.07 0.00 0.00 59.98 60.05 1x4b h ARG 45 Cb 1.76 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 31.66 1x4b h ARG 45 CO 0.18 0.55 0.82 -0.97 -1.07 0.00 0.00 179.97 179.48 1x4b h ASN 46 N 0.57 0.00 0.03 7.04 -1.24 -0.03 1.45 115.58 123.40 1x4b h ASN 46 Ca 0.15 0.00 -0.30 0.00 0.71 0.00 0.00 56.30 56.86 1x4b h ASN 46 Cb 0.12 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 39.14 1x4b h ASN 46 CO -0.02 0.00 -1.64 0.00 -1.29 0.00 0.00 177.43 174.48 1x4b n TYR 47 N -3.76 0.92 0.01 0.67 9.36 -0.58 -4.17 117.16 119.62 1x4b n TYR 47 Ca 0.19 0.33 -0.06 0.00 3.32 0.00 0.00 57.90 61.68 1x4b n TYR 47 Cb 1.13 -1.10 0.12 0.00 -0.63 0.00 0.00 39.34 38.86 1x4b n TYR 47 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 1x4b n TYR 48 N -4.14 1.28 0.63 2.98 4.01 0.32 -3.67 117.16 118.58 1x4b n TYR 48 Ca -0.35 -0.87 0.11 0.00 -0.16 0.00 0.00 57.90 56.63 1x4b n TYR 48 Cb 0.81 -0.48 -0.11 0.00 -0.31 0.00 0.00 39.34 39.25 1x4b n TYR 48 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1x4b n GLU 49 N -0.08 0.24 -0.03 -0.72 1.02 0.47 -3.98 120.64 117.56 1x4b n GLU 49 Ca 0.23 -0.06 -0.18 0.00 -0.02 0.00 0.00 57.16 57.13 1x4b n GLU 49 Cb 0.93 -1.52 -0.13 0.00 -0.02 0.00 0.00 31.44 30.70 1x4b n GLU 49 CO 0.00 0.00 0.00 -0.56 1.18 0.00 0.00 177.13 177.75 1x4b h GLN 50 N 0.00 0.12 0.00 3.49 3.07 -1.80 -3.24 115.11 116.74 1x4b h GLN 50 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 58.65 58.54 1x4b h GLN 50 Cb 0.68 0.07 0.00 0.00 0.08 0.00 0.00 27.48 28.32 1x4b h GLN 50 CO 0.00 1.09 0.00 0.91 0.09 0.00 0.00 178.83 180.92 1x4b n TRP 51 N -4.34 0.61 0.00 0.06 8.01 -1.26 -4.85 117.44 115.67 1x4b n TRP 51 Ca -0.18 0.27 0.00 0.00 -1.31 0.00 0.00 57.50 56.29 1x4b n TRP 51 Cb 0.68 -0.94 0.00 0.00 -2.01 0.00 0.00 31.31 29.04 1x4b n TRP 51 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1x4b n GLY 52 N -0.64 3.12 3.50 6.99 0.00 -1.22 -4.20 105.19 112.75 1x4b n GLY 52 Ca 0.01 -0.96 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 1x4b n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4b s LYS 53 N -2.07 3.25 -0.11 1.61 1.02 -1.26 -3.51 119.74 118.68 1x4b s LYS 53 Ca 0.00 -0.46 -0.30 0.00 0.02 0.00 0.00 55.97 55.23 1x4b s LYS 53 Cb 0.00 -4.11 -0.08 0.00 -0.52 0.00 0.00 37.83 33.13 1x4b s LYS 53 CO 0.00 -1.57 2.09 1.28 -0.92 0.00 0.00 175.35 176.23 1x4b n LEU 54 N 7.49 3.60 0.14 3.17 