#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5z s SER 2 N 0.00 -0.23 -1.07 1.61 1.04 -1.26 -5.00 113.70 108.79 1x5z s SER 2 Ca 0.00 -0.11 -0.04 0.00 0.48 0.00 0.00 55.95 56.28 1x5z s SER 2 Cb 0.00 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1x5z s SER 2 CO 0.00 -0.57 0.91 -0.24 0.98 0.00 0.00 173.24 174.33 1x5z n SER 3 N -0.30 -3.86 -4.64 7.02 2.88 -1.26 -5.00 113.62 108.47 1x5z n SER 3 Ca -0.06 -0.48 -0.35 0.00 -1.33 0.00 0.00 58.87 56.65 1x5z n SER 3 Cb 0.61 -4.32 -0.10 0.00 -0.75 0.00 0.00 64.21 59.65 1x5z n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x5z s GLY 4 N -3.70 1.87 -0.17 0.46 0.00 -1.26 -5.08 107.32 99.44 1x5z s GLY 4 Ca 0.25 -0.77 -0.31 0.00 0.00 0.00 0.00 44.72 43.88 1x5z s GLY 4 CO 0.61 -0.19 1.11 -0.45 0.00 0.00 0.00 173.10 174.18 1x5z s SER 5 N -0.11 -0.23 -0.28 1.64 0.15 -1.26 -5.18 113.70 108.43 1x5z s SER 5 Ca 0.05 0.14 -0.22 0.00 0.70 0.00 0.00 55.95 56.63 1x5z s SER 5 Cb -0.12 0.21 0.11 0.00 -1.71 0.00 0.00 66.02 64.51 1x5z s SER 5 CO 0.02 -0.30 0.89 -0.55 1.20 0.00 0.00 173.24 174.50 1x5z s SER 6 N -1.65 -0.61 0.00 5.45 0.15 -1.26 -5.14 113.70 110.64 1x5z s SER 6 Ca 0.05 1.10 0.00 0.00 0.70 0.00 0.00 55.95 57.80 1x5z s SER 6 Cb -0.01 1.16 0.00 0.00 -1.71 0.00 0.00 66.02 65.46 1x5z s SER 6 CO -0.04 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.83 1x5z n GLY 7 N 2.94 0.50 2.92 9.45 0.00 -1.26 -5.10 105.19 114.64 1x5z n GLY 7 Ca -0.15 -1.28 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 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 -0.22 0.23 0.40 1.61 1.11 -1.26 -5.16 116.67 113.38 1x5z s ASP 8 Ca 0.00 0.12 0.07 0.00 0.18 0.00 0.00 52.55 52.92 1x5z s ASP 8 Cb 0.00 1.14 -0.07 0.00 1.07 0.00 0.00 42.92 45.06 1x5z s ASP 8 CO 0.00 -0.31 0.05 0.27 1.18 0.00 0.00 175.17 176.36 1x5z s ILE 9 N 2.55 2.14 -0.29 0.77 -4.36 -1.26 -5.12 121.20 115.64 1x5z s ILE 9 Ca 0.12 -1.93 -0.05 0.00 -0.26 0.00 0.00 60.65 58.53 1x5z s ILE 9 Cb -0.15 -2.96 0.02 0.00 1.25 0.00 0.00 42.46 40.62 1x5z s ILE 9 CO -0.19 -0.03 0.04 -1.58 0.24 0.00 0.00 174.94 173.42 1x5z s GLN 10 N -3.75 2.92 -0.42 0.37 0.74 -1.26 -5.07 119.66 113.19 1x5z s GLN 10 Ca 0.36 -0.96 -0.10 0.00 0.05 0.00 0.00 55.36 54.72 1x5z s GLN 10 Cb 0.07 -3.26 0.07 0.00 1.10 0.00 0.00 33.01 31.00 1x5z s GLN 10 CO 0.19 -0.47 0.26 0.08 -0.55 0.00 0.00 175.29 174.81 1x5z s VAL 11 N 1.42 4.33 0.32 1.34 1.01 -1.26 -5.08 120.40 122.48 1x5z s VAL 11 Ca 0.01 -1.32 -0.28 0.00 0.00 0.00 0.00 61.98 60.39 1x5z s VAL 11 Cb -0.17 -3.62 -0.09 0.00 0.00 0.00 0.00 36.38 32.49 1x5z s VAL 11 CO 0.00 -0.48 1.08 -0.63 0.00 0.00 0.00 175.10 175.07 1x5z s ILE 12 N 1.45 3.56 -0.34 2.22 1.09 -1.26 -4.92 121.20 123.00 1x5z s ILE 12 Ca 0.03 1.45 -0.07 0.00 -1.10 0.00 0.00 60.65 60.96 1x5z s ILE 12 Cb -0.23 -3.88 -0.23 0.00 -1.06 0.00 0.00 42.46 37.07 1x5z s ILE 12 CO 0.03 0.26 3.49 0.41 -0.10 0.00 0.00 174.94 179.02 1x5z n THR 13 N 0.81 3.28 -0.06 2.92 -1.04 -1.26 -4.65 114.28 114.28 1x5z n THR 13 Ca 0.01 -1.73 -0.10 0.00 -2.04 0.00 0.00 64.05 60.19 1x5z n THR 13 Cb 0.46 -2.13 -0.04 0.00 -1.82 0.00 0.00 70.33 66.81 1x5z n THR 13 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 1x5z h GLN 14 N 3.42 -0.34 -5.73 -2.82 4.20 -2.04 -3.42 115.11 108.38 1x5z h GLN 14 Ca 0.34 0.02 -0.79 0.00 0.06 0.00 0.00 58.65 58.28 1x5z h GLN 14 Cb 1.26 0.08 0.03 0.00 0.30 0.00 0.00 27.48 29.15 1x5z h GLN 14 CO 0.56 -0.23 0.27 2.41 -0.67 0.00 0.00 178.83 181.17 1x5z n THR 15 N -5.42 0.00 -3.64 -0.54 -1.04 -1.26 -4.94 114.28 97.44 1x5z n THR 15 Ca -0.01 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.85 1x5z n THR 15 Cb 0.34 -0.17 -0.08 0.00 -1.82 0.00 0.00 70.33 68.61 1x5z n THR 15 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1x5z s GLY 16 N 1.02 -0.45 