#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 -0.65 0.48 1.61 0.01 -1.26 -5.18 113.70 108.72 1x5z s SER 2 Ca 0.00 0.81 0.08 0.00 1.31 0.00 0.00 55.95 58.16 1x5z s SER 2 Cb 0.00 0.68 0.03 0.00 0.21 0.00 0.00 66.02 66.94 1x5z s SER 2 CO 0.00 -0.52 0.58 -0.44 0.41 0.00 0.00 173.24 173.27 1x5z s SER 3 N -0.90 5.24 0.00 2.44 0.01 -1.26 -5.12 113.70 114.11 1x5z s SER 3 Ca -0.08 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.46 1x5z s SER 3 Cb -0.01 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.01 1x5z s SER 3 CO 0.08 -0.97 0.00 0.61 0.41 0.00 0.00 173.24 173.37 1x5z n GLY 4 N -1.91 -1.23 3.01 3.44 0.00 -1.26 -5.16 105.19 102.09 1x5z n GLY 4 Ca 0.09 0.98 -0.23 0.00 0.00 0.00 0.00 46.02 46.85 1x5z n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5z s SER 5 N 0.00 1.60 0.24 1.61 0.01 -1.26 -5.14 113.70 110.75 1x5z s SER 5 Ca 0.00 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.00 1x5z s SER 5 Cb 0.00 -0.68 -0.04 0.00 0.21 0.00 0.00 66.02 65.51 1x5z s SER 5 CO 0.00 0.04 0.42 -0.55 0.41 0.00 0.00 173.24 173.56 1x5z s SER 6 N 0.57 6.36 0.65 2.44 0.15 -1.26 -5.10 113.70 117.52 1x5z s SER 6 Ca -0.12 0.37 0.00 0.00 0.70 0.00 0.00 55.95 56.91 1x5z s SER 6 Cb -0.14 -2.00 0.00 0.00 -1.71 0.00 0.00 66.02 62.17 1x5z s SER 6 CO 0.03 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 174.97 1x5z n GLY 7 N -1.01 -2.85 3.45 9.45 0.00 -1.26 -5.06 105.19 107.91 1x5z n GLY 7 Ca -0.05 -0.94 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 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 -1.84 -0.62 0.94 1.61 1.01 -1.26 -5.17 116.67 111.34 1x5z s ASP 8 Ca 0.00 1.14 -0.13 0.00 0.71 0.00 0.00 52.55 54.27 1x5z s ASP 8 Cb 0.00 1.11 0.20 0.00 1.01 0.00 0.00 42.92 45.25 1x5z s ASP 8 CO 0.00 -0.20 1.22 2.30 0.21 0.00 0.00 175.17 178.70 1x5z n ILE 9 N 3.24 0.00 -1.94 0.77 -5.35 -1.26 -4.92 119.36 109.89 1x5z n ILE 9 Ca -0.16 -1.06 -0.30 0.00 -0.27 0.00 0.00 62.75 60.95 1x5z n ILE 9 Cb 0.56 -1.40 -0.04 0.00 -1.74 0.00 0.00 39.64 37.02 1x5z n ILE 9 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1x5z s GLN 10 N -5.65 2.42 -0.01 6.28 -0.21 -1.26 -4.90 119.66 116.34 1x5z s GLN 10 Ca 0.71 0.30 -0.12 0.00 0.02 0.00 0.00 55.36 56.27 1x5z s GLN 10 Cb -0.02 -4.74 0.02 0.00 1.00 0.00 0.00 33.01 29.27 1x5z s GLN 10 CO 0.49 -3.26 0.25 0.54 -2.12 0.00 0.00 175.29 171.19 1x5z s VAL 11 N 10.50 0.07 0.22 1.09 0.11 -1.26 -5.18 120.40 125.95 1x5z s VAL 11 Ca 0.74 -0.55 0.04 0.00 -2.93 0.00 0.00 61.98 59.28 1x5z s VAL 11 Cb -0.11 -0.57 -0.05 0.00 -1.53 0.00 0.00 36.38 34.12 1x5z s VAL 11 CO 0.11 -0.30 -0.04 0.27 -3.33 0.00 0.00 175.10 171.80 1x5z s ILE 12 N -1.39 1.20 0.01 7.04 -4.36 -1.26 -5.10 121.20 117.33 1x5z s ILE 12 Ca -0.14 -2.06 -0.30 0.00 -0.26 0.00 0.00 60.65 57.89 1x5z s ILE 12 Cb -0.06 -2.23 -0.08 0.00 1.25 0.00 0.00 42.46 41.34 1x5z s ILE 12 CO 0.03 -0.43 1.89 0.42 0.24 0.00 0.00 174.94 177.09 1x5z s THR 13 N -3.31 3.16 -0.05 8.37 -4.23 -1.26 -4.98 115.64 113.34 1x5z s THR 13 Ca 0.26 0.19 0.07 0.00 -1.18 0.00 0.00 61.69 61.03 1x5z s THR 13 Cb 0.04 -3.13 -0.01 0.00 1.34 0.00 0.00 72.50 70.74 1x5z s THR 13 CO 0.07 -0.02 -0.25 -1.58 -0.54 0.00 0.00 174.62 172.30 1x5z s GLN 14 N 4.39 2.44 -0.23 3.99 0.74 -1.26 -5.11 119.66 124.62 1x5z s GLN 14 Ca 0.85 -0.91 0.02 0.00 0.05 0.00 0.00 55.36 55.37 1x5z s GLN 14 Cb -0.40 -2.14 0.05 0.00 1.10 0.00 0.00 33.01 31.62 1x5z s GLN 14 CO 0.38 0.43 -0.12 0.99 -0.55 0.00 0.00 175.29 176.43 1x5z s THR 15 N -0.28 1.94 0.00 -0.34 2.01 -1.26 -5.12 115.64 112.59 1x5z s THR 15 Ca 0.00 -1.31 0.00 0.00 0.31 0.00 0.00 61.69 60.69 1x5z s THR 15 Cb -0.13 -2.01 0.00 0.00 0.01 0.00 0.00 72.50 70.38 1x5z s THR 15 CO 0.02 0.11 0.00 0.61 -0.69 0.00 0.00 174.62 174.68 1x5z n GLY 16 N 