4.77 -1.26 -3.68 117.00 131.24 1x4b n LEU 54 Ca -0.00 0.56 -0.00 0.00 -0.03 0.00 0.00 56.01 56.54 1x4b n LEU 54 Cb 0.47 -1.51 0.20 0.00 -2.33 0.00 0.00 43.42 40.24 1x4b n LEU 54 CO 0.63 -0.27 0.53 0.71 -1.33 0.00 0.00 177.39 177.66 1x4b h THR 55 N 6.38 1.37 -2.88 -5.08 1.35 0.82 -3.42 112.91 111.46 1x4b h THR 55 Ca -0.45 -2.02 -0.26 0.00 -0.55 0.00 0.00 66.41 63.13 1x4b h THR 55 Cb 1.25 2.10 -0.34 0.00 -1.73 0.00 0.00 68.15 69.42 1x4b h THR 55 CO 0.95 0.57 -0.59 -0.62 -0.25 0.00 0.00 175.52 175.58 1x4b s ASP 56 N -6.81 0.70 -0.19 5.36 2.15 -1.14 -5.00 116.67 111.75 1x4b s ASP 56 Ca -0.01 0.34 0.01 0.00 0.43 0.00 0.00 52.55 53.32 1x4b s ASP 56 Cb 0.13 0.48 0.03 0.00 -0.30 0.00 0.00 42.92 43.26 1x4b s ASP 56 CO 0.75 -0.26 -0.13 0.00 -0.17 0.00 0.00 175.17 175.36 1x4b s VAL 58 N 1.36 1.69 -0.18 0.00 1.01 -0.45 -4.93 120.40 118.91 1x4b s VAL 58 Ca 0.01 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.03 1x4b s VAL 58 Cb -0.15 -1.42 0.03 0.00 0.00 0.00 0.00 36.38 34.85 1x4b s VAL 58 CO -0.09 0.43 -0.11 0.54 0.00 0.00 0.00 175.10 175.86 1x4b s VAL 59 N -0.55 1.59 0.34 2.92 0.11 -1.26 0.31 120.40 123.85 1x4b s VAL 59 Ca 0.08 -0.85 -0.28 0.00 -2.93 0.00 0.00 61.98 58.01 1x4b s VAL 59 Cb -0.08 -1.60 -0.09 0.00 -1.53 0.00 0.00 36.38 33.07 1x4b s VAL 59 CO -0.00 0.27 1.21 -0.04 -3.33 0.00 0.00 175.10 173.22 1x4b s MET 60 N 1.44 4.32 0.08 1.54 -1.94 -0.17 -4.95 119.30 119.63 1x4b s MET 60 Ca 0.01 2.00 0.03 0.00 -1.71 0.00 0.00 55.69 56.02 1x4b s MET 60 Cb -0.15 -2.97 -0.03 0.00 2.01 0.00 0.00 34.83 33.69 1x4b s MET 60 CO -0.09 -0.14 -0.10 1.03 -0.01 0.00 0.00 175.02 175.72 1x4b s ARG 61 N -1.87 0.75 0.24 2.03 0.52 -1.26 -1.09 118.95 118.27 1x4b s ARG 61 Ca 0.50 -1.03 -0.31 0.00 -0.52 0.00 0.00 55.73 54.37 1x4b s ARG 61 Cb -0.35 -0.47 -0.11 0.00 0.52 0.00 0.00 34.95 34.54 1x4b s ARG 61 CO 0.46 0.08 1.61 -0.51 0.02 0.00 0.00 175.30 176.95 1x4b s ASP 62 N -2.16 6.44 0.49 0.23 1.01 -0.40 -4.77 116.67 117.51 1x4b s ASP 62 Ca 0.01 2.84 0.28 0.00 0.71 0.00 0.00 52.55 56.39 1x4b s ASP 62 Cb -0.05 -2.62 0.86 0.00 1.01 0.00 0.00 42.92 42.13 1x4b s ASP 62 CO -0.00 -0.89 1.80 1.55 0.21 0.00 0.00 175.17 177.84 1x4b h PRO 63 N 5.72 0.00 0.00 8.23 0.13 -1.96 0.55 132.00 144.67 1x4b h PRO 63 Ca -0.45 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.37 1x4b h PRO 63 Cb 1.21 