0.03 3.41 0.00 -1.26 -5.16 107.32 104.91 1x5z s GLY 16 Ca 0.92 1.42 0.02 0.00 0.00 0.00 0.00 44.72 47.07 1x5z s GLY 16 CO 0.63 1.15 -0.07 -1.34 0.00 0.00 0.00 173.10 173.47 1x5z s VAL 17 N -0.32 0.50 1.01 1.40 -7.23 -1.26 -4.31 120.40 110.19 1x5z s VAL 17 Ca -0.05 -0.89 -0.12 0.00 -1.81 0.00 0.00 61.98 59.10 1x5z s VAL 17 Cb -0.03 -0.55 0.19 0.00 0.56 0.00 0.00 36.38 36.56 1x5z s VAL 17 CO 0.04 -0.28 1.09 -2.16 -0.31 0.00 0.00 175.10 173.48 1x5z s PRO 18 N -1.27 0.34 -0.17 4.82 0.04 -1.26 -4.97 135.00 132.53 1x5z s PRO 18 Ca -0.08 0.49 -0.06 0.00 0.04 0.00 0.00 61.00 61.40 1x5z s PRO 18 Cb -0.08 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.69 1x5z s PRO 18 CO 0.00 -2.79 0.02 0.20 0.04 0.00 0.00 177.00 174.48 1x5z s GLY 19 N -3.46 1.83 0.25 0.56 0.00 -1.26 -4.03 107.32 101.20 1x5z s GLY 19 Ca 0.65 -0.79 -0.18 0.00 0.00 0.00 0.00 44.72 44.40 1x5z s GLY 19 CO 0.58 0.03 0.20 0.61 0.00 0.00 0.00 173.10 174.52 1x5z n GLN 20 N 3.59 0.00 -1.25 2.90 10.64 -1.26 -4.64 117.38 127.37 1x5z n GLN 20 Ca -0.17 0.00 -0.31 0.00 -1.83 0.00 0.00 57.00 54.69 1x5z n GLN 20 Cb 0.52 -0.77 0.10 0.00 -0.86 0.00 0.00 30.24 29.24 1x5z n GLN 20 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 1x5z s PRO 21 N -0.77 2.03 0.42 2.61 0.04 -1.26 -4.86 135.00 133.21 1x5z s PRO 21 Ca 0.47 1.09 0.07 0.00 0.04 0.00 0.00 61.00 62.67 1x5z s PRO 21 Cb -0.58 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1x5z s PRO 21 CO 0.46 -1.78 0.27 -0.51 0.04 0.00 0.00 177.00 175.48 1x5z s LEU 22 N -5.99 3.23 -1.57 -3.56 1.43 -0.59 -4.66 118.68 106.98 1x5z s LEU 22 Ca 0.62 -0.94 -0.13 0.00 -1.03 0.00 0.00 54.13 52.65 1x5z s LEU 22 Cb -0.17 -1.71 0.10 0.00 0.03 0.00 0.00 46.19 44.44 1x5z s LEU 22 CO 0.56 -0.60 0.80 0.59 0.23 0.00 0.00 176.35 177.93 1x5z n ASN 23 N -1.38 -3.23 -4.67 2.29 3.02 -1.26 0.64 115.26 110.66 1x5z n ASN 23 Ca 0.01 -0.91 -0.42 0.00 -0.03 0.00 0.00 54.58 53.23 1x5z n ASN 23 Cb 0.63 -3.30 -0.04 0.00 -0.61 0.00 0.00 39.78 36.47 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 -3.43 3.41 0.06 3.10 5.36 -1.26 -4.20 117.98 121.02 1x5z s PHE 24 Ca 0.55 1.31 -0.09 0.00 -0.96 0.00 0.00 56.93 57.74 1x5z s PHE 24 Cb -0.29 -3.07 -0.00 0.00 -0.34 0.00 0.00 43.02 39.32 1x5z s PHE 24 CO 0.88 -0.29 0.18 -1.59 -1.46 0.00 0.00 175.22 172.94 1x5z s LYS 25 N 2.36 0.76 -0.08 10.12 -2.85 -0.55 -5.02 119.74 124.47 1x5z s LYS 25 Ca 0.40 -0.80 0.02 0.00 -1.00 0.00 0.00 55.97 54.59 1x5z s LYS 25 Cb -0.16 0.31 0.01 0.00 -2.06 0.00 0.00 37.83 35.93 1x5z s LYS 25 CO 0.12 -0.23 -0.15 0.00 0.10 0.00 0.00 175.35 175.19 1x5z s ALA 26 N -3.18 1.52 -0.03 0.59 0.00 -1.26 -1.91 121.76 117.48 1x5z s ALA 26 Ca -0.00 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.39 1x5z s ALA 26 Cb 0.02 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 22.46 1x5z s ALA 26 CO -0.07 0.07 -0.08 -1.21 0.00 0.00 0.00 175.76 174.46 1x5z s GLU 27 N 0.75 1.03 -0.81 0.00 2.02 -0.98 -4.71 118.70 116.00 1x5z s GLU 27 Ca -0.12 -0.28 -0.25 0.00 0.02 0.00 0.00 54.97 54.34 1x5z s GLU 27 Cb -0.16 -0.95 -0.04 0.00 0.10 0.00 0.00 34.13 33.08 1x5z s GLU 27 CO 0.03 0.06 1.92 -1.25 0.02 0.00 0.00 175.26 176.04 1x5z s PRO 28 N 0.40 2.57 0.24 0.39 0.04 -1.26 -1.41 135.00 135.97 1x5z s PRO 28 Ca -0.07 -0.01 0.24 0.00 0.04 0.00 0.00 61.00 61.20 1x5z s PRO 28 Cb -0.11 -4.85 0.94 0.00 0.04 0.00 0.00 34.50 30.52 1x5z s PRO 28 CO 0.01 -3.19 1.71 -0.85 0.04 0.00 0.00 177.00 174.72 1x5z n GLU 29 N 8.96 0.19 -3.78 4.56 0.28 -1.17 -4.85 120.64 124.83 1x5z n GLU 29 Ca 0.34 0.38 -0.04 0.00 -0.16 0.00 0.00 57.16 57.68 1x5z n GLU 29 Cb 0.48 -1.84 -0.01 0.00 1.43 0.00 0.00 31.44 31.50 1x5z n GLU 29 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1x5z s SER 30 N -4.22 -0.17 0.39 -1.84 0.15 -0.16 -4.94 113.70 