4.56 0.21 3.36 4.40 0.00 -1.26 -4.99 105.19 111.47 1x5z n GLY 16 Ca -0.15 -1.79 -0.43 0.00 0.00 0.00 0.00 46.02 43.64 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 -0.26 1.22 -1.26 1.61 0.24 -1.26 -4.91 118.33 113.72 1x5z n VAL 17 Ca 0.00 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.34 61.49 1x5z n VAL 17 Cb 0.00 -0.12 0.09 0.00 -1.47 0.00 0.00 33.84 32.34 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 -1.11 2.26 -0.14 7.34 0.04 -1.26 -4.98 135.00 137.14 1x5z s PRO 18 Ca 0.61 1.17 -0.12 0.00 0.04 0.00 0.00 61.00 62.70 1x5z s PRO 18 Cb -0.71 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 31.89 1x5z s PRO 18 CO 0.60 -1.64 0.24 0.20 0.04 0.00 0.00 177.00 176.43 1x5z s GLY 19 N -3.40 2.19 0.35 0.56 0.00 -1.26 -4.22 107.32 101.56 1x5z s GLY 19 Ca 0.61 -0.52 -0.21 0.00 0.00 0.00 0.00 44.72 44.60 1x5z s GLY 19 CO 0.56 0.15 0.14 0.61 0.00 0.00 0.00 173.10 174.56 1x5z n GLN 20 N 3.00 0.00 -1.23 2.90 10.64 -1.26 -4.65 117.38 126.78 1x5z n GLN 20 Ca -0.15 0.00 -0.30 0.00 -1.83 0.00 0.00 57.00 54.72 1x5z n GLN 20 Cb 0.53 -0.95 0.11 0.00 -0.86 0.00 0.00 30.24 29.07 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 -0.95 1.81 0.35 2.61 0.04 -1.26 -4.85 135.00 132.75 1x5z s PRO 21 Ca 0.57 1.02 0.08 0.00 0.04 0.00 0.00 61.00 62.71 1x5z s PRO 21 Cb -0.65 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 1x5z s PRO 21 CO 0.59 -1.91 0.15 -0.51 0.04 0.00 0.00 177.00 175.36 1x5z s LEU 22 N -6.06 3.26 -1.40 -3.56 1.43 -0.96 -4.66 118.68 106.73 1x5z s LEU 22 Ca 0.62 -0.78 -0.08 0.00 -1.03 0.00 0.00 54.13 52.85 1x5z s LEU 22 Cb -0.17 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.32 1x5z s LEU 22 CO 0.56 -0.32 1.09 0.59 0.23 0.00 0.00 176.35 178.50 1x5z n ASN 23 N -1.17 -6.36 -4.61 2.29 3.02 -1.26 -0.16 115.26 107.02 1x5z n ASN 23 Ca -0.03 -0.50 -0.43 0.00 -0.03 0.00 0.00 54.58 53.59 1x5z n ASN 23 Cb 0.61 -5.02 -0.02 0.00 -0.61 0.00 0.00 39.78 34.74 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 -3.30 2.63 0.02 3.10 5.36 -1.26 -4.26 117.98 120.28 1x5z s PHE 24 Ca 0.54 0.76 0.01 0.00 -0.96 0.00 0.00 56.93 57.28 1x5z s PHE 24 Cb -0.24 -4.22 -0.02 0.00 -0.34 0.00 0.00 43.02 38.20 1x5z s PHE 24 CO 0.67 -1.63 -0.04 -1.59 -1.46 0.00 0.00 175.22 171.17 1x5z s LYS 25 N 4.54 0.32 -0.07 10.12 -2.85 -0.98 -5.04 119.74 125.79 1x5z s LYS 25 Ca 0.55 -0.52 0.04 0.00 -1.00 0.00 0.00 55.97 55.04 1x5z s LYS 25 Cb -0.12 -0.04 -0.00 0.00 -2.06 0.00 0.00 37.83 35.61 1x5z s LYS 25 CO 0.29 -0.01 -0.20 0.00 0.10 0.00 0.00 175.35 175.53 1x5z s ALA 26 N -1.12 1.80 -0.00 0.59 0.00 -1.26 -2.34 121.76 119.42 1x5z s ALA 26 Ca -0.11 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.05 1x5z s ALA 26 Cb -0.08 -0.64 0.00 0.00 0.00 0.00 0.00 23.12 22.40 1x5z s ALA 26 CO -0.00 0.28 -0.01 -1.21 0.00 0.00 0.00 175.76 174.82 1x5z s GLU 27 N 0.19 0.07 -0.81 0.00 0.41 -1.16 -4.76 118.70 112.65 1x5z s GLU 27 Ca -0.10 -0.01 -0.25 0.00 -0.41 0.00 0.00 54.97 54.20 1x5z s GLU 27 Cb -0.15 -0.10 -0.04 0.00 -1.78 0.00 0.00 34.13 32.06 1x5z s GLU 27 CO 0.05 -0.00 1.92 -1.25 -0.49 0.00 0.00 175.26 175.49 1x5z s PRO 28 N 0.10 2.58 0.46 0.39 0.04 -1.26 -2.11 135.00 135.19 1x5z s PRO 28 Ca -0.01 -0.01 0.24 0.00 0.04 0.00 0.00 61.00 61.26 1x5z s PRO 28 Cb -0.02 -4.85 1.08 0.00 0.04 0.00 0.00 34.50 30.75 1x5z s PRO 28 CO -0.00 -3.18 1.91 1.05 0.04 0.00 0.00 177.00 176.82 1x5z h GLU 29 N 12.44 0.00 0.00 4.56 -0.00 -1.84 -3.46 114.58 126.28 1x5z h GLU 29 Ca -0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 59.36 59.21 1x5z h GLU 29 Cb 1.05 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 29.78 1x5z h GLU 29 CO 1.21 0.22 0.04 0.45 -0.00 0.00 0.00 179.01 180.93 1x5z n SER 30 N -3.56 -1.42 0.16 3.06 2.88 0.10 -4.96 113.62 109.87 