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 1x4b h PRO 63 CO 0.86 0.01 -2.12 0.00 -0.23 0.00 0.00 178.00 176.52 1x4b n ALA 64 N -2.10 1.62 0.08 -0.56 0.00 -1.26 -4.53 120.51 113.76 1x4b n ALA 64 Ca 0.02 -0.82 -0.07 0.00 0.00 0.00 0.00 53.44 52.57 1x4b n ALA 64 Cb 0.42 0.12 0.06 0.00 0.00 0.00 0.00 19.45 20.05 1x4b n ALA 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1x4b h SER 65 N -0.28 0.27 -0.10 0.00 0.87 -1.96 -3.46 113.55 108.89 1x4b h SER 65 Ca -0.47 -0.18 -0.04 0.00 -1.23 0.00 0.00 61.79 59.87 1x4b h SER 65 Cb 1.59 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 63.45 1x4b h SER 65 CO -0.16 0.90 -0.04 0.29 -0.53 0.00 0.00 176.83 177.29 1x4b n LYS 66 N -3.78 -0.98 -4.84 2.24 4.76 0.19 -4.94 118.16 110.81 1x4b n LYS 66 Ca -0.03 0.38 -0.33 0.00 -2.87 0.00 0.00 58.31 55.46 1x4b n LYS 66 Cb 0.70 -4.18 -0.14 0.00 -1.84 0.00 0.00 35.03 29.57 1x4b n LYS 66 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1x4b s ARG 67 N -1.39 3.00 0.05 1.97 0.52 -1.25 -4.77 118.95 117.09 1x4b s ARG 67 Ca 0.00 -0.70 -0.35 0.00 -0.52 0.00 0.00 55.73 54.16 1x4b s ARG 67 Cb 0.00 -2.51 -0.18 0.00 0.52 0.00 0.00 34.95 32.77 1x4b s ARG 67 CO 0.00 0.39 0.88 0.43 0.02 0.00 0.00 175.30 177.02 1x4b n SER 68 N 3.00 -0.34 0.10 0.23 7.64 -1.26 -1.28 113.62 121.72 1x4b n SER 68 Ca -0.18 1.10 -0.04 0.00 1.01 0.00 0.00 58.87 60.76 1x4b n SER 68 Cb 0.52 -0.89 0.12 0.00 -1.01 0.00 0.00 64.21 62.96 1x4b n SER 68 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1x4b h ARG 69 N 2.35 0.18 0.00 1.43 3.08 -1.41 -3.41 114.38 116.59 1x4b h ARG 69 Ca -0.43 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.49 1x4b h ARG 69 Cb 1.37 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.44 1x4b h ARG 69 CO 0.60 0.75 0.00 0.41 -1.07 0.00 0.00 179.97 180.66 1x4b n GLY 70 N 0.31 1.82 3.58 0.04 0.00 -1.26 -4.59 105.19 105.09 1x4b n GLY 70 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 1x4b n GLY 70 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1x4b s PHE 71 N -2.00 -0.72 0.00 1.61 -0.12 -1.26 0.18 117.98 115.67 1x4b s PHE 71 Ca 0.00 1.52 0.00 0.00 -0.05 0.00 0.00 56.93 58.40 1x4b s PHE 71 Cb 0.00 0.34 0.00 0.00 -0.63 0.00 0.00 43.02 42.73 1x4b s PHE 71 CO 0.00 -0.49 0.00 0.41 -0.05 0.00 0.00 175.22 175.09 1x4b n GLY 72 N 1.80 3.43 3.21 1.99 0.00 -0.52 -0.99 105.19 114.10 1x4b n GLY 72 Ca -0.16 -0.85 -0.21 