#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ek4 s LYS 2 N 0.00 3.25 0.14 2.12 3.01 -1.26 -5.02 119.74 121.99 1ek4 s LYS 2 Ca 0.00 1.94 -0.07 0.00 -1.01 0.00 0.00 55.97 56.83 1ek4 s LYS 2 Cb 0.00 -2.17 -0.06 0.00 -1.01 0.00 0.00 37.83 34.59 1ek4 s LYS 2 CO 0.00 -1.01 0.42 1.03 0.51 0.00 0.00 175.35 176.30 1ek4 s ARG 3 N -3.01 3.69 -0.03 1.68 0.52 -1.26 -4.67 118.95 115.87 1ek4 s ARG 3 Ca 0.72 0.05 0.05 0.00 -0.52 0.00 0.00 55.73 56.03 1ek4 s ARG 3 Cb -0.33 -2.84 -0.01 0.00 0.52 0.00 0.00 34.95 32.29 1ek4 s ARG 3 CO 0.38 0.46 -0.19 0.08 0.02 0.00 0.00 175.30 176.05 1ek4 s VAL 4 N -1.62 1.57 0.22 3.52 1.01 -1.26 -1.45 120.40 122.38 1ek4 s VAL 4 Ca 0.40 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1ek4 s VAL 4 Cb -0.12 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.88 1ek4 s VAL 4 CO 0.22 0.45 0.01 0.68 0.00 0.00 0.00 175.10 176.46 1ek4 s VAL 5 N -0.19 0.88 -0.23 2.92 -7.23 0.01 -0.87 120.40 115.69 1ek4 s VAL 5 Ca 0.01 -2.01 -0.06 0.00 -1.81 0.00 0.00 61.98 58.11 1ek4 s VAL 5 Cb -0.10 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.49 1ek4 s VAL 5 CO 0.01 -0.32 0.01 -0.63 -0.31 0.00 0.00 175.10 173.87 1ek4 s ILE 6 N -3.52 3.87 -0.52 -0.62 1.01 -0.38 -0.39 121.20 120.63 1ek4 s ILE 6 Ca 0.29 -0.32 0.08 0.00 0.00 0.00 0.00 60.65 60.69 1ek4 s ILE 6 Cb 0.06 -2.78 0.21 0.00 0.01 0.00 0.00 42.46 39.96 1ek4 s ILE 6 CO 0.08 0.39 1.17 0.35 0.00 0.00 0.00 174.94 176.93 1ek4 n THR 7 N 4.79 1.11 -3.63 2.92 -2.24 -0.57 -1.59 114.28 115.07 1ek4 n THR 7 Ca -0.17 -1.10 -0.04 0.00 -2.27 0.00 0.00 64.05 60.47 1ek4 n THR 7 Cb 0.51 0.43 -0.04 0.00 -2.10 0.00 0.00 70.33 69.13 1ek4 n THR 7 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1ek4 s GLY 8 N -1.13 -0.06 0.06 3.38 0.00 -1.26 -3.86 107.32 104.46 1ek4 s GLY 8 Ca 0.16 2.41 -0.12 0.00 0.00 0.00 0.00 44.72 47.18 1ek4 s GLY 8 CO 0.09 0.95 0.27 0.48 0.00 0.00 0.00 173.10 174.89 1ek4 s LEU 9 N -1.34 1.02 -0.04 0.66 0.05 -1.26 -1.06 118.68 116.70 1ek4 s LEU 9 Ca 0.08 -0.31 -0.10 0.00 0.05 0.00 0.00 54.13 53.85 1ek4 s LEU 9 Cb -0.01 1.27 0.02 0.00 -2.05 0.00 0.00 46.19 45.42 1ek4 s LEU 9 CO -0.05 -0.64 0.24 -0.83 -0.55 0.00 0.00 176.35 174.52 1ek4 s GLY 10 N -2.26 -0.12 -0.19 -3.48 0.00 0.08 -3.27 107.32 98.09 1ek4 s GLY 10 Ca -0.03 0.37 -0.26 0.00 0.00 0.00 0.00 44.72 44.81 1ek4 s GLY 10 CO -0.05 0.23 0.68 -1.50 0.00 0.00 0.00 173.10 172.45 1ek4 s ILE 11 N -0.75 0.00 -0.22 0.90 2.07 -1.26 -1.61 121.20 120.33 1ek4 s ILE 11 Ca -0.08 -0.01 -0.03 0.00 -1.41 0.00 0.00 60.65 59.12 1ek4 s ILE 11 Cb -0.04 -0.96 0.07 0.00 0.13 0.00 0.00 42.46 41.65 1ek4 s ILE 11 CO 0.02 -0.01 0.06 -0.69 -1.91 0.00 0.00 174.94 172.41 1ek4 s VAL 12 N -0.17 0.50 0.34 4.00 1.01 -0.80 -2.95 120.40 122.33 1ek4 s VAL 12 Ca -0.04 -0.70 0.06 0.00 0.00 0.00 0.00 61.98 61.30 1ek4 s VAL 12 Cb -0.03 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1ek4 s VAL 12 CO 0.04 -0.34 0.24 -0.94 0.00 0.00 0.00 175.10 174.10 1ek4 s SER 13 N 1.85 1.89 0.61 3.32 1.04 0.49 -0.63 113.70 122.27 1ek4 s SER 13 Ca 0.02 -1.73 0.39 0.00 0.48 0.00 0.00 55.95 55.11 1ek4 s SER 13 Cb -0.17 0.55 1.94 0.00 0.10 0.00 0.00 66.02 68.44 1ek4 s SER 13 CO -0.14 -1.03 2.20 0.77 0.98 0.00 0.00 173.24 176.03 1ek4 h SER 14 N 2.07 0.00 -0.25 7.02 4.64 -1.76 -2.64 113.55 122.63 1ek4 h SER 14 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1ek4 h SER 14 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1ek4 h SER 14 CO 0.42 0.01 0.00 2.30 -0.87 0.00 0.00 176.83 178.69 1ek4 n ILE 15 N -3.16 2.00 0.00 0.95 -5.35 -1.26 -4.44 119.36 108.10 1ek4 n ILE 15 Ca -0.02 -1.73 0.00 0.00 -0.27 0.00 0.00 62.75 60.73 1ek4 n ILE 15 Cb 0.17 -0.10 0.00 0.00 -1.74 0.00 0.00 39.64 37.97 1ek4 n ILE 15 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ek4 n GLY 16 N -0.40 3.16 1.24 3.28 0.00 -0.99 -3.78 105.19 107.71 1ek4 n GLY 16 Ca 0.19 -0.40 0.12 0.00 0.00 0.00 0.00 46.02 45.93 1ek4 n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ek4 n ASN 17 N 0.00 3.67 -3.61 1.61 3.02 -1.26 -0.38 115.26 118.31 1ek4 n ASN 17 Ca 0.00 -2.00 -0.03 0.00 -0.03 0.00 0.00 54.58 52.52 1ek4 n ASN 17 Cb 0.00 -0.34 -0.00 0.00 -0.61 0.00 0.00 39.78 38.83 1ek4 n ASN 17 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ek4 s ASN 18 N -1.33 -0.10 0.52 6.41 6.03 -1.15 -4.62 114.94 120.69 1ek4 s ASN 18 Ca 0.43 -0.46 0.27 0.00 -1.03 0.00 0.00 52.86 52.07 1ek4 s ASN 18 Cb 0.24 0.45 1.40 0.00 -3.03 0.00 0.00 41.25 40.31 1ek4 s ASN 18 CO 0.33 -0.85 2.05 0.06 -2.03 0.00 0.00 177.10 176.65 1ek4 h GLN 19 N 2.00 0.00 -0.04 3.55 3.07 -1.93 -2.10 115.11 119.66 1ek4 h GLN 19 Ca -0.26 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.47 1ek4 h GLN 19 Cb 1.22 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.78 1ek4 h GLN 19 CO 0.29 0.13 -0.01 1.96 0.09 0.00 0.00 178.83 181.29 1ek4 h GLN 20 N 0.00 0.08 -0.51 0.06 7.50 -1.98 -1.08 115.11 119.17 1ek4 h GLN 20 Ca -0.00 -0.03 -0.07 0.00 0.50 0.00 0.00 58.65 59.05 1ek4 h GLN 20 Cb 0.37 -0.01 -0.02 0.00 0.05 0.00 0.00 27.48 27.88 1ek4 h GLN 20 CO 0.02 0.41 0.06 0.93 -1.50 0.00 0.00 178.83 178.75 1ek4 h GLU 21 N -0.26 0.87 -0.49 1.46 5.08 -1.86 -2.21 114.58 117.17 1ek4 h GLU 21 Ca 0.01 -0.25 0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1ek4 h GLU 21 Cb 0.38 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 1ek4 h GLU 21 CO 0.00 0.87 0.30 0.28 -1.00 0.00 0.00 179.01 179.46 1ek4 h VAL 22 N 0.74 1.08 -0.32 3.13 2.07 -1.37 -0.98 116.25 120.60 1ek4 h VAL 22 Ca 0.15 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.49 1ek4 h VAL 22 Cb 0.44 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1ek4 h VAL 22 CO 0.02 0.11 0.14 0.25 0.02 0.00 0.00 177.57 178.10 1ek4 h LEU 23 N 0.61 0.18 -0.82 2.57 5.85 -1.03 -0.06 115.31 122.62 1ek4 h LEU 23 Ca 0.19 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 1ek4 h LEU 23 Cb -0.02 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 1ek4 h LEU 23 CO -0.07 0.14 0.46 0.00 -0.34 0.00 0.00 178.44 178.64 1ek4 h ALA 24 N 1.18 1.05 -0.51 1.25 0.00 -1.06 -1.84 119.26 119.33 1ek4 h ALA 24 Ca 0.14 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ek4 h ALA 24 Cb 0.08 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1ek4 h ALA 24 CO -0.12 0.54 0.04 0.77 0.00 0.00 0.00 179.25 180.49 1ek4 h SER 25 N 1.14 0.85 -0.68 0.00 0.02 -0.72 -1.93 113.55 112.24 1ek4 h SER 25 Ca 0.29 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1ek4 h SER 25 Cb 0.01 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 1ek4 h SER 25 CO -0.05 0.93 0.36 -0.07 -1.14 0.00 0.00 176.83 176.86 1ek4 h LEU 26 N 0.75 0.85 -0.67 5.07 3.38 -0.70 0.14 115.31 124.14 1ek4 h LEU 26 Ca 0.15 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 1ek4 h LEU 26 Cb 0.46 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1ek4 h LEU 26 CO 0.02 0.71 -0.17 0.03 0.09 0.00 0.00 178.44 179.12 1ek4 h ARG 27 N 0.93 0.85 0.00 1.13 3.08 -1.25 -3.04 114.38 116.08 1ek4 h ARG 27 Ca 0.24 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1ek4 h ARG 27 Cb 0.06 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1ek4 h ARG 27 CO -0.04 0.96 -0.12 0.93 -1.07 0.00 0.00 179.97 180.63 1ek4 h GLU 28 N 0.75 0.00 -1.86 0.04 5.08 -1.12 -3.44 114.58 114.03 1ek4 h GLU 28 Ca 0.11 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.33 1ek4 h GLU 28 Cb 0.69 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.96 1ek4 h GLU 28 CO 0.05 0.00 -0.21 0.41 -1.00 0.00 0.00 179.01 178.26 1ek4 n GLY 29 N 1.15 0.25 3.73 -3.84 0.00 0.41 -5.00 105.19 101.89 1ek4 n GLY 29 Ca 0.04 -0.47 -0.40 0.00 0.00 0.00 0.00 46.02 45.19 1ek4 n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ek4 s ARG 30 N -4.91 4.51 0.46 1.61 3.52 -0.64 -5.01 118.95 118.50 1ek4 s ARG 30 Ca 0.10 1.12 -0.21 0.00 -0.13 0.00 0.00 55.73 56.62 1ek4 s ARG 30 Cb -0.04 -3.40 -0.10 0.00 -1.56 0.00 0.00 34.95 29.84 1ek4 s ARG 30 CO 0.13 0.16 1.00 0.45 -0.81 0.00 0.00 175.30 176.22 1ek4 s SER 31 N 0.37 6.61 -0.02 -2.12 0.15 -1.26 -4.80 113.70 112.64 1ek4 s SER 31 Ca 0.42 1.82 0.06 0.00 0.70 0.00 0.00 55.95 58.95 1ek4 s SER 31 Cb -0.20 -2.55 0.16 0.00 -1.71 0.00 0.00 66.02 61.72 1ek4 s SER 31 CO 0.23 -0.59 1.13 0.61 1.20 0.00 0.00 173.24 175.82 1ek4 n GLY 32 N -0.43 3.08 3.73 9.45 0.00 0.02 -4.95 105.19 116.10 1ek4 n GLY 32 Ca 0.08 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1ek4 n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ek4 s ILE 33 N -1.21 4.99 0.25 -0.61 -1.09 -1.26 -4.05 121.20 118.23 1ek4 s ILE 33 Ca 0.13 