1x5z n SER 30 Ca -0.01 -2.39 0.04 0.00 -1.33 0.00 0.00 58.87 55.17 1x5z n SER 30 Cb 0.36 2.49 0.12 0.00 -0.75 0.00 0.00 64.21 66.43 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 9.09 -1.89 -3.24 114.58 117.07 1x5z h GLU 31 Ca -0.24 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.17 1x5z h GLU 31 Cb 0.96 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.06 1x5z h GLU 31 CO 0.31 0.46 0.00 0.25 0.05 0.00 0.00 179.01 180.08 1x5z n THR 32 N -3.29 0.39 -4.08 -1.06 -2.24 -1.26 -3.27 114.28 99.46 1x5z n THR 32 Ca 0.01 -0.51 -0.14 0.00 -2.27 0.00 0.00 64.05 61.15 1x5z n THR 32 Cb 0.67 0.95 -0.12 0.00 -2.10 0.00 0.00 70.33 69.73 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 -0.39 0.76 0.01 3.42 0.01 -1.25 -1.68 113.70 114.58 1x5z s SER 33 Ca 0.00 -0.42 0.03 0.00 1.31 0.00 0.00 55.95 56.87 1x5z s SER 33 Cb 0.00 0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.23 1x5z s SER 33 CO 0.00 -0.13 -0.10 -0.63 0.41 0.00 0.00 173.24 172.79 1x5z s ILE 34 N -1.03 0.75 -0.22 1.44 1.01 -0.20 0.00 121.20 122.96 1x5z s ILE 34 Ca -0.07 -0.61 -0.05 0.00 0.00 0.00 0.00 60.65 59.92 1x5z s ILE 34 Cb -0.08 -0.67 -0.02 0.00 0.01 0.00 0.00 42.46 41.71 1x5z s ILE 34 CO 0.00 0.06 -0.01 -0.22 0.00 0.00 0.00 174.94 174.77 1x5z s LEU 35 N -0.62 3.10 -0.06 2.97 2.96 -0.90 -1.03 118.68 125.10 1x5z s LEU 35 Ca 0.01 -0.30 -0.02 0.00 -0.22 0.00 0.00 54.13 53.60 1x5z s LEU 35 Cb -0.05 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.81 1x5z s LEU 35 CO 0.00 0.01 0.03 -0.76 -1.32 0.00 0.00 176.35 174.31 1x5z s LEU 36 N 1.34 3.72 -0.06 -0.68 1.43 -0.67 -2.96 118.68 120.79 1x5z s LEU 36 Ca 0.04 0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.34 1x5z s LEU 36 Cb -0.15 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.12 1x5z s LEU 36 CO -0.00 0.35 -0.17 -0.55 0.23 0.00 0.00 176.35 176.21 1x5z s SER 37 N -1.16 2.24 0.09 2.29 0.15 -0.99 -2.69 113.70 113.63 1x5z s SER 37 Ca 0.16 -0.38 -0.06 0.00 0.70 0.00 0.00 55.95 56.37 1x5z s SER 37 Cb -0.12 -0.86 -0.02 0.00 -1.71 0.00 0.00 66.02 63.32 1x5z s SER 37 CO 0.06 0.12 0.12 -1.66 1.20 0.00 0.00 173.24 173.08 1x5z s TRP 38 N 0.32 0.33 -0.27 3.44 -2.14 -1.02 -2.33 118.94 117.26 1x5z s TRP 38 Ca -0.11 -0.78 -0.05 0.00 2.66 0.00 0.00 56.10 57.82 1x5z s TRP 38 Cb -0.14 -0.18 0.01 0.00 -3.10 0.00 0.00 33.47 30.05 1x5z s TRP 38 CO 0.04 -0.51 0.02 0.99 -2.66 0.00 0.00 176.95 174.83 1x5z s THR 39 N -3.90 3.53 0.09 0.66 2.01 0.77 -4.66 115.64 114.15 1x5z s THR 39 Ca 0.08 -0.76 -0.31 0.00 0.31 0.00 0.00 61.69 61.01 1x5z s THR 39 Cb 0.06 -2.78 -0.07 0.00 0.01 0.00 0.00 72.50 69.71 1x5z s THR 39 CO -0.09 0.17 1.38 -2.16 -0.69 0.00 0.00 174.62 173.23 1x5z s PRO 40 N 1.44 4.32 1.00 4.92 0.04 -1.26 -2.28 135.00 143.19 1x5z s PRO 40 Ca 0.02 2.03 -0.12 0.00 0.04 0.00 0.00 61.00 62.97 1x5z s PRO 40 Cb -0.17 -3.32 0.19 0.00 0.04 0.00 0.00 34.50 31.24 1x5z s PRO 40 CO -0.01 -0.45 1.09 -1.25 0.04 0.00 0.00 177.00 176.43 1x5z s PRO 41 N 1.34 0.41 0.38 0.56 0.04 -1.26 -4.88 135.00 131.59 1x5z s PRO 41 Ca 0.64 0.52 0.20 0.00 0.04 0.00 0.00 61.00 62.40 1x5z s PRO 41 Cb -0.35 -1.73 1.21 0.00 0.04 0.00 0.00 34.50 33.66 1x5z s PRO 41 CO 0.30 -2.74 1.66 -0.09 0.04 0.00 0.00 177.00 176.17 1x5z h ARG 42 N -1.90 0.24 -5.62 4.56 9.65 -1.95 -3.39 114.38 115.97 1x5z h ARG 42 Ca -0.55 -0.01 -0.58 0.00 -1.10 0.00 0.00 59.98 57.74 1x5z h ARG 42 Cb 1.33 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.82 1x5z h ARG 42 CO 0.57 0.16 1.56 0.43 2.80 0.00 0.00 179.97 185.49 1x5z n SER 43 N -4.89 1.57 0.04 -3.80 7.64 -1.26 -4.79 113.62 108.13 1x5z n SER 43 Ca 0.33 0.14 -0.19 0.00 1.01 0.00 0.00 58.87 60.16 1x5z n SER 43 Cb 1.12 -1.22 -0.09 0.00 -1.01 0.00 0.00 64.21 63.01 1x5z n SER 43 