0.00 0.00 0.00 0.00 46.02 44.80 1x4b n GLY 72 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x4b s PHE 73 N -2.46 1.42 -0.18 1.61 0.40 0.15 -0.16 117.98 118.77 1x4b s PHE 73 Ca 0.00 -0.43 -0.02 0.00 -0.60 0.00 0.00 56.93 55.87 1x4b s PHE 73 Cb 0.00 -0.80 0.05 0.00 0.51 0.00 0.00 43.02 42.79 1x4b s PHE 73 CO 0.00 0.10 0.02 0.14 0.70 0.00 0.00 175.22 176.19 1x4b s VAL 74 N -1.18 0.56 -0.45 -0.44 -7.23 -0.44 -1.34 120.40 109.88 1x4b s VAL 74 Ca 0.01 -0.48 -0.17 0.00 -1.81 0.00 0.00 61.98 59.53 1x4b s VAL 74 Cb -0.10 -0.99 0.04 0.00 0.56 0.00 0.00 36.38 35.89 1x4b s VAL 74 CO 0.03 -0.12 0.48 -0.89 -0.31 0.00 0.00 175.10 174.29 1x4b s THR 75 N 1.85 5.06 0.99 5.32 2.01 0.72 -2.55 115.64 129.04 1x4b s THR 75 Ca -0.00 -0.52 -0.14 0.00 0.31 0.00 0.00 61.69 61.34 1x4b s THR 75 Cb -0.16 -4.12 0.19 0.00 0.01 0.00 0.00 72.50 68.41 1x4b s THR 75 CO -0.07 -0.55 1.15 -0.36 -0.69 0.00 0.00 174.62 174.10 1x4b s PHE 76 N 2.17 1.89 -0.23 4.92 0.08 -1.18 0.13 117.98 125.76 1x4b s PHE 76 Ca 0.11 0.71 -0.17 0.00 0.12 0.00 0.00 56.93 57.70 1x4b s PHE 76 Cb -0.19 -3.50 -0.17 0.00 -0.57 0.00 0.00 43.02 38.59 1x4b s PHE 76 CO 0.12 -2.81 0.02 0.45 -0.10 0.00 0.00 175.22 172.91 1x4b n SER 77 N -4.03 1.92 -4.98 1.36 2.88 -1.24 -4.52 113.62 105.01 1x4b n SER 77 Ca 0.09 0.35 -0.19 0.00 -1.33 0.00 0.00 58.87 57.79 1x4b n SER 77 Cb 0.59 -0.88 0.03 0.00 -0.75 0.00 0.00 64.21 63.20 1x4b n SER 77 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x4b s SER 78 N -7.07 5.38 0.15 -3.46 0.15 -1.26 -5.01 113.70 102.59 1x4b s SER 78 Ca -0.32 -0.23 0.24 0.00 0.70 0.00 0.00 55.95 56.34 1x4b s SER 78 Cb 0.09 -0.70 0.29 0.00 -1.71 0.00 0.00 66.02 63.99 1x4b s SER 78 CO 0.58 -1.03 1.29 -0.03 1.20 0.00 0.00 173.24 175.25 1x4b h MET 79 N 0.28 0.00 0.00 5.44 4.05 -2.00 -3.31 114.93 119.39 1x4b h MET 79 Ca -0.40 0.00 -0.27 0.00 -0.28 0.00 0.00 59.70 58.74 1x4b h MET 79 Cb 1.29 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 32.04 1x4b h MET 79 CO 0.48 0.00 -1.67 0.00 0.23 0.00 0.00 176.91 175.95 1x4b n ALA 80 N -1.91 1.57 0.27 0.39 0.00 -1.26 -2.76 120.51 116.82 1x4b n ALA 80 Ca 0.03 -0.74 0.14 0.00 0.00 0.00 0.00 53.44 52.86 1x4b n ALA 80 Cb 0.46 -0.86 0.79 0.00 0.00 0.00 0.00 19.45 19.84 1x4b n ALA 80 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1x4b h GLU 81 N 0.00 0.00 0.06 0.00 4.39 -1.73 0.85 114.58 