#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5z h SER 2 N 0.00 -0.02 -3.79 1.61 4.64 -2.10 -3.42 113.55 110.48 1x5z h SER 2 Ca 0.00 0.10 -0.48 0.00 -0.47 0.00 0.00 61.79 60.94 1x5z h SER 2 Cb 0.00 0.14 0.19 0.00 -0.31 0.00 0.00 62.40 62.42 1x5z h SER 2 CO 0.00 0.01 0.14 -0.55 -0.87 0.00 0.00 176.83 175.56 1x5z s SER 3 N -5.30 2.18 0.00 4.97 0.15 -1.26 -5.05 113.70 109.39 1x5z s SER 3 Ca -0.13 1.74 0.00 0.00 0.70 0.00 0.00 55.95 58.26 1x5z s SER 3 Cb 0.16 -2.37 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 1x5z s SER 3 CO 0.73 -3.49 0.00 0.61 1.20 0.00 0.00 173.24 172.29 1x5z n GLY 4 N 0.17 5.43 3.61 9.45 0.00 -1.26 -5.08 105.19 117.50 1x5z n GLY 4 Ca 0.07 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 1x5z n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5z s SER 5 N 1.00 5.67 0.07 1.61 1.04 -1.26 -4.89 113.70 116.94 1x5z s SER 5 Ca 0.00 1.89 -0.34 0.00 0.48 0.00 0.00 55.95 57.98 1x5z s SER 5 Cb 0.00 -2.52 -0.18 0.00 0.10 0.00 0.00 66.02 63.43 1x5z s SER 5 CO 0.00 -1.79 1.51 0.77 0.98 0.00 0.00 173.24 174.71 1x5z h SER 6 N 14.04 -1.17 0.00 7.02 4.64 -1.99 -3.49 113.55 132.61 1x5z h SER 6 Ca -0.41 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1x5z h SER 6 Cb 1.22 0.35 0.00 0.00 -0.31 0.00 0.00 62.40 63.66 1x5z h SER 6 CO 0.97 -0.69 0.00 0.61 -0.87 0.00 0.00 176.83 176.85 1x5z n GLY 7 N -1.57 1.67 3.62 -0.77 0.00 -1.26 -4.47 105.19 102.41 1x5z n GLY 7 Ca -0.13 -0.76 -0.24 0.00 0.00 0.00 0.00 46.02 44.88 1x5z n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x5z s ASP 8 N -4.00 4.23 -0.14 1.61 1.01 -1.26 -5.07 116.67 113.05 1x5z s ASP 8 Ca 0.00 -0.89 -0.19 0.00 0.71 0.00 0.00 52.55 52.18 1x5z s ASP 8 Cb 0.00 -0.60 -0.16 0.00 1.01 0.00 0.00 42.92 43.17 1x5z s ASP 8 CO 0.00 -0.14 0.40 0.40 0.21 0.00 0.00 175.17 176.04 1x5z h ILE 9 N 1.87 1.04 -0.84 0.77 2.04 -2.02 -3.37 117.51 117.00 1x5z h ILE 9 Ca -0.43 -1.85 0.16 0.00 1.00 0.00 0.00 64.86 63.73 1x5z h ILE 9 Cb 1.25 2.04 -0.15 0.00 -0.74 0.00 0.00 36.82 39.21 1x5z h ILE 9 CO 0.64 0.35 -0.27 -0.61 0.00 0.00 0.00 178.15 178.26 1x5z h GLN 10 N -1.00 -0.03 -6.74 2.37 5.75 -2.03 -3.40 115.11 110.03 1x5z h GLN 10 Ca -0.05 0.00 -0.68 0.00 -0.15 0.00 0.00 58.65 57.76 1x5z h GLN 10 Cb 0.74 0.01 -0.21 0.00 1.07 0.00 0.00 27.48 29.08 1x5z h GLN 10 CO -0.03 -0.02 -0.83 0.08 -2.65 0.00 0.00 178.83 175.38 1x5z s VAL 11 N -6.14 2.58 0.44 2.39 1.01 -1.26 -5.15 120.40 114.26 1x5z s VAL 11 Ca -0.14 -1.49 0.06 0.00 0.00 0.00 0.00 61.98 60.40 1x5z s VAL 11 Cb 0.22 -2.13 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 1x5z s VAL 11 CO 0.74 0.19 0.02 0.27 0.00 0.00 0.00 175.10 176.31 1x5z s ILE 12 N -1.02 1.80 -0.19 2.22 -5.25 -1.26 -4.04 121.20 113.45 1x5z s ILE 12 Ca 0.15 -1.99 -0.17 0.00 -0.99 0.00 0.00 60.65 57.65 1x5z s ILE 12 Cb -0.10 -2.79 -0.04 0.00 2.95 0.00 0.00 42.46 42.48 1x5z s ILE 12 CO 0.07 0.00 0.46 -0.89 -1.79 0.00 0.00 174.94 172.79 1x5z s THR 13 N -2.75 5.16 0.08 8.37 2.01 -1.26 -5.06 115.64 122.19 1x5z s THR 13 Ca 0.28 0.86 -0.10 0.00 0.31 0.00 0.00 61.69 63.04 1x5z s THR 13 Cb 0.08 -3.79 0.00 0.00 0.01 0.00 0.00 72.50 68.80 1x5z s THR 13 CO 0.14 0.23 0.21 0.00 -0.69 0.00 0.00 174.62 174.52 1x5z s GLN 14 N 1.35 0.84 0.94 4.92 -2.07 -1.26 -5.13 119.66 119.25 1x5z s GLN 14 Ca 0.22 -0.87 -0.14 0.00 -1.82 0.00 0.00 55.36 52.76 1x5z s GLN 14 Cb -0.15 0.34 -0.00 0.00 -1.09 0.00 0.00 33.01 32.11 1x5z s GLN 14 CO 0.09 -0.27 0.21 0.25 -1.32 0.00 0.00 175.29 174.25 1x5z n THR 15 N 0.07 0.12 0.00 3.63 -2.24 -1.26 -4.92 114.28 109.68 1x5z n THR 15 Ca -0.16 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1x5z n THR 15 Cb 0.62 -0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1x5z n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x5z n GLY 16 N 1.84 -0.62 3.39 3.38 0.00 -1.26 -5.14 105.19 106.78 1x5z