102.92 1x5z s SER 30 Ca 0.05 -0.47 0.19 0.00 0.70 0.00 0.00 55.95 56.42 1x5z s SER 30 Cb 0.10 0.53 0.78 0.00 -1.71 0.00 0.00 66.02 65.72 1x5z s SER 30 CO 0.42 -0.99 1.79 1.05 1.20 0.00 0.00 173.24 176.71 1x5z h GLU 31 N 2.00 0.00 0.00 5.44 4.11 -1.89 -3.14 114.58 121.11 1x5z h GLU 31 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.19 1x5z h GLU 31 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1x5z h GLU 31 CO 0.26 0.34 -0.01 0.25 0.07 0.00 0.00 179.01 179.93 1x5z n THR 32 N -3.62 1.01 -3.93 -1.06 -2.24 -1.26 -3.43 114.28 99.75 1x5z n THR 32 Ca -0.01 -1.06 -0.10 0.00 -2.27 0.00 0.00 64.05 60.62 1x5z n THR 32 Cb 0.46 0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 69.04 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 -1.15 0.17 -0.04 3.42 0.01 -1.18 -1.53 113.70 113.39 1x5z s SER 33 Ca 0.04 -0.47 -0.01 0.00 1.31 0.00 0.00 55.95 56.82 1x5z s SER 33 Cb 0.04 0.19 0.03 0.00 0.21 0.00 0.00 66.02 66.49 1x5z s SER 33 CO 0.00 -0.43 0.08 -0.63 0.41 0.00 0.00 173.24 172.67 1x5z s ILE 34 N -2.12 -0.04 -0.26 1.44 1.01 0.54 -0.99 121.20 120.77 1x5z s ILE 34 Ca -0.09 0.16 -0.10 0.00 0.00 0.00 0.00 60.65 60.62 1x5z s ILE 34 Cb -0.04 -0.14 -0.04 0.00 0.01 0.00 0.00 42.46 42.24 1x5z s ILE 34 CO -0.02 0.07 0.15 -0.22 0.00 0.00 0.00 174.94 174.91 1x5z s LEU 35 N 0.91 3.84 -0.11 2.97 2.96 -0.50 -0.95 118.68 127.79 1x5z s LEU 35 Ca -0.07 -0.06 -0.03 0.00 -0.22 0.00 0.00 54.13 53.74 1x5z s LEU 35 Cb -0.10 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.50 1x5z s LEU 35 CO -0.04 -0.03 0.01 -0.76 -1.32 0.00 0.00 176.35 174.21 1x5z s LEU 36 N 1.62 3.57 -0.06 -0.68 1.43 -0.73 -2.31 118.68 121.52 1x5z s LEU 36 Ca 0.07 0.09 0.06 0.00 -1.03 0.00 0.00 54.13 53.31 1x5z s LEU 36 Cb -0.15 -1.84 -0.01 0.00 0.03 0.00 0.00 46.19 44.22 1x5z s LEU 36 CO 0.08 0.31 -0.24 -0.55 0.23 0.00 0.00 176.35 176.17 1x5z s SER 37 N -0.45 3.01 0.09 2.29 0.15 -0.80 -2.41 113.70 115.56 1x5z s SER 37 Ca 0.08 -0.51 -0.06 0.00 0.70 0.00 0.00 55.95 56.16 1x5z s SER 37 Cb -0.12 -0.91 -0.02 0.00 -1.71 0.00 0.00 66.02 63.26 1x5z s SER 37 CO 0.02 0.23 0.13 -1.66 1.20 0.00 0.00 173.24 173.15 1x5z s TRP 38 N -0.07 0.32 -0.39 3.44 -2.14 -1.06 -1.48 118.94 117.56 1x5z s TRP 38 Ca -0.06 -0.78 -0.07 0.00 2.66 0.00 0.00 56.10 57.85 1x5z s TRP 38 Cb -0.14 -0.18 0.07 0.00 -3.10 0.00 0.00 33.47 30.12 1x5z s TRP 38 CO 0.04 -0.51 0.19 0.99 -2.66 0.00 0.00 176.95 175.01 1x5z s THR 39 N -3.90 3.90 0.20 0.66 2.01 0.21 -4.68 115.64 114.04 1x5z s THR 39 Ca 0.08 -1.40 -0.30 0.00 0.31 0.00 0.00 61.69 60.37 1x5z s THR 39 Cb 0.06 -3.36 -0.09 0.00 0.01 0.00 0.00 72.50 69.12 1x5z s THR 39 CO -0.09 -0.41 1.30 -2.16 -0.69 0.00 0.00 174.62 172.57 1x5z s PRO 40 N 1.37 4.40 0.97 4.92 0.04 -1.26 -1.54 135.00 143.89 1x5z s PRO 40 Ca 0.02 2.04 -0.12 0.00 0.04 0.00 0.00 61.00 62.98 1x5z s PRO 40 Cb -0.22 -3.19 0.17 0.00 0.04 0.00 0.00 34.50 31.30 1x5z s PRO 40 CO 0.01 -0.24 1.09 -1.25 0.04 0.00 0.00 177.00 176.66 1x5z s PRO 41 N -0.19 0.65 0.62 0.56 0.04 -1.26 -4.86 135.00 130.58 1x5z s PRO 41 Ca 0.56 0.61 0.25 0.00 0.04 0.00 0.00 61.00 62.45 1x5z s PRO 41 Cb -0.36 -1.76 1.20 0.00 0.04 0.00 0.00 34.50 33.63 1x5z s PRO 41 CO 0.39 -2.60 1.66 -0.09 0.04 0.00 0.00 177.00 176.39 1x5z h ARG 42 N -1.80 0.00 -5.50 4.56 2.43 -1.96 -3.40 114.38 108.70 1x5z h ARG 42 Ca -0.53 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.09 1x5z h ARG 42 Cb 1.32 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.83 1x5z h ARG 42 CO 0.57 0.00 1.61 0.45 -1.51 0.00 0.00 179.97 181.08 1x5z n SER 43 N -3.22 1.40 0.07 -3.80 2.88 -1.26 -4.78 113.62 104.91 1x5z n SER 43 Ca 0.07 0.06 -0.11 0.00 -1.33 0.00 0.00 58.87 57.56 1x5z n SER 43 Cb 0.81 -1.21 -0.01 0.00 -0.75 0.00 0.00 64.21 63.05 1x5z n SER 43 