#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iz5 s PHE 3 N 0.00 -0.32 -0.13 0.54 -0.12 -0.86 -1.33 117.98 115.76 1iz5 s PHE 3 Ca 0.00 0.08 -0.04 0.00 -0.05 0.00 0.00 56.93 56.93 1iz5 s PHE 3 Cb 0.00 0.59 0.05 0.00 -0.63 0.00 0.00 43.02 43.03 1iz5 s PHE 3 CO 0.00 -0.76 0.07 -2.00 -0.05 0.00 0.00 175.22 172.47 1iz5 s GLU 4 N -3.39 0.15 -0.07 1.99 2.12 -0.15 -1.73 118.70 117.62 1iz5 s GLU 4 Ca 0.07 0.02 0.03 0.00 0.36 0.00 0.00 54.97 55.45 1iz5 s GLU 4 Cb -0.02 -1.43 0.00 0.00 0.26 0.00 0.00 34.13 32.95 1iz5 s GLU 4 CO -0.05 -0.54 -0.18 0.42 -0.54 0.00 0.00 175.26 174.37 1iz5 s ILE 5 N 2.10 1.56 -0.08 -3.70 1.01 0.56 -1.51 121.20 121.14 1iz5 s ILE 5 Ca 0.03 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 59.97 1iz5 s ILE 5 Cb -0.15 -1.37 -0.00 0.00 0.01 0.00 0.00 42.46 40.95 1iz5 s ILE 5 CO -0.07 0.45 -0.21 -0.69 0.00 0.00 0.00 174.94 174.42 1iz5 s VAL 6 N 0.38 1.81 -0.08 2.92 1.01 -0.10 0.09 120.40 126.42 1iz5 s VAL 6 Ca -0.13 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 60.99 1iz5 s VAL 6 Cb -0.16 -1.56 0.00 0.00 0.00 0.00 0.00 36.38 34.67 1iz5 s VAL 6 CO 0.05 0.51 -0.19 0.12 0.00 0.00 0.00 175.10 175.59 1iz5 s PHE 7 N 0.24 2.07 -0.37 5.22 5.36 0.05 -1.03 117.98 129.53 1iz5 s PHE 7 Ca -0.13 -0.80 -0.20 0.00 -0.96 0.00 0.00 56.93 54.84 1iz5 s PHE 7 Cb -0.16 -1.42 0.01 0.00 -0.34 0.00 0.00 43.02 41.11 1iz5 s PHE 7 CO 0.06 -0.34 0.62 -1.21 -1.46 0.00 0.00 175.22 172.89 1iz5 s GLU 8 N 0.42 3.60 0.00 10.12 0.41 -1.26 -0.77 118.70 131.22 1iz5 s GLU 8 Ca -0.16 -0.06 0.00 0.00 -0.41 0.00 0.00 54.97 54.34 1iz5 s GLU 8 Cb -0.17 -3.83 0.00 0.00 -1.78 0.00 0.00 34.13 28.35 1iz5 s GLU 8 CO 0.06 -0.77 0.00 0.41 -0.49 0.00 0.00 175.26 174.47 1iz5 n GLY 9 N 4.76 0.58 0.37 -1.39 0.00 -0.59 -5.00 105.19 103.92 1iz5 n GLY 9 Ca -0.02 -0.75 0.06 0.00 0.00 0.00 0.00 46.02 45.31 1iz5 n GLY 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iz5 h ALA 10 N 0.00 1.51 -0.32 4.61 0.00 -1.15 -2.19 119.26 121.72 1iz5 h ALA 10 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1iz5 h ALA 10 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1iz5 h ALA 10 CO 0.00 0.27 0.16 -0.22 0.00 0.00 0.00 179.25 179.46 1iz5 h LYS 11 N 1.03 0.46 -0.45 0.00 3.11 -1.70 -1.16 116.57 117.85 1iz5 h LYS 11 Ca 0.48 -0.06 -0.05 0.00 -2.81 0.00 0.00 60.65 58.21 1iz5 h LYS 11 Cb 0.42 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.55 1iz5 h LYS 11 CO -0.24 0.41 0.09 1.49 -2.81 0.00 0.00 179.45 178.38 1iz5 h GLU 12 N 0.39 0.69 -0.53 1.90 4.81 -1.73 -0.99 114.58 119.12 1iz5 h GLU 12 Ca 0.11 -0.14 -0.10 0.00 -0.13 0.00 0.00 59.36 59.11 1iz5 h GLU 12 Cb 0.09 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 1iz5 h GLU 12 CO -0.02 0.65 -0.04 0.35 -0.73 0.00 0.00 179.01 179.22 1iz5 h PHE 13 N 0.67 1.07 -0.68 0.92 3.57 -1.08 -1.86 116.94 119.55 1iz5 h PHE 13 Ca 0.15 -0.20 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 1iz5 h PHE 13 Cb 0.29 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 1iz5 h PHE 13 CO 0.01 0.99 0.33 0.00 -2.23 0.00 0.00 178.31 177.41 1iz5 h ALA 14 N 0.94 0.88 -0.80 2.41 0.00 -0.69 -1.85 119.26 120.14 1iz5 h ALA 14 Ca 0.15 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1iz5 h ALA 14 Cb 0.59 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1iz5 h ALA 14 CO 0.04 0.45 0.36 1.96 0.00 0.00 0.00 179.25 182.05 1iz5 h GLN 15 N 0.95 1.18 -0.12 0.00 4.20 -0.98 -0.78 115.11 119.56 1iz5 h GLN 15 Ca 0.23 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1iz5 h GLN 15 Cb 0.12 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1iz5 h GLN 15 CO -0.03 0.93 0.04 1.25 -0.67 0.00 0.00 178.83 180.35 1iz5 h LEU 16 N 1.16 0.17 -0.86 1.46 5.85 -0.97 -0.51 115.31 121.61 1iz5 h LEU 16 Ca 0.27 -0.19 0.02 0.00 0.84 0.00 0.00 57.88 58.83 1iz5 h LEU 16 Cb 0.16 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1iz5 h LEU 16 CO -0.03 0.31 0.56 0.40 -0.34 0.00 0.00 178.44 179.35 1iz5 h ILE 17 N 0.02 1.17 -0.15 4.05 1.08 -1.15 -0.21 117.51 122.33 1iz5 h ILE 17 Ca 0.04 -0.38 -0.01 0.00 -0.39 0.00 0.00 64.86 64.12 1iz5 h ILE 17 Cb 0.20 -0.04 -0.01 0.00 -3.07 0.00 0.00 36.82 33.90 1iz5 h ILE 17 CO -0.00 0.20 0.08 -0.78 -0.69 0.00 0.00 178.15 176.96 1iz5 h ASP 18 N 1.12 0.20 -0.17 1.72 1.82 -0.92 -1.93 116.42 118.26 1iz5 h ASP 18 Ca 0.33 -0.11 -0.05 0.00 -0.39 0.00 0.00 57.03 56.81 1iz5 h ASP 18 Cb -0.05 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 39.89 1iz5 h ASP 18 CO -0.10 0.26 -0.03 0.74 -1.61 0.00 0.00 179.24 178.50 1iz5 h THR 19 N 0.13 1.19 0.00 2.25 2.02 -0.72 -2.57 112.91 115.21 1iz5 h THR 19 Ca 0.05 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.46 1iz5 h THR 19 Cb 0.11 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 1iz5 h THR 19 CO -0.01 0.26 -0.05 0.00 0.37 0.00 0.00 175.52 176.09 1iz5 n ALA 20 N -2.48 2.38 -1.26 6.16 0.00 -0.12 -4.20 120.51 120.99 1iz5 n ALA 20 Ca 0.01 -0.08 0.09 0.00 0.00 0.00 0.00 53.44 53.46 1iz5 n ALA 20 Cb 0.25 -1.44 0.15 0.00 0.00 0.00 0.00 19.45 18.41 1iz5 n ALA 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1iz5 n SER 21 N -1.94 2.09 0.14 0.00 3.41 -0.74 -4.69 113.62 111.89 1iz5 n SER 21 Ca 0.06 -3.27 0.03 0.00 -0.26 0.00 0.00 58.87 55.43 1iz5 n SER 21 Cb 0.39 -0.45 0.41 0.00 -0.26 0.00 0.00 64.21 64.31 1iz5 n SER 21 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1iz5 h LYS 22 N 0.29 0.17 0.00 4.33 1.79 -1.71 -3.13 116.57 118.31 1iz5 h LYS 22 Ca -0.00 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1iz5 h LYS 22 Cb 1.02 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.65 1iz5 h LYS 22 CO 0.00 0.33 -0.93 1.28 -1.08 0.00 0.00 179.45 179.06 1iz5 n LEU 23 N -4.27 0.63 -4.38 2.94 4.77 -1.26 -4.98 117.00 110.45 1iz5 n LEU 23 Ca -0.01 0.02 -0.23 0.00 -0.03 0.00 0.00 56.01 55.76 1iz5 n LEU 23 Cb 0.27 -0.12 -0.11 0.00 -2.33 0.00 0.00 43.42 41.14 1iz5 n LEU 23 CO 0.38 0.03 -0.48 0.27 -1.33 0.00 0.00 177.39 176.26 1iz5 s ILE 24 N -3.18 2.04 -0.08 -0.08 -4.36 -1.18 -4.32 121.20 110.05 1iz5 s ILE 24 Ca 0.05 -2.10 0.15 0.00 -0.26 0.00 0.00 60.65 58.49 1iz5 s ILE 24 Cb 0.14 -2.03 -0.23 0.00 1.25 0.00 0.00 42.46 41.60 1iz5 s ILE 24 CO 0.78 -0.35 0.23 0.47 0.24 0.00 0.00 174.94 176.31 1iz5 n ASP 25 N -0.04 1.23 -3.81 4.36 10.43 -1.26 -4.89 116.55 122.58 1iz5 n ASP 25 Ca -0.10 0.00 -0.11 0.00 2.57 0.00 0.00 54.79 57.15 1iz5 n ASP 25 Cb 0.58 1.38 -0.08 0.00 1.84 0.00 0.00 41.12 44.84 1iz5 n ASP 25 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 1iz5 s GLU 26 N -2.82 0.73 -0.03 -1.24 -6.30 -1.26 -1.66 118.70 106.12 1iz5 s GLU 26 Ca -0.07 -0.58 -0.23 0.00 -2.50 0.00 0.00 54.97 51.59 1iz5 s GLU 26 Cb 0.08 0.31 0.05 0.00 0.00 0.00 0.00 34.13 34.57 1iz5 s GLU 26 CO 0.66 -0.22 0.51 0.00 0.02 0.00 0.00 175.26 176.23 1iz5 s ALA 27 N -2.53 -1.31 -0.34 6.30 0.00 -1.02 -4.94 121.76 117.92 1iz5 s ALA 27 Ca -0.05 0.83 -0.12 0.00 0.00 0.00 0.00 51.96 52.62 1iz5 s ALA 27 Cb -0.01 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 1iz5 s ALA 27 CO -0.04 -0.34 0.21 0.00 0.00 0.00 0.00 175.76 175.60 1iz5 s ALA 28 N -1.37 3.41 -0.22 0.00 0.00 -1.26 -2.07 121.76 120.25 1iz5 s ALA 28 Ca -0.12 -1.42 -0.16 0.00 0.00 0.00 0.00 51.96 50.26 1iz5 s ALA 28 Cb -0.02 -2.58 -0.04 0.00 0.00 0.00 0.00 23.12 20.48 1iz5 s ALA 28 CO 0.06 -1.00 0.41 -0.06 0.00 0.00 0.00 175.76 175.18 1iz5 s PHE 29 N 1.67 3.33 -0.38 0.00 0.40 -0.26 -4.33 117.98 118.42 1iz5 s PHE 29 Ca 0.05 0.58 -0.19 0.00 -0.60 0.00 0.00 56.93 56.78 1iz5 s PHE 29 Cb -0.17 -2.56 0.01 0.00 0.51 0.00 0.00 43.02 40.80 1iz5 s PHE 29 CO 0.09 -0.09 0.54 0.15 0.70 0.00 0.00 175.22 176.60 1iz5 s LYS 30 N 1.60 3.50 -0.35 0.44 -0.14 0.84 -0.90 119.74 124.73 1iz5 s LYS 30 Ca 0.19 -0.26 -0.11 0.00 -1.36 0.00 0.00 55.97 54.42 1iz5 s LYS 30 Cb -0.15 -3.85 0.00 0.00 -1.68 0.00 0.00 37.83 32.15 1iz5 s LYS 30 CO 0.09 -0.74 0.21 0.08 -0.76 0.00 0.00 175.35 174.22 1iz5 s VAL 31 N 2.46 4.87 0.44 3.17 1.01 0.19 -1.42 120.40 131.12 1iz5 s VAL 31 Ca 0.19 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1iz5 s VAL 31 Cb -0.15 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 1iz5 s VAL 31 CO 0.15 -0.07 0.06 0.35 0.00 0.00 0.00 175.10 175.59 1iz5 n THR 32 N 5.04 0.00 0.22 3.92 -2.24 -0.34 -1.44 114.28 119.45 1iz5 n THR 32 Ca -0.13 -2.28 0.06 0.00 -2.27 0.00 0.00 64.05 59.43 1iz5 n THR 32 Cb 0.48 0.62 0.51 0.00 -2.10 0.00 0.00 70.33 69.85 1iz5 n THR 32 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1iz5 h GLU 33 N 0.00 0.01 0.00 -0.78 4.57 -1.98 -2.81 114.58 113.59 1iz5 h GLU 33 Ca -0.36 -0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 57.60 1iz5 h GLU 33 Cb 1.19 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.75 1iz5 h GLU 33 CO 0.58 0.17 -1.15 -0.44 -1.18 0.00 0.00 179.01 176.99 1iz5 h ASP 34 N 0.01 0.00 0.00 1.04 3.32 -1.98 -3.45 116.42 115.36 1iz5 h ASP 34 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1iz5 h ASP 34 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1iz5 h ASP 34 CO 0.02 0.96 0.00 0.61 -1.72 0.00 0.00 179.24 179.11 1iz5 n GLY 35 N 1.39 -1.14 3.55 2.75 0.00 -1.06 -1.27 105.19 109.41 1iz5 n GLY 35 Ca -0.04 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.45 1iz5 n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iz5 s ILE 36 N -3.00 3.85 0.07 -0.61 1.01 -0.14 -1.20 121.20 121.18 1iz5 s ILE 36 Ca 0.00 -0.40 0.02 0.00 0.00 0.00 0.00 60.65 60.27 1iz5 s ILE 36 Cb 0.00 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.81 1iz5 s ILE 36 CO 0.00 0.55 -0.08 -0.94 0.00 0.00 0.00 174.94 174.47 1iz5 s SER 37 N -0.28 1.07 -0.15 3.58 1.04 -0.51 -0.36 113.70 118.09 1iz5 s SER 37 Ca 0.05 -0.75 -0.11 0.00 0.48 0.00 0.00 55.95 55.62 1iz5 s SER 37 Cb -0.13 0.05 0.05 0.00 0.10 0.00 0.00 66.02 66.09 1iz5 s SER 37 CO 0.02 -0.30 0.39 -0.32 0.98 0.00 0.00 173.24 174.01 1iz5 s MET 38 N -2.54 0.41 -0.02 4.02 0.00 -0.45 -0.11 119.30 120.61 1iz5 s MET 38 Ca 0.00 0.64 0.02 0.00 0.00 0.00 0.00 55.69 56.35 1iz5 s MET 38 Cb -0.04 0.10 0.00 0.00 0.00 0.00 0.00 34.83 34.89 1iz5 s MET 38 CO -0.01 -0.10 -0.08 0.50 0.00 0.00 0.00 175.02 175.32 1iz5 s ARG 39 N 0.75 0.82 0.12 4.11 6.06 -1.26 -0.81 118.95 128.73 1iz5 s ARG 39 Ca -0.04 -0.27 -0.25 0.00 -2.50 0.00 0.00 55.73 52.66 1iz5 s ARG 39 Cb -0.05 -0.78 0.07 0.00 0.06 0.00 0.00 34.95 34.25 1iz5 s ARG 39 CO -0.05 0.12 0.63 0.00 -2.50 0.00 0.00 175.30 173.49 1iz5 s ALA 40 N 0.11 -1.64 0.02 6.12 0.00 -0.25 -4.69 121.76 121.44 1iz5 s ALA 40 Ca -0.02 0.66 0.06 0.00 0.00 0.00 0.00 51.96 52.67 1iz5 s ALA 40 Cb -0.07 0.71 -0.03 0.00 0.00 0.00 0.00 23.12 23.73 1iz5 s ALA 40 CO 0.00 -0.70 -0.17 -1.64 0.00 0.00 0.00 175.76 173.26 1iz5 s MET 41 N -3.28 2.17 0.94 0.00 -1.94 -1.26 0.29 119.30 116.23 1iz5 s MET 41 Ca -0.01 -0.92 -0.12 0.00 -1.71 0.00 0.00 55.69 52.93 1iz5 s MET 41 Cb -0.01 -2.24 0.16 0.00 2.01 0.00 0.00 34.83 34.75 1iz5 s MET 41 CO -0.09 0.56 1.10 0.16 -0.01 0.00 0.00 175.02 176.74 1iz5 s ASP 42 N -1.31 3.11 0.41 3.03 -4.77 -0.71 -4.90 116.67 111.53 1iz5 s ASP 42 Ca 0.14 1.27 0.14 0.00 -3.30 0.00 0.00 52.55 50.80 1iz5 s ASP 42 Cb -0.11 -1.93 1.00 0.00 -1.09 0.00 0.00 42.92 40.79 1iz5 s ASP 42 CO 0.05 -2.84 1.91 -0.65 0.70 0.00 0.00 175.17 174.34 1iz5 h PRO 43 N -1.69 0.47 -0.00 2.11 0.11 -1.93 -2.16 132.00 128.90 1iz5 h PRO 43 Ca -0.52 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1iz5 h PRO 43 Cb 1.31 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1iz5 h PRO 43 CO 0.57 0.31 -0.20 -1.13 -0.21 0.00 0.00 178.00 177.35 1iz5 n SER 44 N -4.50 0.28 -1.67 -2.05 3.41 -1.26 -4.95 113.62 102.89 1iz5 n SER 44 Ca 0.15 -0.01 -0.12 0.00 -0.26 0.00 0.00 58.87 58.63 1iz5 n SER 44 Cb 0.51 -0.14 0.01 0.00 -0.26 0.00 0.00 64.21 64.33 1iz5 n SER 44 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1iz5 n ARG 45 N -1.37 -2.28 -0.03 4.33 3.00 -0.81 -4.93 116.66 114.57 1iz5 n ARG 45 Ca 0.08 0.52 0.00 0.00 -0.01 0.00 0.00 57.85 58.45 1iz5 n ARG 45 Cb 0.32 -4.57 -0.10 0.00 0.00 0.00 0.00 32.46 28.11 1iz5 n ARG 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1iz5 n VAL 46 N -3.96 0.40 -4.67 1.55 0.31 -1.26 -4.99 118.33 105.70 1iz5 n VAL 46 Ca -0.08 -0.40 -0.24 0.00 -0.01 0.00 0.00 64.34 63.61 1iz5 n VAL 46 Cb 0.58 -0.23 -0.16 0.00 -0.91 0.00 0.00 33.84 33.12 1iz5 n VAL 46 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1iz5 s VAL 47 N -2.60 1.18 -0.14 2.52 1.01 -1.26 -1.29 120.40 119.81 1iz5 s VAL 47 Ca -0.05 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1iz5 s VAL 47 Cb 0.06 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 1iz5 s VAL 47 CO 0.52 0.35 -0.01 -0.22 0.00 0.00 0.00 175.10 175.73 1iz5 s LEU 48 N -0.01 3.44 -0.12 3.92 2.96 -0.39 -1.74 118.68 126.75 1iz5 s LEU 48 Ca -0.01 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 53.89 1iz5 s LEU 48 Cb -0.09 -1.83 -0.01 0.00 0.50 0.00 0.00 46.19 44.76 1iz5 s LEU 48 CO 0.01 0.22 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.48 1iz5 s ILE 49 N 0.06 2.87 -0.04 6.68 1.01 0.15 -1.25 121.20 130.67 1iz5 s ILE 49 Ca 0.02 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.94 1iz5 s ILE 49 Cb -0.13 -2.18 0.02 0.00 0.01 0.00 0.00 42.46 40.18 1iz5 s ILE 49 CO 0.02 0.54 -0.04 -0.62 0.00 0.00 0.00 174.94 174.83 1iz5 s ASP 50 N 0.26 0.93 -0.08 3.58 2.15 0.25 -1.09 116.67 122.67 1iz5 s ASP 50 Ca -0.10 -0.12 0.03 0.00 0.43 0.00 0.00 52.55 52.78 1iz5 s ASP 50 Cb -0.16 -0.44 0.01 0.00 -0.30 0.00 0.00 42.92 42.03 1iz5 s ASP 50 CO 0.06 -0.06 -0.17 -0.22 -0.17 0.00 0.00 175.17 174.62 1iz5 s LEU 51 N 0.91 1.82 -0.14 -1.34 2.96 0.01 0.02 118.68 122.92 1iz5 s LEU 51 Ca -0.11 -0.40 -0.01 0.00 -0.22 0.00 0.00 54.13 53.39 1iz5 s LEU 51 Cb -0.14 -1.06 0.03 0.00 0.50 0.00 0.00 46.19 45.53 1iz5 s LEU 51 CO 0.00 0.08 -0.05 0.21 -1.32 0.00 0.00 176.35 175.27 1iz5 s ASN 52 N 0.56 2.48 -0.41 3.68 2.47 -0.06 -1.34 114.94 122.32 1iz5 s ASN 52 Ca -0.16 -0.48 0.04 0.00 0.42 0.00 0.00 52.86 52.67 1iz5 s ASN 52 Cb -0.17 -0.83 0.11 0.00 -1.45 0.00 0.00 41.25 38.92 1iz5 s ASN 52 CO 0.05 -0.17 0.14 -0.76 -3.72 0.00 0.00 177.10 172.65 1iz5 s LEU 53 N 1.70 4.40 0.68 3.21 1.43 0.51 -1.09 118.68 129.52 1iz5 s LEU 53 Ca 0.03 -2.49 -0.16 0.00 -1.03 0.00 0.00 54.13 50.47 1iz5 s LEU 53 Cb -0.14 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.51 1iz5 s LEU 53 CO -0.08 -0.32 1.20 -2.84 0.23 0.00 0.00 176.35 174.55 1iz5 s PRO 54 N 0.44 2.46 0.62 1.29 0.02 -1.26 -0.97 135.00 137.59 1iz5 s PRO 54 Ca 0.14 1.75 0.31 0.00 0.02 0.00 0.00 61.00 63.22 1iz5 s PRO 54 Cb -0.22 -1.87 1.75 0.00 0.02 0.00 0.00 34.50 34.18 1iz5 s PRO 54 CO -0.05 -1.59 2.09 0.66 -0.33 0.00 0.00 177.00 177.78 1iz5 h SER 55 N 0.10 0.00 0.13 2.53 4.64 -1.51 -2.13 113.55 117.32 1iz5 h SER 55 Ca -0.48 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.83 1iz5 h SER 55 Cb 1.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1iz5 h SER 55 CO 0.52 0.00 -0.05 0.77 -0.87 0.00 0.00 176.83 177.20 1iz5 h SER 56 N 0.00 0.00 0.07 4.97 4.64 -1.90 -2.48 113.55 118.84 1iz5 h SER 56 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1iz5 h SER 56 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1iz5 h SER 56 CO -0.00 0.05 -0.06 2.30 -0.87 0.00 0.00 176.83 178.24 1iz5 n ILE 57 N -3.80 0.00 -4.11 0.95 -5.35 -0.80 -4.87 119.36 101.38 1iz5 n ILE 57 Ca -0.03 -0.19 -0.34 0.00 -0.27 0.00 0.00 62.75 61.93 1iz5 n ILE 57 Cb 0.14 0.35 -0.07 0.00 -1.74 0.00 0.00 39.64 38.32 1iz5 n ILE 57 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1iz5 s PHE 58 N -2.14 3.32 -0.02 4.28 0.40 -0.94 -4.73 117.98 118.15 1iz5 s PHE 58 Ca 0.35 0.25 0.23 0.00 -0.60 0.00 0.00 56.93 57.17 1iz5 s PHE 58 Cb 0.21 -1.78 0.71 0.00 0.51 0.00 0.00 43.02 42.67 1iz5 s PHE 58 CO 0.39 0.57 1.73 0.66 0.70 0.00 0.00 175.22 179.27 1iz5 h SER 59 N 4.38 0.00 -3.32 1.36 4.64 -1.38 -3.43 113.55 115.80 1iz5 h SER 59 Ca -0.50 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.63 1iz5 h SER 59 Cb 1.19 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.98 1iz5 h SER 59 CO 0.61 0.22 -0.47 -0.75 -0.87 0.00 0.00 176.83 175.57 1iz5 s LYS 60 N -3.44 0.22 -0.31 4.77 2.20 -1.22 -4.99 119.74 116.97 1iz5 s LYS 60 Ca 0.02 0.56 -0.02 0.00 -0.36 0.00 0.00 55.97 56.17 1iz5 s LYS 60 Cb 0.09 -0.11 0.12 0.00 -1.51 0.00 0.00 37.83 36.42 1iz5 s LYS 60 CO 0.65 -0.17 0.20 -0.47 -0.36 0.00 0.00 175.35 175.21 1iz5 s TYR 61 N 1.31 0.23 -0.25 4.03 5.04 -1.26 -0.93 117.35 125.52 1iz5 s TYR 61 Ca -0.09 -0.94 0.02 0.00 -2.44 0.00 0.00 57.07 53.62 1iz5 s TYR 61 Cb -0.10 -0.78 0.06 0.00 0.35 0.00 0.00 41.96 41.48 1iz5 s TYR 61 CO -0.09 -0.86 -0.10 -1.21 -1.34 0.00 0.00 175.55 171.96 1iz5 s GLU 62 N 1.83 2.08 -0.33 4.97 2.02 -0.57 -5.02 118.70 123.67 1iz5 s GLU 62 Ca 0.12 -1.23 -0.01 0.00 0.02 0.00 0.00 