1.33 0.02 0.00 -2.23 0.00 0.00 60.65 59.90 1ek4 s ILE 33 Cb 0.08 -3.98 -0.05 0.00 -1.58 0.00 0.00 42.46 36.93 1ek4 s ILE 33 CO 0.07 0.33 0.05 0.42 -1.23 0.00 0.00 174.94 174.57 1ek4 s THR 34 N 0.37 0.83 0.29 2.92 -4.23 -0.57 -4.24 115.64 111.01 1ek4 s THR 34 Ca 0.34 -2.01 -0.28 0.00 -1.18 0.00 0.00 61.69 58.56 1ek4 s THR 34 Cb -0.18 -2.53 -0.09 0.00 1.34 0.00 0.00 72.50 71.04 1ek4 s THR 34 CO 0.17 -0.14 1.01 0.12 -0.54 0.00 0.00 174.62 175.24 1ek4 s PHE 35 N -3.56 3.69 -0.25 3.99 5.36 -1.26 -1.81 117.98 124.13 1ek4 s PHE 35 Ca 0.33 1.78 0.01 0.00 -0.96 0.00 0.00 56.93 58.09 1ek4 s PHE 35 Cb 0.07 -3.10 0.04 0.00 -0.34 0.00 0.00 43.02 39.70 1ek4 s PHE 35 CO 0.12 -0.10 -0.11 0.45 -1.46 0.00 0.00 175.22 174.12 1ek4 s SER 36 N -1.20 4.21 0.28 6.13 0.15 0.11 -4.89 113.70 118.50 1ek4 s SER 36 Ca 0.46 -1.13 0.04 0.00 0.70 0.00 0.00 55.95 56.02 1ek4 s SER 36 Cb -0.26 -1.58 0.41 0.00 -1.71 0.00 0.00 66.02 62.88 1ek4 s SER 36 CO 0.33 -0.15 1.69 -0.61 1.20 0.00 0.00 173.24 175.70 1ek4 h GLN 37 N 7.88 0.34 -0.15 5.44 5.75 -1.96 -2.65 115.11 129.75 1ek4 h GLN 37 Ca -0.27 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.08 1ek4 h GLN 37 Cb 1.08 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.60 1ek4 h GLN 37 CO 0.53 0.67 0.05 1.49 -2.65 0.00 0.00 178.83 178.92 1ek4 h GLU 38 N 0.29 0.13 -0.32 1.69 4.81 -1.96 0.19 114.58 119.41 1ek4 h GLU 38 Ca 0.03 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1ek4 h GLU 38 Cb 0.80 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1ek4 h GLU 38 CO 0.06 0.08 0.09 -0.07 -0.73 0.00 0.00 179.01 178.44 1ek4 h LEU 39 N 0.13 0.47 -0.30 1.64 3.38 -1.87 -1.80 115.31 116.95 1ek4 h LEU 39 Ca 0.06 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.82 1ek4 h LEU 39 Cb 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1ek4 h LEU 39 CO -0.06 0.57 0.18 0.50 0.09 0.00 0.00 178.44 179.72 1ek4 h LYS 40 N 0.35 0.36 0.00 1.13 3.64 -1.23 -2.24 116.57 118.57 1ek4 h LYS 40 Ca 0.10 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1ek4 h LYS 40 Cb 0.27 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1ek4 h LYS 40 CO -0.00 0.24 -0.10 -0.44 -2.27 0.00 0.00 179.45 176.87 1ek4 h ASP 41 N 0.37 0.00 0.85 4.20 3.32 -0.48 -2.20 116.42 122.47 1ek4 h ASP 41 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1ek4 h ASP 41 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1ek4 h ASP 41 CO -0.05 0.10 0.00 -1.54 -1.72 0.00 0.00 179.24 176.03 1ek4 n SER 42 N -4.13 0.70 0.00 6.45 3.41 -0.69 -4.87 113.62 114.49 1ek4 n SER 42 Ca -0.03 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.24 1ek4 n SER 42 Cb 0.18 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1ek4 n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ek4 n GLY 43 N 0.20 1.02 3.85 5.00 0.00 -0.83 -5.10 105.19 109.32 1ek4 n GLY 43 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1ek4 n GLY 43 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ek4 s MET 44 N -0.85 2.80 -0.04 1.61 -1.94 -1.16 -4.99 119.30 114.74 1ek4 s MET 44 Ca 0.00 0.67 0.16 0.00 -1.71 0.00 0.00 55.69 54.81 1ek4 s MET 44 Cb 0.00 -2.00 -0.21 0.00 2.01 0.00 0.00 34.83 34.63 1ek4 s MET 44 CO 0.00 -1.12 0.57 0.54 -0.01 0.00 0.00 175.02 175.00 1ek4 n ARG 45 N -3.10 0.64 -3.21 2.03 1.74 -1.26 -4.73 116.66 108.77 1ek4 n ARG 45 Ca 0.07 0.17 -0.39 0.00 -0.77 0.00 0.00 57.85 56.92 1ek4 n ARG 45 Cb 0.56 -1.72 -0.07 0.00 -1.02 0.00 0.00 32.46 30.21 1ek4 n ARG 45 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ek4 s SER 46 N -5.74 6.58 -0.15 0.55 0.15 -1.26 -4.75 113.70 109.08 1ek4 s SER 46 Ca -0.05 0.70 0.18 0.00 0.70 0.00 0.00 55.95 57.48 1ek4 s SER 46 Cb 0.08 -2.31 0.37 0.00 -1.71 0.00 0.00 66.02 62.45 1ek4 s SER 46 CO 0.83 -0.21 1.24 1.41 1.20 0.00 0.00 173.24 177.70 1ek4 n HIS 47 N 4.92 0.29 -4.33 3.44 8.25 -1.26 -4.56 115.22 121.96 1ek4 n HIS 47 Ca -0.04 -1.00 -0.24 0.00 -0.26 0.00 0.00 57.72 56.18 1ek4 n HIS 47 Cb 0.50 -0.21 -0.12 0.00 1.12 0.00 0.00 29.99 31.28 1ek4 n HIS 47 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1ek4 s VAL 48 N -2.89 1.90 0.19 1.59 -7.23 -1.26 0.09 120.40 112.79 1ek4 s VAL 48 Ca 0.35 -1.78 -0.21 0.00 -1.81 0.00 0.00 61.98 58.53 1ek4 s VAL 48 Cb 0.30 -1.80 0.05 0.00 0.56 0.00 0.00 36.38 35.50 1ek4 s VAL 48 CO 0.04 -0.15 0.61 -1.66 -0.31 0.00 0.00 175.10 173.63 1ek4 s TRP 49 N -1.57 -0.38 -0.87 2.82 -2.14 -0.75 -4.47 118.94 111.57 1ek4 s TRP 49 Ca 0.13 0.09 -0.10 0.00 2.66 0.00 0.00 56.10 58.88 1ek4 s TRP 49 Cb -0.08 0.56 0.23 0.00 -3.10 0.00 0.00 33.47 31.07 1ek4 s TRP 49 CO 0.06 -0.94 0.80 0.20 -2.66 0.00 0.00 176.95 174.41 1ek4 s GLY 50 N -2.81 2.82 0.40 3.67 0.00 -0.10 -1.51 107.32 109.79 1ek4 s GLY 50 Ca 0.05 -3.49 -0.09 0.00 0.00 0.00 0.00 44.72 41.19 1ek4 s GLY 50 CO -0.07 1.25 0.74 0.54 0.00 0.00 0.00 173.10 175.55 1ek4 s ASN 51 N 1.52 6.46 -0.28 1.64 6.03 -1.26 -2.06 114.94 126.99 1ek4 s ASN 51 Ca 0.22 1.03 -0.25 0.00 -1.03 0.00 0.00 52.86 52.82 1ek4 s ASN 51 Cb -0.11 -2.28 0.00 0.00 -3.03 0.00 0.00 41.25 35.83 1ek4 s ASN 51 CO -0.08 -0.39 0.86 -0.69 -2.03 0.00 0.00 177.10 174.76 1ek4 s VAL 52 N -2.38 4.76 -1.24 3.54 1.01 -1.26 -4.18 120.40 120.65 1ek4 s VAL 52 Ca 0.49 1.45 -0.10 0.00 0.00 0.00 0.00 61.98 63.82 1ek4 s VAL 52 Cb -0.10 -4.18 0.19 0.00 0.00 0.00 0.00 36.38 32.28 1ek4 s VAL 52 CO 0.33 -0.22 1.70 0.29 0.00 0.00 0.00 175.10 177.21 1ek4 n LYS 53 N 6.24 3.64 -3.69 2.72 4.76 -1.26 -4.90 118.16 125.67 1ek4 n LYS 53 Ca 0.06 -3.74 -0.11 0.00 -2.87 0.00 0.00 58.31 51.65 1ek4 n LYS 53 Cb 0.48 -2.90 -0.10 0.00 -1.84 0.00 0.00 35.03 30.67 1ek4 n LYS 53 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1ek4 s LEU 54 N -0.02 -0.15 -0.41 -0.35 2.96 -1.26 -4.96 118.68 114.50 1ek4 s LEU 54 Ca 0.39 1.03 -0.23 0.00 -0.22 0.00 0.00 54.13 55.11 1ek4 s LEU 54 Cb 0.05 1.66 0.02 0.00 0.50 0.00 0.00 46.19 48.42 1ek4 s LEU 54 CO 0.01 -0.19 0.77 -0.62 -1.32 0.00 0.00 176.35 175.00 1ek4 s ASP 55 N 0.97 6.46 0.00 3.68 2.15 -1.26 -4.91 116.67 123.77 1ek4 s ASP 55 Ca -0.06 0.06 0.21 0.00 0.43 0.00 0.00 52.55 53.19 1ek4 s ASP 55 Cb -0.06 -2.38 0.89 0.00 -0.30 0.00 0.00 42.92 41.07 1ek4 s ASP 55 CO -0.08 -0.82 1.62 0.35 -0.17 0.00 0.00 175.17 176.06 1ek4 n THR 56 N 5.97 0.13 -1.69 1.71 -2.24 -1.26 -4.89 114.28 112.01 1ek4 n THR 56 Ca 0.02 -0.23 -0.44 0.00 -2.27 0.00 0.00 64.05 61.13 1ek4 n THR 56 Cb 0.48 0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 68.84 1ek4 n THR 56 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1ek4 n THR 57 N -0.05 0.23 -1.01 4.28 -1.04 -1.26 -2.02 114.28 113.41 1ek4 n THR 57 Ca 0.16 -0.06 -0.00 0.00 -2.04 0.00 0.00 64.05 62.11 1ek4 n THR 57 Cb 0.24 -1.67 -0.00 0.00 -1.82 0.00 0.00 70.33 67.08 1ek4 n THR 57 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ek4 n GLY 58 N 3.25 0.15 0.08 3.41 0.00 -1.26 -4.83 105.19 106.00 1ek4 n GLY 58 Ca 0.15 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.29 1ek4 n GLY 58 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ek4 n LEU 59 N -0.05 0.72 -4.07 0.99 4.77 -0.85 -4.80 117.00 113.70 1ek4 n LEU 59 Ca -0.00 0.42 -0.20 0.00 -0.03 0.00 0.00 56.01 56.19 1ek4 n LEU 59 Cb 0.39 -0.27 -0.15 0.00 -2.33 0.00 0.00 43.42 41.06 1ek4 n LEU 59 CO 0.01 -0.11 -0.45 -0.63 -1.33 0.00 0.00 177.39 174.87 1ek4 s ILE 60 N -3.12 0.93 0.25 -0.08 1.01 -1.26 -5.08 121.20 113.85 1ek4 s ILE 60 Ca 0.09 -0.55 -0.31 0.00 0.00 0.00 0.00 60.65 59.88 1ek4 s ILE 60 Cb 0.13 -0.79 -0.14 0.00 0.01 0.00 0.00 42.46 41.68 1ek4 s ILE 60 CO 0.64 0.23 1.35 -0.67 0.00 0.00 0.00 174.94 176.49 1ek4 n ASP 61 N 2.70 2.52 -0.26 3.58 2.03 -1.26 -4.69 116.55 121.17 1ek4 n ASP 61 Ca -0.14 1.15 -0.01 0.00 0.52 0.00 0.00 54.79 56.31 1ek4 n ASP 61 Cb 0.56 -1.40 0.05 0.00 -0.72 0.00 0.00 41.12 39.61 1ek4 n ASP 61 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1ek4 h ARG 62 N 3.81 -0.06 0.00 -0.67 3.08 -1.98 0.80 114.38 119.36 1ek4 h ARG 62 Ca -0.45 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.60 1ek4 h ARG 62 Cb 1.29 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.35 1ek4 h ARG 62 CO 0.73 -0.04 -0.03 0.87 -1.07 0.00 0.00 179.97 180.42 1ek4 h LYS 63 N -0.06 0.00 0.05 0.04 1.57 -2.01 -2.52 116.57 113.63 1ek4 h LYS 63 Ca 0.32 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.77 1ek4 h LYS 63 Cb 0.57 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.85 1ek4 h LYS 63 CO -0.79 0.03 -1.79 0.28 -0.57 0.00 0.00 179.45 176.62 1ek4 n VAL 64 N -3.19 1.63 0.27 0.50 0.31 -0.15 -4.33 118.33 113.37 1ek4 n VAL 64 Ca -0.01 -0.36 