n GLY 16 Ca 0.05 0.62 -0.39 0.00 0.00 0.00 0.00 46.02 46.30 1x5z n GLY 16 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1x5z n VAL 17 N 0.00 1.36 -1.10 1.61 0.24 -1.26 -4.95 118.33 114.23 1x5z n VAL 17 Ca 0.00 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.34 61.50 1x5z n VAL 17 Cb 0.00 -0.40 0.22 0.00 -1.47 0.00 0.00 33.84 32.19 1x5z n VAL 17 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1x5z s PRO 18 N -1.59 -0.77 0.06 7.34 0.04 -1.26 -4.93 135.00 133.89 1x5z s PRO 18 Ca 0.63 0.10 0.05 0.00 0.04 0.00 0.00 61.00 61.83 1x5z s PRO 18 Cb -0.50 -1.63 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 1x5z s PRO 18 CO 0.59 -3.44 -0.07 0.20 0.04 0.00 0.00 177.00 174.31 1x5z s GLY 19 N -3.75 1.78 0.43 0.56 0.00 -1.26 -4.01 107.32 101.08 1x5z s GLY 19 Ca 0.69 -1.12 -0.24 0.00 0.00 0.00 0.00 44.72 44.05 1x5z s GLY 19 CO 0.57 -1.05 1.00 0.61 0.00 0.00 0.00 173.10 174.22 1x5z n GLN 20 N 1.09 1.31 -1.24 2.90 -0.00 -1.26 -4.74 117.38 115.44 1x5z n GLN 20 Ca -0.14 0.47 -0.31 0.00 -0.00 0.00 0.00 57.00 57.03 1x5z n GLN 20 Cb 0.52 -2.04 0.11 0.00 -0.00 0.00 0.00 30.24 28.82 1x5z n GLN 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1x5z s PRO 21 N -2.06 1.94 0.45 2.61 0.04 -1.26 -4.83 135.00 131.88 1x5z s PRO 21 Ca 0.64 1.06 0.07 0.00 0.04 0.00 0.00 61.00 62.81 1x5z s PRO 21 Cb -0.54 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 1x5z s PRO 21 CO 0.56 -1.84 0.36 -0.51 0.04 0.00 0.00 177.00 175.61 1x5z s LEU 22 N -6.02 3.15 -1.60 -3.56 1.43 -0.84 -4.64 118.68 106.60 1x5z s LEU 22 Ca 0.62 -0.95 -0.15 0.00 -1.03 0.00 0.00 54.13 52.63 1x5z s LEU 22 Cb -0.17 -1.69 0.11 0.00 0.03 0.00 0.00 46.19 44.47 1x5z s LEU 22 CO 0.56 -0.77 0.82 0.59 0.23 0.00 0.00 176.35 177.79 1x5z n ASN 23 N -1.56 -3.51 -4.66 2.29 3.02 -1.26 -0.73 115.26 108.84 1x5z n ASN 23 Ca 0.02 -0.92 -0.43 0.00 -0.03 0.00 0.00 54.58 53.22 1x5z n ASN 23 Cb 0.63 -3.23 -0.02 0.00 -0.61 0.00 0.00 39.78 36.54 1x5z n ASN 23 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1x5z s PHE 24 N -3.37 3.34 0.01 3.10 5.36 -1.25 -3.96 117.98 121.21 1x5z s PHE 24 Ca 0.62 1.45 -0.12 0.00 -0.96 0.00 0.00 56.93 57.93 1x5z s PHE 24 Cb -0.33 -3.25 0.01 0.00 -0.34 0.00 0.00 43.02 39.11 1x5z s PHE 24 CO 0.89 -0.47 0.24 -1.59 -1.46 0.00 0.00 175.22 172.83 1x5z s LYS 25 N 3.16 0.66 -0.16 10.12 -2.85 -0.85 -5.03 119.74 124.77 1x5z s LYS 25 Ca 0.44 -0.41 -0.02 0.00 -1.00 0.00 0.00 55.97 54.98 1x5z s LYS 25 Cb -0.15 0.28 -0.02 0.00 -2.06 0.00 0.00 37.83 35.89 1x5z s LYS 25 CO 0.06 -0.19 -0.09 0.00 0.10 0.00 0.00 175.35 175.24 1x5z s ALA 26 N -1.87 2.76 -0.05 0.59 0.00 -1.26 -2.38 121.76 119.54 1x5z s ALA 26 Ca -0.10 -0.95 -0.01 0.00 0.00 0.00 0.00 51.96 50.89 1x5z s ALA 26 Cb -0.04 -1.43 0.03 0.00 0.00 0.00 0.00 23.12 21.68 1x5z s ALA 26 CO 0.00 0.05 0.01 -1.21 0.00 0.00 0.00 175.76 174.61 1x5z s GLU 27 N 0.67 0.37 0.05 0.00 0.41 -0.83 -4.79 118.70 114.59 1x5z s GLU 27 Ca -0.05 0.16 -0.31 0.00 -0.41 0.00 0.00 54.97 54.37 1x5z s GLU 27 Cb -0.15 -0.73 -0.07 0.00 -1.78 0.00 0.00 34.13 31.40 1x5z s GLU 27 CO 0.02 -0.26 1.41 -1.25 -0.49 0.00 0.00 175.26 174.69 1x5z s PRO 28 N 1.76 4.30 -0.22 0.39 0.04 -1.26 -0.95 135.00 139.05 1x5z s PRO 28 Ca 0.01 2.03 0.12 0.00 0.04 0.00 0.00 61.00 63.20 1x5z s PRO 28 Cb -0.13 -3.44 -0.22 0.00 0.04 0.00 0.00 34.50 30.76 1x5z s PRO 28 CO -0.04 -0.52 -0.05 -0.85 0.04 0.00 0.00 177.00 175.59 1x5z n GLU 29 N 4.76 0.68 -3.24 4.56 0.28 -1.20 -4.82 120.64 121.66 1x5z n GLU 29 Ca 0.12 0.05 -0.11 0.00 -0.16 0.00 0.00 57.16 57.07 1x5z n GLU 29 Cb 0.43 -1.52 -0.04 0.00 1.43 0.00 0.00 31.44 31.74 1x5z n GLU 29 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1x5z n SER 30 N -2.94 -0.25 0.10 -1.84 2.88 -0.80 -4.99 113.62 105.78 1x5z n SER 30 Ca -0.38 -2.21 -0.03 0.00 -1.33 0.00 0.00 58.87 54.92 1x5z n SER 30 Cb 