54.97 53.87 1iz5 s GLU 62 Cb -0.17 -2.79 0.07 0.00 0.10 0.00 0.00 34.13 31.34 1iz5 s GLU 62 CO -0.24 -0.57 0.05 0.08 0.02 0.00 0.00 175.26 174.60 1iz5 s VAL 63 N 1.19 2.86 0.01 2.63 1.01 -1.26 -0.98 120.40 125.86 1iz5 s VAL 63 Ca -0.08 -1.74 -0.25 0.00 0.00 0.00 0.00 61.98 59.91 1iz5 s VAL 63 Cb -0.20 -2.80 -0.16 0.00 0.00 0.00 0.00 36.38 33.22 1iz5 s VAL 63 CO -0.05 -0.33 1.24 0.58 0.00 0.00 0.00 175.10 176.54 1iz5 h VAL 64 N 6.50 0.67 -3.52 2.92 2.07 -1.61 -3.45 116.25 119.84 1iz5 h VAL 64 Ca -0.16 -0.57 -0.31 0.00 0.82 0.00 0.00 66.70 66.47 1iz5 h VAL 64 Cb 1.05 0.96 -0.34 0.00 -1.52 0.00 0.00 31.29 31.44 1iz5 h VAL 64 CO 0.56 0.11 -0.74 -1.61 0.02 0.00 0.00 177.57 175.92 1iz5 s GLU 65 N -4.70 0.09 0.70 1.57 0.41 -1.18 -4.93 118.70 110.64 1iz5 s GLU 65 Ca -0.14 0.14 -0.16 0.00 -0.41 0.00 0.00 54.97 54.39 1iz5 s GLU 65 Cb 0.02 -0.33 -0.01 0.00 -1.78 0.00 0.00 34.13 32.04 1iz5 s GLU 65 CO 0.54 -0.15 0.94 -0.35 -0.49 0.00 0.00 175.26 175.75 1iz5 n PRO 66 N 4.13 0.57 -3.59 0.39 -0.04 -1.26 -3.03 135.00 132.17 1iz5 n PRO 66 Ca -0.27 0.25 -0.11 0.00 -0.04 0.00 0.00 63.50 63.33 1iz5 n PRO 66 Cb 0.50 -2.19 -0.04 0.00 -0.04 0.00 0.00 33.50 31.74 1iz5 n PRO 66 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1iz5 s GLU 67 N -3.18 1.15 -0.26 0.54 2.02 -0.52 -4.80 118.70 113.65 1iz5 s GLU 67 Ca 0.74 -0.67 0.01 0.00 0.02 0.00 0.00 54.97 55.07 1iz5 s GLU 67 Cb -0.36 0.50 0.07 0.00 0.10 0.00 0.00 34.13 34.45 1iz5 s GLU 67 CO 0.50 -0.47 -0.02 -0.08 0.02 0.00 0.00 175.26 175.21 1iz5 s THR 68 N -3.80 1.62 -0.24 3.63 -1.32 -1.26 0.55 115.64 114.83 1iz5 s THR 68 Ca 0.03 -1.46 -0.08 0.00 -1.21 0.00 0.00 61.69 58.98 1iz5 s THR 68 Cb 0.01 -1.96 -0.04 0.00 -1.51 0.00 0.00 72.50 69.00 1iz5 s THR 68 CO -0.11 -0.25 0.09 0.27 -2.21 0.00 0.00 174.62 172.41 1iz5 s ILE 69 N 1.32 4.59 -0.04 5.08 -4.36 -0.07 -4.88 121.20 122.83 1iz5 s ILE 69 Ca -0.01 -0.08 -0.15 0.00 -0.26 0.00 0.00 60.65 60.14 1iz5 s ILE 69 Cb -0.19 -3.13 -0.05 0.00 1.25 0.00 0.00 42.46 40.34 1iz5 s ILE 69 CO -0.09 0.36 0.41 -0.83 0.24 0.00 0.00 174.94 175.03 1iz5 s GLY 70 N 1.31 2.43 0.05 6.27 0.00 -1.21 -1.10 107.32 115.07 1iz5 s GLY 70 Ca 0.05 -0.24 -0.07 0.00 0.00 0.00 0.00 44.72 44.46 1iz5 s GLY 70 CO 0.04 0.31 0.13 -1.34 0.00 0.00 0.00 173.10 172.24 1iz5 s VAL 71 N -0.55 0.14 -0.25 1.40 -7.23 -0.88 -0.73 120.40 112.30 1iz5 s VAL 71 Ca 0.23 -1.13 -0.23 0.00 -1.81 0.00 0.00 61.98 59.04 1iz5 s VAL 71 Cb -0.16 -1.07 -0.01 0.00 0.56 0.00 0.00 36.38 35.71 1iz5 s VAL 71 CO 0.12 -0.62 0.77 0.21 -0.31 0.00 0.00 175.10 175.27 1iz5 s ASN 72 N -2.37 6.75 0.31 4.85 3.84 -1.26 -2.43 114.94 124.62 1iz5 s ASN 72 Ca -0.01 0.90 0.00 0.00 0.21 0.00 0.00 52.86 53.96 1iz5 s ASN 72 Cb 0.01 -2.41 0.49 0.00 -0.55 0.00 0.00 41.25 38.79 1iz5 s ASN 72 CO -0.06 -0.49 1.89 -0.07 -2.79 0.00 0.00 177.10 175.57 1iz5 h LEU 73 N 9.16 0.75 -0.75 3.21 3.38 -1.67 -2.17 115.31 127.21 1iz5 h LEU 73 Ca -0.24 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.64 1iz5 h LEU 73 Cb 1.10 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.62 1iz5 h LEU 73 CO 0.85 0.67 0.49 0.44 0.09 0.00 0.00 178.44 180.98 1iz5 h ASP 74 N 0.81 0.87 -0.16 -0.43 3.45 -1.92 0.30 116.42 119.35 1iz5 h ASP 74 Ca 0.19 -0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.61 1iz5 h ASP 74 Cb 0.15 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 38.70 1iz5 h ASP 74 CO -0.02 0.64 0.03 -0.74 -1.57 0.00 0.00 179.24 177.58 1iz5 h HIS 75 N 1.02 0.27 -0.32 4.55 2.76 -1.87 -1.77 115.15 119.81 1iz5 h HIS 75 Ca 0.28 -0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.42 1iz5 h HIS 75 Cb -0.11 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 28.76 1iz5 h HIS 75 CO -0.02 0.41 0.19 1.25 -1.30 0.00 0.00 177.93 178.47 1iz5 h LEU 76 N 0.05 0.32 -1.75 0.26 5.85 -0.97 -2.44 115.31 116.64 1iz5 h LEU 76 Ca 0.05 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 1iz5 h LEU 76 Cb 0.28 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 1iz5 h LEU 76 CO 0.00 0.24 -0.16 0.11 -0.34 0.00 0.00 178.44 178.29 1iz5 h LYS 77 N 0.40 0.00 -0.51 1.25 1.57 -0.33 -0.92 116.57 118.03 1iz5 h LYS 77 Ca 0.12 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1iz5 h LYS 77 Cb -0.02 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1iz5 h LYS 77 CO -0.05 0.16 0.09 -0.22 -0.57 0.00 0.00 179.45 178.87 1iz5 h LYS 78 N 0.00 0.80 0.01 3.15 3.64 -0.82 -1.13 116.57 122.22 1iz5 h LYS 78 Ca -0.00 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1iz5 h LYS 78 Cb 0.32 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1iz5 h LYS 78 CO 0.02 0.74 -0.01 0.82 -2.27 0.00 0.00 179.45 178.76 1iz5 h ILE 79 N 0.76 1.53 -0.02 2.00 2.04 -1.27 -3.31 117.51 119.24 1iz5 h ILE 79 Ca 0.16 -1.99 0.01 0.00 1.00 0.00 0.00 64.86 64.04 1iz5 h ILE 79 Cb 0.33 2.82 -0.00 0.00 -0.74 0.00 0.00 36.82 39.22 1iz5 h ILE 79 CO 0.00 0.49 0.02 -0.07 0.00 0.00 0.00 178.15 178.60 1iz5 h LEU 80 N -0.92 0.00 -2.43 1.44 3.38 -1.17 -1.84 115.31 113.77 1iz5 h LEU 80 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1iz5 h LEU 80 Cb 0.81 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1iz5 h LEU 80 CO 0.00 0.00 -0.03 0.50 0.09 0.00 0.00 178.44 179.00 1iz5 h LYS 81 N 0.00 0.00 0.00 1.13 3.64 -1.29 -2.11 116.57 117.94 1iz5 h LYS 81 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1iz5 h LYS 81 Cb 0.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1iz5 h LYS 81 CO -0.00 0.03 0.00 0.00 -2.27 0.00 0.00 179.45 177.21 1iz5 h ARG 82 N 0.00 0.00 -6.86 1.90 3.08 -1.50 -3.46 114.38 107.53 1iz5 h ARG 82 Ca -0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 1iz5 h ARG 82 Cb 0.10 0.00 0.08 0.00 0.08 0.00 0.00 29.97 30.23 1iz5 h ARG 82 CO 0.00 0.00 0.71 0.20 -1.07 0.00 0.00 179.97 179.82 1iz5 s GLY 83 N -4.00 2.79 0.35 0.04 0.00 -0.80 -5.03 107.32 100.68 1iz5 s GLY 83 Ca 0.06 1.38 0.07 0.00 0.00 0.00 0.00 44.72 46.22 1iz5 s GLY 83 CO 0.59 2.12 0.48 0.54 0.00 0.00 0.00 173.10 176.83 1iz5 s LYS 84 N -1.50 3.06 0.21 2.90 1.02 -1.26 -4.26 119.74 119.91 1iz5 s LYS 84 Ca 0.53 -1.06 -0.16 0.00 0.02 0.00 0.00 55.97 55.30 1iz5 s LYS 84 Cb -0.42 -2.80 0.21 0.00 -0.52 0.00 0.00 37.83 34.30 1iz5 s LYS 84 CO 0.53 0.01 1.61 0.00 -0.92 0.00 0.00 175.35 176.58 1iz5 h ALA 85 N 0.86 0.27 -0.32 5.17 0.00 -1.95 -2.08 119.26 121.20 1iz5 h ALA 85 Ca -0.45 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1iz5 h ALA 85 Cb 1.26 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1iz5 h ALA 85 CO 0.51 -0.51 0.00 1.63 0.00 0.00 0.00 179.25 180.88 1iz5 n LYS 86 N -5.45 2.08 -1.96 0.00 5.02 -1.26 -4.25 118.16 112.34 1iz5 n LYS 86 Ca 0.07 -1.64 -0.34 0.00 -2.02 0.00 0.00 58.31 54.37 1iz5 n LYS 86 Cb 0.35 -1.43 0.03 0.00 -0.02 0.00 0.00 35.03 33.96 1iz5 n LYS 86 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1iz5 s ASP 87 N -1.39 5.30 -0.16 4.39 1.01 -0.80 -4.69 116.67 120.33 1iz5 s ASP 87 Ca 0.34 2.13 -0.09 0.00 0.71 0.00 0.00 52.55 55.65 1iz5 s ASP 87 Cb 0.19 -2.57 -0.05 0.00 1.01 0.00 0.00 42.92 41.50 1iz5 s ASP 87 CO 0.27 -1.50 0.13 -0.89 0.21 0.00 0.00 175.17 173.39 1iz5 s THR 88 N -2.01 5.43 -0.20 -1.27 2.01 -0.17 -0.91 115.64 118.51 1iz5 s THR 88 Ca 0.71 0.19 -0.06 0.00 0.31 0.00 0.00 61.69 62.83 1iz5 s THR 88 Cb -0.23 -3.43 -0.03 0.00 0.01 0.00 0.00 72.50 68.82 1iz5 s THR 88 CO 0.35 0.52 0.03 -0.22 -0.69 0.00 0.00 174.62 174.61 1iz5 s LEU 89 N -0.24 3.49 -0.21 4.42 2.96 0.05 -1.09 118.68 128.07 1iz5 s LEU 89 Ca 0.11 -0.09 -0.01 0.00 -0.22 0.00 0.00 54.13 53.91 1iz5 s LEU 89 Cb -0.11 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 44.69 1iz5 s LEU 89 CO 0.01 0.09 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.39 1iz5 s ILE 90 N 0.83 2.73 -0.22 6.68 1.01 0.30 -0.77 121.20 131.77 1iz5 s ILE 90 Ca 0.02 -0.76 -0.05 0.00 0.00 0.00 0.00 60.65 59.86 1iz5 s ILE 90 Cb -0.14 -2.23 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 1iz5 s ILE 90 CO 0.02 0.45 -0.00 -0.76 0.00 0.00 0.00 174.94 174.64 1iz5 s LEU 91 N 1.38 3.14 0.03 2.97 1.43 0.11 -1.05 118.68 126.68 1iz5 s LEU 91 Ca 0.05 -0.28 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 1iz5 s LEU 91 Cb -0.14 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.26 1iz5 s LEU 91 CO -0.08 0.01 -0.12 -0.54 0.23 0.00 0.00 176.35 175.85 1iz5 s LYS 92 N 1.31 0.87 -0.04 1.70 1.02 -0.20 -0.32 119.74 124.08 1iz5 s