0.15 0.00 -0.01 0.00 0.00 64.34 64.11 1ek4 n VAL 64 Cb 0.24 -1.85 0.72 0.00 -0.91 0.00 0.00 33.84 32.03 1ek4 n VAL 64 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 1ek4 h VAL 65 N -0.49 0.29 0.00 2.52 3.04 -0.88 -2.95 116.25 117.78 1ek4 h VAL 65 Ca -0.43 -0.60 0.00 0.00 -1.01 0.00 0.00 66.70 64.66 1ek4 h VAL 65 Cb 1.68 1.46 0.00 0.00 -2.01 0.00 0.00 31.29 32.41 1ek4 h VAL 65 CO -0.10 0.09 0.00 0.08 -1.01 0.00 0.00 177.57 176.62 1ek4 h ARG 66 N 0.00 0.00 -0.01 4.17 0.11 -1.64 -0.74 114.38 116.27 1ek4 h ARG 66 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1ek4 h ARG 66 Cb 0.45 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.53 1ek4 h ARG 66 CO 0.01 0.00 -0.40 1.19 0.10 0.00 0.00 179.97 180.87 1ek4 n PHE 67 N -2.99 0.00 -4.04 4.08 3.01 -1.11 -4.86 117.46 111.55 1ek4 n PHE 67 Ca -0.03 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.14 1ek4 n PHE 67 Cb 0.08 -0.06 -0.06 0.00 -0.01 0.00 0.00 39.48 39.43 1ek4 n PHE 67 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1ek4 s MET 68 N -2.52 2.97 0.53 -1.08 -1.94 -0.29 -3.34 119.30 113.63 1ek4 s MET 68 Ca 0.20 -0.72 0.08 0.00 -1.71 0.00 0.00 55.69 53.55 1ek4 s MET 68 Cb 0.18 -2.74 0.05 0.00 2.01 0.00 0.00 34.83 34.34 1ek4 s MET 68 CO 0.57 0.54 0.64 -1.54 -0.01 0.00 0.00 175.02 175.22 1ek4 s SER 69 N -2.68 5.10 0.33 3.03 1.04 -1.26 -4.92 113.70 114.35 1ek4 s SER 69 Ca 0.31 -0.84 0.01 0.00 0.48 0.00 0.00 55.95 55.91 1ek4 s SER 69 Cb -0.11 0.07 0.58 0.00 0.10 0.00 0.00 66.02 66.65 1ek4 s SER 69 CO 0.23 -1.13 1.98 0.44 0.98 0.00 0.00 173.24 175.75 1ek4 h ASP 70 N 0.45 0.77 -0.69 7.02 3.32 -1.94 -1.87 116.42 123.48 1ek4 h ASP 70 Ca -0.34 -0.03 0.03 0.00 0.02 0.00 0.00 57.03 56.71 1ek4 h ASP 70 Cb 1.29 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 40.60 1ek4 h ASP 70 CO 0.46 0.58 0.42 0.00 -1.72 0.00 0.00 179.24 178.99 1ek4 h ALA 71 N 1.55 0.90 -0.33 3.45 0.00 -1.87 -0.17 119.26 122.79 1ek4 h ALA 71 Ca 0.24 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 1ek4 h ALA 71 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1ek4 h ALA 71 CO -0.05 0.18 -0.28 0.77 0.00 0.00 0.00 179.25 179.88 1ek4 h SER 72 N 0.82 0.70 -0.07 0.00 0.02 -1.79 -2.00 113.55 111.23 1ek4 h SER 72 Ca 0.28 -0.27 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1ek4 h SER 72 Cb 0.04 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 1ek4 h SER 72 CO -0.12 0.94 0.03 0.40 -1.14 0.00 0.00 176.83 176.95 1ek4 h ILE 73 N 0.59 1.13 -0.88 3.27 2.04 -0.57 0.17 117.51 123.27 1ek4 h ILE 73 Ca 0.07 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 1ek4 h ILE 73 Cb 0.77 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 38.08 1ek4 h ILE 73 CO 0.06 0.11 0.52 1.88 0.00 0.00 0.00 178.15 180.73 1ek4 h TYR 74 N -0.04 1.16 -0.32 1.37 0.05 -0.99 -1.26 116.97 116.95 1ek4 h TYR 74 Ca 0.02 -0.01 -0.14 0.00 0.05 0.00 0.00 58.73 58.65 1ek4 h TYR 74 Cb 0.15 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 1ek4 h TYR 74 CO -0.02 0.78 -0.38 0.00 -1.05 0.00 0.00 178.16 177.48 1ek4 h ALA 75 N 1.28 0.73 -0.08 3.88 0.00 -1.20 -2.06 119.26 121.81 1ek4 h ALA 75 Ca 0.31 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1ek4 h ALA 75 Cb -0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1ek4 h ALA 75 CO -0.06 0.66 0.04 0.35 0.00 0.00 0.00 179.25 180.24 1ek4 h PHE 76 N 0.62 0.11 -0.58 0.00 3.57 -0.18 0.11 116.94 120.58 1ek4 h PHE 76 Ca 0.05 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1ek4 h PHE 76 Cb 0.93 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.61 1ek4 h PHE 76 CO 0.05 0.18 0.25 -0.07 -2.23 0.00 0.00 178.31 176.49 1ek4 h LEU 77 N 0.01 0.75 -0.69 0.59 3.38 -1.22 -1.43 115.31 116.71 1ek4 h LEU 77 Ca 0.03 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1ek4 h LEU 77 Cb 0.11 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1ek4 h LEU 77 CO -0.00 0.66 -0.01 0.28 0.09 0.00 0.00 178.44 179.45 1ek4 h SER 78 N 0.82 0.98 -0.41 -0.43 0.02 -1.02 -2.40 113.55 111.12 1ek4 h SER 78 Ca 0.20 -0.28 -0.10 0.00 -0.84 0.00 0.00 61.79 60.78 1ek4 h SER 78 Cb 0.13 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1ek4 h SER 78 CO -0.02 1.04 -0.09 -0.03 -1.14 0.00 0.00 176.83 176.59 1ek4 h MET 79 N 0.92 0.85 -0.76 3.45 1.85 -0.28 0.01 114.93 120.97 1ek4 h MET 79 Ca 0.16 -0.28 0.00 0.00 -0.61 0.00 0.00 59.70 58.97 1ek4 h MET 79 Cb 0.55 -0.07 -0.04 0.00 0.43 0.00 0.00 31.60 32.47 1ek4 h MET 79 CO 0.03 0.91 0.48 0.93 -0.40 0.00 0.00 176.91 178.86 1ek4 h GLU 80 N 0.77 1.01 -0.37 0.39 5.08 -1.06 0.40 114.58 120.81 1ek4 h GLU 80 Ca 0.13 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.38 1ek4 h GLU 80 Cb 0.59 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1ek4 h GLU 80 CO 0.04 0.69 0.10 1.96 -1.00 0.00 0.00 179.01 180.79 1ek4 h GLN 81 N 1.03 0.59 -0.87 2.33 4.20 -1.03 -2.58 115.11 118.78 1ek4 h GLN 81 Ca 0.27 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.82 1ek4 h GLN 81 Cb -0.08 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.58 1ek4 h GLN 81 CO -0.06 0.62 0.44 0.00 -0.67 0.00 0.00 178.83 179.17 1ek4 h ALA 82 N 0.94 1.11 -0.37 3.87 0.00 -0.47 -0.20 119.26 124.15 1ek4 h ALA 82 Ca 0.12 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ek4 h ALA 82 Cb 0.29 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ek4 h ALA 82 CO -0.00 0.65 0.15 0.82 0.00 0.00 0.00 179.25 180.87 1ek4 h ILE 83 N 1.22 1.19 -0.49 0.00 2.04 -0.81 0.20 117.51 120.86 1ek4 h ILE 83 Ca 0.30 -0.58 -0.07 0.00 1.00 0.00 0.00 64.86 65.52 1ek4 h ILE 83 Cb 0.08 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1ek4 h ILE 83 CO -0.04 0.21 0.05 0.00 0.00 0.00 0.00 178.15 178.36 1ek4 h ALA 84 N 0.99 0.65 -0.27 1.87 0.00 -1.24 -2.18 119.26 119.08 1ek4 h ALA 84 Ca 0.12 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1ek4 h ALA 84 Cb 0.18 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1ek4 h ALA 84 CO -0.01 0.41 -0.11 0.22 0.00 0.00 0.00 179.25 179.76 1ek4 h ASP 85 N 0.69 0.43 1.42 0.00 3.58 -0.85 -2.31 116.42 119.38 1ek4 h ASP 85 Ca 0.14 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.49 1ek4 h ASP 85 Cb 0.44 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.38 1ek4 h ASP 85 CO 0.02 0.58 0.00 0.00 -2.88 0.00 0.00 179.24 176.95 1ek4 h ALA 86 N 1.47 1.00 -0.89 -0.78 0.00 -0.72 -3.45 119.26 115.90 1ek4 h ALA 86 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1ek4 h ALA 86 Cb 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ek4 h ALA 86 CO 0.03 0.00 -0.13 0.41 0.00 0.00 0.00 179.25 179.55 1ek4 n GLY 87 N 1.02 0.21 3.83 0.00 0.00 -0.87 -4.76 105.19 104.63 1ek4 n GLY 87 Ca 0.05 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 45.04 1ek4 n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ek4 s LEU 88 N -1.57 4.38 0.23 0.99 1.43 -0.94 -5.06 118.68 118.14 1ek4 s LEU 88 Ca 0.02 0.62 0.06 0.00 -1.03 0.00 0.00 54.13 53.80 1ek4 s LEU 88 Cb -0.01 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.90 1ek4 s LEU 88 CO 0.02 0.32 0.21 -0.44 0.23 0.00 0.00 176.35 176.69 1ek4 s SER 89 N -0.72 5.66 0.25 2.29 0.01 -1.26 -4.72 113.70 115.21 1ek4 s SER 89 Ca 0.18 -0.16 -0.07 0.00 1.31 0.00 0.00 55.95 57.20 1ek4 s SER 89 Cb -0.14 -1.49 0.44 0.00 0.21 0.00 0.00 66.02 65.04 1ek4 s SER 89 CO 0.07 -0.02 1.62 -0.65 0.41 0.00 0.00 173.24 174.67 1ek4 h PRO 90 N 1.68 0.06 0.00 12.44 0.11 -1.99 0.27 132.00 144.57 1ek4 h PRO 90 Ca -0.49 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ek4 h PRO 90 Cb 1.23 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ek4 h PRO 90 CO 0.62 0.04 -0.00 1.05 -0.21 0.00 0.00 178.00 179.49 1ek4 h GLU 91 N 0.06 0.00 0.16 1.05 9.09 -1.95 0.16 114.58 123.15 1ek4 h GLU 91 Ca 0.42 0.00 -0.30 0.00 0.05 0.00 0.00 59.36 59.53 1ek4 h GLU 91 Cb 0.73 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.84 1ek4 h GLU 91 CO -0.74 0.00 -1.42 0.00 0.05 0.00 0.00 179.01 176.91 1ek4 h ALA 92 N 2.00 0.10 0.00 1.06 0.00 -0.84 -3.40 119.26 118.17 1ek4 h ALA 92 Ca -0.00 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 53.94 1ek4 h ALA 92 Cb 0.06 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1ek4 h ALA 92 CO 0.00 0.97 -0.96 2.48 0.00 0.00 0.00 179.25 181.74 1ek4 n TYR 93 N -3.55 0.00 -3.04 0.00 0.18 -1.04 -4.93 117.16 104.79 1ek4 n TYR 93 Ca -0.14 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.32 1ek4 n TYR 93 Cb 1.05 -0.09 -0.06 0.00 -0.38 0.00 0.00 39.34 39.85 1ek4 n TYR 93 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1ek4 s GLN 94 N -2.14 4.07 -1.65 -3.48 -0.21 0.54 -4.03 119.66 112.76 1ek4 s GLN 94 Ca -0.01 0.81 -0.13 0.00 0.02 0.00 0.00 55.36 56.05 1ek4 s GLN 94 Cb 0.04 -2.35 0.12 0.00 1.00 0.00 0.00 33.01 31.82 1ek4 s GLN 94 CO 0.24 0.10 0.59 0.09 -2.12 0.00 0.00 175.29 174.19 1ek4 n ASN 95 N -0.46 -1.96 -4.00 5.90 3.02 0.05 -4.84 115.26 112.97 1ek4 n ASN 95 Ca 0.05 -1.08 -0.31 0.00 -0.03 0.00 0.00 54.58 53.21 1ek4 n ASN 95 Cb 0.53 -2.51 -0.16 0.00 -0.61 0.00 0.00 39.78 37.04 1ek4 n ASN 95 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1ek4 s ASN 96 N -3.64 3.75 0.65 6.41 3.84 -1.26 -4.96 114.94 119.72 1ek4 s ASN 96 Ca 0.51 -1.07 0.38 0.00 0.21 0.00 0.00 52.86 52.89 1ek4 s ASN 96 Cb -0.29 -1.29 2.08 0.00 -0.55 0.00 0.00 41.25 41.20 1ek4 s ASN 96 CO 0.94 -0.18 2.17 -0.65 -2.79 0.00 0.00 177.10 176.60 1ek4 h PRO 97 N 7.92 0.00 -0.16 0.43 0.11 -1.92 -1.61 132.00 136.78 1ek4 h PRO 97 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1ek4 h PRO 97 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ek4 h PRO 97 CO 0.46 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.79 1ek4 n ARG 98 N -2.96 1.78 -4.88 1.05 5.12 -1.26 -4.06 116.66 111.45 1ek4 n ARG 98 Ca -0.03 -1.17 -0.32 0.00 -1.93 0.00 0.00 57.85 54.40 1ek4 n ARG 98 Cb 0.18 -1.42 -0.17 0.00 -1.16 0.00 0.00 32.46 29.90 1ek4 n ARG 98 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1ek4 s VAL 99 N -1.80 2.02 0.17 1.55 1.01 -0.60 -0.35 120.40 122.38 1ek4 s VAL 99 Ca 0.33 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.36 1ek4 s VAL 99 Cb 0.18 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 1ek4 s VAL 99 CO 0.28 0.55 0.06 0.61 0.00 0.00 0.00 175.10 176.59 1ek4 n GLY 100 N 3.85 3.75 3.11 4.51 0.00 -0.33 -0.81 105.19 119.27 1ek4 n GLY 100 Ca -0.20 -2.00 -0.12 0.00 0.00 0.00 0.00 46.02 43.71 1ek4 n GLY 100 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ek4 s LEU 101 N 0.00 0.23 -0.26 0.99 0.20 -0.13 -0.97 118.68 118.74 1ek4 s LEU 101 Ca 0.09 0.62 -0.02 0.00 0.69 0.00 0.00 54.13 55.51 1ek4 s LEU 101 Cb 0.00 0.88 0.08 0.00 -0.43 0.00 0.00 46.19 46.73 1ek4 s LEU 101 CO 0.06 -0.18 0.07 -0.63 -0.29 0.00 0.00 176.35 175.38 1ek4 s ILE 102 N 1.38 0.72 -0.07 6.68 1.01 -0.07 -2.92 121.20 127.93 1ek4 s ILE 102 Ca -0.09 -1.03 -0.12 0.00 0.00 0.00 0.00 60.65 59.42 1ek4 s ILE 102 Cb -0.10 -1.39 0.03 0.00 0.01 0.00 0.00 42.46 41.01 1ek4 s ILE 102 CO -0.10 -0.47 0.29 0.00 0.00 0.00 0.00 174.94 174.67 1ek4 s ALA 103 N 1.73 -0.73 0.20 9.38 0.00 -1.14 -2.56 121.76 128.63 1ek4 s ALA 103 Ca 0.05 0.59 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 1ek4 s ALA 103 Cb -0.17 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.70 1ek4 s ALA 103 CO -0.19 -0.19 0.27 0.41 0.00 0.00 0.00 175.76 176.06 1ek4 n GLY 104 N 2.21 2.64 3.15 0.00 0.00 -1.06 -3.49 105.19 108.65 1ek4 n GLY 104 Ca -0.17 -1.54 -0.10 0.00 0.00 0.00 0.00 46.02 44.21 1ek4 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ek4 s SER 105 N -2.24 1.02 0.13 1.61 1.04 -1.26 -2.08 113.70 111.92 1ek4 s SER 105 Ca 0.17 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 55.63 1ek4 s SER 105 Cb -0.00 0.11 -0.11 0.00 0.10 0.00 0.00 66.02 66.12 1ek4 s SER 105 CO 0.12 -0.47 1.30 1.23 0.98 0.00 0.00 173.24 176.40 1ek4 h GLY 106 N 3.10 0.25 -0.03 7.32 0.00 -1.82 -3.39 103.07 108.49 1ek4 h GLY 106 Ca -0.35 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 46.47 1ek4 h GLY 106 CO 0.63 0.44 -0.02 0.61 0.00 0.00 0.00 176.54 178.21 1ek4 n GLY 107 N 1.09 0.79 7.00 4.60 0.00 -1.26 -4.72 105.19 112.69 1ek4 n GLY 107 Ca -0.05 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1ek4 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ek4 n GLY 108 N -0.34 2.84 2.60 -0.02 0.00 -1.26 -4.07 105.19 104.93 1ek4 n GLY 108 Ca 0.01 0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1ek4 n GLY 108 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ek4 s SER 109 N -4.00 1.93 0.31 1.61 0.15 -1.25 -4.69 113.70 107.76 1ek4 s SER 109 Ca 0.00 -1.98 -0.00 0.00 0.70 0.00 0.00 55.95 54.67 1ek4 s SER 109 Cb 0.00 0.08 0.52 0.00 -1.71 0.00 0.00 66.02 64.91 1ek4 s SER 109 CO 0.00 -0.27 1.97 -0.65 1.20 0.00 0.00 173.24 175.49 1ek4 h PRO 110 N 6.87 0.99 -0.34 5.44 0.11 -1.92 -1.81 132.00 141.34 1ek4 h PRO 110 Ca 0.07 -0.06 0.03 0.00 0.11 0.00 0.00 66.00 66.15 1ek4 h PRO 110 Cb 1.01 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 31.86 1ek4 h PRO 110 CO 0.23 0.66 0.16 -0.09 -0.21 0.00 0.00 178.00 178.75 1ek4 h ARG 111 N 1.02 0.32 0.00 1.05 2.43 -1.93 -1.31 114.38 115.96 1ek4 h ARG 111 Ca 0.31 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.44 1ek4 h ARG 111 Cb -0.03 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1ek4 h ARG 111 CO -0.08 0.21 -0.09 0.74 -1.51 0.00 0.00 179.97 179.23 1ek4 h PHE 112 N 0.33 0.00 -0.36 2.20 -1.00 -1.86 -0.70 116.94 115.55 1ek4 h PHE 112 Ca 0.15 0.00 -0.16 0.00 2.81 0.00 0.00 57.97 60.77 1ek4 h PHE 112 Cb 0.07 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.63 1ek4 h PHE 112 CO -0.11 0.09 -0.40 1.96 -1.61 0.00 0.00 178.31 178.25 1ek4 h GLN 113 N 0.00 0.88 -0.13 1.51 4.20 -1.02 -1.73 115.11 118.81 1ek4 h GLN 113 Ca -0.00 -0.46 -0.22 0.00 0.06 0.00 0.00 58.65 58.03 1ek4 h GLN 113 Cb 1.04 0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.84 1ek4 h GLN 113 CO 0.01 1.11 -0.78 0.28 -0.67 0.00 0.00 178.83 178.78 1ek4 h VAL 114 N 0.71 1.29 -0.24 -0.54 2.07 -1.14 -2.84 116.25 115.56 1ek4 h VAL 114 Ca 0.06 -2.02 0.04 0.00 0.82 0.00 0.00 66.70 65.60 1ek4 h VAL 114 Cb 0.98 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 32.73 1ek4 h VAL 114 CO 0.09 0.63 0.01 0.15 0.02 0.00 0.00 177.57 178.48 1ek4 h PHE 115 N 0.49 0.01 -0.43 1.57 3.57 -1.03 0.83 116.94 121.96 1ek4 h PHE 115 Ca -0.05 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.51 1ek4 h PHE 115 Cb 1.40 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 40.13 1ek4 h PHE 115 CO 0.08 -0.02 0.17 0.78 -2.23 0.00 0.00 178.31 177.08 1ek4 h GLY 116 N 0.09 0.56 1.03 2.40 0.00 -1.30 0.18 103.07 106.04 1ek4 h GLY 116 Ca 0.11 -0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.28 1ek4 h GLY 116 CO -0.18 0.04 0.13 0.00 0.00 0.00 0.00 176.54 176.53 1ek4 h ALA 117 N 1.27 0.82 -0.14 3.60 0.00 -1.21 -1.13 119.26 122.46 1ek4 h ALA 117 Ca 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1ek4 h ALA 117 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1ek4 h ALA 117 CO -0.18 0.55 0.03 -0.44 0.00 0.00 0.00 179.25 179.21 1ek4 h ASP 118 N 0.92 0.21 -0.61 0.00 3.45 -0.38 -2.59 116.42 117.43 1ek4 h ASP 118 Ca 0.19 -0.23 -0.00 0.00 0.43 0.00 0.00 57.03 57.42 1ek4 h ASP 118 Cb 0.39 -0.06 -0.03 0.00 -0.56 0.00 0.00 39.33 39.07 1ek4 h ASP 118 CO 0.01 0.39 0.36 0.00 -1.57 0.00 0.00 179.24 178.43 1ek4 h ALA 119 N 0.83 0.77 -0.34 3.45 0.00 -0.57 -2.39 119.26 121.02 1ek4 h ALA 119 Ca 0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ek4 h ALA 119 Cb 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ek4 h ALA 119 CO 0.00 0.25 0.19 1.98 0.00 0.00 0.00 179.25 181.68 1ek4 h MET 120 N 0.82 0.46 -0.02 0.00 1.85 -1.14 -1.73 114.93 115.17 1ek4 h MET 120 Ca 0.22 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.27 1ek4 h MET 120 Cb -0.02 -0.10 0.00 0.00 0.43 0.00 0.00 31.60 31.91 1ek4 h MET 120 CO -0.04 0.33 0.00 0.54 -0.40 0.00 0.00 176.91 177.34 1ek4 n ARG 121 N -4.45 1.35 -1.49 0.39 1.74 -0.92 -4.27 116.66 109.00 1ek4 n ARG 121 Ca 0.02 -0.51 -0.12 0.00 -0.77 0.00 0.00 57.85 56.47 1ek4 n ARG 121 Cb 0.09 -1.46 0.06 0.00 -1.02 0.00 0.00 32.46 30.13 1ek4 n ARG 121 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ek4 n GLY 122 N 1.07 0.45 0.09 -0.13 0.00 -0.65 -4.98 105.19 101.04 1ek4 n GLY 122 Ca 0.20 -1.95 0.10 0.00 0.00 0.00 0.00 46.02 44.36 1ek4 n GLY 122 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ek4 n PRO 123 N -1.97 0.12 -0.00 1.61 -0.04 -1.26 -2.99 135.00 130.47 1ek4 n PRO 123 Ca 0.08 0.42 0.08 0.00 -0.04 0.00 0.00 63.50 64.03 1ek4 n PRO 123 Cb 0.29 -1.76 -0.10 0.00 -0.04 0.00 0.00 33.50 31.90 1ek4 n PRO 123 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ek4 n ARG 124 N -1.99 1.54 0.00 0.54 1.74 -1.26 -5.06 116.66 112.16 1ek4 n ARG 124 Ca 0.02 -0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1ek4 n ARG 124 Cb 0.17 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1ek4 n ARG 124 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ek4 n GLY 125 N 1.41 3.04 0.40 -0.13 0.00 -1.16 -2.26 105.19 106.49 1ek4 n GLY 125 Ca 0.02 -0.12 0.20 0.00 0.00 0.00 0.00 46.02 46.13 1ek4 n GLY 125 