118.15 1x4b h GLU 81 Ca -0.27 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.10 1x4b h GLU 81 Cb 1.94 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.56 1x4b h GLU 81 CO 0.07 0.08 -1.82 1.33 -1.16 0.00 0.00 179.01 177.52 1x4b n VAL 82 N -3.68 1.65 0.30 3.13 0.24 -1.25 -3.44 118.33 115.29 1x4b n VAL 82 Ca -0.02 -0.40 0.17 0.00 -2.04 0.00 0.00 64.34 62.05 1x4b n VAL 82 Cb 0.19 -1.83 0.98 0.00 -1.47 0.00 0.00 33.84 31.71 1x4b n VAL 82 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1x4b h ASP 83 N -0.41 0.00 0.07 -1.34 3.32 -1.30 -1.21 116.42 115.54 1x4b h ASP 83 Ca -0.43 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.61 1x4b h ASP 83 Cb 1.72 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.27 1x4b h ASP 83 CO -0.08 0.00 -0.03 0.00 -1.72 0.00 0.00 179.24 177.41 1x4b h ALA 84 N 1.98 -0.31 -0.95 3.45 0.00 -0.96 -3.13 119.26 119.33 1x4b h ALA 84 Ca 0.00 -0.02 0.27 0.00 0.00 0.00 0.00 54.91 55.17 1x4b h ALA 84 Cb 0.03 0.03 -0.17 0.00 0.00 0.00 0.00 17.79 17.69 1x4b h ALA 84 CO -0.00 -0.31 0.12 0.00 0.00 0.00 0.00 179.25 179.06 1x4b h ALA 85 N -1.80 1.26 -0.88 0.00 0.00 -1.53 1.27 119.26 117.57 1x4b h ALA 85 Ca -0.01 0.30 0.20 0.00 0.00 0.00 0.00 54.91 55.41 1x4b h ALA 85 Cb 0.07 0.50 -0.12 0.00 0.00 0.00 0.00 17.79 18.24 1x4b h ALA 85 CO 0.02 -0.58 0.39 0.52 0.00 0.00 0.00 179.25 179.60 1x4b h MET 86 N 0.05 0.42 -1.68 0.00 2.07 -1.31 0.45 114.93 114.94 1x4b h MET 86 Ca 0.60 -0.03 -0.68 0.00 -2.07 0.00 0.00 59.70 57.53 1x4b h MET 86 Cb 1.27 -0.10 -0.34 0.00 -1.87 0.00 0.00 31.60 30.56 1x4b h MET 86 CO -0.84 0.28 0.21 0.00 1.07 0.00 0.00 176.91 177.63 1x4b n ALA 87 N -2.49 5.83 -2.58 6.32 0.00 0.43 -4.57 120.51 123.44 1x4b n ALA 87 Ca 0.21 -4.16 -0.09 0.00 0.00 0.00 0.00 53.44 49.40 1x4b n ALA 87 Cb 0.60 -1.29 0.04 0.00 0.00 0.00 0.00 19.45 18.80 1x4b n ALA 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x4b n ALA 88 N -0.54 3.48 -2.75 0.00 0.00 0.15 -4.95 120.51 115.89 1x4b n ALA 88 Ca 0.48 -3.17 -0.23 0.00 0.00 0.00 0.00 53.44 50.52 1x4b n ALA 88 Cb 0.47 -0.72 -0.01 0.00 0.00 0.00 0.00 19.45 19.19 1x4b n ALA 88 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1x4b s ARG 89 N -3.65 3.47 0.55 0.00 0.52 -1.26 -4.44 118.95 114.15 1x4b s ARG 89 Ca 0.35 -0.45 -0.09 0.00 -0.52 0.00 0.00 55.73 55.01 1x4b s ARG 89 Cb 0.37 -2.73 0.13 0.00 0.52 0.00 0.00 34.95 