LYS 92 Ca 0.04 -0.64 -0.01 0.00 0.02 0.00 0.00 55.97 55.38 1iz5 s LYS 92 Cb -0.15 -0.84 0.03 0.00 -0.52 0.00 0.00 37.83 36.35 1iz5 s LYS 92 CO 0.00 0.21 0.03 0.21 -0.92 0.00 0.00 175.35 174.89 1iz5 s LYS 93 N -0.91 0.12 0.00 1.68 2.36 -0.71 -0.87 119.74 121.41 1iz5 s LYS 93 Ca 0.01 0.24 0.00 0.00 -2.55 0.00 0.00 55.97 53.67 1iz5 s LYS 93 Cb -0.07 -0.53 0.00 0.00 -1.05 0.00 0.00 37.83 36.19 1iz5 s LYS 93 CO 0.01 -0.25 0.00 0.41 1.55 0.00 0.00 175.35 177.06 1iz5 n GLY 94 N 4.81 3.15 0.08 5.54 0.00 -1.26 -2.03 105.19 115.48 1iz5 n GLY 94 Ca -0.13 -1.71 -0.11 0.00 0.00 0.00 0.00 46.02 44.07 1iz5 n GLY 94 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1iz5 h GLU 95 N 0.00 0.08 -7.16 1.61 5.08 -2.00 -3.42 114.58 108.77 1iz5 h GLU 95 Ca 0.00 -0.14 -0.53 0.00 -1.00 0.00 0.00 59.36 57.69 1iz5 h GLU 95 Cb 0.00 0.05 0.15 0.00 0.50 0.00 0.00 28.75 29.45 1iz5 h GLU 95 CO 0.00 0.88 0.41 -1.21 -1.00 0.00 0.00 179.01 178.09 1iz5 s GLU 96 N -2.64 2.35 -0.48 2.33 2.02 -1.26 -4.88 118.70 116.14 1iz5 s GLU 96 Ca -0.04 1.76 -0.07 0.00 0.02 0.00 0.00 54.97 56.64 1iz5 s GLU 96 Cb 0.08 -1.86 -0.21 0.00 0.10 0.00 0.00 34.13 32.24 1iz5 s GLU 96 CO 0.83 -1.67 3.36 -1.71 0.02 0.00 0.00 175.26 176.09 1iz5 n ASN 97 N -2.46 6.14 -3.66 -0.19 5.15 -1.26 -4.84 115.26 114.14 1iz5 n ASN 97 Ca 0.13 -2.48 -0.12 0.00 -0.60 0.00 0.00 54.58 51.51 1iz5 n ASN 97 Cb 0.50 -1.43 -0.06 0.00 -0.53 0.00 0.00 39.78 38.27 1iz5 n ASN 97 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 1iz5 s PHE 98 N 1.41 -0.23 -0.23 1.20 -0.12 -1.26 -2.83 117.98 115.91 1iz5 s PHE 98 Ca 0.66 0.09 -0.10 0.00 -0.05 0.00 0.00 56.93 57.53 1iz5 s PHE 98 Cb 0.27 0.23 -0.05 0.00 -0.63 0.00 0.00 43.02 42.84 1iz5 s PHE 98 CO -0.02 -0.62 0.14 -1.17 -0.05 0.00 0.00 175.22 173.50 1iz5 s LEU 99 N -2.30 4.00 -0.27 -1.99 2.96 0.55 -4.57 118.68 117.06 1iz5 s LEU 99 Ca -0.02 0.08 -0.15 0.00 -0.22 0.00 0.00 54.13 53.81 1iz5 s LEU 99 Cb 0.00 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 1iz5 s LEU 99 CO -0.06 0.07 0.37 -0.70 -1.32 0.00 0.00 176.35 174.72 1iz5 s GLU 100 N 1.01 4.03 -0.17 1.98 2.12 -0.05 -0.45 118.70 127.17 1iz5 s GLU 100 Ca 0.07 0.05 -0.01 0.00 0.36 0.00 0.00 54.97 55.44 1iz5 s GLU 100 Cb -0.13 -3.65 -0.00 0.00 0.26 0.00 0.00 34.13 30.60 1iz5 s GLU 100 CO 0.04 -0.26 -0.13 0.42 -0.54 0.00 0.00 175.26 174.78 1iz5 s ILE 101 N 2.03 2.79 -0.11 -3.70 1.01 0.36 -1.03 121.20 122.56 1iz5 s ILE 101 Ca 0.15 -0.72 0.03 0.00 0.00 0.00 0.00 60.65 60.12 1iz5 s ILE 101 Cb -0.16 -2.20 -0.00 0.00 0.01 0.00 0.00 42.46 40.11 1iz5 s ILE 101 CO 0.10 0.50 -0.22 -0.89 0.00 0.00 0.00 174.94 174.43 1iz5 s THR 102 N 0.97 2.26 -0.25 2.92 2.01 -0.22 0.47 115.64 123.80 1iz5 s THR 102 Ca -0.02 -0.95 -0.05 0.00 0.31 0.00 0.00 61.69 60.98 1iz5 s THR 102 Cb -0.15 -1.88 -0.01 0.00 0.01 0.00 0.00 72.50 70.48 1iz5 s THR 102 CO -0.02 0.55 0.02 -0.63 -0.69 0.00 0.00 174.62 173.85 1iz5 s ILE 103 N 0.34 3.74 -0.26 1.82 1.01 0.24 -0.54 121.20 127.56 1iz5 s ILE 103 Ca -0.17 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 59.99 1iz5 s ILE 103 Cb -0.18 -2.79 0.04 0.00 0.01 0.00 0.00 42.46 39.55 1iz5 s ILE 103 CO 0.08 0.30 -0.08 -1.58 0.00 0.00 0.00 174.94 173.66 1iz5 s GLN 104 N 1.51 2.51 0.00 2.79 0.74 -0.25 -1.29 119.66 125.67 1iz5 s GLN 104 Ca 0.05 -1.18 0.00 0.00 0.05 0.00 0.00 55.36 54.28 1iz5 s GLN 104 Cb -0.15 -2.95 0.00 0.00 1.10 0.00 0.00 33.01 31.00 1iz5 s GLN 104 CO -0.00 -0.50 0.00 0.41 -0.55 0.00 0.00 175.29 174.65 1iz5 n GLY 105 N 4.56 3.40 0.00 2.59 0.00 -1.26 -1.00 105.19 113.48 1iz5 n GLY 105 Ca -0.15 -0.43 0.13 0.00 0.00 0.00 0.00 46.02 45.56 1iz5 n GLY 105 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iz5 n THR 106 N 0.00 0.17 -3.57 2.61 -2.24 -1.26 -4.76 114.28 105.23 1iz5 n THR 106 Ca 0.00 0.04 -0.15 0.00 -2.27 0.00 0.00 64.05 61.67 1iz5 n THR 106 Cb 0.00 -0.59 -0.06 0.00 -2.10 0.00 0.00 70.33 67.58 1iz5 n THR 106 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iz5 s ALA 107 N -2.86 -1.42 -0.23 6.98 0.00 -1.26 -5.15 121.76 117.81 1iz5 s ALA 107 Ca 0.17 0.78 -0.07 0.00 0.00 0.00 0.00 51.96 52.83 1iz5 s ALA 107 Cb 0.17 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.53 1iz5 s ALA 107 CO 0.46 -0.46 0.07 0.95 0.00 0.00 0.00 175.76 176.78 1iz5 s THR 108 N -2.05 4.43 -0.06 0.00 -4.23 -1.26 -4.32 115.64 108.15 1iz5 s THR 108 Ca -0.07 -0.14 0.04 0.00 -1.18 0.00 0.00 61.69 60.33 1iz5 s THR 108 Cb -0.01 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.78 1iz5 s THR 108 CO 0.02 0.36 -0.17 -0.13 -0.54 0.00 0.00 174.62 174.16 1iz5 s ARG 109 N 1.33 2.01 -0.02 3.99 1.81 -0.41 -4.99 118.95 122.67 1iz5 s ARG 109 Ca 0.05 -0.60 0.05 0.00 -1.72 0.00 0.00 55.73 53.51 1iz5 s ARG 109 Cb -0.15 -1.65 -0.03 0.00 -0.45 0.00 0.00 34.95 32.67 1iz5 s ARG 109 CO 0.04 0.16 -0.16 0.99 -0.68 0.00 0.00 175.30 175.64 1iz5 s THR 110 N 0.32 2.90 0.13 0.02 2.01 -1.26 -0.59 115.64 119.17 1iz5 s THR 110 Ca -0.11 -0.88 0.02 0.00 0.31 0.00 0.00 61.69 61.03 1iz5 s THR 110 Cb -0.14 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 1iz5 s THR 110 CO 0.04 0.52 -0.05 -0.36 -0.69 0.00 0.00 174.62 174.08 1iz5 s PHE 111 N -0.78 1.08 -0.05 4.92 0.40 0.18 -4.99 117.98 118.75 1iz5 s PHE 111 Ca 0.12 -0.91 0.05 0.00 -0.60 0.00 0.00 56.93 55.59 1iz5 s PHE 111 Cb -0.11 -0.60 -0.00 0.00 0.51 0.00 0.00 43.02 42.82 1iz5 s PHE 111 CO 0.02 -0.11 -0.19 1.03 0.70 0.00 0.00 175.22 176.67 1iz5 s ARG 112 N -3.84 2.00 -0.22 0.44 0.52 -1.26 -0.48 118.95 116.11 1iz5 s ARG 112 Ca 0.17 -0.68 -0.00 0.00 -0.52 0.00 0.00 55.73 54.69 1iz5 s ARG 112 Cb 0.05 -1.71 0.03 0.00 0.52 0.00 0.00 34.95 33.83 1iz5 s ARG 112 CO -0.01 0.27 -0.12 0.08 0.02 0.00 0.00 175.30 175.54 1iz5 s VAL 113 N 0.02 2.54 0.42 3.52 1.01 0.40 -4.95 120.40 123.36 1iz5 s VAL 113 Ca -0.05 -1.03 -0.25 0.00 0.00 0.00 0.00 61.98 60.65 1iz5 s VAL 113 Cb -0.12 -2.23 -0.08 0.00 0.00 0.00 0.00 36.38 33.95 1iz5 s VAL 113 CO 0.03 0.31 1.27 -2.16 0.00 0.00 0.00 175.10 174.55 1iz5 s PRO 114 N 1.30 3.92 0.15 2.72 0.04 -1.26 -0.33 135.00 141.53 1iz5 s PRO 114 Ca 0.01 2.07 -0.11 0.00 0.04 0.00 0.00 61.00 63.02 1iz5 s PRO 114 Cb -0.16 -2.69 -0.07 0.00 0.04 0.00 0.00 34.50 31.63 1iz5 s PRO 114 CO -0.07 -0.51 0.49 -0.51 0.04 0.00 0.00 177.00 176.44 1iz5 s LEU 115 N -2.55 4.29 0.32 -3.56 1.43 -1.13 -4.72 118.68 112.76 1iz5 s LEU 115 Ca 0.58 0.91 0.03 0.00 -1.03 0.00 0.00 54.13 54.63 1iz5 s LEU 115 Cb -0.36 -3.31 -0.06 0.00 0.03 0.00 0.00 46.19 42.49 1iz5 s LEU 115 CO 0.46 0.07 0.07 0.27 0.23 0.00 0.00 176.35 177.45 1iz5 s ILE 116 N -1.56 0.99 0.00 -0.59 -4.36 0.10 -4.99 121.20 110.79 1iz5 s ILE 116 Ca 0.39 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.78 1iz5 s ILE 116 Cb -0.13 -2.72 0.00 0.00 1.25 0.00 0.00 42.46 40.86 1iz5 s ILE 116 CO 0.20 0.00 0.00 0.47 0.24 0.00 0.00 174.94 175.85 1iz5 n ASP 117 N -0.71 0.00 -2.03 4.36 8.00 -1.26 -3.32 116.55 121.59 1iz5 n ASP 117 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1iz5 n ASP 117 Cb 0.66 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.76 1iz5 n ASP 117 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1iz5 n VAL 118 N -0.16-12.96 -1.21 2.53 0.31 -1.26 -4.70 118.33 100.88 1iz5 n VAL 118 Ca 0.00 3.20 -0.31 0.00 -0.01 0.00 0.00 64.34 67.22 1iz5 n VAL 118 Cb 0.00 -5.48 0.10 0.00 -0.91 0.00 0.00 33.84 27.55 1iz5 n VAL 118 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 1iz5 s GLU 119 N -0.77 2.14 0.00 5.55 2.56 -1.26 -4.92 118.70 122.00 1iz5 s GLU 119 Ca 0.00 1.19 0.00 0.00 0.00 0.00 0.00 54.97 56.16 1iz5 s GLU 119 Cb 0.00 -1.88 0.00 0.00 2.00 0.00 0.00 34.13 34.25 1iz5 s GLU 119 CO 0.00 -1.74 0.00 0.39 -0.56 0.00 0.00 175.26 173.35 1iz5 n GLU 120 N -3.59 2.03 0.00 4.30 1.02 -1.26 -5.02 120.64 118.12 1iz5 n GLU 120 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1iz5 n GLU 120 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.95 1iz5 n GLU 120 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1iz5 n PRO 126 N -0.42 0.00 -2.04 3.49 -0.04 -1.26 -5.18 135.00 129.56 1iz5 n PRO 126 Ca 0.00 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.07 1iz5 n PRO 126 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1iz5 n PRO 126 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1iz5 s GLU 127 N -4.66 3.83 -0.62 0.54 2.56 -1.26 -4.99 118.70 114.11 1iz5 s GLU 127 Ca 0.00 2.13 