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1x5z h ASP 44 N 14.19 0.46 -2.11 -3.46 3.58 -2.00 -3.41 116.42 123.67 1x5z h ASP 44 Ca -0.17 -0.35 -0.54 0.00 0.42 0.00 0.00 57.03 56.39 1x5z h ASP 44 Cb 1.31 -0.14 -0.08 0.00 1.72 0.00 0.00 39.33 42.14 1x5z h ASP 44 CO 1.21 1.13 1.15 0.42 -2.88 0.00 0.00 179.24 180.26 1x5z s THR 45 N -3.37 3.72 -0.10 2.25 -4.23 -1.26 -4.95 115.64 107.70 1x5z s THR 45 Ca -0.05 0.19 -0.02 0.00 -1.18 0.00 0.00 61.69 60.63 1x5z s THR 45 Cb 0.10 -4.86 0.04 0.00 1.34 0.00 0.00 72.50 69.12 1x5z s THR 45 CO 0.85 -1.79 0.04 -0.63 -0.54 0.00 0.00 174.62 172.55 1x5z s ILE 46 N 5.92 0.14 -0.05 2.99 1.01 -1.26 -4.96 121.20 125.00 1x5z s ILE 46 Ca 0.40 0.08 -0.24 0.00 0.00 0.00 0.00 60.65 60.88 1x5z s ILE 46 Cb -0.07 -0.48 -0.23 0.00 0.01 0.00 0.00 42.46 41.69 1x5z s ILE 46 CO 0.11 0.06 1.05 0.00 0.00 0.00 0.00 174.94 176.16 1x5z h ALA 47 N 8.37 0.04 -2.18 9.38 0.00 -1.92 -3.42 119.26 129.53 1x5z h ALA 47 Ca -0.16 -0.45 0.31 0.00 0.00 0.00 0.00 54.91 54.61 1x5z h ALA 47 Cb 1.13 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 1x5z h ALA 47 CO 0.24 0.08 0.85 0.54 0.00 0.00 0.00 179.25 180.95 1x5z s ASN 48 N -6.29 0.00 0.16 0.00 2.20 -1.22 -3.93 114.94 105.87 1x5z s ASN 48 Ca -0.16 -0.28 0.10 0.00 -0.94 0.00 0.00 52.86 51.59 1x5z s ASN 48 Cb 0.01 0.20 -0.04 0.00 -2.00 0.00 0.00 41.25 39.42 1x5z s ASN 48 CO 0.74 -0.41 -0.22 -0.31 -2.94 0.00 0.00 177.10 173.97 1x5z s TYR 49 N -2.06 2.39 -0.24 1.54 1.51 -1.14 -0.16 117.35 119.20 1x5z s TYR 49 Ca 0.28 -0.33 -0.09 0.00 -1.01 0.00 0.00 57.07 55.92 1x5z s TYR 49 Cb -0.01 -1.23 -0.04 0.00 -0.11 0.00 0.00 41.96 40.57 1x5z s TYR 49 CO 0.00 0.44 0.13 -2.00 -1.11 0.00 0.00 175.55 173.01 1x5z s GLU 50 N -2.43 3.96 -0.64 -0.62 2.56 0.07 -3.38 118.70 118.23 1x5z s GLU 50 Ca 0.19 -0.33 0.01 0.00 0.00 0.00 0.00 54.97 54.84 1x5z s GLU 50 Cb -0.09 -3.47 0.16 0.00 2.00 0.00 0.00 34.13 32.73 1x5z s GLU 50 CO 0.10 0.01 0.43 -1.17 -0.56 0.00 0.00 175.26 174.07 1x5z s LEU 51 N 1.15 4.92 -0.70 2.70 2.96 -1.25 -1.41 118.68 127.06 1x5z s LEU 51 Ca 0.06 -3.16 -0.27 0.00 -0.22 0.00 0.00 54.13 50.54 1x5z s LEU 51 Cb -0.14 -1.76 0.01 0.00 0.50 0.00 0.00 46.19 44.80 1x5z s LEU 51 CO 0.05 -0.26 1.47 -0.69 -1.32 0.00 0.00 176.35 175.59 1x5z s VAL 52 N -0.51 3.61 0.03 1.68 1.01 -0.31 -3.36 120.40 122.55 1x5z s VAL 52 Ca 0.19 0.35 0.08 0.00 0.00 0.00 0.00 61.98 62.60 1x5z s VAL 52 Cb -0.18 -4.60 -0.03 0.00 0.00 0.00 0.00 36.38 31.56 1x5z s VAL 52 CO -0.05 -1.55 -0.21 -0.72 0.00 0.00 0.00 175.10 172.57 1x5z s TYR 53 N 6.80 2.48 0.06 5.22 -0.85 -0.52 -2.55 117.35 127.98 1x5z s TYR 53 Ca 0.45 -0.31 -0.00 0.00 -0.52 0.00 0.00 57.07 56.69 1x5z s TYR 53 Cb -0.09 -1.46 -0.04 0.00 0.38 0.00 0.00 41.96 40.75 1x5z s TYR 53 CO 0.17 0.18 -0.04 -1.59 -1.52 0.00 0.00 175.55 172.75 1x5z s LYS 54 N -1.24 0.62 -0.70 -3.49 -2.85 -1.22 -1.08 119.74 109.77 1x5z s LYS 54 Ca 0.13 -1.14 -0.27 0.00 -1.00 0.00 0.00 55.97 53.69 1x5z s LYS 54 Cb -0.10 0.07 0.02 0.00 -2.06 0.00 0.00 37.83 35.76 1x5z s LYS 54 CO 0.03 -0.07 1.39 0.34 0.10 0.00 0.00 175.35 177.14 1x5z s ASP 55 N -2.69 6.00 0.43 0.03 2.15 -1.26 -3.22 116.67 118.12 1x5z s ASP 55 Ca 0.04 -0.25 0.00 0.00 0.43 0.00 0.00 52.55 52.77 1x5z s ASP 55 Cb 0.04 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.11 1x5z s ASP 55 CO -0.07 -1.92 0.00 0.61 -0.17 0.00 0.00 175.17 173.62 1x5z n GLY 56 N 5.42 0.21 0.06 2.66 0.00 -1.19 -1.59 105.19 110.77 1x5z n GLY 56 Ca 0.07 -0.89 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 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 0.00 -1.05 1.61 4.81 -1.91 -3.34 114.58 114.70 1x5z h GLU 57 Ca 0.00 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.06 1x5z h GLU 57 Cb 0.00 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.28 