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ek4 h LEU 126 N 0.00 0.23 -1.08 0.99 3.38 -1.86 -0.89 115.31 116.08 1ek4 h LEU 126 Ca 0.00 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1ek4 h LEU 126 Cb 0.00 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1ek4 h LEU 126 CO 0.00 0.11 -0.13 0.11 0.09 0.00 0.00 178.44 178.61 1ek4 h LYS 127 N 0.24 0.49 -0.00 1.13 1.57 -1.84 -2.40 116.57 115.76 1ek4 h LYS 127 Ca 0.38 -0.14 -0.17 0.00 -1.87 0.00 0.00 60.65 58.84 1ek4 h LYS 127 Cb 1.14 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1ek4 h LYS 127 CO -0.09 0.62 -0.81 0.00 -0.57 0.00 0.00 179.45 178.61 1ek4 h ALA 128 N 1.41 0.65 -0.22 3.86 0.00 -1.25 -3.23 119.26 120.47 1ek4 h ALA 128 Ca 0.08 -0.71 -0.02 0.00 0.00 0.00 0.00 54.91 54.26 1ek4 h ALA 128 Cb 0.51 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1ek4 h ALA 128 CO 0.03 0.95 0.06 0.28 0.00 0.00 0.00 179.25 180.57 1ek4 h VAL 129 N 0.04 1.21 0.00 0.00 2.07 -1.13 -3.48 116.25 114.95 1ek4 h VAL 129 Ca -0.02 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1ek4 h VAL 129 Cb 1.41 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 32.41 1ek4 h VAL 129 CO 0.11 0.21 0.00 0.61 0.02 0.00 0.00 177.57 178.52 1ek4 n GLY 130 N -0.54 -1.50 0.72 2.17 0.00 -0.94 -4.62 105.19 100.48 1ek4 n GLY 130 Ca -0.04 -1.57 0.08 0.00 0.00 0.00 0.00 46.02 44.49 1ek4 n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ek4 n PRO 131 N -1.65 1.92 -0.08 1.61 -0.04 -1.26 -4.31 135.00 131.19 1ek4 n PRO 131 Ca 0.00 -1.41 0.05 0.00 -0.04 0.00 0.00 63.50 62.10 1ek4 n PRO 131 Cb 0.00 -1.35 0.09 0.00 -0.04 0.00 0.00 33.50 32.21 1ek4 n PRO 131 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ek4 n TYR 132 N 0.64 0.21 0.06 0.54 4.01 -1.26 -4.68 117.16 116.67 1ek4 n TYR 132 Ca 0.15 -0.24 -0.06 0.00 -0.16 0.00 0.00 57.90 57.59 1ek4 n TYR 132 Cb 0.35 -0.01 0.12 0.00 -0.31 0.00 0.00 39.34 39.49 1ek4 n TYR 132 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1ek4 h VAL 133 N 2.03 1.35 0.08 -0.72 2.07 -1.82 -3.16 116.25 116.08 1ek4 h VAL 133 Ca 0.00 -1.82 0.00 0.00 0.82 0.00 0.00 66.70 65.70 1ek4 h VAL 133 Cb 0.58 1.85 -0.00 0.00 -1.52 0.00 0.00 31.29 32.19 1ek4 h VAL 133 CO 0.00 0.55 -0.06 0.58 0.02 0.00 0.00 177.57 178.65 1ek4 h VAL 134 N 0.27 0.86 0.00 2.57 2.07 -1.92 0.95 116.25 121.04 1ek4 h VAL 134 Ca 0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1ek4 h VAL 134 Cb 1.03 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1ek4 h VAL 134 CO 0.09 0.00 -0.09 0.71 0.02 0.00 0.00 177.57 178.30 1ek4 h THR 135 N -0.15 0.32 0.21 2.57 1.35 -1.83 0.13 112.91 115.50 1ek4 h THR 135 Ca -0.00 -0.58 -0.33 0.00 -0.55 0.00 0.00 66.41 64.95 1ek4 h THR 135 Cb 0.14 1.44 0.02 0.00 -1.73 0.00 0.00 68.15 68.02 1ek4 h THR 135 CO -0.01 0.09 -1.53 0.11 -0.25 0.00 0.00 175.52 173.93 1ek4 h LYS 136 N 0.00 0.43 0.00 4.72 1.57 -1.40 -3.40 116.57 118.49 1ek4 h LYS 136 Ca -0.00 -0.74 -0.11 0.00 -1.87 0.00 0.00 60.65 57.93 1ek4 h LYS 136 Cb 0.43 0.28 -0.02 0.00 0.08 0.00 0.00 32.23 33.00 1ek4 h LYS 136 CO 0.01 1.34 -1.51 0.00 -0.57 0.00 0.00 179.45 178.73 1ek4 n ALA 137 N -2.72 2.24 -1.75 3.86 0.00 0.28 -4.24 120.51 118.18 1ek4 n ALA 137 Ca -0.18 -0.52 -0.37 0.00 0.00 0.00 0.00 53.44 52.37 1ek4 n ALA 137 Cb 1.08 -0.88 0.04 0.00 0.00 0.00 0.00 19.45 19.69 1ek4 n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ek4 s MET 138 N -3.13 2.99 0.50 0.00 0.23 0.43 -3.91 119.30 116.40 1ek4 s MET 138 Ca -0.04 2.07 0.19 0.00 -1.03 0.00 0.00 55.69 56.88 1ek4 s MET 138 Cb 0.10 -2.08 1.25 0.00 -1.53 0.00 0.00 34.83 32.56 1ek4 s MET 138 CO 0.83 -1.26 2.02 0.00 -2.03 0.00 0.00 175.02 174.58 1ek4 h ALA 139 N 1.13 2.23 -0.34 3.16 0.00 -1.93 -1.24 119.26 122.27 1ek4 h ALA 139 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1ek4 h ALA 139 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1ek4 h ALA 139 CO 0.56 -0.35 0.00 -1.13 0.00 0.00 0.00 179.25 178.33 1ek4 n SER 140 N -4.44 2.39 -0.23 0.00 3.41 -1.26 -4.50 113.62 108.98 1ek4 n SER 140 Ca 0.07 -2.14 0.03 0.00 -0.26 0.00 0.00 58.87 56.57 1ek4 n SER 140 Cb 0.42 -0.35 0.13 0.00 -0.26 0.00 0.00 64.21 64.15 1ek4 n SER 140 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1ek4 h GLY 141 N 4.99 0.78 0.82 5.00 0.00 -1.45 -0.81 103.07 112.39 1ek4 h GLY 141 Ca 0.00 0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.46 1ek4 h GLY 141 CO 0.08 -0.24 0.55 -2.08 0.00 0.00 0.00 176.54 174.84 1ek4 h VAL 142 N 0.12 1.10 0.09 4.60 2.07 -1.85 0.02 116.25 122.42 1ek4 h VAL 142 Ca 0.37 -0.36 -0.19 0.00 0.82 0.00 0.00 66.70 67.35 1ek4 h VAL 142 Cb 0.63 -0.03 0.02 0.00 -1.52 0.00 0.00 31.29 30.40 1ek4 h VAL 142 CO -0.59 0.19 -0.79 0.77 0.02 0.00 0.00 177.57 177.17 1ek4 h SER 143 N 1.04 0.53 -0.45 0.57 4.64 -1.43 -3.23 113.55 115.23 1ek4 h SER 143 Ca 0.36 -0.87 0.02 0.00 -0.47 0.00 0.00 61.79 60.83 1ek4 h SER 143 Cb 0.07 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 61.96 1ek4 h SER 143 CO -0.14 1.36 0.26 0.00 -0.87 0.00 0.00 176.83 177.44 1ek4 h ALA 144 N 0.19 0.56 0.00 5.18 0.00 -1.03 -0.43 119.26 123.73 1ek4 h ALA 144 Ca -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1ek4 h ALA 144 Cb 1.56 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1ek4 h ALA 144 CO 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.34 1ek4 n LEU 146 N -2.22 2.26 -0.32 0.00 4.32 -1.03 -4.36 117.00 115.65 1ek4 n LEU 146 Ca 0.03 0.13 0.05 0.00 -0.02 0.00 0.00 56.01 56.19 1ek4 n LEU 146 Cb 0.26 -0.77 0.24 0.00 -1.62 0.00 0.00 43.42 41.53 1ek4 n LEU 146 CO 0.21 0.67 1.25 0.00 -1.22 0.00 0.00 177.39 178.31 1ek4 h ALA 147 N -0.53 1.51 0.57 -1.18 0.00 -1.17 -1.90 119.26 116.56 1ek4 h ALA 147 Ca -0.59 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.28 1ek4 h ALA 147 Cb 1.66 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 19.19 1ek4 h ALA 147 CO -0.26 0.33 -0.27 1.15 0.00 0.00 0.00 179.25 180.20 1ek4 h THR 148 N 1.03 0.23 -0.17 0.00 2.02 -1.75 -0.71 112.91 113.56 1ek4 h THR 148 Ca 0.41 -0.40 -0.07 0.00 0.77 0.00 0.00 66.41 67.12 1ek4 h THR 148 Cb 0.25 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 1ek4 h THR 148 CO -0.17 0.04 -0.20 1.55 0.37 0.00 0.00 175.52 177.11 1ek4 h PRO 149 N -1.08 0.29 -0.28 6.66 0.13 -1.75 -2.53 132.00 133.44 1ek4 h PRO 149 Ca -0.08 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1ek4 h PRO 149 Cb 0.64 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1ek4 h PRO 149 CO 0.13 0.49 0.00 1.19 -0.23 0.00 0.00 178.00 179.57 1ek4 n PHE 150 N -4.20 0.19 -3.95 1.56 3.01 -0.72 -4.90 117.46 108.45 1ek4 n PHE 150 Ca -0.01 -0.09 -0.28 0.00 1.01 0.00 0.00 57.45 58.09 1ek4 n PHE 150 Cb 0.33 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 39.77 1ek4 n PHE 150 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1ek4 n LYS 151 N -0.10 -4.19 -2.64 -1.08 4.76 -0.95 -4.59 118.16 109.35 1ek4 n LYS 151 Ca 0.04 0.49 -0.42 0.00 -2.87 0.00 0.00 58.31 55.56 1ek4 n LYS 151 Cb 0.16 -5.04 -0.04 0.00 -1.84 0.00 0.00 35.03 28.28 1ek4 n LYS 151 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1ek4 s ILE 152 N -3.58 4.48 -0.36 -0.18 -1.09 -0.29 -0.77 121.20 119.42 1ek4 s ILE 152 Ca 0.34 1.91 0.08 0.00 -2.23 0.00 0.00 60.65 60.75 1ek4 s ILE 152 Cb -0.18 -4.22 -0.10 0.00 -1.58 0.00 0.00 42.46 36.39 1ek4 s ILE 152 CO 0.87 0.22 0.34 1.41 -1.23 0.00 0.00 174.94 176.55 1ek4 n HIS 153 N 3.33 0.00 -0.12 3.97 8.25 -1.25 -4.86 115.22 124.54 1ek4 n HIS 153 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.51 1ek4 n HIS 153 Cb 0.49 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1ek4 n HIS 153 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ek4 n GLY 154 N 1.29 1.16 3.75 -1.41 0.00 0.01 -4.68 105.19 105.30 1ek4 n GLY 154 Ca 0.01 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.15 1ek4 n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ek4 s VAL 155 N 1.07 2.39 -0.28 1.61 -7.23 -1.26 -4.85 120.40 111.85 1ek4 s VAL 155 Ca 0.00 0.26 0.01 0.00 -1.81 0.00 0.00 61.98 60.44 1ek4 s VAL 155 Cb 0.00 -3.12 0.16 0.00 0.56 0.00 0.00 36.38 33.99 1ek4 s VAL 155 CO 0.00 -0.04 0.46 0.21 -0.31 0.00 0.00 175.10 175.42 1ek4 s ASN 156 N -1.36 -0.25 0.07 4.85 2.47 -1.25 -0.96 114.94 118.51 1ek4 s ASN 156 Ca 0.76 0.07 -0.28 0.00 0.42 0.00 0.00 52.86 53.83 1ek4 s ASN 156 Cb -0.34 1.42 0.09 0.00 -1.45 0.00 0.00 41.25 40.97 1ek4 s ASN 156 CO 0.38 -0.32 1.10 -0.72 -3.72 0.00 0.00 177.10 173.83 1ek4 s TYR 157 N 2.64 -0.10 -0.03 0.43 1.13 -1.15 -5.01 117.35 115.25 1ek4 s TYR 157 Ca 0.12 -0.11 0.04 0.00 -1.41 0.00 0.00 