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 1x5z h ASP 44 N 13.83 0.86 -1.27 6.43 1.82 -1.99 -3.41 116.42 132.69 1x5z h ASP 44 Ca -0.19 -0.67 -0.40 0.00 -0.39 0.00 0.00 57.03 55.38 1x5z h ASP 44 Cb 1.31 -0.26 -0.05 0.00 0.68 0.00 0.00 39.33 41.01 1x5z h ASP 44 CO 1.16 1.47 1.02 0.42 -1.61 0.00 0.00 179.24 181.70 1x5z s THR 45 N -3.37 3.45 -0.15 2.25 -4.23 -1.26 -4.92 115.64 107.40 1x5z s THR 45 Ca -0.09 -0.15 -0.00 0.00 -1.18 0.00 0.00 61.69 60.27 1x5z s THR 45 Cb 0.07 -4.07 0.03 0.00 1.34 0.00 0.00 72.50 69.88 1x5z s THR 45 CO 0.91 -1.02 -0.08 -0.63 -0.54 0.00 0.00 174.62 173.26 1x5z s ILE 46 N 9.27 1.21 -0.05 2.99 1.01 -1.26 -4.92 121.20 129.44 1x5z s ILE 46 Ca 0.66 -0.56 -0.26 0.00 0.00 0.00 0.00 60.65 60.49 1x5z s ILE 46 Cb -0.09 -1.28 -0.21 0.00 0.01 0.00 0.00 42.46 40.89 1x5z s ILE 46 CO 0.07 0.25 1.14 0.00 0.00 0.00 0.00 174.94 176.41 1x5z h ALA 47 N 8.11 -0.03 -1.90 9.38 0.00 -1.88 -3.42 119.26 129.53 1x5z h ALA 47 Ca -0.28 -0.29 0.31 0.00 0.00 0.00 0.00 54.91 54.65 1x5z h ALA 47 Cb 1.12 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.83 1x5z h ALA 47 CO 0.43 -0.22 0.82 0.54 0.00 0.00 0.00 179.25 180.82 1x5z s ASN 48 N -5.76 -0.03 -0.05 0.00 2.20 -1.16 -3.91 114.94 106.23 1x5z s ASN 48 Ca -0.16 -0.24 0.04 0.00 -0.94 0.00 0.00 52.86 51.56 1x5z s ASN 48 Cb 0.01 0.21 -0.02 0.00 -2.00 0.00 0.00 41.25 39.44 1x5z s ASN 48 CO 0.66 -0.40 -0.16 -0.31 -2.94 0.00 0.00 177.10 173.95 1x5z s TYR 49 N -2.25 2.66 -0.20 1.54 1.51 -0.89 -0.75 117.35 118.97 1x5z s TYR 49 Ca 0.22 -0.22 -0.16 0.00 -1.01 0.00 0.00 57.07 55.89 1x5z s TYR 49 Cb 0.01 -1.62 -0.04 0.00 -0.11 0.00 0.00 41.96 40.20 1x5z s TYR 49 CO -0.01 0.13 0.42 -2.00 -1.11 0.00 0.00 175.55 172.98 1x5z s GLU 50 N -0.65 4.18 -0.55 -0.62 2.12 -0.21 -2.91 118.70 120.06 1x5z s GLU 50 Ca 0.10 0.24 -0.03 0.00 0.36 0.00 0.00 54.97 55.64 1x5z s GLU 50 Cb -0.11 -3.53 0.14 0.00 0.26 0.00 0.00 34.13 30.89 1x5z s GLU 50 CO 0.01 -0.04 0.36 -1.17 -0.54 0.00 0.00 175.26 173.88 1x5z s LEU 51 N 1.30 5.24 -0.74 2.70 2.96 -1.24 -1.16 118.68 127.74 1x5z s LEU 51 Ca 0.20 -2.59 -0.27 0.00 -0.22 0.00 0.00 54.13 51.26 1x5z s LEU 51 Cb -0.15 -1.85 0.03 0.00 0.50 0.00 0.00 46.19 44.73 1x5z s LEU 51 CO 0.08 -0.43 1.26 -0.69 -1.32 0.00 0.00 176.35 175.25 1x5z s VAL 52 N 0.33 3.77 0.12 1.68 1.01 -0.33 -3.15 120.40 123.83 1x5z s VAL 52 Ca 0.14 0.33 0.10 0.00 0.00 0.00 0.00 61.98 62.55 1x5z s VAL 52 Cb -0.21 -4.91 -0.04 0.00 0.00 0.00 0.00 36.38 31.22 1x5z s VAL 52 CO -0.04 -1.83 -0.25 -0.72 0.00 0.00 0.00 175.10 172.27 1x5z s TYR 53 N 5.60 2.12 -0.01 5.22 1.13 -0.56 -2.52 117.35 128.33 1x5z s TYR 53 Ca 0.34 -0.39 -0.11 0.00 -1.41 0.00 0.00 57.07 55.50 1x5z s TYR 53 Cb -0.09 -1.15 0.01 0.00 -1.10 0.00 0.00 41.96 39.64 1x5z s TYR 53 CO 0.14 0.30 0.23 -1.59 -2.51 0.00 0.00 175.55 172.12 1x5z s LYS 54 N -2.04 0.58 -0.51 -3.49 -2.85 -1.23 -1.17 119.74 109.03 1x5z s LYS 54 Ca 0.12 -0.28 -0.27 0.00 -1.00 0.00 0.00 55.97 54.53 1x5z s LYS 54 Cb -0.10 0.25 -0.02 0.00 -2.06 0.00 0.00 37.83 35.90 1x5z s LYS 54 CO 0.06 -0.15 1.84 0.34 0.10 0.00 0.00 175.35 177.53 1x5z s ASP 55 N -1.34 5.49 0.77 0.03 2.15 -1.26 -3.21 116.67 119.31 1x5z s ASP 55 Ca -0.14 0.69 0.00 0.00 0.43 0.00 0.00 52.55 53.53 1x5z s ASP 55 Cb -0.06 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1x5z s ASP 55 CO 0.03 -2.14 0.00 0.61 -0.17 0.00 0.00 175.17 173.50 1x5z n GLY 56 N 5.59 0.24 0.12 2.66 0.00 -1.18 -1.09 105.19 111.53 1x5z n GLY 56 Ca 0.22 -0.95 -0.15 0.00 0.00 0.00 0.00 46.02 45.13 1x5z n GLY 56 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1x5z h GLU 57 N 0.00 0.27 -1.21 1.61 4.11 -1.92 -3.23 114.58 114.22 1x5z h GLU 57 Ca 0.00 -0.25 -0.28 0.00 0.07 0.00 0.00 59.36 58.90 1x5z h GLU 57 Cb 0.00 0.06 -0.15 0.00 0.50 0.00 0.00 28.75 29.17 1x5z h GLU 57 CO 0.00 0.93 0.36 0.72 0.07 0.00 0.00 179.01 181.09 1x5z n HIS 58 N -4.44 1.52 -1.25 2.06 8.25 -1.26 -4.91 115.22 115.19 1x5z n HIS 58 Ca -0.09 -1.48 0.00 0.00 -0.26 0.00 0.00 57.72 55.88 1x5z n HIS 58 Cb 0.52 -0.74 0.00 0.00 1.12 0.00 0.00 29.99 30.89 1x5z n HIS 58 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5z n GLY 59 N -0.05 0.00 3.30 -1.41 0.00 -0.25 -4.93 105.19 101.85 1x5z n GLY 59 Ca 0.30 -1.