1.09 0.89 0.02 0.00 -0.75 0.00 0.00 64.21 65.46 1x5z n SER 30 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1x5z h GLU 31 N 0.00 0.00 0.00 -1.46 4.11 -1.94 -3.12 114.58 112.16 1x5z h GLU 31 Ca -0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.30 1x5z h GLU 31 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1x5z h GLU 31 CO 0.20 0.77 0.00 0.25 0.07 0.00 0.00 179.01 180.30 1x5z n THR 32 N -3.47 0.24 -4.34 -1.06 -2.24 -1.26 -3.24 114.28 98.91 1x5z n THR 32 Ca -0.00 -0.60 -0.20 0.00 -2.27 0.00 0.00 64.05 60.98 1x5z n THR 32 Cb 0.78 0.91 -0.10 0.00 -2.10 0.00 0.00 70.33 69.82 1x5z n THR 32 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1x5z s SER 33 N -0.24 2.60 -0.10 3.42 0.01 -1.25 -2.07 113.70 116.08 1x5z s SER 33 Ca 0.00 -0.96 -0.09 0.00 1.31 0.00 0.00 55.95 56.21 1x5z s SER 33 Cb 0.00 -0.14 0.03 0.00 0.21 0.00 0.00 66.02 66.11 1x5z s SER 33 CO 0.00 -0.12 0.26 -0.63 0.41 0.00 0.00 173.24 173.16 1x5z s ILE 34 N -2.61 0.00 0.01 1.44 1.01 0.37 -1.91 121.20 119.51 1x5z s ILE 34 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.83 1x5z s ILE 34 Cb -0.03 -0.38 -0.04 0.00 0.01 0.00 0.00 42.46 42.03 1x5z s ILE 34 CO 0.07 -0.01 0.09 -0.22 0.00 0.00 0.00 174.94 174.86 1x5z s LEU 35 N 0.09 3.90 -0.05 2.97 2.96 -0.13 -0.39 118.68 128.03 1x5z s LEU 35 Ca -0.00 0.12 0.06 0.00 -0.22 0.00 0.00 54.13 54.09 1x5z s LEU 35 Cb -0.02 -2.34 -0.01 0.00 0.50 0.00 0.00 46.19 44.32 1x5z s LEU 35 CO 0.00 0.25 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.30 1x5z s LEU 36 N -1.88 2.02 -0.25 -0.68 1.43 -0.96 -1.97 118.68 116.39 1x5z s LEU 36 Ca 0.24 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1x5z s LEU 36 Cb -0.12 -1.24 0.04 0.00 0.03 0.00 0.00 46.19 44.91 1x5z s LEU 36 CO 0.16 0.23 -0.09 -0.44 0.23 0.00 0.00 176.35 176.44 1x5z s SER 37 N -0.18 4.30 0.05 2.29 0.01 -1.00 -3.52 113.70 115.66 1x5z s SER 37 Ca -0.01 -1.09 -0.02 0.00 1.31 0.00 0.00 55.95 56.14 1x5z s SER 37 Cb -0.12 -1.61 -0.03 0.00 0.21 0.00 0.00 66.02 64.46 1x5z s SER 37 CO 0.02 -0.16 -0.01 -1.66 0.41 0.00 0.00 173.24 171.85 1x5z s TRP 38 N 1.23 0.45 -0.18 2.43 -2.14 -1.20 -2.01 118.94 117.52 1x5z s TRP 38 Ca -0.03 -0.96 -0.00 0.00 2.66 0.00 0.00 56.10 57.77 1x5z s TRP 38 Cb -0.18 -0.33 0.01 0.00 -3.10 0.00 0.00 33.47 29.86 1x5z s TRP 38 CO -0.05 -0.37 -0.15 0.99 -2.66 0.00 0.00 176.95 174.70 1x5z s THR 39 N -3.62 2.53 0.25 0.66 2.01 0.09 -4.66 115.64 112.90 1x5z s THR 39 Ca 0.04 -0.80 -0.30 0.00 0.31 0.00 0.00 61.69 60.95 1x5z s THR 39 Cb 0.06 -2.08 -0.09 0.00 0.01 0.00 0.00 72.50 70.39 1x5z s THR 39 CO -0.09 0.51 1.27 -2.16 -0.69 0.00 0.00 174.62 173.46 1x5z s PRO 40 N 1.14 4.42 1.17 4.92 0.04 -1.26 -1.98 135.00 143.45 1x5z s PRO 40 Ca 0.01 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 62.92 1x5z s PRO 40 Cb -0.14 -3.16 0.27 0.00 0.04 0.00 0.00 34.50 31.50 1x5z s PRO 40 CO -0.06 -0.16 1.11 -1.25 0.04 0.00 0.00 177.00 176.68 1x5z s PRO 41 N -0.77 -0.92 0.57 0.56 0.04 -1.26 -4.88 135.00 128.34 1x5z s PRO 41 Ca 0.53 0.04 0.29 0.00 0.04 0.00 0.00 61.00 61.89 1x5z s PRO 41 Cb -0.37 -1.62 1.48 0.00 0.04 0.00 0.00 34.50 34.03 1x5z s PRO 41 CO 0.43 -3.53 1.92 -0.09 0.04 0.00 0.00 177.00 175.76 1x5z h ARG 42 N -2.46 0.00 -6.01 4.56 9.65 -1.97 -3.41 114.38 114.75 1x5z h ARG 42 Ca -0.47 0.00 -0.64 0.00 -1.10 0.00 0.00 59.98 57.78 1x5z h ARG 42 Cb 1.30 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.87 1x5z h ARG 42 CO 0.39 0.00 1.42 0.45 2.80 0.00 0.00 179.97 185.03 1x5z n SER 43 N -3.91 2.68 0.06 -3.80 2.88 -1.26 -4.80 113.62 105.45 1x5z n SER 43 Ca 0.10 0.38 0.13 0.00 -1.33 0.00 0.00 58.87 58.14 1x5z n SER 43 Cb 0.69 -1.38 0.34 0.00 -0.75 0.00 0.00 64.21 63.11 1x5z n SER 43 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1x5z n ASP 44 N 10.29 0.58 -4.37 -3.46 8.00 -1.26 -4.62 116.55 121.71 1x5z n ASP 