33.24 1x4b s ARG 89 CO -0.02 0.23 0.61 -0.35 0.02 0.00 0.00 175.30 175.79 1x4b n PRO 90 N -1.65 -1.35 -3.84 3.54 -0.04 -1.26 -5.15 135.00 125.24 1x4b n PRO 90 Ca -0.06 -0.95 -0.27 0.00 -0.04 0.00 0.00 63.50 62.18 1x4b n PRO 90 Cb 0.56 -0.75 -0.17 0.00 -0.04 0.00 0.00 33.50 33.11 1x4b n PRO 90 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1x4b s HIS 91 N -2.23 1.44 -0.23 0.54 3.76 -1.26 -5.07 115.29 112.24 1x4b s HIS 91 Ca 0.37 -0.92 -0.09 0.00 -0.15 0.00 0.00 55.06 54.26 1x4b s HIS 91 Cb -0.02 -1.19 -0.05 0.00 1.11 0.00 0.00 32.58 32.43 1x4b s HIS 91 CO 0.27 -0.58 0.13 -1.54 -0.85 0.00 0.00 174.74 172.17 1x4b s SER 92 N 1.72 5.87 -0.07 1.40 1.04 -1.26 0.24 113.70 122.64 1x4b s SER 92 Ca 0.01 0.06 -0.00 0.00 0.48 0.00 0.00 55.95 56.49 1x4b s SER 92 Cb -0.15 -2.05 0.02 0.00 0.10 0.00 0.00 66.02 63.94 1x4b s SER 92 CO -0.07 0.07 -0.03 -0.63 0.98 0.00 0.00 173.24 173.56 1x4b s ILE 93 N 0.99 0.60 0.00 -1.02 -1.09 0.23 -4.71 121.20 116.21 1x4b s ILE 93 Ca 0.06 -0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.41 1x4b s ILE 93 Cb -0.14 -0.68 0.00 0.00 -1.58 0.00 0.00 42.46 40.07 1x4b s ILE 93 CO 0.04 0.28 0.00 -0.67 -1.23 0.00 0.00 174.94 173.35 1x4b n ASP 94 N 4.72 -4.51 0.00 3.58 2.03 -1.26 -1.04 116.55 120.07 1x4b n ASP 94 Ca -0.14 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.17 1x4b n ASP 94 Cb 0.50 -2.31 0.00 0.00 -0.72 0.00 0.00 41.12 38.59 1x4b n ASP 94 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x4b n GLY 95 N -0.62 1.68 3.93 0.27 0.00 -1.26 -5.07 105.19 104.12 1x4b n GLY 95 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1x4b n GLY 95 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1x4b s ARG 96 N -0.91 2.74 -0.51 1.61 1.70 -0.20 -5.03 118.95 118.34 1x4b s ARG 96 Ca 0.00 -0.13 -0.16 0.00 -0.47 0.00 0.00 55.73 54.97 1x4b s ARG 96 Cb 0.00 -2.27 0.10 0.00 -0.57 0.00 0.00 34.95 32.21 1x4b s ARG 96 CO 0.00 -0.81 0.47 0.08 -1.08 0.00 0.00 175.30 173.96 1x4b s VAL 97 N -3.02 5.19 0.39 4.99 1.01 -1.26 -0.60 120.40 127.11 1x4b s VAL 97 Ca 0.55 -1.26 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 1x4b s VAL 97 Cb -0.11 -4.25 0.09 0.00 0.00 0.00 0.00 36.38 32.11 1x4b s VAL 97 CO 0.44 -0.75 0.53 1.33 0.00 0.00 0.00 175.10 176.65 1x4b n VAL 98 N 5.25 0.00 -3.18 2.92 0.24 0.14 -4.98 118.33 118.73 1x4b n VAL 98 Ca -0.13 -0.52 0.02 0.00 -2.04 