57.07 55.71 1ek4 s TYR 157 Cb -0.13 0.59 -0.03 0.00 -1.10 0.00 0.00 41.96 41.29 1ek4 s TYR 157 CO -0.24 -0.57 -0.14 -1.12 -2.51 0.00 0.00 175.55 170.97 1ek4 s SER 158 N -2.92 4.05 -0.09 -0.18 0.01 -1.26 -2.90 113.70 110.41 1ek4 s SER 158 Ca 0.13 -0.22 -0.01 0.00 1.31 0.00 0.00 55.95 57.16 1ek4 s SER 158 Cb 0.01 -0.84 -0.03 0.00 0.21 0.00 0.00 66.02 65.38 1ek4 s SER 158 CO -0.01 0.33 -0.06 -0.63 0.41 0.00 0.00 173.24 173.28 1ek4 s ILE 159 N -0.78 3.79 -0.03 1.44 1.01 -1.26 -4.96 121.20 120.41 1ek4 s ILE 159 Ca 0.12 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.37 1ek4 s ILE 159 Cb -0.11 -2.58 0.00 0.00 0.01 0.00 0.00 42.46 39.78 1ek4 s ILE 159 CO 0.02 0.57 -0.10 -0.55 0.00 0.00 0.00 174.94 174.88 1ek4 s SER 160 N -0.47 1.36 -0.41 3.58 0.15 -1.26 -4.21 113.70 112.44 1ek4 s SER 160 Ca 0.07 -0.21 0.09 0.00 0.70 0.00 0.00 55.95 56.59 1ek4 s SER 160 Cb -0.12 -0.40 0.38 0.00 -1.71 0.00 0.00 66.02 64.16 1ek4 s SER 160 CO 0.02 0.07 1.29 -1.54 1.20 0.00 0.00 173.24 174.28 1ek4 n SER 161 N 3.35 -1.88 0.00 5.45 3.41 -1.26 -4.91 113.62 117.78 1ek4 n SER 161 Ca -0.19 -2.75 0.00 0.00 -0.26 0.00 0.00 58.87 55.67 1ek4 n SER 161 Cb 0.54 1.16 0.00 0.00 -0.26 0.00 0.00 64.21 65.65 1ek4 n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ek4 n ALA 162 N -0.36 0.00 1.03 7.33 0.00 -1.26 -1.27 120.51 125.97 1ek4 n ALA 162 Ca -0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.52 1ek4 n ALA 162 Cb 0.81 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.76 1ek4 n ALA 162 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ek4 n SER 163 N 3.88 0.00 -0.38 0.00 7.64 -1.26 -2.11 113.62 121.39 1ek4 n SER 163 Ca 0.00 -0.43 0.07 0.00 1.01 0.00 0.00 58.87 59.52 1ek4 n SER 163 Cb 0.00 -0.06 0.01 0.00 -1.01 0.00 0.00 64.21 63.15 1ek4 n SER 163 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ek4 n ALA 164 N -1.06 2.94 -0.04 -0.43 0.00 -0.40 -4.41 120.51 117.12 1ek4 n ALA 164 Ca 0.12 -0.53 -0.01 0.00 0.00 0.00 0.00 53.44 53.02 1ek4 n ALA 164 Cb 0.07 -0.50 -0.01 0.00 0.00 0.00 0.00 19.45 19.02 1ek4 n ALA 164 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1ek4 n THR 165 N 0.05 -0.06 0.48 0.00 -1.04 -0.90 -0.97 114.28 111.85 1ek4 n THR 165 Ca 0.06 1.04 0.09 0.00 -2.04 0.00 0.00 64.05 63.21 1ek4 n THR 165 Cb 0.31 -1.36 0.40 0.00 -1.82 0.00 0.00 70.33 67.85 1ek4 n THR 165 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1ek4 n SER 166 N -2.93 0.29 0.05 8.00 3.41 -1.04 -2.13 113.62 119.27 1ek4 n SER 166 Ca 0.00 0.57 -0.20 0.00 -0.26 0.00 0.00 58.87 58.98 1ek4 n SER 166 Cb 0.02 -0.63 -0.14 0.00 -0.26 0.00 0.00 64.21 63.20 1ek4 n SER 166 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ek4 h ALA 167 N 2.43 -0.07 -0.02 7.33 0.00 -1.32 -3.00 119.26 124.61 1ek4 h ALA 167 Ca 0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 54.91 54.16 1ek4 h ALA 167 Cb 0.32 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ek4 h ALA 167 CO 0.00 0.41 -0.26 0.45 0.00 0.00 0.00 179.25 179.85 1ek4 h HIS 168 N -0.27 0.04 -0.49 0.00 -0.00 -1.07 -1.39 115.15 111.97 1ek4 h HIS 168 Ca -0.14 -0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.20 1ek4 h HIS 168 Cb 1.64 -0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 29.02 1ek4 h HIS 168 CO 0.18 0.29 0.21 0.00 -0.00 0.00 0.00 177.93 178.62 1ek4 h ILE 170 N 0.65 1.27 -0.63 0.00 2.04 -1.30 -1.95 117.51 117.58 1ek4 h ILE 170 Ca 0.17 -1.16 -0.06 0.00 1.00 0.00 0.00 64.86 64.80 1ek4 h ILE 170 Cb 0.16 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1ek4 h ILE 170 CO -0.02 0.40 0.15 1.23 0.00 0.00 0.00 178.15 179.92 1ek4 h GLY 171 N 0.72 1.05 1.55 5.37 0.00 -1.00 -1.48 103.07 109.28 1ek4 h GLY 171 Ca 0.13 -0.63 -0.12 0.00 0.00 0.00 0.00 47.33 46.70 1ek4 h GLY 171 CO 0.04 0.59 -0.38 -0.57 0.00 0.00 0.00 176.54 176.22 1ek4 h ASN 172 N 0.94 0.52 -0.72 0.19 -0.73 -0.86 -2.02 115.58 112.90 1ek4 h ASN 172 Ca 0.20 -0.22 -0.04 0.00 1.87 0.00 0.00 56.30 58.11 1ek4 h ASN 172 Cb 0.33 -0.15 -0.03 0.00 0.27 0.00 0.00 38.32 38.74 1ek4 h ASN 172 CO -0.00 0.85 0.31 0.00 -0.37 0.00 0.00 177.43 178.22 1ek4 h ALA 173 N 1.18 0.93 -0.25 1.57 0.00 -0.89 -0.87 119.26 120.92 1ek4 h ALA 173 Ca 0.04 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1ek4 h ALA 173 Cb 0.85 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1ek4 h ALA 173 CO 0.07 0.53 0.10 0.28 0.00 0.00 0.00 179.25 180.24 1ek4 h VAL 174 N 1.02 0.97 -0.92 0.00 2.07 -0.89 -2.50 116.25 115.99 1ek4 h VAL 174 Ca 0.24 -0.08 0.01 0.00 0.82 0.00 0.00 66.70 67.70 1ek4 h VAL 174 Cb 0.18 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1ek4 h VAL 174 CO -0.02 0.04 0.61 -0.33 0.02 0.00 0.00 177.57 177.89 1ek4 h GLU 175 N 0.23 1.19 -0.63 1.57 5.08 -0.86 -0.19 114.58 120.97 1ek4 h GLU 175 Ca 0.10 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1ek4 h GLU 175 Cb 0.05 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 29.00 1ek4 h GLU 175 CO -0.09 0.79 0.33 1.96 -1.00 0.00 0.00 179.01 181.00 1ek4 h GLN 176 N 1.23 0.88 0.01 2.33 1.08 -0.75 0.08 115.11 119.95 1ek4 h GLN 176 Ca 0.34 -0.10 -0.21 0.00 -1.45 0.00 0.00 58.65 57.23 1ek4 h GLN 176 Cb -0.11 -0.17 0.02 0.00 -0.05 0.00 0.00 27.48 27.16 1ek4 h GLN 176 CO -0.08 0.66 -0.83 0.82 -0.95 0.00 0.00 178.83 178.45 1ek4 h ILE 177 N 0.88 1.36 -0.25 2.54 2.04 -1.04 -1.90 117.51 121.14 1ek4 h ILE 177 Ca 0.22 -2.18 -0.01 0.00 1.00 0.00 0.00 64.86 63.90 1ek4 h ILE 177 Cb 0.05 2.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 1ek4 h ILE 177 CO -0.03 0.65 0.13 1.56 0.00 0.00 0.00 178.15 180.46 1ek4 h GLN 178 N 0.12 0.34 0.00 2.37 4.20 -0.71 0.11 115.11 121.55 1ek4 h GLN 178 Ca -0.11 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.57 1ek4 h GLN 178 Cb 1.52 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.22 1ek4 h GLN 178 CO 0.16 0.27 0.00 1.28 -0.67 0.00 0.00 178.83 179.87 1ek4 n LEU 179 N -4.46 0.00 -0.26 1.46 4.77 -0.02 -3.66 117.00 114.83 1ek4 n LEU 179 Ca 0.01 0.32 -0.03 0.00 -0.03 0.00 0.00 56.01 56.27 1ek4 n LEU 179 Cb 0.10 -0.32 -0.01 0.00 -2.33 0.00 0.00 43.42 40.86 1ek4 n LEU 179 CO 0.35 -0.04 -0.03 0.61 -1.33 0.00 0.00 177.39 176.95 1ek4 n GLY 180 N 0.94 0.64 0.11 -0.72 0.00 0.39 -4.92 105.19 101.63 1ek4 n GLY 180 Ca 0.11 -0.47 -0.00 0.00 0.00 0.00 0.00 46.02 45.67 1ek4 n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ek4 h LYS 181 N 0.30 0.00 -4.32 1.61 1.57 -1.55 -3.48 116.57 110.71 1ek4 h LYS 181 Ca -0.07 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.52 1ek4 h LYS 181 Cb 0.34 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.47 1ek4 h LYS 181 CO 0.10 0.44 -0.70 -0.65 -0.57 0.00 0.00 179.45 178.08 1ek4 s GLN 182 N -2.90 0.55 -0.18 3.15 -1.52 -1.16 -4.80 119.66 112.79 1ek4 s GLN 182 Ca -0.00 -0.96 0.16 0.00 -1.95 0.00 0.00 55.36 52.62 1ek4 s GLN 182 Cb 0.08 -0.01 -0.23 0.00 -0.22 0.00 0.00 33.01 32.63 1ek4 s GLN 182 CO 0.79 -0.04 0.06 -0.25 -0.25 0.00 0.00 175.29 175.60 1ek4 n ASP 183 N 0.83 0.44 -3.84 5.90 8.00 0.52 -4.37 116.55 124.02 1ek4 n ASP 183 Ca -0.19 -0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.19 1ek4 n ASP 183 Cb 0.58 0.95 -0.14 0.00 -0.02 0.00 0.00 41.12 42.49 1ek4 n ASP 183 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ek4 s ILE 184 N -2.45 -0.00 -0.05 0.53 1.01 -1.11 -1.37 121.20 117.76 1ek4 s ILE 184 Ca -0.09 0.01 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 1ek4 s ILE 184 Cb 0.05 -0.09 0.04 0.00 0.01 0.00 0.00 42.46 42.47 1ek4 s ILE 184 CO 0.76 0.01 0.09 -0.69 0.00 0.00 0.00 174.94 175.10 1ek4 s VAL 185 N 0.10 -0.14 -0.15 2.92 1.01 0.17 -1.18 120.40 123.12 1ek4 s VAL 185 Ca -0.01 0.38 -0.27 0.00 0.00 0.00 0.00 61.98 62.08 1ek4 s VAL 185 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 36.38 36.17 1ek4 s VAL 185 CO -0.00 0.16 0.90 -0.36 0.00 0.00 0.00 175.10 175.79 1ek4 s PHE 186 N 2.05 3.44 -0.00 5.22 0.40 -0.14 -1.58 117.98 127.36 1ek4 s PHE 186 Ca 0.02 1.37 0.05 0.00 -0.60 0.00 0.00 56.93 57.78 1ek4 s PHE 186 Cb -0.12 -3.08 -0.01 0.00 0.51 0.00 0.00 43.02 40.31 1ek4 s PHE 186 CO -0.04 -0.25 -0.15 0.00 0.70 0.00 0.00 175.22 175.48 1ek4 s ALA 187 N 2.18 1.27 0.00 5.36 0.00 -0.43 -0.89 121.76 129.25 1ek4 s ALA 187 Ca 0.42 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.68 1ek4 s ALA 187 Cb -0.17 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.65 1ek4 s ALA 187 CO 0.13 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.60 1ek4 n GLY 188 N 2.54 -0.73 0.00 0.00 0.00 -1.06 -0.40 105.19 105.53 1ek4 n GLY 188 Ca -0.15 