44 Ca 0.35 0.29 -0.45 0.00 0.71 0.00 0.00 54.79 55.69 1x5z n ASP 44 Cb 0.32 -0.27 -0.04 0.00 -0.02 0.00 0.00 41.12 41.12 1x5z n ASP 44 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1x5z s THR 45 N -3.09 5.04 -0.08 -3.53 -4.23 -1.26 -5.00 115.64 103.49 1x5z s THR 45 Ca 0.10 -1.48 -0.02 0.00 -1.18 0.00 0.00 61.69 59.11 1x5z s THR 45 Cb 0.15 -4.50 0.03 0.00 1.34 0.00 0.00 72.50 69.52 1x5z s THR 45 CO 0.64 -1.12 0.04 -0.63 -0.54 0.00 0.00 174.62 173.01 1x5z s ILE 46 N 1.97 0.11 -0.03 2.99 1.01 -1.26 -4.93 121.20 121.06 1x5z s ILE 46 Ca 0.15 0.18 -0.22 0.00 0.00 0.00 0.00 60.65 60.76 1x5z s ILE 46 Cb -0.19 -0.40 -0.26 0.00 0.01 0.00 0.00 42.46 41.62 1x5z s ILE 46 CO 0.00 0.13 1.00 0.00 0.00 0.00 0.00 174.94 176.07 1x5z h ALA 47 N 8.38 0.01 -2.29 9.38 0.00 -1.93 -3.43 119.26 129.39 1x5z h ALA 47 Ca -0.15 -0.58 0.27 0.00 0.00 0.00 0.00 54.91 54.46 1x5z h ALA 47 Cb 1.13 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 1x5z h ALA 47 CO 0.22 0.27 0.78 0.27 0.00 0.00 0.00 179.25 180.79 1x5z n ASN 48 N -4.29 -1.39 -4.36 0.00 0.23 -1.22 -3.79 115.26 100.44 1x5z n ASN 48 Ca -0.11 -1.49 -0.31 0.00 -0.53 0.00 0.00 54.58 52.14 1x5z n ASN 48 Cb 0.66 2.20 -0.15 0.00 -2.08 0.00 0.00 39.78 40.41 1x5z n ASN 48 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 1x5z s TYR 49 N -2.07 2.39 -0.21 -2.53 1.51 -1.17 -0.49 117.35 114.78 1x5z s TYR 49 Ca 0.27 -0.38 -0.16 0.00 -1.01 0.00 0.00 57.07 55.79 1x5z s TYR 49 Cb -0.02 -1.46 -0.04 0.00 -0.11 0.00 0.00 41.96 40.34 1x5z s TYR 49 CO 0.02 0.10 0.41 -2.00 -1.11 0.00 0.00 175.55 172.96 1x5z s GLU 50 N -1.03 4.16 -0.50 -0.62 2.56 -0.17 -3.35 118.70 119.76 1x5z s GLU 50 Ca 0.12 0.20 -0.02 0.00 0.00 0.00 0.00 54.97 55.27 1x5z s GLU 50 Cb -0.10 -3.55 0.13 0.00 2.00 0.00 0.00 34.13 32.61 1x5z s GLU 50 CO 0.01 -0.08 0.30 -1.17 -0.56 0.00 0.00 175.26 173.76 1x5z s LEU 51 N 1.43 5.18 -0.86 2.70 2.96 -1.25 -1.69 118.68 127.16 1x5z s LEU 51 Ca 0.19 -2.41 -0.20 0.00 -0.22 0.00 0.00 54.13 51.49 1x5z s LEU 51 Cb -0.15 -1.82 0.11 0.00 0.50 0.00 0.00 46.19 44.83 1x5z s LEU 51 CO 0.08 -0.45 1.10 -0.69 -1.32 0.00 0.00 176.35 175.07 1x5z s VAL 52 N 0.58 4.57 0.16 1.68 1.01 -0.18 -3.02 120.40 125.21 1x5z s VAL 52 Ca 0.12 -1.20 0.08 0.00 0.00 0.00 0.00 61.98 60.99 1x5z s VAL 52 Cb -0.22 -4.77 -0.04 0.00 0.00 0.00 0.00 36.38 31.35 1x5z s VAL 52 CO -0.04 -1.52 -0.06 -0.72 0.00 0.00 0.00 175.10 172.76 1x5z s TYR 53 N 3.20 2.72 0.03 5.22 1.13 -0.72 -2.73 117.35 126.20 1x5z s TYR 53 Ca 0.30 -0.18 -0.07 0.00 -1.41 0.00 0.00 57.07 55.72 1x5z s TYR 53 Cb -0.08 -1.34 -0.01 0.00 -1.10 0.00 0.00 41.96 39.43 1x5z s TYR 53 CO -0.04 0.50 0.12 -1.59 -2.51 0.00 0.00 175.55 172.03 1x5z s LYS 54 N -2.75 0.58 -0.65 -3.49 -2.85 -1.19 -0.94 119.74 108.44 1x5z s LYS 54 Ca 0.25 -0.64 -0.27 0.00 -1.00 0.00 0.00 55.97 54.31 1x5z s LYS 54 Cb -0.09 0.23 0.01 0.00 -2.06 0.00 0.00 37.83 35.92 1x5z s LYS 54 CO 0.16 -0.15 1.52 0.34 0.10 0.00 0.00 175.35 177.32 1x5z s ASP 55 N -1.92 5.84 0.43 0.03 2.15 -1.26 -3.16 116.67 118.77 1x5z s ASP 55 Ca -0.08 0.00 0.00 0.00 0.43 0.00 0.00 52.55 52.91 1x5z s ASP 55 Cb -0.03 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 1x5z s ASP 55 CO -0.03 -2.00 0.00 0.61 -0.17 0.00 0.00 175.17 173.58 1x5z n GLY 56 N 5.47 0.15 0.10 2.66 0.00 -1.17 -1.80 105.19 110.60 1x5z n GLY 56 Ca 0.11 -0.91 -0.18 0.00 0.00 0.00 0.00 46.02 45.03 1x5z n GLY 56 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1x5z h GLU 57 N 0.00 0.08 -0.97 1.61 4.81 -1.90 -3.33 114.58 114.88 1x5z h GLU 57 Ca 0.00 -0.14 -0.14 0.00 -0.13 0.00 0.00 59.36 58.95 1x5z h GLU 57 Cb 0.00 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 29.35 1x5z h GLU 57 CO 0.00 1.07 0.18 0.72 -0.73 0.00 0.00 179.01 180.24 1x5z n HIS 58 N -4.37 0.97 -2.32 0.92 8.25 -1.26 -4.91 115.22 112.51 1x5z n HIS 58 Ca -0.20 -0.81 -0.28 0.00 -0.26 0.00 0.00 57.72 56.17 1x5z n HIS 58 Cb 0.66 -0.44 0.01 0.00 1.12 0.00 0.00 29.99 31.35 1x5z n HIS 58 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1x5z s GLY 59 N 0.12 1.58 -0.13 -1.41 0.00 -0.74 -4.93 107.32 101.80 1x5z s GLY 59 Ca 0.19 -0.44 -0.19 0.00 0.00 0.00 0.00 44.72 44.28 1x5z s GLY 59 CO 0.04 -0.20 0.51 1.85 0.00 0.00 0.00 173.10 175.29 1x5z s GLU 60 N -4.97 4.31 0.37 2.90 2.56 -1.26 -4.64 118.70 117.97 1x5z s GLU 60 Ca 0.52 0.48 -0.28 0.00 0.00 0.00 0.00 54.97 55.69 1x5z s GLU 60 Cb -0.11 -3.47 -0.11 0.00 2.00 0.00 0.00 34.13 32.45 1x5z s GLU 60 CO 0.48 0.08 1.44 -1.21 -0.56 0.00 0.00 175.26 175.49 1x5z s GLU 61 N 0.87 4.13 -0.04 4.30 2.02 -1.26 -4.22 118.70 124.50 1x5z s GLU 61 Ca 0.26 2.48 -0.03 0.00 0.02 0.00 0.00 54.97 57.71 1x5z s GLU 61 Cb -0.15 -2.97 0.02 0.00 0.10 0.00 0.00 34.13 31.13 1x5z s GLU 61 CO 0.11 -0.48 0.10 -0.65 0.02 0.00 0.00 175.26 174.36 1x5z s GLN 62 N -2.06 0.08 -0.20 1.61 -1.52 -0.12 -4.92 119.66 112.53 1x5z s GLN 62 Ca 0.52 0.23 -0.08 0.00 -1.95 0.00 0.00 55.36 54.08 1x5z s GLN 62 Cb -0.45 -0.08 -0.04 0.00 -0.22 0.00 0.00 33.01 32.22 1x5z s GLN 62 CO 0.60 -0.09 0.08 1.03 -0.25 0.00 0.00 175.29 176.66 1x5z s ARG 63 N 0.62 3.96 -0.05 2.91 0.52 -1.25 -1.76 118.95 123.89 1x5z s ARG 63 Ca -0.05 -0.34 0.00 0.00 -0.52 0.00 0.00 55.73 54.82 1x5z s ARG 63 Cb -0.07 -3.29 -0.03 0.00 0.52 0.00 0.00 34.95 32.08 1x5z s ARG 63 CO -0.03 0.17 -0.03 0.42 0.02 0.00 0.00 175.30 175.86 1x5z s ILE 64 N 0.66 3.98 -0.80 1.52 1.01 -1.17 -4.91 121.20 121.50 1x5z s ILE 64 Ca 0.04 -0.46 -0.26 0.00 0.00 0.00 0.00 60.65 59.98 1x5z s ILE 64 Cb -0.13 -2.68 0.03 0.00 0.01 0.00 0.00 42.46 39.69 1x5z s ILE 64 CO 0.01 0.54 1.35 -0.89 0.00 0.00 0.00 174.94 175.96 1x5z s THR 65 N -0.91 3.74 0.09 2.92 2.01 -1.26 -3.86 115.64 118.38 1x5z s THR 65 Ca 0.14 0.13 -0.03 0.00 0.31 0.00 0.00 61.69 62.25 1x5z s THR 65 Cb -0.11 -4.90 -0.05 0.00 0.01 0.00 0.00 72.50 67.46 1x5z s THR 65 CO 0.04 -1.82 0.29 -0.63 -0.69 0.00 0.00 174.62 171.81 1x5z s ILE 66 N 5.78 5.28 0.35 1.82 1.01 -1.21 -5.01 121.20 129.21 1x5z s ILE 66 Ca 0.39 -0.14 -0.26 0.00 0.00 0.00 0.00 60.65 60.64 1x5z s ILE 66 Cb -0.06 -3.62 -0.09 0.00 0.01 0.00 0.00 42.46 38.69 1x5z s ILE 66 CO 0.09 0.12 1.04 -1.61 0.00 0.00 0.00 174.94 174.58 1x5z s GLU 67 N -2.50 4.39 -1.18 2.79 2.02 -1.26 -3.04 118.70 119.90 1x5z s GLU 67 Ca 0.37 1.56 -0.23 0.00 0.02 0.00 0.00 54.97 56.69 1x5z s GLU 67 Cb -0.13 -2.79 -0.09 0.00 0.10 0.00 0.00 34.13 31.23 1x5z s GLU 67 CO 0.25 0.05 1.94 -1.25 0.02 0.00 0.00 175.26 176.27 1x5z s PRO 68 N -2.09 2.48 0.00 0.39 0.04 -1.25 -4.60 135.00 129.98 1x5z s PRO 68 Ca 0.52 -1.16 0.00 0.00 0.04 0.00 0.00 61.00 60.40 1x5z s PRO 68 Cb -0.24 -5.24 0.00 0.00 0.04 0.00 0.00 34.50 29.06 1x5z s PRO 68 CO 0.31 -4.00 0.00 0.41 0.04 0.00 0.00 177.00 173.76 1x5z n GLY 69 N 5.81 4.22 0.00 0.56 0.00 -1.26 -5.00 105.19 109.52 1x5z n GLY 69 Ca 0.45 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1x5z n GLY 69 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x5z n THR 70 N 0.00 0.00 -4.36 2.61 -2.24 -1.26 -4.69 114.28 104.34 1x5z n THR 70 Ca 0.00 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.55 1x5z n THR 70 Cb 0.00 -0.31 -0.11 0.00 -2.10 0.00 0.00 70.33 67.81 1x5z n THR 70 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1x5z s SER 71 N -3.51 2.86 -0.03 3.42 1.04 -1.26 -3.23 113.70 112.98 1x5z s SER 71 Ca 0.00 -0.88 -0.11 0.00 0.48 0.00 0.00 55.95 55.44 1x5z s SER 71 Cb 0.00 -0.18 0.02 0.00 0.10 0.00 0.00 66.02 65.96 1x5z s SER 71 CO 0.00 -0.01 0.24 -0.47 0.98 0.00 0.00 173.24 173.98 1x5z s TYR 72 N -2.06 -0.14 -0.33 5.02 5.04 -1.23 -5.00 117.35 118.65 1x5z s TYR 72 Ca 0.18 0.25 -0.03 0.00 -2.44 0.00 0.00 57.07 55.03 1x5z s TYR 72 Cb -0.06 0.05 0.06 0.00 0.35 0.00 0.00 41.96 42.36 1x5z s TYR 72 