1x5z h GLU 57 CO 0.00 0.50 0.22 -2.39 -0.73 0.00 0.00 179.01 176.61 1x5z n HIS 58 N -4.67 1.01 0.00 0.92 1.44 -1.26 -4.88 115.22 107.78 1x5z n HIS 58 Ca -0.07 -1.00 0.00 0.00 -2.01 0.00 0.00 57.72 54.64 1x5z n HIS 58 Cb 0.27 -0.51 0.00 0.00 0.12 0.00 0.00 29.99 29.88 1x5z n HIS 58 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1x5z n GLY 59 N 0.02 -0.71 3.10 -1.39 0.00 -0.62 -4.93 105.19 100.66 1x5z n GLY 59 Ca 0.20 -1.46 -0.28 0.00 0.00 0.00 0.00 46.02 44.47 1x5z n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x5z s GLU 60 N 0.00 2.33 -0.51 1.61 2.02 -1.26 -4.74 118.70 118.14 1x5z s GLU 60 Ca 0.00 -0.62 -0.28 0.00 0.02 0.00 0.00 54.97 54.09 1x5z s GLU 60 Cb 0.00 -1.87 -0.00 0.00 0.10 0.00 0.00 34.13 32.35 1x5z s GLU 60 CO 0.00 0.04 1.62 -1.21 0.02 0.00 0.00 175.26 175.73 1x5z s GLU 61 N 0.68 3.15 -0.09 1.61 2.02 -1.26 -3.48 118.70 121.33 1x5z s GLU 61 Ca -0.13 0.76 0.03 0.00 0.02 0.00 0.00 54.97 55.66 1x5z s GLU 61 Cb -0.16 -4.20 -0.01 0.00 0.10 0.00 0.00 34.13 29.86 1x5z s GLU 61 CO 0.03 -2.10 -0.20 -0.65 0.02 0.00 0.00 175.26 172.36 1x5z s GLN 62 N 5.91 2.99 -0.04 1.61 -1.52 -0.25 -4.90 119.66 123.46 1x5z s GLN 62 Ca 0.63 -0.82 -0.12 0.00 -1.95 0.00 0.00 55.36 53.11 1x5z s GLN 62 Cb -0.14 -2.37 -0.05 0.00 -0.22 0.00 0.00 33.01 30.23 1x5z s GLN 62 CO 0.26 0.27 0.32 1.03 -0.25 0.00 0.00 175.29 176.92 1x5z s ARG 63 N 0.14 3.75 0.08 2.91 3.00 -1.26 -1.43 118.95 126.14 1x5z s ARG 63 Ca -0.11 0.23 0.08 0.00 0.00 0.00 0.00 55.73 55.93 1x5z s ARG 63 Cb -0.16 -3.21 -0.04 0.00 0.00 0.00 0.00 34.95 31.55 1x5z s ARG 63 CO 0.06 0.72 -0.17 0.42 0.00 0.00 0.00 175.30 176.33 1x5z s ILE 64 N -1.07 2.87 -0.86 1.52 1.01 -1.21 -4.93 121.20 118.52 1x5z s ILE 64 Ca 0.21 -1.32 -0.24 0.00 0.00 0.00 0.00 60.65 59.30 1x5z s ILE 64 Cb -0.15 -2.26 0.05 0.00 0.01 0.00 0.00 42.46 40.11 1x5z s ILE 64 CO 0.10 0.22 1.29 -0.89 0.00 0.00 0.00 174.94 175.67 1x5z s THR 65 N -1.04 3.97 0.06 2.92 2.01 -1.26 -3.99 115.64 118.31 1x5z s THR 65 Ca 0.16 -0.33 -0.08 0.00 0.31 0.00 0.00 61.69 61.75 1x5z s THR 65 Cb -0.11 -4.93 -0.05 0.00 0.01 0.00 0.00 72.50 67.42 1x5z s THR 65 CO 0.08 -1.81 0.34 -0.63 -0.69 0.00 0.00 174.62 171.91 1x5z s ILE 66 N 4.94 5.19 0.35 1.82 1.01 -1.22 -5.01 121.20 128.28 1x5z s ILE 66 Ca 0.37 0.28 -0.26 0.00 0.00 0.00 0.00 60.65 61.04 1x5z s ILE 66 Cb -0.06 -3.61 -0.09 0.00 0.01 0.00 0.00 42.46 38.71 1x5z s ILE 66 CO 0.02 0.29 1.05 -1.61 0.00 0.00 0.00 174.94 174.69 1x5z s GLU 67 N -1.94 4.36 -1.13 2.79 2.02 -1.26 -2.89 118.70 120.65 1x5z s GLU 67 Ca 0.32 1.58 -0.23 0.00 0.02 0.00 0.00 54.97 56.66 1x5z s GLU 67 Cb -0.13 -2.78 -0.08 0.00 0.10 0.00 0.00 34.13 31.24 1x5z s GLU 67 CO 0.18 0.02 1.94 -1.25 0.02 0.00 0.00 175.26 176.17 1x5z s PRO 68 N -2.11 2.50 0.00 0.39 0.04 -1.25 -4.61 135.00 129.96 1x5z s PRO 68 Ca 0.53 -0.98 0.00 0.00 0.04 0.00 0.00 61.00 60.59 1x5z s PRO 68 Cb -0.25 -5.20 0.00 0.00 0.04 0.00 0.00 34.50 29.09 1x5z s PRO 68 CO 0.31 -3.87 0.00 0.41 0.04 0.00 0.00 177.00 173.89 1x5z n GLY 69 N 6.03 4.02 0.00 0.56 0.00 -1.26 -5.01 105.19 109.52 1x5z n GLY 69 Ca 0.44 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -4.09 2.61 -2.24 -1.26 -4.74 114.28 104.56 1x5z n THR 70 Ca 0.00 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.70 1x5z n THR 70 Cb 0.00 -0.47 -0.10 0.00 -2.10 0.00 0.00 70.33 67.66 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 -3.10 0.61 0.02 3.42 1.04 -1.26 -2.55 113.70 111.87 1x5z s SER 71 Ca 0.00 -0.91 0.00 0.00 0.48 0.00 0.00 55.95 55.53 1x5z s SER 71 Cb 0.00 0.16 -0.02 0.00 0.10 0.00 0.00 66.02 66.26 1x5z s SER 71 CO 0.00 -0.51 -0.03 -0.47 0.98 0.00 0.00 173.24 173.21 1x5z s TYR 72 N -3.38 0.27 -0.45 5.02 5.04 -1.01 -4.98 117.35 117.86 1x5z s TYR 72 Ca 0.04 -0.40 -0.04 0.00 -2.44 0.00 0.00 57.07 54.22 1x5z s TYR 72 Cb 0.04 -0.19 0.12 0.00 0.35 0.00 0.00 41.96 42.28 1x5z s TYR 72 CO -0.07 -0.13 0.26 0.50 -1.34 0.00 0.00 175.55 174.77 1x5z s ARG 73 N -1.14 2.16 0.16 4.97 3.52 -1.26 -1.77 118.95 125.59 1x5z s ARG 73 Ca -0.11 -1.90 -0.29 0.00 -0.13 0.00 0.00 55.73 53.30 1x5z s ARG 73 Cb -0.08 -3.67 -0.07 0.00 -1.56 0.00 0.00 34.95 29.57 1x5z s ARG 73 CO -0.01 -1.11 0.92 -1.17 -0.81 0.00 0.00 175.30 173.13 1x5z s LEU 74 N 1.03 4.56 0.25 -0.88 2.96 -0.13 -4.91 118.68 121.56 1x5z s LEU 74 Ca 0.09 1.81 0.03 0.00 -0.22 0.00 0.00 54.13 55.84 1x5z s LEU 74 Cb -0.23 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.86 1x5z s LEU 74 CO -0.04 0.05 0.04 -1.10 -1.32 0.00 0.00 176.35 173.98 1x5z s GLN 75 N -0.56 1.38 0.00 1.98 -0.21 -1.26 -0.33 119.66 120.65 1x5z s GLN 75 Ca 0.43 -1.72 0.00 0.00 0.02 0.00 0.00 55.36 54.09 1x5z s GLN 75 Cb -0.24 -0.51 0.00 0.00 1.00 0.00 0.00 33.01 33.26 1x5z s GLN 75 CO 0.30 -0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.71 1x5z n GLY 76 N -0.45 0.40 3.26 3.09 0.00 -0.58 -4.98 105.19 105.92 1x5z n GLY 76 Ca -0.03 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.66 1.04 -0.07 0.99 1.43 -1.15 -5.04 118.68 114.22 1x5z s LEU 77 Ca 0.00 -1.33 -0.05 0.00 -1.03 0.00 0.00 54.13 51.72 1x5z s LEU 77 Cb 0.00 0.58 -0.04 0.00 0.03 0.00 0.00 46.19 46.76 1x5z s LEU 77 CO 0.00 -0.89 0.14 -0.54 0.23 0.00 0.00 176.35 175.30 1x5z s LYS 78 N -4.13 3.39 0.86 1.70 1.02 -1.26 -4.51 119.74 116.81 1x5z s LYS 78 Ca 0.37 -0.24 -0.11 0.00 0.02 0.00 0.00 55.97 56.00 1x5z s LYS 78 Cb 0.06 -3.11 0.11 0.00 -0.52 0.00 0.00 37.83 34.36 1x5z s LYS 78 CO 0.12 0.73 1.09 -1.25 -0.92 0.00 0.00 175.35 175.12 1x5z s PRO 79 N -1.41 1.55 -1.43 -1.68 0.04 -1.22 -3.89 135.00 126.96 1x5z s PRO 79 Ca 0.20 0.93 -0.08 0.00 0.04 0.00 0.00 61.00 62.09 1x5z s PRO 79 Cb -0.12 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.59 1x5z s PRO 79 CO 0.10 -2.07 0.27 0.09 0.04 0.00 0.00 177.00 175.44 1x5z n ASN 80 N -3.78 -0.66 -3.76 6.66 5.03 -0.91 -4.89 115.26 112.95 1x5z n ASN 80 Ca 0.08 -1.21 -0.13 0.00 0.87 0.00 0.00 54.58 54.19 1x5z n ASN 80 Cb 0.55 -2.03 -0.10 0.00 -1.02 0.00 0.00 39.78 37.18 1x5z n ASN 80 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1x5z s SER 81 N -4.17 -0.28 0.11 6.41 0.01 -1.25 -5.02 113.70 109.52 1x5z s SER 81 Ca 0.12 0.42 -0.15 0.00 1.31 0.00 0.00 55.95 57.65 1x5z s SER 81 Cb -0.06 0.52 -0.07 0.00 0.21 0.00 0.00 66.02 66.62 1x5z s SER 81 CO 0.96 -0.27 0.53 -0.22 0.41 0.00 0.00 173.24 174.65 1x5z s LEU 82 N -0.50 4.39 -0.10 2.44 2.96 -1.26 -3.42 118.68 123.19 1x5z s LEU 82 Ca -0.06 1.08 -0.04 0.00 -0.22 0.00 0.00 54.13 54.89 1x5z s LEU 82 Cb -0.04 -3.11 0.05 0.00 0.50 0.00 0.00 46.19 43.60 1x5z s LEU 82 CO 0.02 0.16 0.18 -0.31 -1.32 0.00 0.00 176.35 175.08 1x5z s TYR 83 N -1.35 -0.21 0.52 5.38 2.02 -1.24 -3.19 117.35 119.29 1x5z s TYR 83 Ca 0.34 0.59 -0.20 0.00 -0.37 0.00 0.00 57.07 57.44 1x5z s TYR 83 Cb -0.16 -0.25 -0.07 0.00 -0.40 0.00 0.00 41.96 41.08 1x5z s TYR 83 CO 0.18 -0.32 1.10 0.71 -1.57 0.00 0.00 175.55 175.65 1x5z s TYR 84 N 2.31 2.78 -0.01 2.71 1.51 -1.20 -3.36 117.35 122.09 1x5z s TYR 84 Ca 0.03 1.55 -0.02 0.00 -1.01 0.00 0.00 57.07 57.63 1x5z s TYR 84 Cb -0.12 -3.22 -0.00 0.00 -0.11 0.00 0.00 41.96 38.50 1x5z s TYR 84 CO -0.07 -1.34 0.03 -0.06 -1.11 0.00 0.00 175.55 173.01 1x5z s PHE 85 N -1.83 0.04 -0.15 2.71 0.08 0.22 -3.42 117.98 115.63 1x5z s PHE 85 Ca 0.71 -0.08 -0.05 0.00 0.12 0.00 0.00 56.93 57.63 1x5z s PHE 85 Cb -0.22 -0.04 0.07 0.00 -0.57 0.00 0.00 43.02 42.26 1x5z s PHE 85 CO 0.25 -0.09 0.31 1.03 -0.10 0.00 0.00 175.22 176.61 1x5z s ARG 86 N -0.51 0.20 0.21 0.44 0.52 -1.06 -2.49 118.95 116.26 1x5z s ARG 86 Ca -0.06 0.80 -0.06 0.00 -0.52 0.00 