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1ek4 n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ek4 n GLY 189 N 0.00 -1.66 3.74 -0.02 0.00 -0.54 -2.55 105.19 104.17 1ek4 n GLY 189 Ca 0.00 -1.08 -0.08 0.00 0.00 0.00 0.00 46.02 44.85 1ek4 n GLY 189 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ek4 s GLY 190 N 0.00 -0.23 -0.23 -0.02 0.00 -0.88 -1.47 107.32 104.49 1ek4 s GLY 190 Ca 0.00 -0.10 -0.16 0.00 0.00 0.00 0.00 44.72 44.46 1ek4 s GLY 190 CO 0.00 -0.03 0.58 1.85 0.00 0.00 0.00 173.10 175.50 1ek4 s GLU 191 N -3.88 0.62 0.72 2.90 2.56 -0.18 -4.16 118.70 117.29 1ek4 s GLU 191 Ca 0.08 0.95 -0.11 0.00 0.00 0.00 0.00 54.97 55.89 1ek4 s GLU 191 Cb -0.05 0.18 0.03 0.00 2.00 0.00 0.00 34.13 36.29 1ek4 s GLU 191 CO 0.02 -0.12 1.10 -1.83 -0.56 0.00 0.00 175.26 173.86 1ek4 s GLU 192 N 1.04 2.65 -0.15 4.30 -1.05 -1.26 -1.62 118.70 122.61 1ek4 s GLU 192 Ca -0.06 0.33 -0.00 0.00 -0.15 0.00 0.00 54.97 55.09 1ek4 s GLU 192 Cb -0.06 -2.03 0.03 0.00 -0.44 0.00 0.00 34.13 31.64 1ek4 s GLU 192 CO -0.10 -1.14 -0.09 -1.17 0.95 0.00 0.00 175.26 173.71 1ek4 s LEU 193 N -5.38 1.60 0.08 1.83 2.96 -1.26 -4.69 118.68 113.82 1ek4 s LEU 193 Ca 0.59 -0.54 -0.26 0.00 -0.22 0.00 0.00 54.13 53.70 1ek4 s LEU 193 Cb -0.11 -1.01 0.08 0.00 0.50 0.00 0.00 46.19 45.65 1ek4 s LEU 193 CO 0.50 -0.12 0.70 0.00 -1.32 0.00 0.00 176.35 176.11 1ek4 h TRP 195 N 2.12 0.21 -0.97 0.00 5.08 -1.98 -1.68 115.95 118.74 1ek4 h TRP 195 Ca -0.29 -0.04 0.19 0.00 1.08 0.00 0.00 58.89 59.82 1ek4 h TRP 195 Cb 1.27 -0.05 -0.09 0.00 -3.00 0.00 0.00 29.16 27.29 1ek4 h TRP 195 CO 0.25 0.47 0.61 0.93 -1.28 0.00 0.00 178.44 179.43 1ek4 h GLU 196 N 0.17 0.65 0.06 0.12 3.07 -1.96 -0.95 114.58 115.74 1ek4 h GLU 196 Ca 0.02 -0.04 -0.31 0.00 -0.50 0.00 0.00 59.36 58.53 1ek4 h GLU 196 Cb 0.62 -0.15 -0.03 0.00 -0.84 0.00 0.00 28.75 28.35 1ek4 h GLU 196 CO 0.04 0.43 -1.72 -0.12 -1.40 0.00 0.00 179.01 176.24 1ek4 n MET 197 N -4.65 0.67 -0.19 2.33 1.56 -1.07 -4.45 117.12 111.32 1ek4 n MET 197 Ca 0.21 0.39 0.03 0.00 -0.27 0.00 0.00 57.70 58.07 1ek4 n MET 197 Cb 0.59 -1.71 0.30 0.00 2.15 0.00 0.00 33.22 34.55 1ek4 n MET 197 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1ek4 h ALA 198 N -0.22 1.58 -0.13 -5.12 0.00 -1.02 -2.80 119.26 111.54 1ek4 h ALA 198 Ca -0.41 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.46 1ek4 h ALA 198 Cb 1.70 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1ek4 h ALA 198 CO -0.07 0.36 0.05 0.00 0.00 0.00 0.00 179.25 179.59 1ek4 h GLU 200 N 0.17 0.27 -0.09 0.00 3.07 -1.73 0.13 114.58 116.41 1ek4 h GLU 200 Ca 0.05 -0.09 -0.24 0.00 -0.50 0.00 0.00 59.36 58.58 1ek4 h GLU 200 Cb 0.04 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1ek4 h GLU 200 CO -0.01 0.51 -0.88 0.74 -1.40 0.00 0.00 179.01 177.98 1ek4 h PHE 201 N 0.25 1.02 -0.62 4.33 0.04 -1.40 -2.99 116.94 117.57 1ek4 h PHE 201 Ca 0.04 -0.49 -0.07 0.00 2.80 0.00 0.00 57.97 60.24 1ek4 h PHE 201 Cb 0.58 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.56 1ek4 h PHE 201 CO 0.01 1.32 0.10 0.22 -0.60 0.00 0.00 178.31 179.37 1ek4 h ASP 202 N 0.47 0.97 -0.08 2.17 1.82 -1.07 -1.58 116.42 119.11 1ek4 h ASP 202 Ca -0.08 -0.22 0.02 0.00 -0.39 0.00 0.00 57.03 56.36 1ek4 h ASP 202 Cb 1.51 -0.26 -0.00 0.00 0.68 0.00 0.00 39.33 41.26 1ek4 h ASP 202 CO 0.18 0.97 0.07 0.00 -1.61 0.00 0.00 179.24 178.84 1ek4 h ALA 203 N 1.14 1.93 -0.57 -0.78 0.00 -0.66 0.05 119.26 120.38 1ek4 h ALA 203 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1ek4 h ALA 203 Cb 0.41 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ek4 h ALA 203 CO 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.15 1ek4 n MET 204 N -4.27 2.59 -1.81 0.00 0.00 -0.89 -4.96 117.12 107.78 1ek4 n MET 204 Ca -0.01 -2.45 -0.09 0.00 0.00 0.00 0.00 57.70 55.15 1ek4 n MET 204 Cb 0.18 -1.54 -0.02 0.00 0.00 0.00 0.00 33.22 31.84 1ek4 n MET 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ek4 n GLY 205 N 1.58 0.41 0.09 3.17 0.00 0.00 -4.95 105.19 105.50 1ek4 n GLY 205 Ca 0.22 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.79 1ek4 n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ek4 h ALA 206 N 0.26 0.60 -2.74 4.61 0.00 -1.52 -3.48 119.26 116.99 1ek4 h ALA 206 Ca -0.20 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.13 1ek4 h ALA 206 Cb 0.93 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1ek4 h ALA 206 CO 0.25 0.00 -0.39 -0.51 0.00 0.00 0.00 179.25 178.60 1ek4 s LEU 207 N -4.73 4.30 0.26 0.00 1.43 -1.26 -1.86 118.68 116.81 1ek4 s LEU 207 Ca 0.04 0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 53.26 1ek4 s LEU 207 Cb 0.12 -3.13 -0.10 0.00 0.03 0.00 0.00 46.19 43.10 1ek4 s LEU 207 CO 0.74 0.08 1.43 -0.55 0.23 0.00 0.00 176.35 178.27 1ek4 s SER 208 N -2.65 6.66 0.00 2.29 0.15 -0.65 -4.65 113.70 114.85 1ek4 s SER 208 Ca 0.38 2.67 0.00 0.00 0.70 0.00 0.00 55.95 59.70 1ek4 s SER 208 Cb -0.12 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 1ek4 s SER 208 CO 0.27 -0.69 0.00 0.35 1.20 0.00 0.00 173.24 174.37 1ek4 n THR 209 N 2.15 0.00 1.25 6.45 -2.24 -1.26 -4.38 114.28 116.25 1ek4 n THR 209 Ca 0.06 -0.14 0.14 0.00 -2.27 0.00 0.00 64.05 61.84 1ek4 n THR 209 Cb 0.40 0.68 0.60 0.00 -2.10 0.00 0.00 70.33 69.92 1ek4 n THR 209 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ek4 n LYS 210 N -0.59 0.35 -1.63 -0.78 5.02 -1.26 -4.23 118.16 115.04 1ek4 n LYS 210 Ca 0.00 -0.08 -0.08 0.00 -2.02 0.00 0.00 58.31 56.12 1ek4 n LYS 210 Cb 0.00 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 33.60 1ek4 n LYS 210 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1ek4 n TYR 211 N -1.25 1.40 0.20 2.13 4.02 -1.26 -4.81 117.16 117.60 1ek4 n TYR 211 Ca 0.11 -1.81 0.05 0.00 -0.01 0.00 0.00 57.90 56.24 1ek4 n TYR 211 Cb 0.29 -0.28 0.49 0.00 -0.02 0.00 0.00 39.34 39.82 1ek4 n TYR 211 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1ek4 h ASN 212 N 1.75 0.04 1.14 7.72 2.35 -1.93 -2.24 115.58 124.42 1ek4 h ASN 212 Ca 0.12 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.84 1ek4 h ASN 212 Cb 1.37 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 39.72 1ek4 h ASN 212 CO 0.37 0.21 -0.11 0.44 -1.65 0.00 0.00 177.43 176.69 1ek4 h ASP 213 N 0.05 0.00 -2.28 5.81 3.32 -1.94 -3.32 116.42 118.06 1ek4 h ASP 213 Ca 0.01 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.47 1ek4 h ASP 213 Cb 0.31 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.46 1ek4 h ASP 213 CO 0.02 0.11 -0.85 0.35 -1.72 0.00 0.00 179.24 177.16 1ek4 n THR 214 N -3.22 0.51 -0.29 0.35 -2.24 -0.85 -5.00 114.28 103.55 1ek4 n THR 214 Ca 0.01 -4.42 0.11 0.00 -2.27 0.00 0.00 64.05 57.49 1ek4 n THR 214 Cb 0.41 -1.98 0.26 0.00 -2.10 0.00 0.00 70.33 66.91 1ek4 n THR 214 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1ek4 h PRO 215 N 4.53 0.17 0.00 -0.78 0.11 -1.65 -1.09 132.00 133.30 1ek4 h PRO 215 Ca 0.16 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1ek4 h PRO 215 Cb 0.80 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1ek4 h PRO 215 CO 0.60 0.11 0.00 0.39 -0.21 0.00 0.00 178.00 178.90 1ek4 n GLU 216 N -5.26 0.04 0.00 1.05 1.02 -1.26 -2.15 120.64 114.08 1ek4 n GLU 216 Ca 0.20 0.39 0.07 0.00 -0.02 0.00 0.00 57.16 57.79 1ek4 n GLU 216 Cb 0.64 -1.60 0.04 0.00 -0.02 0.00 0.00 31.44 30.50 1ek4 n GLU 216 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1ek4 n LYS 217 N -1.68 1.21 -0.03 3.49 5.02 -0.42 -4.65 118.16 121.10 1ek4 n LYS 217 Ca 0.02 -1.12 -0.11 0.00 -2.02 0.00 0.00 58.31 55.08 1ek4 n LYS 217 Cb 0.11 -1.23 -0.05 0.00 -0.02 0.00 0.00 35.03 33.84 1ek4 n LYS 217 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ek4 h ALA 218 N 2.53 0.17 -1.92 7.82 0.00 -1.41 -3.39 119.26 123.06 1ek4 h ALA 218 Ca 0.00 -0.07 -0.59 0.00 0.00 0.00 0.00 54.91 54.25 1ek4 h ALA 218 Cb 0.53 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.17 1ek4 h ALA 218 CO 0.00 -0.28 0.66 0.45 0.00 0.00 0.00 179.25 180.08 1ek4 s SER 219 N -5.45 6.59 -0.38 0.00 0.15 -1.26 -4.75 113.70 108.60 1ek4 s SER 219 Ca -0.13 0.34 0.11 0.00 0.70 0.00 0.00 55.95 56.97 1ek4 s SER 219 Cb 0.07 -2.47 0.32 0.00 -1.71 0.00 0.00 66.02 62.23 1ek4 s SER 219 CO 0.69 -1.02 0.69 -2.11 1.20 0.00 0.00 173.24 172.69 1ek4 n ARG 220 N 7.16 0.91 -1.57 5.44 1.85 -1.26 -4.63 116.66 124.56 1ek4 n ARG 220 Ca 0.08 -3.28 -0.51 0.00 -1.00 0.00 0.00 57.85 53.14 1ek4 n ARG 220 Cb 0.48 -1.57 -0.05 0.00 -1.05 0.00 0.00 32.46 30.28 1ek4 n ARG 220 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1ek4 n THR 221 N 0.57 0.57 -0.71 8.89 -1.04 -1.26 -0.96 