CO 0.08 -0.29 0.07 0.50 -1.34 0.00 0.00 175.55 174.56 1x5z s ARG 73 N -0.97 2.36 0.07 4.97 3.52 -1.26 -2.26 118.95 125.39 1x5z s ARG 73 Ca -0.10 -1.38 -0.23 0.00 -0.13 0.00 0.00 55.73 53.88 1x5z s ARG 73 Cb -0.05 -3.33 -0.06 0.00 -1.56 0.00 0.00 34.95 29.95 1x5z s ARG 73 CO 0.02 -0.73 0.70 -1.17 -0.81 0.00 0.00 175.30 173.31 1x5z s LEU 74 N 1.25 4.49 0.09 -0.88 2.96 0.47 -4.92 118.68 122.15 1x5z s LEU 74 Ca -0.01 1.41 0.02 0.00 -0.22 0.00 0.00 54.13 55.33 1x5z s LEU 74 Cb -0.20 -3.12 -0.04 0.00 0.50 0.00 0.00 46.19 43.33 1x5z s LEU 74 CO -0.01 0.13 -0.08 -1.10 -1.32 0.00 0.00 176.35 173.97 1x5z s GLN 75 N -0.55 0.80 0.00 1.98 -0.21 -1.26 -0.48 119.66 119.93 1x5z s GLN 75 Ca 0.34 -1.21 0.00 0.00 0.02 0.00 0.00 55.36 54.52 1x5z s GLN 75 Cb -0.21 -0.32 0.00 0.00 1.00 0.00 0.00 33.01 33.49 1x5z s GLN 75 CO 0.22 0.02 0.00 0.41 -2.12 0.00 0.00 175.29 173.82 1x5z n GLY 76 N 0.32 0.83 3.37 3.09 0.00 -0.88 -5.00 105.19 106.92 1x5z n GLY 76 Ca -0.15 -0.59 -0.22 0.00 0.00 0.00 0.00 46.02 45.07 1x5z n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x5z s LEU 77 N -0.64 1.82 -0.03 0.99 1.43 -0.94 -5.06 118.68 116.24 1x5z s LEU 77 Ca 0.00 -1.73 -0.01 0.00 -1.03 0.00 0.00 54.13 51.36 1x5z s LEU 77 Cb 0.00 0.32 -0.04 0.00 0.03 0.00 0.00 46.19 46.51 1x5z s LEU 77 CO 0.00 -1.02 0.05 -0.54 0.23 0.00 0.00 176.35 175.07 1x5z s LYS 78 N -3.55 3.04 0.79 1.70 1.02 -1.26 -4.59 119.74 116.87 1x5z s LYS 78 Ca 0.34 -0.45 -0.11 0.00 0.02 0.00 0.00 55.97 55.77 1x5z s LYS 78 Cb 0.02 -2.84 0.06 0.00 -0.52 0.00 0.00 37.83 34.55 1x5z s LYS 78 CO 0.23 0.67 1.09 -1.25 -0.92 0.00 0.00 175.35 175.17 1x5z s PRO 79 N -1.43 2.15 -1.30 -1.68 0.04 -1.20 -3.80 135.00 127.78 1x5z s PRO 79 Ca 0.19 1.13 -0.10 0.00 0.04 0.00 0.00 61.00 62.27 1x5z s PRO 79 Cb -0.12 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.55 1x5z s PRO 79 CO 0.10 -1.71 0.18 -1.71 0.04 0.00 0.00 177.00 173.89 1x5z n ASN 80 N -3.56 -0.48 -3.84 6.66 2.85 -0.84 -4.87 115.26 111.18 1x5z n ASN 80 Ca 0.09 -1.15 -0.12 0.00 -0.11 0.00 0.00 54.58 53.28 1x5z n ASN 80 Cb 0.53 -1.42 -0.12 0.00 1.24 0.00 0.00 39.78 40.01 1x5z n ASN 80 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1x5z s SER 81 N -4.08 -0.10 0.04 1.20 0.01 -1.25 -5.00 113.70 104.52 1x5z s SER 81 Ca 0.13 0.16 -0.24 0.00 1.31 0.00 0.00 55.95 57.31 1x5z s SER 81 Cb -0.07 0.27 -0.05 0.00 0.21 0.00 0.00 66.02 66.38 1x5z s SER 81 CO 0.89 -0.13 0.74 -0.22 0.41 0.00 0.00 173.24 174.93 1x5z s LEU 82 N -0.30 4.44 -0.04 2.44 2.96 -1.26 -3.47 118.68 123.45 1x5z s LEU 82 Ca -0.04 1.40 -0.01 0.00 -0.22 0.00 0.00 54.13 55.27 1x5z s LEU 82 Cb -0.03 -3.19 0.03 0.00 0.50 0.00 0.00 46.19 43.51 1x5z s LEU 82 CO 0.00 0.03 0.04 -0.31 -1.32 0.00 0.00 176.35 174.79 1x5z s TYR 83 N -0.07 0.18 0.48 5.38 2.02 -1.24 -3.04 117.35 121.07 1x5z s TYR 83 Ca 0.37 0.13 -0.19 0.00 -0.37 0.00 0.00 57.07 57.01 1x5z s TYR 83 Cb -0.20 -0.46 -0.09 0.00 -0.40 0.00 0.00 41.96 40.81 1x5z s TYR 83 CO 0.22 -0.18 0.99 0.71 -1.57 0.00 0.00 175.55 175.73 1x5z s TYR 84 N 1.74 3.22 -0.02 2.71 1.51 -1.19 -3.10 117.35 122.21 1x5z s TYR 84 Ca -0.00 1.56 -0.06 0.00 -1.01 0.00 0.00 57.07 57.56 1x5z s TYR 84 Cb -0.12 -2.91 0.01 0.00 -0.11 0.00 0.00 41.96 38.82 1x5z s TYR 84 CO -0.03 -0.48 0.13 -0.06 -1.11 0.00 0.00 175.55 174.01 1x5z s PHE 85 N -2.25 -0.04 -0.11 2.71 0.08 0.39 -3.20 117.98 115.56 1x5z s PHE 85 Ca 0.63 0.09 -0.04 0.00 0.12 0.00 0.00 56.93 57.73 1x5z s PHE 85 Cb -0.12 -0.01 0.05 0.00 -0.57 0.00 0.00 43.02 42.38 1x5z s PHE 85 CO 0.22 -0.19 0.23 1.03 -0.10 0.00 0.00 175.22 176.41 1x5z s ARG 86 N -0.71 0.14 0.08 0.44 1.81 -1.10 -2.64 118.95 116.97 1x5z s ARG 86 Ca -0.08 0.62 -0.01 0.00 -1.72 0.00 0.00 55.73 54.54 1x5z s ARG 86 Cb -0.05 -0.11 -0.04 0.00 -0.45 0.00 0.00 34.95 34.30 1x5z s ARG 86 CO 0.01 -0.24 0.26 -1.17 -0.68 0.00 0.00 175.30 