0.00 55.73 55.89 1x5z s ARG 86 Cb -0.04 0.01 -0.06 0.00 0.52 0.00 0.00 34.95 35.39 1x5z s ARG 86 CO -0.00 -0.30 0.48 -1.17 0.02 0.00 0.00 175.30 174.32 1x5z s LEU 87 N 2.47 4.18 -0.30 2.53 2.96 -1.25 -1.16 118.68 128.12 1x5z s LEU 87 Ca 0.01 0.72 -0.04 0.00 -0.22 0.00 0.00 54.13 54.60 1x5z s LEU 87 Cb -0.12 -3.48 0.19 0.00 0.50 0.00 0.00 46.19 43.28 1x5z s LEU 87 CO -0.10 -0.05 0.78 0.00 -1.32 0.00 0.00 176.35 175.66 1x5z s ALA 88 N -1.82 -2.90 0.13 5.97 0.00 -0.50 -0.37 121.76 122.26 1x5z s ALA 88 Ca 0.44 1.44 -0.35 0.00 0.00 0.00 0.00 51.96 53.49 1x5z s ALA 88 Cb -0.11 -2.47 -0.16 0.00 0.00 0.00 0.00 23.12 20.37 1x5z s ALA 88 CO 0.25 -1.64 1.26 0.00 0.00 0.00 0.00 175.76 175.63 1x5z n ALA 89 N 5.38 -0.81 -3.27 0.00 0.00 -1.24 -0.75 120.51 119.82 1x5z n ALA 89 Ca 0.01 0.49 -0.36 0.00 0.00 0.00 0.00 53.44 53.58 1x5z n ALA 89 Cb 0.54 -2.06 -0.13 0.00 0.00 0.00 0.00 19.45 17.80 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 0.07 3.45 -0.01 0.00 3.52 0.78 -2.42 118.95 124.34 1x5z s ARG 90 Ca 0.79 -0.60 0.01 0.00 -0.13 0.00 0.00 55.73 55.80 1x5z s ARG 90 Cb -0.90 -3.20 -0.04 0.00 -1.56 0.00 0.00 34.95 29.26 1x5z s ARG 90 CO 0.49 -0.23 -0.01 0.45 -0.81 0.00 0.00 175.30 175.19 1x5z s SER 91 N 1.54 5.06 0.00 -2.12 0.15 -1.25 -3.34 113.70 113.73 1x5z s SER 91 Ca 0.06 -0.01 0.12 0.00 0.70 0.00 0.00 55.95 56.82 1x5z s SER 91 Cb -0.15 -1.32 0.73 0.00 -1.71 0.00 0.00 66.02 63.58 1x5z s SER 91 CO 0.00 0.29 1.16 -0.81 1.20 0.00 0.00 173.24 175.09 1x5z n PRO 92 N 1.50 0.49 -0.00 5.44 -0.04 -1.26 -1.98 135.00 139.15 1x5z n PRO 92 Ca -0.15 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.32 1x5z n PRO 92 Cb 0.53 -1.39 -0.01 0.00 -0.04 0.00 0.00 33.50 32.58 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 -0.89 3.82 0.00 0.54 3.00 -1.26 -5.07 117.38 117.52 1x5z n GLN 93 Ca 0.09 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1x5z n GLN 93 Cb 0.04 -0.78 0.00 0.00 0.00 0.00 0.00 30.24 29.50 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 1.58 3.20 3.63 1.08 0.00 -0.84 -4.71 105.19 109.13 1x5z n GLY 94 Ca 0.00 0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 2.89 0.00 0.99 0.00 -1.26 -3.88 117.00 115.74 1x5z n LEU 95 Ca 0.00 1.05 0.00 0.00 0.00 0.00 0.00 56.01 57.06 1x5z n LEU 95 Cb 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 43.42 42.04 1x5z n LEU 95 CO 0.00 -1.33 0.00 0.61 0.00 0.00 0.00 177.39 176.67 1x5z n GLY 96 N 1.12 0.93 3.72 -3.96 0.00 -1.01 -4.85 105.19 101.13 1x5z n GLY 96 Ca 0.09 -0.50 -0.23 0.00 0.00 0.00 0.00 46.02 45.38 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 -3.44 3.46 0.03 4.61 0.00 -1.26 -4.97 121.76 120.19 1x5z s ALA 97 Ca 0.00 -1.81 0.04 0.00 0.00 0.00 0.00 51.96 50.20 1x5z s ALA 97 Cb 0.00 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 1x5z s ALA 97 CO 0.00 0.06 -0.07 -1.12 0.00 0.00 0.00 175.76 174.63 1x5z s SER 98 N -3.82 4.57 0.88 0.00 0.01 -1.26 -3.69 113.70 110.38 1x5z s SER 98 Ca 0.37 -0.21 -0.12 0.00 1.31 0.00 0.00 55.95 57.29 1x5z s SER 98 Cb -0.03 -1.02 0.12 0.00 0.21 0.00 0.00 66.02 65.30 1x5z s SER 98 CO 0.22 0.25 1.16 0.42 0.41 0.00 0.00 173.24 175.70 1x5z s THR 99 N -1.06 2.00 0.73 1.44 -4.23 0.50 -4.97 115.64 110.05 1x5z s THR 99 Ca 0.19 0.00 -0.16 0.00 -1.18 0.00 0.00 61.69 60.54 1x5z s THR 99 Cb -0.11 -2.85 -0.01 0.00 1.34 0.00 0.00 72.50 70.87 1x5z s THR 99 CO 0.10 0.00 0.76 0.00 -0.54 0.00 0.00 174.62 174.94 1x5z n ALA 100 N -3.60 -0.89 -2.35 3.99 0.00 -1.26 -4.63 120.51 111.77 1x5z n ALA 100 Ca 0.07 -0.24 -0.41 0.00 0.00 0.00 0.00 53.44 52.87 1x5z n ALA 100 Cb 0.60 -1.