0.05 0.00 0.00 0.00 0.00 54.97 57.14 1iz5 s GLU 127 Cb 0.00 -2.65 0.16 0.00 2.00 0.00 0.00 34.13 33.64 1iz5 s GLU 127 CO 0.00 -0.59 0.43 -0.48 -0.56 0.00 0.00 175.26 174.06 1iz5 s LEU 128 N -2.64 3.95 -1.27 2.70 0.05 -1.26 -5.04 118.68 115.18 1iz5 s LEU 128 Ca 0.60 -3.56 -0.19 0.00 0.05 0.00 0.00 54.13 51.02 1iz5 s LEU 128 Cb -0.37 -1.35 0.02 0.00 -2.05 0.00 0.00 46.19 42.44 1iz5 s LEU 128 CO 0.47 -0.12 1.83 -0.81 -0.55 0.00 0.00 176.35 177.17 1iz5 n PRO 129 N 2.32 2.72 -2.06 1.48 -0.04 -1.26 -4.97 135.00 133.19 1iz5 n PRO 129 Ca 0.20 -2.98 -0.37 0.00 -0.04 0.00 0.00 63.50 60.31 1iz5 n PRO 129 Cb 0.37 -3.53 0.02 0.00 -0.04 0.00 0.00 33.50 30.32 1iz5 n PRO 129 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1iz5 s PHE 130 N 5.95 2.57 0.00 0.54 2.99 -1.26 -4.82 117.98 123.94 1iz5 s PHE 130 Ca 0.57 1.48 0.00 0.00 0.00 0.00 0.00 56.93 58.99 1iz5 s PHE 130 Cb 0.04 -3.52 0.00 0.00 0.00 0.00 0.00 43.02 39.54 1iz5 s PHE 130 CO 0.08 -2.10 0.30 0.25 -0.00 0.00 0.00 175.22 173.75 1iz5 n THR 131 N -0.98 0.00 -3.84 0.64 -2.24 -0.29 -4.97 114.28 102.60 1iz5 n THR 131 Ca 0.10 -0.49 -0.12 0.00 -2.27 0.00 0.00 64.05 61.27 1iz5 n THR 131 Cb 0.48 1.02 -0.13 0.00 -2.10 0.00 0.00 70.33 69.60 1iz5 n THR 131 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iz5 s ALA 132 N -0.38 -0.25 -0.04 6.98 0.00 -0.96 -1.00 121.76 126.11 1iz5 s ALA 132 Ca 0.00 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.21 1iz5 s ALA 132 Cb 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.00 1iz5 s ALA 132 CO 0.00 -0.06 -0.05 0.21 0.00 0.00 0.00 175.76 175.86 1iz5 s LYS 133 N -0.06 0.88 -0.01 0.00 2.20 0.09 -1.80 119.74 121.04 1iz5 s LYS 133 Ca -0.01 -0.13 0.01 0.00 -0.36 0.00 0.00 55.97 55.49 1iz5 s LYS 133 Cb -0.01 -0.87 -0.00 0.00 -1.51 0.00 0.00 37.83 35.44 1iz5 s LYS 133 CO 0.00 -0.07 -0.05 0.54 -0.36 0.00 0.00 175.35 175.41 1iz5 s VAL 134 N 0.88 0.40 -0.16 4.02 0.11 0.40 -0.90 120.40 125.16 1iz5 s VAL 134 Ca -0.12 -0.19 0.00 0.00 -2.93 0.00 0.00 61.98 58.74 1iz5 s VAL 134 Cb -0.14 -0.35 -0.00 0.00 -1.53 0.00 0.00 36.38 34.36 1iz5 s VAL 134 CO 0.00 0.12 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.05 1iz5 s VAL 135 N 0.01 2.61 0.13 2.04 1.01 -0.07 -0.20 120.40 125.93 1iz5 s VAL 135 Ca 0.00 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.17 1iz5 s VAL 135 Cb -0.03 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 1iz5 s VAL 135 CO -0.00 0.52 0.08 0.68 0.00 0.00 0.00 175.10 176.38 1iz5 s VAL 136 N 0.84 0.10 0.34 2.92 -7.23 -0.48 -0.27 120.40 116.62 1iz5 s VAL 136 Ca -0.05 -1.83 -0.24 0.00 -1.81 0.00 0.00 61.98 58.05 1iz5 s VAL 136 Cb -0.15 -1.99 -0.10 0.00 0.56 0.00 0.00 36.38 34.70 1iz5 s VAL 136 CO -0.01 -0.47 0.92 -0.76 -0.31 0.00 0.00 175.10 174.48 1iz5 s LEU 137 N -3.03 4.22 0.40 1.32 1.02 -1.26 -0.51 118.68 120.84 1iz5 s LEU 137 Ca 0.22 1.75 0.17 0.00 0.02 0.00 0.00 54.13 56.29 1iz5 s LEU 137 Cb 0.07 -4.13 1.06 0.00 0.02 0.00 0.00 46.19 43.21 1iz5 s LEU 137 CO 0.01 -0.14 1.81 1.23 0.02 0.00 0.00 176.35 179.27 1iz5 h GLY 138 N 2.82 1.12 0.27 -3.19 0.00 -0.75 -0.49 103.07 102.85 1iz5 h GLY 138 Ca -0.47 -0.21 0.16 0.00 0.00 0.00 0.00 47.33 46.80 1iz5 h GLY 138 CO 0.64 -0.07 0.62 -2.09 0.00 0.00 0.00 176.54 175.64 1iz5 h GLU 139 N 0.44 0.84 0.37 4.80 4.81 -1.57 0.23 114.58 124.50 1iz5 h GLU 139 Ca 0.54 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.70 1iz5 h GLU 139 Cb 1.31 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1iz5 h GLU 139 CO -0.25 0.56 -0.18 0.28 -0.73 0.00 0.00 179.01 178.69 1iz5 h VAL 140 N 0.87 0.64 -0.48 0.32 2.07 -1.38 -1.20 116.25 117.09 1iz5 h VAL 140 Ca 0.55 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 68.00 1iz5 h VAL 140 Cb 0.73 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1iz5 h VAL 140 CO -0.33 0.01 0.14 -0.07 0.02 0.00 0.00 177.57 177.33 1iz5 h LEU 141 N -0.51 0.71 -0.35 2.57 4.07 -1.45 0.26 115.31 120.62 1iz5 h LEU 141 Ca -0.05 -0.21 0.02 0.00 0.08 0.00 0.00 57.88 57.72 1iz5 h LEU 141 Cb 0.39 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 41.91 1iz5 h LEU 141 CO 0.08 0.73 0.17 0.11 -1.08 0.00 0.00 178.44 178.46 1iz5 h LYS 142 N 0.64 0.34 -0.42 1.13 1.57 -0.92 -0.62 116.57 118.30 1iz5 h LYS 142 Ca 0.15 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 1iz5 h LYS 142 Cb 0.29 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1iz5 h LYS 142 CO -0.00 0.23 -0.16 0.00 -0.57 0.00 0.00 179.45 178.94 1iz5 h ALA 143 N 1.18 0.58 -0.48 3.86 0.00 -1.11 -2.85 119.26 120.44 1iz5 h ALA 143 Ca 0.14 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1iz5 h ALA 143 Cb 0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1iz5 h ALA 143 CO -0.10 0.51 0.26 0.00 0.00 0.00 0.00 179.25 179.91 1iz5 h ALA 144 N 0.83 0.62 -0.48 0.00 0.00 -0.62 -1.93 119.26 117.68 1iz5 h ALA 144 Ca 0.10 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1iz5 h ALA 144 Cb 0.71 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1iz5 h ALA 144 CO 0.05 0.15 0.17 0.28 0.00 0.00 0.00 179.25 179.90 1iz5 h VAL 145 N 0.63 1.22 -0.63 0.00 2.07 -1.14 -0.76 116.25 117.65 1iz5 h VAL 145 Ca 0.17 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1iz5 h VAL 145 Cb 0.07 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1iz5 h VAL 145 CO -0.03 0.26 0.36 0.11 0.02 0.00 0.00 177.57 178.30 1iz5 h LYS 146 N 0.63 0.86 -0.43 1.57 1.57 -1.35 -1.35 116.57 118.07 1iz5 h LYS 146 Ca 0.16 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1iz5 h LYS 146 Cb 0.24 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1iz5 h LYS 146 CO -0.01 0.63 0.06 0.00 -0.57 0.00 0.00 179.45 179.56 1iz5 h ALA 147 N 1.18 0.58 -0.76 3.86 0.00 -1.16 -3.00 119.26 119.96 1iz5 h ALA 147 Ca 0.22 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1iz5 h ALA 147 Cb 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1iz5 h ALA 147 CO -0.04 0.31 0.41 0.00 0.00 0.00 0.00 179.25 179.93 1iz5 h ALA 148 N 0.93 0.97 0.00 0.00 0.00 -0.92 -2.15 119.26 118.10 1iz5 h ALA 148 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1iz5 h ALA 148 Cb 0.40 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1iz5 h ALA 148 CO 0.01 0.49 0.02 0.66 0.00 0.00 0.00 179.25 180.43 1iz5 h SER 149 N 1.05 0.00 0.52 0.00 4.64 -1.10 -0.92 113.55 117.74 1iz5 h SER 149 Ca 0.27 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.49 1iz5 h SER 149 Cb 0.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 1iz5 h SER 149 CO -0.04 0.00 -0.48 -0.07 -0.87 0.00 0.00 176.83 175.37 1iz5 h LEU 150 N 0.00 0.00 -0.11 5.97 3.38 -1.38 -3.36 115.31 119.81 1iz5 h LEU 150 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iz5 h LEU 150 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1iz5 h LEU 150 CO 0.00 0.48 0.00 1.33 0.09 0.00 0.00 178.44 180.34 1iz5 n VAL 151 N -3.91 0.00 -3.78 1.22 0.24 -0.43 -5.11 118.33 106.57 1iz5 n VAL 151 Ca -0.01 -0.44 -0.08 0.00 -2.04 0.00 0.00 64.34 61.77 1iz5 n VAL 151 Cb 0.51 1.02 -0.03 0.00 -1.47 0.00 0.00 33.84 33.87 1iz5 n VAL 151 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1iz5 s SER 152 N -0.76 -0.30 0.00 -1.34 0.15 -0.72 -3.91 113.70 106.82 1iz5 s SER 152 Ca 0.00 -0.51 0.24 0.00 0.70 0.00 0.00 55.95 56.37 1iz5 s SER 152 Cb 0.00 0.67 0.18 0.00 -1.71 0.00 0.00 66.02 65.17 1iz5 s SER 152 CO 0.00 -1.22 1.24 -0.67 1.20 0.00 0.00 173.24 173.78 1iz5 n ASP 153 N -0.42 2.55 -4.13 5.45 2.03 -1.26 -4.13 116.55 116.64 1iz5 n ASP 153 Ca -0.07 -1.78 -0.16 0.00 0.52 0.00 0.00 54.79 53.30 1iz5 n ASP 153 Cb 0.61 0.16 -0.12 0.00 -0.72 0.00 0.00 41.12 41.05 1iz5 n ASP 153 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1iz5 s SER 154 N -2.17 1.33 -0.05 1.67 1.04 -1.26 -0.72 113.70 113.54 1iz5 s SER 154 Ca 0.25 -0.60 0.04 0.00 0.48 0.00 0.00 55.95 56.12 1iz5 s SER 154 Cb 0.19 -0.01 -0.00 0.00 0.10 0.00 0.00 66.02 66.30 1iz5 s SER 154 CO 0.40 -0.14 -0.17 -0.51 0.98 0.00 0.00 173.24 173.80 1iz5 s ILE 155 N -1.39 1.44 -0.17 -1.02 1.10 0.33 -4.68 121.20 116.82 1iz5 s ILE 155 Ca -0.05 -0.71 -0.11 0.00 -0.51 0.00 0.00 60.65 59.28 1iz5 s ILE 155 Cb -0.10 -1.25 -0.05 0.00 0.15 0.00 0.00 42.46 41.22 1iz5 s ILE 155 CO 0.01 0.42 0.18 -0.75 -2.11 0.00 0.00 174.94 172.69 1iz5 s LYS 156 N 0.13 4.06 -0.16 3.50 2.20 0.14 -0.70 119.74 128.91 1iz5 s LYS 156 Ca -0.06 -0.11 -0.05 0.00 -0.36 0.00 0.00 55.97 55.39 1iz5 s LYS 156 Cb -0.12 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.79 1iz5 s LYS 156 CO 0.03 0.39 0.02 -0.06 -0.36 0.00 0.00 175.35 175.36 1iz5 s PHE 157 N 0.08 3.15 -0.06 4.03 0.40 0.17 -1.64 117.98 124.11 1iz5 s PHE 157 Ca 0.12 -0.05 0.01 0.00 -0.60 0.00 0.00 56.93 56.40 1iz5 s PHE 157 Cb -0.12 -1.99 0.02 0.00 0.51 0.00 0.00 43.02 41.44 1iz5 s PHE 157 CO 0.01 0.13 -0.07 0.42 0.70 0.00 0.00 175.22 176.41 1iz5 s ILE 158 N 0.19 0.75 -0.06 0.64 1.01 0.40 -1.87 121.20 122.26 1iz5 s ILE 158 Ca 0.01 -0.23 0.02 0.00 0.00 0.00 0.00 60.65 60.46 1iz5 s ILE 158 Cb -0.13 -0.75 0.01 0.00 0.01 0.00 0.00 42.46 41.60 1iz5 s ILE 158 CO 0.02 0.28 -0.13 0.00 0.00 0.00 0.00 174.94 175.11 1iz5 s ALA 159 N 1.01 1.28 0.19 9.38 0.00 -0.32 -0.06 121.76 133.24 1iz5 s ALA 159 Ca -0.09 -0.43 0.01 0.00 0.00 0.00 0.00 51.96 51.45 1iz5 s ALA 159 Cb -0.14 -0.57 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 1iz5 s ALA 159 CO -0.00 0.13 0.04 1.03 0.00 0.00 0.00 175.76 176.96 1iz5 s ARG 160 N 0.63 1.15 -0.44 0.00 0.52 -0.15 -1.50 118.95 119.16 1iz5 s ARG 160 Ca -0.14 -1.58 -0.43 0.00 -0.52 0.00 0.00 55.73 53.06 1iz5 s ARG 160 Cb -0.16 -0.14 -0.18 0.00 0.52 0.00 0.00 34.95 34.99 1iz5 s ARG 160 CO 0.04 -0.21 1.87 -1.91 0.02 0.00 0.00 175.30 175.11 1iz5 n GLU 161 N -0.27 0.35 -1.66 3.54 4.07 -1.26 -0.25 120.64 125.17 1iz5 n GLU 161 Ca -0.04 0.12 -0.20 0.00 -0.06 0.00 0.00 57.16 56.98 1iz5 n GLU 161 Cb 0.64 -1.73 -0.08 0.00 -0.06 0.00 0.00 31.44 30.21 1iz5 n GLU 161 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1iz5 n ASN 162 N 6.07 -5.30 -3.78 4.31 3.02 -1.26 -4.97 115.26 113.34 1iz5 n ASN 162 Ca 0.39 0.45 -0.13 0.00 -0.03 0.00 0.00 54.58 55.26 1iz5 n ASN 162 Cb 0.02 -4.67 -0.13 0.00 -0.61 0.00 0.00 39.78 34.38 1iz5 n ASN 162 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1iz5 s GLU 163 N -3.82 0.17 -0.10 3.52 2.12 0.66 -3.03 118.70 118.22 1iz5 s GLU 163 Ca 0.00 0.32 0.01 0.00 0.36 0.00 0.00 54.97 55.66 1iz5 s GLU 163 Cb 0.00 -0.02 0.02 0.00 0.26 0.00 0.00 34.13 34.39 1iz5 s GLU 163 CO 0.00 -0.09 -0.10 0.12 -0.54 0.00 0.00 175.26 174.66 1iz5 s PHE 164 N 0.60 1.50 -0.04 5.30 5.36 -0.40 -0.97 117.98 129.33 1iz5 s PHE 164 Ca -0.04 -0.68 0.06 0.00 -0.96 0.00 0.00 56.93 55.31 1iz5 s PHE 164 Cb -0.06 -1.18 -0.01 0.00 -0.34 0.00 0.00 43.02 41.43 1iz5 s PHE 164 CO -0.03 -0.43 -0.22 0.42 -1.46 0.00 0.00 175.22 173.51 1iz5 s ILE 165 N 1.28 1.74 -0.11 3.12 1.01 0.92 -0.71 121.20 128.44 1iz5 s ILE 165 Ca -0.03 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.72 1iz5 s ILE 165 Cb -0.14 -1.47 0.02 0.00 0.01 0.00 0.00 42.46 40.88 1iz5 s ILE 165 CO -0.04 0.49 -0.15 -0.04 0.00 0.00 0.00 174.94 175.21 1iz5 s MET 166 N -0.26 2.18 0.04 2.79 -1.94 -0.35 -0.45 119.30 121.31 1iz5 s MET 166 Ca 0.02 -0.54 0.00 0.00 -1.71 0.00 0.00 55.69 53.46 1iz5 s MET 166 Cb -0.11 -1.89 -0.03 0.00 2.01 0.00 0.00 34.83 34.82 1iz5 s MET 166 CO 0.01 -0.09 -0.04 -1.59 -0.01 0.00 0.00 175.02 173.30 1iz5 s LYS 167 N 1.07 0.49 -0.00 2.03 -2.85 -0.65 -0.52 119.74 119.31 1iz5 s LYS 167 Ca -0.05 -0.89 -0.07 0.00 -1.00 0.00 0.00 55.97 53.96 1iz5 s LYS 167 Cb -0.15 0.04 0.00 0.00 -2.06 0.00 0.00 37.83 35.66 1iz5 s LYS 167 CO -0.03 -0.05 0.13 0.00 0.10 0.00 0.00 175.35 175.50 1iz5 s ALA 168 N -2.41 -0.30 0.04 0.59 0.00 0.23 -0.68 121.76 119.22 1iz5 s ALA 168 Ca -0.05 -0.11 -0.23 0.00 0.00 0.00 0.00 51.96 51.58 1iz5 s ALA 168 Cb -0.03 0.07 0.05 0.00 0.00 0.00 0.00 23.12 23.21 1iz5 s ALA 168 CO -0.04 -0.19 0.52 -1.83 0.00 0.00 0.00 175.76 174.22 1iz5 s GLU 169 N -1.22 1.02 0.00 0.00 -1.05 -1.26 -0.60 118.70 115.59 1iz5 s GLU 169 Ca -0.13 -0.20 0.00 0.00 -0.15 0.00 0.00 54.97 54.49 1iz5 s GLU 169 Cb -0.07 0.47 0.00 0.00 -0.44 0.00 0.00 34.13 34.09 1iz5 s GLU 169 CO 0.01 -0.36 0.00 0.41 0.95 0.00 0.00 175.26 176.27 1iz5 n GLY 170 N 0.48 5.88 0.09 -3.83 0.00 -0.39 -4.70 105.19 102.73 1iz5 n GLY 170 Ca -0.18 -1.79 -0.13 0.00 0.00 0.00 0.00 46.02 43.92 1iz5 n GLY 170 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1iz5 h GLU 171 N 0.00 -0.13 0.00 1.61 4.39 -2.02 -3.38 114.58 115.05 1iz5 h GLU 171 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1iz5 h GLU 171 Cb 0.00 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1iz5 h GLU 171 CO 0.00 -0.09 0.00 0.25 -1.16 0.00 0.00 179.01 178.01 1iz5 n THR 172 N -5.16 0.00 -4.00 1.13 -2.24 -1.26 -5.07 114.28 97.68 1iz5 n THR 172 Ca -0.08 -0.35 -0.24 0.00 -2.27 0.00 0.00 64.05 61.11 1iz5 n THR 172 Cb 0.09 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.33 1iz5 n THR 172 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1iz5 s GLN 173 N -0.59 3.27 0.01 -0.78 -0.21 -1.26 -5.12 119.66 114.97 1iz5 s GLN 173 Ca 0.00 -0.74 -0.17 0.00 0.02 0.00 0.00 55.36 54.46 1iz5 s GLN 173 Cb 0.00 -2.84 0.03 0.00 1.00 0.00 0.00 33.01 31.21 1iz5 s GLN 173 CO 0.00 0.48 0.38 -1.21 -2.12 0.00 0.00 175.29 172.82 1iz5 s GLU 174 N -3.45 0.81 -0.02 2.91 2.02 -1.26 -1.26 118.70 118.45 1iz5 s GLU 174 Ca 0.33 -0.24 0.00 0.00 0.02 0.00 0.00 54.97 55.09 1iz5 s GLU 174 Cb -0.10 0.36 0.03 0.00 0.10 0.00 0.00 34.13 34.52 1iz5 s GLU 174 CO 0.27 -0.25 0.02 0.08 0.02 0.00 0.00 175.26 175.41 1iz5 s VAL 175 N -1.83 -0.03 -0.11 2.63 1.01 0.24 -4.99 120.40 117.32 1iz5 s VAL 175 Ca -0.10 0.18 -0.07 0.00 0.00 0.00 0.00 61.98 62.00 1iz5 s VAL 175 Cb -0.03 -0.09 0.04 0.00 0.00 0.00 0.00 36.38 36.30 1iz5 s VAL 175 CO 0.02 0.09 0.27 -1.83 0.00 0.00 0.00 175.10 173.65 1iz5 s GLU 176 N 0.97 0.27 -0.13 2.72 -1.05 -1.26 -0.60 118.70 119.62 1iz5 s GLU 176 Ca -0.08 0.49 -0.00 0.00 -0.15 0.00 0.00 54.97 55.23 1iz5 s GLU 176 Cb -0.12 -0.00 0.02 0.00 -0.44 0.00 0.00 34.13 33.59 1iz5 s GLU 176 CO -0.03 -0.11 -0.11 0.42 0.95 0.00 0.00 175.26 176.39 1iz5 s ILE 177 N 0.82 1.28 -0.21 1.83 1.01 0.32 -5.00 121.20 121.26 1iz5 s ILE 177 Ca -0.06 -0.46 -0.01 0.00 0.00 0.00 0.00 60.65 60.12 1iz5 s ILE 177 Cb -0.07 -1.26 0.01 0.00 0.01 0.00 0.00 42.46 41.16 1iz5 s ILE 177 CO -0.05 0.40 -0.11 -0.75 0.00 0.00 0.00 174.94 174.42 1iz5 s LYS 178 N 1.60 3.13 0.20 2.79 2.20 -1.26 -1.21 119.74 127.19 1iz5 s LYS 178 Ca 0.05 -0.77 0.10 0.00 -0.36 0.00 0.00 55.97 54.99 1iz5 s LYS 178 Cb -0.13 -2.82 -0.04 0.00 -1.51 0.00 0.00 37.83 33.33 1iz5 s LYS 178 CO -0.09 -0.23 -0.13 -0.51 -0.36 0.00 0.00 175.35 174.02 1iz5 s LEU 179 N 1.37 2.81 0.11 5.43 1.43 0.11 -5.00 118.68 124.95 1iz5 s LEU 179 Ca 0.05 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.44 1iz5 s LEU 179 Cb -0.14 -1.48 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 1iz5 s LEU 179 CO -0.08 0.09 -0.01 0.42 0.23 0.00 0.00 176.35 177.00 1iz5 s THR 180 N -1.83 0.41 0.13 5.49 -4.23 -1.26 -1.27 115.64 113.07 1iz5 s THR 180 Ca 0.25 -1.90 -0.05 0.00 -1.18 0.00 0.00 61.69 58.81 1iz5 s THR 180 Cb -0.08 -1.81 -0.17 0.00 1.34 0.00 0.00 72.50 71.78 1iz5 s THR 180 CO 0.14 -0.73 1.31 0.25 -0.54 0.00 0.00 174.62 175.05 1iz5 h LEU 181 N 2.94 0.57 -0.65 4.79 5.85 -1.81 -0.60 115.31 126.39 1iz5 h LEU 181 Ca -0.35 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 57.93 1iz5 h LEU 181 Cb 1.17 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 1iz5 h LEU 181 CO 0.63 1.23 0.42 -0.33 -0.34 0.00 0.00 178.44 180.06 1iz5 h GLU 182 N 0.26 0.87 -0.24 1.25 3.07 -1.92 -2.23 114.58 115.63 1iz5 h GLU 182 Ca -0.08 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.72 1iz5 h GLU 182 Cb 1.55 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 29.26 1iz5 h GLU 182 CO 0.16 0.59 0.00 -0.25 -1.40 0.00 0.00 179.01 178.11 1iz5 n ASP 183 N -4.62 1.96 -2.09 1.42 9.92 -1.23 -4.95 116.55 116.96 1iz5 n ASP 183 Ca 0.05 -1.81 -0.17 0.00 -0.53 0.00 0.00 54.79 52.33 1iz5 n ASP 183 Cb 0.03 -0.16 0.00 0.00 -0.64 0.00 0.00 41.12 40.35 1iz5 n ASP 183 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1iz5 n GLU 184 N 0.52 -2.03 0.14 -1.24 1.02 -0.84 -4.88 120.64 113.34 1iz5 n GLU 184 Ca 0.16 0.81 0.12 0.00 -0.02 0.00 0.00 57.16 58.23 1iz5 n GLU 184 Cb 0.36 -5.27 0.20 0.00 -0.02 0.00 0.00 31.44 26.71 1iz5 n GLU 184 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1iz5 h GLY 185 N -0.28 0.00 -3.95 0.62 0.00 -1.38 -3.44 103.07 94.65 1iz5 h GLY 185 Ca -0.41 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.23 1iz5 h GLY 185 CO 0.48 0.00 -0.86 1.08 0.00 0.00 0.00 176.54 177.23 1iz5 s LEU 186 N -5.29 2.36 0.00 3.11 1.43 -1.13 -4.72 118.68 114.44 1iz5 s