173.47 1x5z s LEU 87 N 1.96 4.33 -0.30 2.53 2.96 -1.25 -1.01 118.68 127.91 1x5z s LEU 87 Ca -0.02 0.36 -0.03 0.00 -0.22 0.00 0.00 54.13 54.21 1x5z s LEU 87 Cb -0.11 -3.06 0.19 0.00 0.50 0.00 0.00 46.19 43.71 1x5z s LEU 87 CO -0.08 0.14 0.74 0.00 -1.32 0.00 0.00 176.35 175.83 1x5z s ALA 88 N -1.55 -2.71 0.14 5.97 0.00 -0.68 -0.63 121.76 122.30 1x5z s ALA 88 Ca 0.37 1.55 -0.34 0.00 0.00 0.00 0.00 51.96 53.53 1x5z s ALA 88 Cb -0.13 -2.38 -0.16 0.00 0.00 0.00 0.00 23.12 20.46 1x5z s ALA 88 CO 0.27 -1.53 1.29 0.00 0.00 0.00 0.00 175.76 175.79 1x5z n ALA 89 N 5.41 -0.53 -3.12 0.00 0.00 -1.25 -1.00 120.51 120.03 1x5z n ALA 89 Ca -0.00 0.48 -0.34 0.00 0.00 0.00 0.00 53.44 53.58 1x5z n ALA 89 Cb 0.53 -2.09 -0.13 0.00 0.00 0.00 0.00 19.45 17.76 1x5z n ALA 89 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1x5z s ARG 90 N 0.06 3.55 0.04 0.00 3.52 0.35 -2.60 118.95 123.87 1x5z s ARG 90 Ca 0.78 -0.57 0.09 0.00 -0.13 0.00 0.00 55.73 55.89 1x5z s ARG 90 Cb -0.86 -2.92 -0.03 0.00 -1.56 0.00 0.00 34.95 29.58 1x5z s ARG 90 CO 0.49 0.10 -0.26 0.45 -0.81 0.00 0.00 175.30 175.26 1x5z s SER 91 N 0.73 3.08 0.00 -2.12 0.15 -1.26 -3.02 113.70 111.26 1x5z s SER 91 Ca -0.02 -0.57 0.11 0.00 0.70 0.00 0.00 55.95 56.17 1x5z s SER 91 Cb -0.15 -0.28 0.67 0.00 -1.71 0.00 0.00 66.02 64.55 1x5z s SER 91 CO 0.02 0.25 1.10 -0.81 1.20 0.00 0.00 173.24 175.01 1x5z n PRO 92 N 1.83 0.49 -0.00 5.44 -0.04 -1.26 -2.03 135.00 139.42 1x5z n PRO 92 Ca -0.17 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.33 1x5z n PRO 92 Cb 0.52 -1.36 -0.05 0.00 -0.04 0.00 0.00 33.50 32.57 1x5z n PRO 92 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1x5z n GLN 93 N -0.86 0.61 0.00 0.54 3.00 -1.26 -5.05 117.38 114.35 1x5z n GLN 93 Ca 0.08 -0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.02 1x5z n GLN 93 Cb 0.04 -1.13 0.00 0.00 0.00 0.00 0.00 30.24 29.15 1x5z n GLN 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1x5z n GLY 94 N 2.03 2.60 3.52 1.08 0.00 -0.86 -4.91 105.19 108.66 1x5z n GLY 94 Ca -0.01 0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 1x5z n GLY 94 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1x5z n LEU 95 N 0.00 1.21 0.00 0.99 0.00 -1.26 -4.20 117.00 113.74 1x5z n LEU 95 Ca 0.00 0.93 0.00 0.00 0.00 0.00 0.00 56.01 56.94 1x5z n LEU 95 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 43.42 42.20 1x5z n LEU 95 CO 0.00 -2.35 0.00 0.61 0.00 0.00 0.00 177.39 175.65 1x5z n GLY 96 N 1.55 1.05 3.84 -3.96 0.00 -1.07 -4.74 105.19 101.85 1x5z n GLY 96 Ca 0.11 -0.71 -0.24 0.00 0.00 0.00 0.00 46.02 45.18 1x5z n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x5z s ALA 97 N -3.32 4.02 0.04 4.61 0.00 -1.26 -4.97 121.76 120.88 1x5z s ALA 97 Ca 0.00 -1.74 0.08 0.00 0.00 0.00 0.00 51.96 50.31 1x5z s ALA 97 Cb 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 23.12 22.40 1x5z s ALA 97 CO 0.00 -0.27 -0.24 -1.54 0.00 0.00 0.00 175.76 173.71 1x5z s SER 98 N -4.09 3.38 0.99 0.00 1.04 -1.26 -3.76 113.70 110.00 1x5z s SER 98 Ca 0.40 -0.53 -0.14 0.00 0.48 0.00 0.00 55.95 56.16 1x5z s SER 98 Cb -0.00 -0.40 0.18 0.00 0.10 0.00 0.00 66.02 65.90 1x5z s SER 98 CO 0.23 0.26 1.14 0.42 0.98 0.00 0.00 173.24 176.28 1x5z s THR 99 N -0.84 1.92 0.82 2.02 -4.23 0.20 -4.98 115.64 110.55 1x5z s THR 99 Ca 0.13 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.50 1x5z s THR 99 Cb -0.10 -2.67 0.06 0.00 1.34 0.00 0.00 72.50 71.12 1x5z s THR 99 CO 0.03 0.00 0.98 0.00 -0.54 0.00 0.00 174.62 175.09 1x5z n ALA 100 N -4.05 -0.64 -2.27 3.99 0.00 -1.26 -4.67 120.51 111.62 1x5z n ALA 100 Ca 0.08 -0.36 -0.40 0.00 0.00 0.00 0.00 53.44 52.76 1x5z n ALA 100 Cb 0.59 -2.12 -0.03 0.00 0.00 0.00 0.00 19.45 17.89 1x5z n ALA 100 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1x5z s GLU 101 N -3.84 3.05 0.05 0.00 2.12 -1.26 -4.78 118.70 