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.13 3.29 -0.35 1.61 2.02 -1.26 -4.76 118.70 118.11 1x5z s GLU 60 Ca 0.00 -0.71 -0.28 0.00 0.02 0.00 0.00 54.97 54.00 1x5z s GLU 60 Cb 0.00 -2.71 -0.01 0.00 0.10 0.00 0.00 34.13 31.51 1x5z s GLU 60 CO 0.00 0.01 1.69 -1.21 0.02 0.00 0.00 175.26 175.77 1x5z s GLU 61 N 0.86 3.40 0.10 1.61 2.02 -1.26 -3.86 118.70 121.57 1x5z s GLU 61 Ca -0.04 1.29 0.10 0.00 0.02 0.00 0.00 54.97 56.34 1x5z s GLU 61 Cb -0.15 -4.15 -0.04 0.00 0.10 0.00 0.00 34.13 29.90 1x5z s GLU 61 CO -0.00 -1.78 -0.25 -0.65 0.02 0.00 0.00 175.26 172.60 1x5z s GLN 62 N 5.46 1.45 -0.10 1.61 -1.52 -0.32 -4.93 119.66 121.31 1x5z s GLN 62 Ca 0.75 -1.23 -0.01 0.00 -1.95 0.00 0.00 55.36 52.92 1x5z s GLN 62 Cb -0.20 -1.80 -0.03 0.00 -0.22 0.00 0.00 33.01 30.77 1x5z s GLN 62 CO 0.33 0.44 -0.06 1.03 -0.25 0.00 0.00 175.29 176.78 1x5z s ARG 63 N -1.76 3.09 -0.06 2.91 3.00 -1.26 -1.50 118.95 123.36 1x5z s ARG 63 Ca 0.12 -0.54 0.02 0.00 0.00 0.00 0.00 55.73 55.33 1x5z s ARG 63 Cb -0.10 -2.71 -0.03 0.00 0.00 0.00 0.00 34.95 32.12 1x5z s ARG 63 CO 0.04 0.51 -0.10 0.42 0.00 0.00 0.00 175.30 176.17 1x5z s ILE 64 N -0.39 3.39 -0.89 1.52 1.01 -1.19 -4.92 121.20 119.74 1x5z s ILE 64 Ca 0.06 -0.60 -0.25 0.00 0.00 0.00 0.00 60.65 59.86 1x5z s ILE 64 Cb -0.12 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 40.02 1x5z s ILE 64 CO 0.02 0.59 1.38 -0.89 0.00 0.00 0.00 174.94 176.05 1x5z s THR 65 N -0.78 3.82 -0.03 2.92 2.01 -1.26 -3.70 115.64 118.63 1x5z s THR 65 Ca 0.12 -0.23 -0.10 0.00 0.31 0.00 0.00 61.69 61.79 1x5z s THR 65 Cb -0.11 -4.97 -0.05 0.00 0.01 0.00 0.00 72.50 67.38 1x5z s THR 65 CO 0.01 -1.88 0.30 -0.63 -0.69 0.00 0.00 174.62 171.72 1x5z s ILE 66 N 5.42 5.24 0.43 1.82 1.01 -1.15 -5.00 121.20 128.97 1x5z s ILE 66 Ca 0.42 0.47 -0.24 0.00 0.00 0.00 0.00 60.65 61.29 1x5z s ILE 66 Cb -0.04 -3.58 -0.08 0.00 0.01 0.00 0.00 42.46 38.78 1x5z s ILE 66 CO 0.01 0.52 1.21 -1.83 0.00 0.00 0.00 174.94 174.85 1x5z s GLU 67 N -1.28 3.88 -1.10 2.79 -1.05 -1.26 -2.10 118.70 118.58 1x5z s GLU 67 Ca 0.23 1.91 -0.23 0.00 -0.15 0.00 0.00 54.97 56.72 1x5z s GLU 67 Cb -0.14 -2.58 -0.08 0.00 -0.44 0.00 0.00 34.13 30.89 1x5z s GLU 67 CO 0.11 -0.48 1.94 -1.25 0.95 0.00 0.00 175.26 176.53 1x5z s PRO 68 N -2.45 2.51 0.00 -4.83 0.04 -1.25 -4.54 135.00 124.47 1x5z s PRO 68 Ca 0.60 -0.91 0.00 0.00 0.04 0.00 0.00 61.00 60.73 1x5z s PRO 68 Cb -0.32 -5.19 0.00 0.00 0.04 0.00 0.00 34.50 29.03 1x5z s PRO 68 CO 0.40 -3.81 0.00 0.41 0.04 0.00 0.00 177.00 174.04 1x5z n GLY 69 N 6.12 3.85 0.00 0.56 0.00 -1.26 -5.01 105.19 109.45 1x5z n GLY 69 Ca 0.43 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -4.12 2.61 -2.24 -1.26 -4.71 114.28 104.56 1x5z n THR 70 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 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 -3.21 0.40 -0.08 3.42 1.04 -1.26 -2.43 113.70 111.58 1x5z s SER 71 Ca 0.00 -1.12 -0.14 0.00 0.48 0.00 0.00 55.95 55.17 1x5z s SER 71 Cb 0.00 0.25 0.03 0.00 0.10 0.00 0.00 66.02 66.40 1x5z s SER 71 CO 0.00 -0.67 0.35 -0.47 0.98 0.00 0.00 173.24 173.43 1x5z s TYR 72 N -3.99 -0.32 -0.36 5.02 5.04 -1.10 -5.00 117.35 116.65 1x5z s TYR 72 Ca 0.17 0.68 -0.04 0.00 -2.44 0.00 0.00 57.07 55.44 1x5z s TYR 72 Cb 0.08 0.13 0.07 0.00 0.35 0.00 0.00 41.96 42.59 