LEU 186 Ca 0.06 -0.72 0.14 0.00 -1.03 0.00 0.00 54.13 52.58 1iz5 s LEU 186 Cb 0.09 -1.26 -0.19 0.00 0.03 0.00 0.00 46.19 44.86 1iz5 s LEU 186 CO 0.68 0.18 0.74 -0.07 0.23 0.00 0.00 176.35 178.11 1iz5 h LEU 187 N 3.89 0.00 -7.00 1.79 3.38 -0.93 -3.43 115.31 113.01 1iz5 h LEU 187 Ca -0.51 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.57 1iz5 h LEU 187 Cb 1.17 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.73 1iz5 h LEU 187 CO 0.40 0.83 0.55 -0.62 0.09 0.00 0.00 178.44 179.69 1iz5 s ASP 188 N -5.98 -0.35 -0.26 -0.43 2.15 -1.16 -4.97 116.67 105.67 1iz5 s ASP 188 Ca -0.04 0.18 -0.18 0.00 0.43 0.00 0.00 52.55 52.95 1iz5 s ASP 188 Cb 0.08 0.32 0.07 0.00 -0.30 0.00 0.00 42.92 43.10 1iz5 s ASP 188 CO 0.82 -0.46 0.67 -0.51 -0.17 0.00 0.00 175.17 175.52 1iz5 s ILE 189 N -2.14 -0.00 -0.04 4.11 2.07 -1.26 -0.89 121.20 123.05 1iz5 s ILE 189 Ca 0.02 0.01 -0.02 0.00 -1.41 0.00 0.00 60.65 59.26 1iz5 s ILE 189 Cb -0.01 -0.96 0.03 0.00 0.13 0.00 0.00 42.46 41.66 1iz5 s ILE 189 CO -0.04 0.00 0.05 -1.61 -1.91 0.00 0.00 174.94 171.43 1iz5 s GLU 190 N 1.24 -0.01 0.02 3.50 0.41 -0.08 -4.75 118.70 119.03 1iz5 s GLU 190 Ca -0.07 0.32 0.04 0.00 -0.41 0.00 0.00 54.97 54.84 1iz5 s GLU 190 Cb -0.05 -0.50 -0.01 0.00 -1.78 0.00 0.00 34.13 31.79 1iz5 s GLU 190 CO -0.13 -0.29 -0.12 0.14 -0.49 0.00 0.00 175.26 174.37 1iz5 s VAL 191 N 1.92 0.92 -0.09 2.63 -7.23 -1.26 -0.73 120.40 116.56 1iz5 s VAL 191 Ca 0.02 -0.73 0.04 0.00 -1.81 0.00 0.00 61.98 59.50 1iz5 s VAL 191 Cb -0.12 -0.81 -0.24 0.00 0.56 0.00 0.00 36.38 35.76 1iz5 s VAL 191 CO -0.03 0.09 0.47 0.00 -0.31 0.00 0.00 175.10 175.32 1iz5 n GLN 192 N 2.33 0.69 -3.55 4.82 6.02 -0.17 -4.91 117.38 122.63 1iz5 n GLN 192 Ca -0.16 0.26 -0.11 0.00 -0.01 0.00 0.00 57.00 56.98 1iz5 n GLN 192 Cb 0.56 -1.73 -0.03 0.00 1.02 0.00 0.00 30.24 30.05 1iz5 n GLN 192 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1iz5 s GLU 193 N -2.57 1.25 0.14 -1.09 -1.05 -1.26 -5.12 118.70 108.99 1iz5 s GLU 193 Ca -0.14 -0.62 -0.35 0.00 -0.15 0.00 0.00 54.97 53.71 1iz5 s GLU 193 Cb 0.07 0.54 -0.15 0.00 -0.44 0.00 0.00 34.13 34.16 1iz5 s GLU 193 CO 0.79 -0.53 1.49 -1.91 0.95 0.00 0.00 175.26 176.05 1iz5 n GLU 194 N -0.33 1.79 -4.63 -4.83 2.13 -1.26 -4.82 120.64 108.69 1iz5 n GLU 194 Ca -0.15 0.65 -0.26 0.00 0.66 0.00 0.00 57.16 58.05 1iz5 n GLU 194 Cb 0.64 -2.37 -0.17 0.00 0.27 0.00 0.00 31.44 29.82 1iz5 n GLU 194 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1iz5 s THR 195 N 0.74 1.33 -0.02 6.31 2.01 -0.57 -4.93 115.64 120.52 1iz5 s THR 195 Ca 0.81 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 62.25 1iz5 s THR 195 Cb -0.78 -1.20 0.00 0.00 0.01 0.00 0.00 72.50 70.54 1iz5 s THR 195 CO 0.41 0.40 -0.07 -0.54 -0.69 0.00 0.00 174.62 174.13 1iz5 s LYS 196 N 0.71 0.72 0.17 4.92 1.02 -1.26 -1.18 119.74 124.85 1iz5 s LYS 196 Ca -0.13 -0.22 -0.23 0.00 0.02 0.00 0.00 55.97 55.41 1iz5 s LYS 196 Cb -0.16 -0.70 0.07 0.00 -0.52 0.00 0.00 37.83 36.51 1iz5 s LYS 196 CO 0.03 0.08 0.62 0.45 -0.92 0.00 0.00 175.35 175.61 1iz5 s SER 197 N 0.20 -0.54 0.12 2.83 0.15 -0.78 -1.76 113.70 113.92 1iz5 s SER 197 Ca -0.03 -0.06 0.06 0.00 0.70 0.00 0.00 55.95 56.63 1iz5 s SER 197 Cb -0.07 0.61 -0.04 0.00 -1.71 0.00 0.00 66.02 64.81 1iz5 s SER 197 CO 0.00 -1.00 -0.15 0.00 1.20 0.00 0.00 173.24 173.29 1iz5 s ALA 198 N -3.76 1.54 0.12 5.45 0.00 -1.26 0.41 121.76 124.26 1iz5 s ALA 198 Ca 0.02 -1.29 -0.05 0.00 0.00 0.00 0.00 51.96 50.64 1iz5 s ALA 198 Cb -0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 1iz5 s ALA 198 CO -0.11 0.13 0.13 0.71 0.00 0.00 0.00 175.76 176.62 1iz5 s TYR 199 N -2.04 0.54 0.01 0.00 1.51 0.12 -0.91 117.35 116.58 1iz5 s TYR 199 Ca 0.09 -0.96 -0.30 0.00 -1.01 0.00 0.00 57.07 54.89 1iz5 s TYR 199 Cb -0.05 -0.27 -0.05 0.00 -0.11 0.00 0.00 41.96 41.48 1iz5 s TYR 199 CO 0.03 -0.56 1.29 0.20 -1.11 0.00 0.00 175.55 175.41 1iz5 s GLY 200 N -2.97 2.06 0.24 0.71 0.00 -1.26 -0.51 107.32 105.59 1iz5 s GLY 200 Ca 0.16 0.82 -0.07 0.00 0.00 0.00 0.00 44.72 45.63 1iz5 s GLY 200 CO -0.03 2.30 1.92 -2.08 0.00 0.00 0.00 173.10 175.21 1iz5 h VAL 201 N 4.79 1.23 -0.64 1.40 2.07 -1.25 -2.75 116.25 121.10 1iz5 h VAL 201 Ca -0.38 -0.44 0.10 0.00 0.82 0.00 0.00 66.70 66.81 1iz5 h VAL 201 Cb 1.18 -0.16 -0.08 0.00 -1.52 0.00 0.00 31.29 30.72 1iz5 h VAL 201 CO 0.87 0.23 0.24 0.28 0.02 0.00 0.00 177.57 179.22 1iz5 h SER 202 N 1.28 0.23 -0.25 0.57 0.02 -1.92 -0.53 113.55 112.95 1iz5 h SER 202 Ca 0.36 0.09 -0.08 0.00 -0.84 0.00 0.00 61.79 61.31 1iz5 h SER 202 Cb -0.12 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1iz5 h SER 202 CO -0.08 0.13 -0.17 1.88 -1.14 0.00 0.00 176.83 177.45 1iz5 h TYR 203 N 0.42 0.64 -0.74 3.45 -1.99 -1.90 -2.80 116.97 114.04 1iz5 h TYR 203 Ca 0.33 -0.17 -0.02 0.00 2.00 0.00 0.00 58.73 60.86 1iz5 h TYR 203 Cb 0.43 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 38.98 1iz5 h TYR 203 CO -0.17 0.84 0.37 -0.07 -0.00 0.00 0.00 178.16 179.12 1iz5 h LEU 204 N 0.26 0.95 -0.22 3.88 3.38 -1.20 -1.86 115.31 120.51 1iz5 h LEU 204 Ca 0.05 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.94 1iz5 h LEU 204 Cb 0.69 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1iz5 h LEU 204 CO 0.05 0.80 0.09 -1.28 0.09 0.00 0.00 178.44 178.18 1iz5 h SER 205 N 1.05 0.13 0.36 -0.43 0.87 -1.04 -1.55 113.55 112.93 1iz5 h SER 205 Ca 0.26 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.79 1iz5 h SER 205 Cb 0.09 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 1iz5 h SER 205 CO -0.04 0.10 -0.23 0.44 -0.53 0.00 0.00 176.83 176.58 1iz5 h ASP 206 N 0.21 0.00 0.06 6.23 3.32 -1.21 -0.72 116.42 124.32 1iz5 h ASP 206 Ca 0.09 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.93 1iz5 h ASP 206 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1iz5 h ASP 206 CO -0.08 0.23 -0.80 0.24 -1.72 0.00 0.00 179.24 177.11 1iz5 h MET 207 N 0.00 0.60 -0.01 3.56 2.86 -0.62 -3.34 114.93 117.98 1iz5 h MET 207 Ca -0.00 -0.52 0.00 0.00 -2.06 0.00 0.00 59.70 57.12 1iz5 h MET 207 Cb 0.47 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.25 1iz5 h MET 207 CO 0.03 1.14 -0.34 1.33 1.06 0.00 0.00 176.91 180.13 1iz5 n VAL 208 N -3.87 0.00 -0.16 -2.22 0.24 -0.65 -4.55 118.33 107.12 1iz5 n VAL 208 Ca -0.06 -0.33 -0.02 0.00 -2.04 0.00 0.00 64.34 61.89 1iz5 n VAL 208 Cb 0.75 1.22 0.07 0.00 -1.47 0.00 0.00 33.84 34.41 1iz5 n VAL 208 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1iz5 h LYS 209 N 2.04 0.21 0.00 7.34 1.63 -1.25 -1.70 116.57 124.85 1iz5 h LYS 209 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1iz5 h LYS 209 Cb 0.61 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.19 1iz5 h LYS 209 CO 0.00 0.14 0.00 0.41 -3.45 0.00 0.00 179.45 176.55 1iz5 n GLY 210 N -1.29 -1.34 3.78 5.01 0.00 -1.26 -4.87 105.19 105.21 1iz5 n GLY 210 Ca 0.06 -0.10 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 1iz5 n GLY 210 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iz5 s LEU 211 N -2.87 3.49 0.39 0.99 1.02 -0.64 -4.81 118.68 116.25 1iz5 s LEU 211 Ca 0.17 2.01 -0.09 0.00 0.02 0.00 0.00 54.13 56.24 1iz5 s LEU 211 Cb 0.18 -4.56 -0.06 0.00 0.02 0.00 0.00 46.19 41.77 1iz5 s LEU 211 CO 0.46 -1.46 0.73 -0.83 0.02 0.00 0.00 176.35 175.27 1iz5 s GLY 212 N -2.41 1.90 0.48 -3.19 0.00 -1.26 -4.97 107.32 97.86 1iz5 s GLY 212 Ca 0.68 -0.30 0.13 0.00 0.00 0.00 0.00 44.72 45.23 1iz5 s GLY 212 CO 0.37 -0.12 2.10 0.50 0.00 0.00 0.00 173.10 175.95 1iz5 h LYS 213 N 1.28 0.21 -0.41 2.90 1.57 -1.96 -2.43 116.57 117.74 1iz5 h LYS 213 Ca -0.47 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1iz5 h LYS 213 Cb 1.19 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1iz5 h LYS 213 CO 0.64 0.14 0.00 0.00 -0.57 0.00 0.00 179.45 179.66 1iz5 n ALA 214 N -2.52 2.42 -1.78 3.86 0.00 -1.26 -1.98 120.51 119.25 1iz5 n ALA 214 Ca 0.00 -1.02 -0.37 0.00 0.00 0.00 0.00 53.44 52.06 1iz5 n ALA 214 Cb 0.11 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 18.67 1iz5 n ALA 214 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1iz5 s ASP 215 N -1.46 6.33 -0.10 0.00 1.01 -0.92 -4.79 116.67 116.74 1iz5 s ASP 215 Ca 0.39 2.21 -0.20 0.00 0.71 0.00 0.00 52.55 55.66 1iz5 s ASP 215 Cb 0.23 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.52 1iz5 s ASP 215 CO 0.32 -0.80 0.57 -0.70 0.21 0.00 0.00 175.17 174.77 1iz5 s GLU 216 N -2.68 4.37 -0.07 8.23 2.56 -1.26 -0.39 118.70 129.46 1iz5 s GLU 216 Ca 0.62 0.62 0.03 0.00 0.00 0.00 0.00 54.97 56.24 1iz5 s GLU 216 Cb -0.26 -3.45 0.01 0.00 2.00 0.00 0.00 34.13 32.43 1iz5 s GLU 216 CO 0.32 0.10 -0.16 0.08 -0.56 0.00 0.00 175.26 175.04 1iz5 s VAL 217 N 0.75 1.45 -0.20 3.70 1.01 0.33 -4.48 120.40 122.96 1iz5 s VAL 217 Ca 0.30 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.54 1iz5 s VAL 217 Cb -0.16 -1.28 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 1iz5 s VAL 217 CO 0.13 0.42 0.04 -0.89 0.00 0.00 0.00 175.10 174.80 1iz5 s THR 218 N 0.44 4.41 -0.08 3.92 2.01 -0.34 -1.39 115.64 124.61 1iz5 s THR 218 Ca -0.13 -0.16 0.05 0.00 0.31 0.00 0.00 61.69 61.75 1iz5 s THR 218 Cb -0.15 -3.00 -0.01 0.00 0.01 0.00 0.00 72.50 69.35 1iz5 s THR 218 CO 0.05 0.43 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.55 1iz5 s ILE 219 N 0.76 2.26 -0.04 1.82 1.01 0.72 -0.42 121.20 127.32 1iz5 s ILE 219 Ca 0.02 -0.98 0.03 0.00 0.00 0.00 0.00 60.65 59.72 1iz5 s ILE 219 Cb -0.14 -1.85 0.00 0.00 0.01 0.00 0.00 42.46 40.48 1iz5 s ILE 219 CO 0.02 0.56 -0.12 -0.54 0.00 0.00 0.00 174.94 174.86 1iz5 s LYS 220 N -0.02 1.30 0.29 2.79 1.02 -0.12 -0.45 119.74 124.55 1iz5 s LYS 220 Ca -0.07 -0.41 -0.07 0.00 0.02 0.00 0.00 55.97 55.43 1iz5 s LYS 220 Cb -0.15 -1.17 0.03 0.00 -0.52 0.00 0.00 37.83 36.02 1iz5 s LYS 220 CO 0.05 0.15 0.50 1.97 -0.92 0.00 0.00 175.35 177.10 1iz5 n PHE 221 N 3.30 -1.69 -3.98 3.18 1.16 -0.75 -0.40 117.46 118.28 1iz5 n PHE 221 Ca -0.19 -1.58 -0.11 0.00 -1.87 0.00 0.00 57.45 53.71 1iz5 n PHE 221 Cb 0.53 0.58 -0.03 0.00 -1.61 0.00 0.00 39.48 38.96 1iz5 n PHE 221 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1iz5 s GLY 222 N -2.61 0.83 -0.03 4.97 0.00 -1.26 -1.14 107.32 108.08 1iz5 s GLY 222 Ca 0.16 -1.06 -0.30 0.00 0.00 0.00 0.00 44.72 43.53 1iz5 s GLY 222 CO 0.12 -0.67 1.91 -1.31 0.00 0.00 0.00 173.10 173.15 1iz5 s ASN 223 N -3.11 6.36 -1.48 1.64 -0.87 -1.26 -2.13 114.94 114.10 1iz5 s ASN 223 Ca 0.23 2.40 0.00 0.00 -1.57 0.00 0.00 52.86 53.92 1iz5 s ASN 223 Cb -0.02 -2.53 0.00 0.00 -0.02 0.00 0.00 41.25 38.68 1iz5 s ASN 223 CO 0.14 -1.16 0.00 -0.62 -2.57 0.00 0.00 177.10 172.89 1iz5 n GLU 224 N 7.62 -1.90 -4.10 -0.60 -0.58 -0.72 -4.96 120.64 115.40 1iz5 n GLU 224 Ca 0.21 0.84 -0.24 0.00 -0.42 0.00 0.00 57.16 57.54 1iz5 n GLU 224 Cb 0.42 -5.45 -0.07 0.00 -0.57 0.00 0.00 31.44 25.77 1iz5 n GLU 224 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1iz5 s MET 225 N -4.95 2.24 0.80 3.49 -1.94 -0.90 -4.88 119.30 113.16 1iz5 s MET 225 Ca 0.00 -1.82 -0.11 0.00 -1.71 0.00 0.00 55.69 52.05 1iz5 s MET 225 Cb 0.00 -2.01 0.07 0.00 2.01 0.00 0.00 34.83 34.90 1iz5 s MET 225 CO 0.00 -0.11 1.09 -2.14 -0.01 0.00 0.00 175.02 173.85 1iz5 s PRO 226 N -3.91 2.04 0.01 2.03 0.02 -1.26 -4.35 135.00 129.58 1iz5 s PRO 226 Ca 0.41 0.91 0.06 0.00 0.02 0.00 0.00 61.00 62.40 1iz5 s PRO 226 Cb 0.03 -1.89 -0.03 0.00 0.02 0.00 0.00 34.50 32.63 1iz5 s PRO 226 CO 0.23 -1.72 -0.16 0.00 -0.33 0.00 0.00 177.00 175.02 1iz5 s MET 227 N -4.99 2.25 -0.19 5.54 0.23 -0.28 -4.24 119.30 117.62 1iz5 s MET 227 Ca 0.61 -0.87 -0.03 0.00 -1.03 0.00 0.00 55.69 54.37 1iz5 s MET 227 Cb -0.16 -2.28 -0.01 0.00 -1.53 0.00 0.00 34.83 30.85 1iz5 s MET 227 CO 0.56 0.57 -0.06 -1.14 -2.03 0.00 0.00 175.02 172.92 1iz5 s GLN 228 N -1.25 3.44 -0.11 3.16 0.74 0.46 -0.71 119.66 125.39 1iz5 s GLN 228 Ca 0.14 -0.61 0.02 0.00 0.05 0.00 0.00 55.36 54.96 1iz5 s GLN 228 Cb -0.11 -2.93 -0.01 0.00 1.10 0.00 0.00 33.01 31.07 1iz5 s GLN 228 CO 0.04 -0.03 -0.18 1.41 -0.55 0.00 0.00 175.29 175.98 1iz5 s MET 229 N 1.04 3.20 0.01 1.67 -2.45 -0.27 -0.94 119.30 121.57 1iz5 s MET 229 Ca 0.01 -0.77 0.07 0.00 -1.25 0.00 0.00 55.69 53.74 1iz5 s MET 229 Cb -0.15 -2.48 -0.02 0.00 1.25 0.00 0.00 34.83 33.44 1iz5 s MET 229 CO -0.00 0.22 -0.21 -1.21 1.05 0.00 0.00 175.02 174.87 1iz5 s GLU 230 N 0.30 1.56 -0.03 4.11 2.02 0.43 -1.05 118.70 126.04 1iz5 s GLU 230 Ca -0.13 -0.83 0.02 0.00 0.02 0.00 0.00 54.97 54.04 1iz5 s GLU 230 Cb -0.17 -1.58 0.01 0.00 0.10 0.00 0.00 34.13 32.49 1iz5 s GLU 230 CO 0.07 0.42 -0.07 -0.47 0.02 0.00 0.00 175.26 175.23 1iz5 s TYR 231 N -0.62 0.83 -0.05 1.61 5.04 -0.41 -1.20 117.35 122.55 1iz5 s TYR 231 Ca 0.08 -0.22 -0.02 0.00 -2.44 0.00 0.00 57.07 54.47 1iz5 s TYR 231 Cb -0.08 -0.64 -0.04 0.00 0.35 0.00 0.00 41.96 41.55 1iz5 s TYR 231 CO 0.00 -0.13 0.06 0.71 -1.34 0.00 0.00 175.55 174.86 1iz5 s TYR 232 N 0.46 3.30 -0.14 4.97 1.51 -1.26 -0.92 117.35 125.27 1iz5 s TYR 232 Ca -0.07 0.26 0.02 0.00 -1.01 0.00 0.00 57.07 56.27 1iz5 s TYR 232 Cb -0.11 -1.79 0.00 0.00 -0.11 0.00 0.00 41.96 39.95 1iz5 s TYR 232 CO 0.00 0.56 -0.19 -1.50 -1.11 0.00 0.00 175.55 173.31 1iz5 s ILE 233 N -1.06 2.36 -1.41 2.71 2.07 -0.01 -4.62 121.20 121.24 1iz5 s ILE 233 Ca 0.18 -0.88 -0.11 0.00 -1.41 0.00 0.00 60.65 58.43 1iz5 s ILE 233 Cb -0.12 -1.96 0.08 0.00 0.13 0.00 0.00 42.46 40.59 1iz5 s ILE 233 CO 0.08 0.54 0.63 0.54 -1.91 0.00 0.00 174.94 174.82 1iz5 n ARG 234 N 3.93 -3.97 0.00 3.50 5.12 -1.26 -0.62 116.66 123.36 1iz5 n ARG 234 Ca -0.19 0.54 0.00 0.00 -1.93 0.00 0.00 57.85 56.26 1iz5 n ARG 234 Cb 0.52 -5.30 0.00 0.00 -1.16 0.00 0.00 32.46 26.52 1iz5 n ARG 234 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1iz5 n ASP 235 N -2.46 0.00 0.05 0.55 8.00 -1.26 -4.33 116.55 117.10 1iz5 n ASP 235 Ca -0.00 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.47 1iz5 n ASP 235 Cb 0.54 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.56 1iz5 n ASP 235 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1iz5 h GLU 236 N 0.00 0.00 -6.86 -1.24 4.39 -1.94 -3.47 114.58 105.46 1iz5 h GLU 236 Ca 0.00 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.21 1iz5 h GLU 236 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1iz5 h GLU 236 CO 0.00 0.55 0.13 0.20 -1.16 0.00 0.00 179.01 178.74 1iz5 s GLY 237 N -4.77 1.95 -0.12 -3.84 0.00 0.21 -4.64 107.32 96.12 1iz5 s GLY 237 Ca -0.01 -0.18 -0.09 0.00 0.00 0.00 0.00 44.72 44.44 1iz5 s GLY 237 CO 0.80 0.02 0.30 1.09 0.00 0.00 0.00 173.10 175.31 1iz5 s ARG 238 N -3.85 0.32 -0.19 2.90 1.70 -0.25 -0.83 118.95 118.74 1iz5 s ARG 238 Ca 0.52 0.47 -0.03 0.00 -0.47 0.00 0.00 55.73 56.22 1iz5 s ARG 238 Cb -0.10 0.09 -0.01 0.00 -0.57 0.00 0.00 34.95 34.35 1iz5 s ARG 238 CO 0.31 -0.08 -0.06 -1.17 -1.08 0.00 0.00 175.30 173.23 1iz5 s LEU 239 N 0.50 2.94 -0.03 -1.89 2.96 -0.09 -0.88 118.68 122.19 1iz5 s LEU 239 Ca -0.03 -0.32 0.05 0.00 -0.22 0.00 0.00 54.13 53.61 1iz5 s LEU 239 Cb -0.04 -1.72 -0.01 0.00 0.50 0.00 0.00 46.19 44.92 1iz5 s LEU 239 CO -0.03 0.06 -0.17 -0.89 -1.32 0.00 0.00 176.35 174.01 1iz5 s THR 240 N 1.00 1.36 -0.01 3.68 2.01 0.10 -1.28 115.64 122.50 1iz5 s THR 240 Ca 0.00 -0.70 0.08 0.00 0.31 0.00 0.00 61.69 61.38 1iz5 s THR 240 Cb -0.15 -1.15 -0.02 0.00 0.01 0.00 0.00 72.50 71.19 1iz5 s THR 240 CO 0.00 0.39 -0.25 -0.36 -0.69 0.00 0.00 174.62 173.71 1iz5 s PHE 241 N -0.14 2.25 -0.21 4.92 0.40 -0.22 -0.58 117.98 124.40 1iz5 s PHE 241 Ca 0.01 -0.42 0.01 0.00 -0.60 0.00 0.00 56.93 55.92 1iz5 s PHE 241 Cb -0.09 -1.43 0.05 0.00 0.51 0.00 0.00 43.02 42.06 1iz5 s PHE 241 CO 0.01 -0.01 -0.09 -1.17 0.70 0.00 0.00 175.22 174.66 1iz5 s LEU 242 N -0.70 2.41 -0.19 -0.37 2.96 -0.38 -1.11 118.68 121.29 1iz5 s LEU 242 Ca 0.10 -0.99 -0.05 0.00 -0.22 0.00 0.00 54.13 52.97 1iz5 s LEU 242 Cb -0.10 -1.23 -0.03 0.00 0.50 0.00 0.00 46.19 45.34 1iz5 s LEU 242 CO -0.00 -0.17 -0.00 -0.22 -1.32 0.00 0.00 176.35 174.63 1iz5 s LEU 243 N 1.39 3.30 0.51 -0.68 2.96 0.11 -1.26 118.68 125.00 1iz5 s LEU 243 Ca -0.03 -0.17 -0.22 0.00 -0.22 0.00 0.00 54.13 53.49 1iz5 s LEU 243 Cb -0.17 -1.83 -0.06 0.00 0.50 0.00 0.00 46.19 44.63 1iz5 s LEU 243 CO -0.07 0.09 1.26 0.00 -1.32 0.00 0.00 176.35 176.30 1iz5 s ALA 244 N 0.86 2.87 0.67 5.97 0.00 -0.41 -1.13 121.76 130.59 1iz5 s ALA 244 Ca 0.01 1.12 -0.12 0.00 0.00 0.00 0.00 51.96 52.97 1iz5 s ALA 244 Cb -0.14 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 1iz5 s ALA 244 CO 0.02 -1.02 1.06 -1.25 0.00 0.00 0.00 175.76 174.57 1iz5 s PRO 245 N -2.84 3.05 0.00 0.00 0.04 -1.26 -4.69 135.00 129.30 1iz5 s PRO 245 Ca 0.68 1.03 0.24 0.00 0.04 0.00 0.00 61.00 62.99 1iz5 s PRO 245 Cb -0.34 -2.00 0.23 0.00 0.04 0.00 0.00 34.50 32.42 1iz5 s PRO 245 CO 0.40 -1.02 1.28 -2.13 0.04 0.00 0.00 177.00 175.58