114.04 1x5z s GLU 101 Ca 0.70 0.46 0.04 0.00 0.36 0.00 0.00 54.97 56.53 1x5z s GLU 101 Cb -0.29 -4.23 -0.04 0.00 0.26 0.00 0.00 34.13 29.83 1x5z s GLU 101 CO 0.54 -2.24 -0.06 0.96 -0.54 0.00 0.00 175.26 173.93 1x5z s ILE 102 N 7.10 3.70 0.01 -3.70 -4.36 -1.08 -4.98 121.20 117.89 1x5z s ILE 102 Ca 0.56 -0.93 0.02 0.00 -0.26 0.00 0.00 60.65 60.04 1x5z s ILE 102 Cb -0.12 -2.68 -0.01 0.00 1.25 0.00 0.00 42.46 40.91 1x5z s ILE 102 CO 0.22 0.26 -0.05 -0.94 0.24 0.00 0.00 174.94 174.68 1x5z s SER 103 N -1.81 0.60 -0.01 4.36 1.04 -1.26 -0.46 113.70 116.15 1x5z s SER 103 Ca 0.20 -0.23 0.05 0.00 0.48 0.00 0.00 55.95 56.45 1x5z s SER 103 Cb -0.11 -0.02 -0.01 0.00 0.10 0.00 0.00 66.02 65.97 1x5z s SER 103 CO 0.12 -0.03 -0.15 0.00 0.98 0.00 0.00 173.24 174.15 1x5z s ALA 104 N -0.52 1.24 -0.24 5.32 0.00 -1.18 -4.90 121.76 121.48 1x5z s ALA 104 Ca -0.02 -0.65 -0.14 0.00 0.00 0.00 0.00 51.96 51.15 1x5z s ALA 104 Cb -0.04 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.72 1x5z s ALA 104 CO -0.00 0.31 0.35 0.50 0.00 0.00 0.00 175.76 176.91 1x5z s ARG 105 N -0.35 4.08 1.26 0.00 3.52 -1.26 -3.64 118.95 122.56 1x5z s ARG 105 Ca 0.06 0.04 -0.18 0.00 -0.13 0.00 0.00 55.73 55.51 1x5z s ARG 105 Cb -0.06 -3.60 0.31 0.00 -1.56 0.00 0.00 34.95 30.04 1x5z s ARG 105 CO -0.01 -0.14 1.02 0.95 -0.81 0.00 0.00 175.30 176.31 1x5z s THR 106 N 1.66 1.58 0.40 4.11 -4.23 -1.23 -4.67 115.64 113.26 1x5z s THR 106 Ca 0.15 0.00 -0.23 0.00 -1.18 0.00 0.00 61.69 60.43 1x5z s THR 106 Cb -0.15 -2.23 -0.09 0.00 1.34 0.00 0.00 72.50 71.36 1x5z s THR 106 CO 0.08 0.00 1.01 -0.04 -0.54 0.00 0.00 174.62 175.13 1x5z s MET 107 N -5.02 4.22 -0.80 3.99 1.00 -1.18 -4.05 119.30 117.46 1x5z s MET 107 Ca 0.69 1.38 -0.26 0.00 0.00 0.00 0.00 55.69 57.50 1x5z s MET 107 Cb -0.15 -2.47 0.02 0.00 0.00 0.00 0.00 34.83 32.23 1x5z s MET 107 CO 0.59 -0.07 1.48 1.14 0.00 0.00 0.00 175.02 178.16 1x5z s GLN 108 N -2.63 3.14 -0.80 2.03 0.00 -1.26 -1.99 119.66 118.14 1x5z s GLN 108 Ca 0.58 -0.31 -0.26 0.00 -0.00 0.00 0.00 55.36 55.37 1x5z s GLN 108 Cb -0.18 -4.58 -0.18 0.00 0.00 0.00 0.00 33.01 28.08 1x5z s GLN 108 CO 0.23 -2.37 2.50 -1.13 0.00 0.00 0.00 175.29 174.52 1x5z n SER 109 N 10.23 0.93 -4.09 12.60 3.41 -1.26 -4.88 113.62 130.56 1x5z n SER 109 Ca 0.16 -0.35 -0.32 0.00 -0.26 0.00 0.00 58.87 58.10 1x5z n SER 109 Cb 0.50 -1.18 -0.16 0.00 -0.26 0.00 0.00 64.21 63.11 1x5z n SER 109 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1x5z s SER 110 N 9.15 3.31 0.00 4.04 0.15 -1.26 -4.96 113.70 124.13 1x5z s SER 110 Ca 1.17 -0.77 0.00 0.00 0.70 0.00 0.00 55.95 57.05 1x5z s SER 110 Cb -0.70 -1.44 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 1x5z s SER 110 CO 0.37 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.38 1x5z n GLY 111 N 4.61 0.56 3.59 9.45 0.00 -1.26 -5.09 105.19 117.05 1x5z n GLY 111 Ca -0.19 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 1x5z n GLY 111 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5z s PRO 112 N 0.00 3.25 0.27 1.61 0.04 -1.26 -4.99 135.00 133.91 1x5z s PRO 112 Ca 0.00 1.17 0.07 0.00 0.04 0.00 0.00 61.00 62.28 1x5z s PRO 112 Cb 0.00 -4.20 -0.04 0.00 0.04 0.00 0.00 34.50 30.31 1x5z s PRO 112 CO 0.00 -1.96 0.19 0.45 0.04 0.00 0.00 177.00 175.72 1x5z s SER 113 N 6.02 5.38 -0.17 6.66 0.15 -1.26 -5.12 113.70 125.37 1x5z s SER 113 Ca 0.73 -0.33 0.01 0.00 0.70 0.00 0.00 55.95 57.06 1x5z s SER 113 Cb -0.19 -1.27 0.02 0.00 -1.71 0.00 0.00 66.02 62.87 1x5z s SER 113 CO 0.31 -0.09 -0.16 -0.55 1.20 0.00 0.00 173.24 173.95 1x5z s SER 114 N -3.85 2.97 0.00 5.45 0.15 -1.26 -5.32 113.70 111.84 1x5z s SER 114 Ca 0.34 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.38 1x5z s SER 114 Cb -0.07 -1.32 0.00 0.00 -1.71 0.00 0.00 66.02 62.92 1x5z s SER 114 CO 0.25 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.25