1x5z s TYR 72 CO -0.03 -0.29 0.12 0.50 -1.34 0.00 0.00 175.55 174.50 1x5z s ARG 73 N -0.52 2.36 -0.05 4.97 3.52 -1.26 -1.67 118.95 126.31 1x5z s ARG 73 Ca -0.06 -1.44 -0.27 0.00 -0.13 0.00 0.00 55.73 53.83 1x5z s ARG 73 Cb -0.04 -3.44 -0.03 0.00 -1.56 0.00 0.00 34.95 29.89 1x5z s ARG 73 CO 0.02 -0.81 0.84 -1.17 -0.81 0.00 0.00 175.30 173.38 1x5z s LEU 74 N 1.27 4.32 0.09 -0.88 2.96 -0.19 -4.92 118.68 121.33 1x5z s LEU 74 Ca 0.01 1.40 0.10 0.00 -0.22 0.00 0.00 54.13 55.41 1x5z s LEU 74 Cb -0.21 -3.32 -0.03 0.00 0.50 0.00 0.00 46.19 43.12 1x5z s LEU 74 CO -0.01 -0.22 -0.26 -1.10 -1.32 0.00 0.00 176.35 173.44 1x5z s GLN 75 N 1.09 1.49 0.00 1.98 -0.21 -1.26 -1.03 119.66 121.72 1x5z s GLN 75 Ca 0.44 -1.22 0.00 0.00 0.02 0.00 0.00 55.36 54.60 1x5z s GLN 75 Cb -0.19 -1.83 0.00 0.00 1.00 0.00 0.00 33.01 31.99 1x5z s GLN 75 CO 0.22 0.45 0.00 0.41 -2.12 0.00 0.00 175.29 174.24 1x5z n GLY 76 N 1.28 0.79 3.33 3.09 0.00 -0.68 -5.02 105.19 107.98 1x5z n GLY 76 Ca -0.18 -0.74 -0.11 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 0.89 0.03 0.99 1.43 -0.93 -5.03 118.68 116.07 1x5z s LEU 77 Ca 0.00 -1.25 -0.09 0.00 -1.03 0.00 0.00 54.13 51.75 1x5z s LEU 77 Cb 0.00 0.85 -0.05 0.00 0.03 0.00 0.00 46.19 47.02 1x5z s LEU 77 CO 0.00 -0.95 0.34 -0.54 0.23 0.00 0.00 176.35 175.43 1x5z s LYS 78 N -4.07 3.70 0.52 1.70 1.02 -1.26 -4.51 119.74 116.84 1x5z s LYS 78 Ca 0.34 0.11 -0.20 0.00 0.02 0.00 0.00 55.97 56.23 1x5z s LYS 78 Cb 0.04 -3.07 -0.06 0.00 -0.52 0.00 0.00 37.83 34.22 1x5z s LYS 78 CO 0.12 0.62 1.14 -1.25 -0.92 0.00 0.00 175.35 175.06 1x5z s PRO 79 N -1.69 3.47 -1.30 -1.68 0.04 -1.20 -3.72 135.00 128.92 1x5z s PRO 79 Ca 0.29 1.65 -0.10 0.00 0.04 0.00 0.00 61.00 62.88 1x5z s PRO 79 Cb -0.14 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1x5z s PRO 79 CO 0.16 -0.76 0.57 -1.71 0.04 0.00 0.00 177.00 175.29 1x5z n ASN 80 N -1.08 -2.34 -3.85 6.66 5.15 0.17 -4.88 115.26 115.09 1x5z n ASN 80 Ca 0.10 -1.03 -0.12 0.00 -0.60 0.00 0.00 54.58 52.93 1x5z n ASN 80 Cb 0.50 -3.07 -0.14 0.00 -0.53 0.00 0.00 39.78 36.55 1x5z n ASN 80 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1x5z s SER 81 N -3.99 -0.06 0.21 1.20 0.01 -1.24 -4.93 113.70 104.90 1x5z s SER 81 Ca 0.20 0.12 -0.27 0.00 1.31 0.00 0.00 55.95 57.31 1x5z s SER 81 Cb -0.08 0.11 -0.09 0.00 0.21 0.00 0.00 66.02 66.18 1x5z s SER 81 CO 0.89 -0.03 0.86 -0.22 0.41 0.00 0.00 173.24 175.15 1x5z s LEU 82 N 0.08 4.59 -0.18 2.44 2.96 -1.26 -3.36 118.68 123.95 1x5z s LEU 82 Ca -0.00 1.78 -0.04 0.00 -0.22 0.00 0.00 54.13 55.64 1x5z s LEU 82 Cb -0.01 -3.51 0.09 0.00 0.50 0.00 0.00 46.19 43.26 1x5z s LEU 82 CO -0.00 0.16 0.29 -0.31 -1.32 0.00 0.00 176.35 175.16 1x5z s TYR 83 N -1.22 -0.50 0.66 5.38 2.02 -1.21 -3.09 117.35 119.39 1x5z s TYR 83 Ca 0.40 0.80 -0.14 0.00 -0.37 0.00 0.00 57.07 57.76 1x5z s TYR 83 Cb -0.24 -0.08 0.00 0.00 -0.40 0.00 0.00 41.96 41.25 1x5z s TYR 83 CO 0.28 -0.50 1.09 0.71 -1.57 0.00 0.00 175.55 175.57 1x5z s TYR 84 N 2.44 2.73 0.01 2.71 1.51 -1.20 -3.05 117.35 122.50 1x5z s TYR 84 Ca 0.05 1.53 -0.12 0.00 -1.01 0.00 0.00 57.07 57.52 1x5z s TYR 84 Cb -0.14 -3.10 0.01 0.00 -0.11 0.00 0.00 41.96 38.63 1x5z s TYR 84 CO -0.11 -1.55 0.26 -0.06 -1.11 0.00 0.00 175.55 172.97 1x5z s PHE 85 N -2.50 -0.08 -0.28 2.71 0.08 0.17 -3.54 117.98 114.55 1x5z s PHE 85 Ca 0.65 0.02 -0.08 0.00 0.12 0.00 0.00 56.93 57.63 1x5z s PHE 85 Cb -0.19 0.05 0.13 0.00 -0.57 0.00 0.00 43.02 42.44 1x5z s PHE 85 CO 0.44 -0.41 0.59 1.03 -0.10 0.00 0.00 175.22 176.77 1x5z s ARG 86 N -1.86 0.52 0.07 0.44 0.52 -1.05 -2.47 118.95 115.12 1x5z s ARG 86 Ca -0.10 1.31 -0.16 0.00 -0.52 0.00 0.00 55.73 56.26 1x5z s ARG 86 Cb -0.04 0.70 -0.06 0.00 0.52 0.00 0.00 34.95 36.07 1x5z s ARG 86 CO 0.01 -0.25 0.50 -1.17 0.02 0.00 0.00 175.30 174.40 1x5z s LEU 87 N 2.82 4.46 -0.26 2.53 2.96 -1.25 -1.19 118.68 128.75 1x5z s LEU 87 Ca -0.03 1.09 -0.01 0.00 -0.22 0.00 0.00 54.13 54.97 1x5z s LEU 87 Cb -0.12 -2.89 0.15 0.00 0.50 0.00 0.00 46.19 43.83 1x5z s LEU 87 CO -0.18 0.24 0.41 0.00 -1.32 0.00 0.00 176.35 175.51 1x5z s ALA 88 N -1.20 -1.27 0.26 5.97 0.00 -0.31 -0.24 121.76 124.97 1x5z s ALA 88 Ca 0.30 0.83 -0.29 0.00 0.00 0.00 0.00 51.96 52.79 1x5z s ALA 88 Cb -0.17 -1.85 -0.14 0.00 0.00 0.00 0.00 23.12 20.96 1x5z s ALA 88 CO 0.17 -1.41 1.06 0.00 0.00 0.00 0.00 175.76 175.59 1x5z n ALA 89 N 5.37 -0.31 -3.96 0.00 0.00 -1.25 -1.04 120.51 119.31 1x5z n ALA 89 Ca -0.02 0.41 -0.31 0.00 0.00 0.00 0.00 53.44 53.52 1x5z n ALA 89 Cb 0.50 -2.03 -0.16 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 -1.21 2.49 0.18 0.00 3.52 0.07 -2.78 118.95 121.22 1x5z s ARG 90 Ca 0.63 -0.64 0.11 0.00 -0.13 0.00 0.00 55.73 55.70 1x5z s ARG 90 Cb -0.74 -2.20 -0.04 0.00 -1.56 0.00 0.00 34.95 30.41 1x5z s ARG 90 CO 0.58 -0.19 -0.23 0.45 -0.81 0.00 0.00 175.30 175.10 1x5z s SER 91 N 1.33 3.51 0.00 -2.12 0.15 -1.25 -2.86 113.70 112.47 1x5z s SER 91 Ca 0.03 -0.81 0.15 0.00 0.70 0.00 0.00 55.95 56.01 1x5z s SER 91 Cb -0.13 -0.30 0.68 0.00 -1.71 0.00 0.00 66.02 64.56 1x5z s SER 91 CO -0.09 0.13 1.43 -0.81 1.20 0.00 0.00 173.24 175.10 1x5z n PRO 92 N 0.37 0.12 -0.01 5.44 -0.04 -1.26 -2.23 135.00 137.38 1x5z n PRO 92 Ca -0.13 0.20 0.04 0.00 -0.04 0.00 0.00 63.50 63.56 1x5z n PRO 92 Cb 0.55 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.38 1x5z n PRO 92 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1x5z n GLN 93 N -1.38 0.66 0.00 0.54 -0.06 -1.26 -5.04 117.38 110.84 1x5z n GLN 93 Ca 0.05 -0.04 0.00 0.00 -2.00 0.00 0.00 57.00 55.01 1x5z n GLN 93 Cb 0.14 -1.60 0.00 0.00 -4.06 0.00 0.00 30.24 24.72 1x5z n GLN 93 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1x5z n GLY 94 N 1.40 3.55 3.73 1.69 0.00 -0.95 -4.91 105.19 109.71 1x5z n GLY 94 Ca -0.12 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 1x5z n GLY 94 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x5z s LEU 95 N 0.00 3.47 0.00 0.99 2.96 -1.26 -3.76 118.68 121.07 1x5z s LEU 95 Ca 0.00 2.49 0.00 0.00 -0.22 0.00 0.00 54.13 56.40 1x5z s LEU 95 Cb 0.00 -4.60 0.00 0.00 0.50 0.00 0.00 46.19 42.09 1x5z s LEU 95 CO 0.00 -2.10 0.00 0.61 -1.32 0.00 0.00 176.35 173.54 1x5z n GLY 96 N 0.66 1.92 3.67 7.98 0.00 -1.12 -4.81 105.19 113.50 1x5z n GLY 96 Ca 0.15 -1.38 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.90 3.28 -0.09 4.61 0.00 -1.26 -4.97 121.76 120.42 1x5z s ALA 97 Ca 0.00 -1.74 -0.02 0.00 0.00 0.00 0.00 51.96 50.19 1x5z s ALA 97 Cb 0.00 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 1x5z s ALA 97 CO 0.00 0.17 0.02 -1.12 0.00 0.00 0.00 175.76 174.83 1x5z s SER 98 N -3.73 5.41 0.72 0.00 0.01 -1.26 -3.93 113.70 110.91 1x5z s SER 98 Ca 0.34 0.19 -0.11 0.00 1.31 0.00 0.00 55.95 57.67 1x5z s SER 98 Cb -0.04 -1.56 0.03 0.00 0.21 0.00 0.00 66.02 64.65 1x5z s SER 98 CO 0.21 0.38 1.08 0.42 0.41 0.00 0.00 173.24 175.73 1x5z s THR 99 N -0.92 3.67 0.73 1.44 -4.23 0.67 -4.96 115.64 112.04 1x5z s THR 99 Ca 0.14 0.57 -0.17 0.00 -1.18 0.00 0.00 61.69 61.05 1x5z s THR 99 Cb -0.11 -3.18 -0.12 0.00 1.34 0.00 0.00 72.50 70.43 1x5z s THR 99 CO 0.03 -0.68 -0.22 0.00 -0.54 0.00 0.00 174.62 173.20 1x5z n ALA 100 N -3.18 -3.62 -2.53 3.99 0.00 -1.26 -4.59 120.51 109.32 1x5z n ALA 100 Ca 0.08 -0.32 -0.43 0.00 0.00 0.00 0.00 53.44 52.77 1x5z n ALA 100 Cb 0.53 -1.41 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 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 -1.77 3.86 0.23 0.00 2.12 -1.26 -4.77 118.70 117.12 1x5z s GLU 101 Ca 0.53 0.96 0.10 0.00 0.36 0.00 0.00 54.97 56.91 