0.00 0.00 64.34 61.68 1x4b n VAL 98 Cb 0.42 -1.58 -0.02 0.00 -1.47 0.00 0.00 33.84 31.19 1x4b n VAL 98 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 1x4b s GLU 99 N -4.04 0.54 0.56 7.34 1.03 0.71 -4.32 118.70 120.51 1x4b s GLU 99 Ca 0.32 0.92 -0.17 0.00 0.03 0.00 0.00 54.97 56.06 1x4b s GLU 99 Cb -0.01 0.41 -0.05 0.00 -0.80 0.00 0.00 34.13 33.67 1x4b s GLU 99 CO 0.22 -0.65 1.04 -1.25 -1.33 0.00 0.00 175.26 173.29 1x4b s PRO 100 N 2.82 3.51 0.24 -4.83 0.04 -1.26 -0.91 135.00 134.60 1x4b s PRO 100 Ca 0.19 1.22 0.02 0.00 0.04 0.00 0.00 61.00 62.47 1x4b s PRO 100 Cb -0.15 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 1x4b s PRO 100 CO -0.21 -0.66 0.17 0.15 0.04 0.00 0.00 177.00 176.50 1x4b s LYS 101 N -3.86 1.37 -0.12 4.56 -0.14 0.19 -4.85 119.74 116.89 1x4b s LYS 101 Ca 0.64 -1.75 -0.07 0.00 -1.36 0.00 0.00 55.97 53.43 1x4b s LYS 101 Cb -0.15 0.28 -0.04 0.00 -1.68 0.00 0.00 37.83 36.23 1x4b s LYS 101 CO 0.32 -0.47 0.13 1.03 -0.76 0.00 0.00 175.35 175.60 1x4b s ARG 102 N -3.94 3.45 -0.82 1.68 0.52 -1.26 0.36 118.95 118.93 1x4b s ARG 102 Ca 0.39 -0.16 -0.03 0.00 -0.52 0.00 0.00 55.73 55.42 1x4b s ARG 102 Cb 0.06 -3.17 0.19 0.00 0.52 0.00 0.00 34.95 32.55 1x4b s ARG 102 CO 0.17 0.75 2.35 0.00 0.02 0.00 0.00 175.30 178.58 1x4b n ALA 103 N 2.08 6.49 -2.52 2.13 0.00 -0.28 -4.48 120.51 123.93 1x4b n ALA 103 Ca -0.20 -3.79 -0.24 0.00 0.00 0.00 0.00 53.44 49.21 1x4b n ALA 103 Cb 0.55 -2.23 -0.14 0.00 0.00 0.00 0.00 19.45 17.63 1x4b n ALA 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1x4b s VAL 104 N -3.17 1.48 0.50 0.00 -7.23 -1.26 -4.64 120.40 106.08 1x4b s VAL 104 Ca 0.53 -1.05 0.00 0.00 -1.81 0.00 0.00 61.98 59.65 1x4b s VAL 104 Cb 0.33 -1.29 0.00 0.00 0.56 0.00 0.00 36.38 35.99 1x4b s VAL 104 CO -0.24 0.21 0.00 0.00 -0.31 0.00 0.00 175.10 174.76 1x4b n ALA 105 N 2.06 -2.75 -3.46 1.32 0.00 -1.26 -5.00 120.51 111.42 1x4b n ALA 105 Ca -0.17 0.68 -0.13 0.00 0.00 0.00 0.00 53.44 53.83 1x4b n ALA 105 Cb 0.54 -1.27 -0.13 0.00 0.00 0.00 0.00 19.45 18.59 1x4b n ALA 105 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1x4b s ARG 106 N -4.29 0.19 0.15 0.00 1.70 -1.26 -5.03 118.95 110.41 1x4b s ARG 106 Ca 0.00 0.39 0.00 0.00 -0.47 0.00 0.00 55.73 55.65 1x4b s ARG 106 Cb 0.00 -0.04 0.00 0.00 -0.57 0.00 0.00 34.95 34.34 1x4b s ARG 106 CO 0.00 -0.11 0.00 -1.91 -1.08 0.00 0.00 