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.03 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 -3.13 3.20 0.27 0.00 2.12 -1.26 -4.76 118.70 115.13 1x5z s GLU 101 Ca 0.69 0.42 0.08 0.00 0.36 0.00 0.00 54.97 56.52 1x5z s GLU 101 Cb -0.34 -4.17 -0.04 0.00 0.26 0.00 0.00 34.13 29.84 1x5z s GLU 101 CO 0.54 -2.07 0.13 0.96 -0.54 0.00 0.00 175.26 174.28 1x5z s ILE 102 N 6.45 3.89 0.05 -3.70 -4.36 -1.04 -4.98 121.20 117.51 1x5z s ILE 102 Ca 0.53 -1.61 -0.02 0.00 -0.26 0.00 0.00 60.65 59.28 1x5z s ILE 102 Cb -0.11 -3.15 -0.03 0.00 1.25 0.00 0.00 42.46 40.42 1x5z s ILE 102 CO 0.23 -0.33 0.01 -0.94 0.24 0.00 0.00 174.94 174.15 1x5z s SER 103 N -3.79 0.38 -0.05 4.36 1.04 -1.26 -0.61 113.70 113.77 1x5z s SER 103 Ca 0.33 -0.84 -0.03 0.00 0.48 0.00 0.00 55.95 55.89 1x5z s SER 103 Cb -0.07 0.21 0.03 0.00 0.10 0.00 0.00 66.02 66.29 1x5z s SER 103 CO 0.23 -0.57 0.12 0.00 0.98 0.00 0.00 173.24 174.00 1x5z s ALA 104 N -3.45 -0.22 -0.25 5.32 0.00 -1.21 -4.81 121.76 117.13 1x5z s ALA 104 Ca 0.03 0.52 -0.13 0.00 0.00 0.00 0.00 51.96 52.37 1x5z s ALA 104 Cb 0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1x5z s ALA 104 CO -0.08 -0.12 0.30 0.50 0.00 0.00 0.00 175.76 176.36 1x5z s ARG 105 N 0.81 4.06 1.23 0.00 3.52 -1.26 -3.60 118.95 123.71 1x5z s ARG 105 Ca -0.06 -0.05 -0.16 0.00 -0.13 0.00 0.00 55.73 55.32 1x5z s ARG 105 Cb -0.08 -3.60 0.30 0.00 -1.56 0.00 0.00 34.95 30.01 1x5z s ARG 105 CO -0.04 -0.12 1.01 0.95 -0.81 0.00 0.00 175.30 176.29 1x5z s THR 106 N 1.60 1.73 0.67 4.11 -4.23 -1.22 -4.61 115.64 113.69 1x5z s THR 106 Ca 0.13 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.51 1x5z s THR 106 Cb -0.15 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.52 1x5z s THR 106 CO 0.08 0.00 1.07 -0.04 -0.54 0.00 0.00 174.62 175.19 1x5z s MET 107 N -4.81 2.93 -0.97 3.99 1.00 -1.26 -4.33 119.30 115.85 1x5z s MET 107 Ca 0.68 1.10 -0.24 0.00 0.00 0.00 0.00 55.69 57.23 1x5z s MET 107 Cb -0.19 -1.98 0.05 0.00 0.00 0.00 0.00 34.83 32.70 1x5z s MET 107 CO 0.61 -1.11 1.42 -1.14 0.00 0.00 0.00 175.02 174.80 1x5z s GLN 108 N -4.66 3.53 -0.03 2.03 0.74 -1.26 -2.15 119.66 117.86 1x5z s GLN 108 Ca 0.61 -0.98 -0.29 0.00 0.05 0.00 0.00 55.36 54.74 1x5z s GLN 108 Cb -0.16 -5.17 -0.08 0.00 1.10 0.00 0.00 33.01 28.71 1x5z s GLN 108 CO 0.49 -2.20 2.05 0.45 -0.55 0.00 0.00 175.29 175.53 1x5z s SER 109 N 4.77 6.16 0.30 6.67 0.15 -1.26 -4.97 113.70 125.53 1x5z s SER 109 Ca 0.44 2.47 0.04 0.00 0.70 0.00 0.00 55.95 59.60 1x5z s SER 109 Cb -0.01 -2.52 -0.06 0.00 -1.71 0.00 0.00 66.02 61.71 1x5z s SER 109 CO -0.06 -1.32 0.02 -0.94 1.20 0.00 0.00 173.24 172.15 1x5z s SER 110 N 5.57 2.40 0.05 5.45 1.04 -1.26 -4.98 113.70 121.98 1x5z s SER 110 Ca 0.92 -1.32 -0.10 0.00 0.48 0.00 0.00 55.95 55.94 1x5z s SER 110 Cb -0.40 -0.09 0.01 0.00 0.10 0.00 0.00 66.02 65.63 1x5z s SER 110 CO 0.40 -0.54 0.21 -0.83 0.98 0.00 0.00 173.24 173.46 1x5z s GLY 111 N -3.46 0.02 1.06 7.32 0.00 -1.26 -5.17 107.32 105.84 1x5z s GLY 111 Ca 0.34 -0.31 -0.14 0.00 0.00 0.00 0.00 44.72 44.60 1x5z s GLY 111 CO 0.14 -0.50 1.10 2.56 0.00 0.00 0.00 173.10 176.40 1x5z s PRO 112 N -2.86 -0.08 0.83 2.90 0.04 -1.26 -4.99 135.00 129.59 1x5z s PRO 112 Ca -0.03 0.34 -0.13 0.00 0.04 0.00 0.00 61.00 61.22 1x5z s PRO 112 Cb 0.00 -1.69 0.08 0.00 0.04 0.00 0.00 34.50 32.93 1x5z s PRO 112 CO -0.05 -3.04 1.08 0.43 0.04 0.00 0.00 177.00 175.46 1x5z n SER 113 N -4.36 0.49 -4.18 6.66 7.64 -1.26 -4.99 113.62 113.63 1x5z n SER 113 Ca 0.07 0.54 -0.37 0.00 1.01 0.00 0.00 58.87 60.12 1x5z n SER 113 Cb 0.58 -1.46 -0.12 0.00 -1.01 0.00 0.00 64.21 62.20 1x5z n SER 113 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x5z s SER 114 N -2.16 5.20 0.00 6.43 0.01 -1.26 -5.35 113.70 116.58 1x5z s SER 114 Ca 0.70 -1.58 0.00 0.00 1.31 0.00 0.00 55.95 56.38 1x5z s SER 114 Cb -0.28 -1.82 0.00 0.00 0.21 0.00 0.00 66.02 64.13 1x5z s SER 114 CO 0.54 -0.42 0.00 0.61 0.41 0.00 0.00 173.24 174.38