1x5z s GLU 101 Cb -0.35 -3.86 -0.05 0.00 0.26 0.00 0.00 34.13 30.13 1x5z s GLU 101 CO 0.71 -1.19 -0.18 0.96 -0.54 0.00 0.00 175.26 175.02 1x5z s ILE 102 N 4.32 2.07 0.06 -3.70 -4.36 -1.03 -4.99 121.20 113.56 1x5z s ILE 102 Ca 0.51 -2.24 -0.03 0.00 -0.26 0.00 0.00 60.65 58.63 1x5z s ILE 102 Cb -0.12 -2.12 -0.03 0.00 1.25 0.00 0.00 42.46 41.44 1x5z s ILE 102 CO 0.25 -0.45 0.03 -0.94 0.24 0.00 0.00 174.94 174.07 1x5z s SER 103 N -3.26 0.36 0.00 4.36 1.04 -1.26 0.45 113.70 115.39 1x5z s SER 103 Ca 0.24 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.83 1x5z s SER 103 Cb -0.04 0.23 -0.00 0.00 0.10 0.00 0.00 66.02 66.31 1x5z s SER 103 CO 0.10 -0.60 -0.01 0.00 0.98 0.00 0.00 173.24 173.71 1x5z s ALA 104 N -3.63 0.06 -0.20 5.32 0.00 -1.17 -4.87 121.76 117.27 1x5z s ALA 104 Ca 0.04 -0.14 -0.11 0.00 0.00 0.00 0.00 51.96 51.76 1x5z s ALA 104 Cb 0.05 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.15 1x5z s ALA 104 CO -0.09 -0.02 0.15 0.50 0.00 0.00 0.00 175.76 176.30 1x5z s ARG 105 N -0.31 4.18 0.78 0.00 3.52 -1.26 -3.36 118.95 122.50 1x5z s ARG 105 Ca -0.03 -0.19 -0.11 0.00 -0.13 0.00 0.00 55.73 55.27 1x5z s ARG 105 Cb -0.02 -3.44 0.06 0.00 -1.56 0.00 0.00 34.95 29.99 1x5z s ARG 105 CO -0.00 0.26 1.08 0.95 -0.81 0.00 0.00 175.30 176.78 1x5z s THR 106 N 0.47 3.33 1.10 4.11 -4.23 -1.21 -4.44 115.64 114.76 1x5z s THR 106 Ca 0.09 0.43 -0.12 0.00 -1.18 0.00 0.00 61.69 60.91 1x5z s THR 106 Cb -0.12 -3.03 0.25 0.00 1.34 0.00 0.00 72.50 70.94 1x5z s THR 106 CO -0.00 -0.56 1.06 -0.04 -0.54 0.00 0.00 174.62 174.53 1x5z s MET 107 N -5.00 -0.44 -0.92 3.99 1.00 -1.22 -3.51 119.30 113.21 1x5z s MET 107 Ca 0.61 1.09 -0.16 0.00 0.00 0.00 0.00 55.69 57.23 1x5z s MET 107 Cb -0.16 -1.59 0.18 0.00 0.00 0.00 0.00 34.83 33.26 1x5z s MET 107 CO 0.56 -3.48 0.99 -1.14 0.00 0.00 0.00 175.02 171.95 1x5z s GLN 108 N -4.49 3.67 0.43 2.03 0.74 -1.26 -0.65 119.66 120.13 1x5z s GLN 108 Ca 0.68 -2.19 -0.23 0.00 0.05 0.00 0.00 55.36 53.67 1x5z s GLN 108 Cb -0.25 -4.70 -0.08 0.00 1.10 0.00 0.00 33.01 29.08 1x5z s GLN 108 CO 0.63 -1.54 1.09 0.45 -0.55 0.00 0.00 175.29 175.37 1x5z s SER 109 N 2.83 6.48 0.11 6.67 0.15 -1.26 -5.00 113.70 123.68 1x5z s SER 109 Ca 0.27 2.13 0.05 0.00 0.70 0.00 0.00 55.95 59.10 1x5z s SER 109 Cb -0.07 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.61 1x5z s SER 109 CO -0.09 -0.69 0.03 -0.55 1.20 0.00 0.00 173.24 173.14 1x5z s SER 110 N -1.52 5.11 -0.63 5.45 0.15 -1.26 -4.98 113.70 116.02 1x5z s SER 110 Ca 0.61 -0.19 0.05 0.00 0.70 0.00 0.00 55.95 57.12 1x5z s SER 110 Cb -0.24 -1.23 0.16 0.00 -1.71 0.00 0.00 66.02 63.00 1x5z s SER 110 CO 0.30 0.14 0.43 -0.83 1.20 0.00 0.00 173.24 174.48 1x5z s GLY 111 N -2.54 2.55 0.14 9.45 0.00 -1.26 -5.09 107.32 110.57 1x5z s GLY 111 Ca 0.27 -3.50 -0.31 0.00 0.00 0.00 0.00 44.72 41.18 1x5z s GLY 111 CO 0.19 1.26 1.34 2.56 0.00 0.00 0.00 173.10 178.46 1x5z s PRO 112 N -1.01 4.35 0.31 2.90 0.04 -1.26 -5.03 135.00 135.31 1x5z s PRO 112 Ca 0.25 2.04 0.01 0.00 0.04 0.00 0.00 61.00 63.33 1x5z s PRO 112 Cb -0.06 -3.24 0.01 0.00 0.04 0.00 0.00 34.50 31.24 1x5z s PRO 112 CO -0.15 -0.36 0.05 0.45 0.04 0.00 0.00 177.00 177.04 1x5z n SER 113 N 3.51 2.68 -4.34 6.66 2.88 -1.26 -5.14 113.62 118.61 1x5z n SER 113 Ca 0.09 -2.30 -0.32 0.00 -1.33 0.00 0.00 58.87 55.01 1x5z n SER 113 Cb 0.43 0.16 -0.15 0.00 -0.75 0.00 0.00 64.21 63.90 1x5z n SER 113 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1x5z s SER 114 N -2.74 3.69 0.00 -3.46 0.01 -1.26 -5.35 113.70 104.59 1x5z s SER 114 Ca 0.04 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.92 1x5z s SER 114 Cb -0.00 -1.36 0.00 0.00 0.21 0.00 0.00 66.02 64.86 1x5z s SER 114 CO 0.03 0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.48