175.30 172.20 1x4b n GLU 107 N 3.70 0.00 -0.38 3.89 0.00 -1.26 -4.92 120.64 121.67 1x4b n GLU 107 Ca -0.20 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 56.86 1x4b n GLU 107 Cb 0.55 0.00 -0.09 0.00 0.00 0.00 0.00 31.44 31.90 1x4b n GLU 107 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1x4b n GLU 108 N -2.99 -0.40 -2.85 5.31 2.13 -1.26 -4.90 120.64 115.68 1x4b n GLU 108 Ca 0.00 1.46 -0.00 0.00 0.66 0.00 0.00 57.16 59.28 1x4b n GLU 108 Cb 0.00 -2.15 -0.00 0.00 0.27 0.00 0.00 31.44 29.56 1x4b n GLU 108 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1x4b n SER 109 N -5.07 -7.61 -3.15 4.31 7.64 -1.26 -5.05 113.62 103.43 1x4b n SER 109 Ca 0.02 1.16 0.06 0.00 1.01 0.00 0.00 58.87 61.12 1x4b n SER 109 Cb 0.24 -4.33 -0.01 0.00 -1.01 0.00 0.00 64.21 59.10 1x4b n SER 109 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x4b s GLY 110 N -1.46 -0.41 0.40 0.23 0.00 -1.26 -4.62 107.32 100.19 1x4b s GLY 110 Ca -0.00 2.83 0.00 0.00 0.00 0.00 0.00 44.72 47.55 1x4b s GLY 110 CO 0.57 4.11 0.00 -1.26 0.00 0.00 0.00 173.10 176.52 1x4b n SER 111 N 5.27 -3.57 -2.88 1.64 2.88 -1.26 -5.02 113.62 110.69 1x4b n SER 111 Ca -0.00 0.85 -0.03 0.00 -1.33 0.00 0.00 58.87 58.35 1x4b n SER 111 Cb 0.57 3.39 0.00 0.00 -0.75 0.00 0.00 64.21 67.42 1x4b n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4b n GLY 112 N -1.42 -2.76 3.80 0.46 0.00 -1.26 -4.94 105.19 99.07 1x4b n GLY 112 Ca 0.00 0.54 -0.34 0.00 0.00 0.00 0.00 46.02 46.23 1x4b n GLY 112 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4b s PRO 113 N -1.71 3.77 -0.35 1.61 0.04 -1.26 -4.90 135.00 132.20 1x4b s PRO 113 Ca 0.06 1.34 -0.40 0.00 0.04 0.00 0.00 61.00 62.05 1x4b s PRO 113 Cb -0.01 -2.09 -0.15 0.00 0.04 0.00 0.00 34.50 32.29 1x4b s PRO 113 CO 0.64 -0.45 1.94 0.43 0.04 0.00 0.00 177.00 179.59 1x4b n SER 114 N -1.05 2.00 -3.65 6.66 7.64 -1.26 -4.87 113.62 119.09 1x4b n SER 114 Ca 0.09 0.82 -0.01 0.00 1.01 0.00 0.00 58.87 60.78 1x4b n SER 114 Cb 0.53 -1.13 -0.07 0.00 -1.01 0.00 0.00 64.21 62.53 1x4b n SER 114 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x4b s SER 115 N 5.05 -0.12 0.00 6.43 1.04 -1.26 -5.27 113.70 119.57 1x4b s SER 115 Ca 1.06 0.22 0.00 0.00 0.48 0.00 0.00 55.95 57.70 1x4b s SER 115 Cb -1.10 0.67 0.00 0.00 0.10 0.00 0.00 66.02 65.70 1x4b s SER 115 CO 0.62 -0.04 0.00 0.61 0.98 0.00 0.00 173.24 175.41