114.28 120.34 1ek4 n THR 221 Ca 0.23 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1ek4 n THR 221 Cb 0.63 -0.74 0.00 0.00 -1.82 0.00 0.00 70.33 68.40 1ek4 n THR 221 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1ek4 n TYR 222 N 1.77 0.00 -2.86 -1.42 4.01 -1.26 -4.76 117.16 112.64 1ek4 n TYR 222 Ca 0.17 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.51 1ek4 n TYR 222 Cb 0.21 -0.40 -0.06 0.00 -0.31 0.00 0.00 39.34 38.79 1ek4 n TYR 222 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1ek4 s ASP 223 N -2.84 7.50 0.60 7.72 2.15 -0.13 -1.37 116.67 130.28 1ek4 s ASP 223 Ca 0.00 1.77 0.29 0.00 0.43 0.00 0.00 52.55 55.04 1ek4 s ASP 223 Cb 0.00 -2.55 1.59 0.00 -0.30 0.00 0.00 42.92 41.66 1ek4 s ASP 223 CO 0.00 0.14 2.00 0.00 -0.17 0.00 0.00 175.17 177.14 1ek4 h ALA 224 N 4.51 1.91 -0.60 3.66 0.00 -0.49 -2.49 119.26 125.76 1ek4 h ALA 224 Ca -0.45 -0.01 -0.37 0.00 0.00 0.00 0.00 54.91 54.07 1ek4 h ALA 224 Cb 1.20 0.02 -0.23 0.00 0.00 0.00 0.00 17.79 18.79 1ek4 h ALA 224 CO 0.68 -0.47 -0.04 0.72 0.00 0.00 0.00 179.25 180.13 1ek4 n HIS 225 N -3.67 1.96 -2.00 0.00 8.25 -1.26 -5.02 115.22 113.49 1ek4 n HIS 225 Ca 0.04 -2.01 -0.33 0.00 -0.26 0.00 0.00 57.72 55.16 1ek4 n HIS 225 Cb 0.47 -0.65 0.02 0.00 1.12 0.00 0.00 29.99 30.95 1ek4 n HIS 225 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1ek4 s ARG 226 N -3.44 3.15 -0.17 -0.41 1.70 -0.94 -4.99 118.95 113.85 1ek4 s ARG 226 Ca 0.50 1.35 0.21 0.00 -0.47 0.00 0.00 55.73 57.32 1ek4 s ARG 226 Cb 0.43 -2.00 0.43 0.00 -0.57 0.00 0.00 34.95 33.24 1ek4 s ARG 226 CO 0.01 -0.96 1.18 -0.40 -1.08 0.00 0.00 175.30 174.04 1ek4 n ASP 227 N -2.01 0.80 0.00 -2.89 5.75 -1.25 -4.69 116.55 112.26 1ek4 n ASP 227 Ca 0.10 -2.04 0.00 0.00 -0.01 0.00 0.00 54.79 52.84 1ek4 n ASP 227 Cb 0.52 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 1ek4 n ASP 227 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ek4 n GLY 228 N -0.34 2.92 3.92 6.12 0.00 -0.77 -3.57 105.19 113.47 1ek4 n GLY 228 Ca 0.01 -2.05 -0.27 0.00 0.00 0.00 0.00 46.02 43.71 1ek4 n GLY 228 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ek4 s PHE 229 N -2.58 3.24 -0.27 1.61 -0.12 -0.78 -3.82 117.98 115.26 1ek4 s PHE 229 Ca 0.00 0.66 -0.07 0.00 -0.05 0.00 0.00 56.93 57.47 1ek4 s PHE 229 Cb 0.00 -2.79 -0.01 0.00 -0.63 0.00 0.00 43.02 39.59 1ek4 s PHE 229 CO 0.00 -0.89 0.07 0.08 -0.05 0.00 0.00 175.22 174.44 1ek4 s VAL 230 N -3.03 4.10 0.46 -2.49 1.01 -1.26 -1.63 120.40 117.55 1ek4 s VAL 230 Ca 0.55 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.85 1ek4 s VAL 230 Cb -0.11 -3.01 -0.07 0.00 0.00 0.00 0.00 36.38 33.19 1ek4 s VAL 230 CO 0.46 0.22 1.23 -0.51 0.00 0.00 0.00 175.10 176.49 1ek4 s ILE 231 N 1.55 2.82 0.22 2.22 2.07 -1.26 0.42 121.20 129.24 1ek4 s ILE 231 Ca 0.05 0.65 -0.10 0.00 -1.41 0.00 0.00 60.65 59.84 1ek4 s ILE 231 Cb -0.16 -3.34 -0.01 0.00 0.13 0.00 0.00 42.46 39.08 1ek4 s ILE 231 CO 0.03 0.02 0.37 0.00 -1.91 0.00 0.00 174.94 173.45 1ek4 s ALA 232 N -1.43 0.06 0.36 1.50 0.00 -0.06 -0.92 121.76 121.27 1ek4 s ALA 232 Ca 0.63 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 51.62 1ek4 s ALA 232 Cb -0.33 1.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.85 1ek4 s ALA 232 CO 0.40 -0.76 0.18 0.41 0.00 0.00 0.00 175.76 175.99 1ek4 n GLY 233 N -0.32 3.19 0.00 0.00 0.00 -0.88 -4.12 105.19 103.05 1ek4 n GLY 233 Ca -0.02 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1ek4 n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ek4 n GLY 234 N -0.62 0.92 3.65 -0.02 0.00 -0.64 -4.36 105.19 104.12 1ek4 n GLY 234 Ca -0.01 -1.95 -0.09 0.00 0.00 0.00 0.00 46.02 43.97 1ek4 n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ek4 s GLY 235 N 0.00 0.43 -0.01 -0.02 0.00 0.20 -1.01 107.32 106.91 1ek4 s GLY 235 Ca 0.00 -0.77 -0.28 0.00 0.00 0.00 0.00 44.72 43.66 1ek4 s GLY 235 CO 0.00 -0.51 0.74 -0.32 0.00 0.00 0.00 173.10 173.01 1ek4 s GLY 236 N -3.01 -0.52 -0.21 0.20 0.00 -0.54 -1.90 107.32 101.34 1ek4 s GLY 236 Ca 0.20 1.17 -0.20 0.00 0.00 0.00 0.00 44.72 45.90 1ek4 s GLY 236 CO 0.09 0.67 0.57 -0.29 0.00 0.00 0.00 173.10 174.14 1ek4 s MET 237 N -2.14 0.67 0.06 2.90 1.75 -0.63 -1.46 119.30 120.45 1ek4 s MET 237 Ca -0.04 0.78 0.05 0.00 -1.25 0.00 0.00 55.69 55.22 1ek4 s MET 237 Cb -0.00 0.33 -0.03 0.00 2.84 0.00 0.00 34.83 37.96 1ek4 s MET 237 CO -0.00 -0.08 -0.13 0.14 -0.65 0.00 0.00 175.02 174.29 1ek4 s VAL 238 N 0.27 1.01 -0.43 10.11 -7.23 0.46 -0.74 120.40 123.85 1ek4 s VAL 238 Ca -0.00 -1.24 -0.18 0.00 -1.81 0.00 0.00 61.98 58.74 1ek4 s VAL 238 Cb -0.04 -0.98 0.03 0.00 0.56 0.00 0.00 36.38 35.95 1ek4 s VAL 238 CO 0.01 -0.24 0.50 -0.69 -0.31 0.00 0.00 175.10 174.37 1ek4 s VAL 239 N -1.26 5.01 -0.25 1.32 1.01 -0.23 -1.31 120.40 124.69 1ek4 s VAL 239 Ca -0.03 -0.28 -0.14 0.00 0.00 0.00 0.00 61.98 61.53 1ek4 s VAL 239 Cb -0.10 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 1ek4 s VAL 239 CO 0.02 -0.50 0.33 -0.69 0.00 0.00 0.00 175.10 174.26 1ek4 s VAL 240 N 2.32 5.22 0.04 2.92 1.01 -0.62 -1.52 120.40 129.78 1ek4 s VAL 240 Ca 0.15 0.50 0.01 0.00 0.00 0.00 0.00 61.98 62.64 1ek4 s VAL 240 Cb -0.17 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1ek4 s VAL 240 CO 0.15 0.21 -0.06 -0.70 0.00 0.00 0.00 175.10 174.69 1ek4 s GLU 241 N 1.77 0.50 0.30 2.72 2.12 0.47 -0.65 118.70 125.93 1ek4 s GLU 241 Ca 0.14 -0.79 -0.29 0.00 0.36 0.00 0.00 54.97 54.39 1ek4 s GLU 241 Cb -0.15 -0.15 -0.10 0.00 0.26 0.00 0.00 34.13 33.99 1ek4 s GLU 241 CO 0.09 0.01 1.30 -2.00 -0.54 0.00 0.00 175.26 174.12 1ek4 s GLU 242 N -1.86 4.38 0.12 4.30 -6.30 -0.47 -0.81 118.70 118.05 1ek4 s GLU 242 Ca -0.09 2.17 -0.30 0.00 -2.50 0.00 0.00 54.97 54.25 1ek4 s GLU 242 Cb -0.08 -3.10 -0.09 0.00 0.00 0.00 0.00 34.13 30.87 1ek4 s GLU 242 CO -0.01 -0.18 1.60 1.25 0.02 0.00 0.00 175.26 177.94 1ek4 h LEU 243 N 3.79 -1.14 -0.73 2.70 5.85 -1.60 -1.23 115.31 122.95 1ek4 h LEU 243 Ca -0.48 0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.40 1ek4 h LEU 243 Cb 1.22 0.44 -0.04 0.00 0.37 0.00 0.00 40.66 42.65 1ek4 h LEU 243 CO 0.68 -0.46 0.46 -0.33 -0.34 0.00 0.00 178.44 178.45 1ek4 h GLU 244 N -0.60 0.88 -0.74 1.25 4.39 -1.93 -0.48 114.58 117.36 1ek4 h GLU 244 Ca 0.03 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 1ek4 h GLU 244 Cb 0.64 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 29.06 1ek4 h GLU 244 CO -0.25 0.58 0.40 1.25 -1.16 0.00 0.00 179.01 179.83 1ek4 h HIS 245 N 0.90 1.03 0.02 4.33 2.76 -1.92 0.71 115.15 122.98 1ek4 h HIS 245 Ca 0.29 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.43 1ek4 h HIS 245 Cb 0.00 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 28.64 1ek4 h HIS 245 CO -0.04 0.73 -0.01 0.00 -1.30 0.00 0.00 177.93 177.31 1ek4 h ALA 246 N 1.20 -0.02 -0.46 5.26 0.00 -0.69 -2.95 119.26 121.60 1ek4 h ALA 246 Ca 0.26 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1ek4 h ALA 246 Cb 0.05 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ek4 h ALA 246 CO -0.04 -0.37 0.29 -0.07 0.00 0.00 0.00 179.25 179.05 1ek4 h LEU 247 N -0.30 0.48 -2.15 0.00 3.38 -0.94 -2.15 115.31 113.63 1ek4 h LEU 247 Ca -0.00 -0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.04 1ek4 h LEU 247 Cb 0.28 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1ek4 h LEU 247 CO 0.00 0.34 0.27 0.00 0.09 0.00 0.00 178.44 179.15 1ek4 h ALA 248 N 1.19 1.89 -0.53 1.53 0.00 -0.81 -0.57 119.26 121.95 1ek4 h ALA 248 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ek4 h ALA 248 Cb -0.02 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ek4 h ALA 248 CO -0.06 -0.40 0.00 2.89 0.00 0.00 0.00 179.25 181.68 1ek4 n ARG 249 N -3.76 2.92 -2.51 0.00 1.85 -0.89 -4.97 116.66 109.30 1ek4 n ARG 249 Ca 0.03 -2.43 -0.15 0.00 -1.00 0.00 0.00 57.85 54.30 1ek4 n ARG 249 Cb 0.41 -1.49 0.01 0.00 -1.05 0.00 0.00 32.46 30.34 1ek4 n ARG 249 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ek4 n GLY 250 N 0.98 -0.22 3.79 2.89 0.00 -0.22 -4.99 105.19 107.41 1ek4 n GLY 250 Ca 0.19 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1ek4 n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ek4 s ALA 251 N -2.86 2.61 -0.16 4.61 0.00 -0.86 -5.01 121.76 120.10 1ek4 s ALA 251 Ca 0.09 0.43 -0.22 0.00 0.00 0.00 0.00 51.96 52.26 1ek4 s ALA 251 Cb -0.04 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 1ek4 s ALA 251 CO 0.12 -1.05 0.69 -1.58 0.00 0.00 0.00 175.76 173.93 1ek4 s HIS 252 N -2.46 3.43 -0.23 0.00 5.65 -1.26 -4.84 115.29 115.58 1ek4 s HIS 252 Ca 0.64 1.07 -0.07 0.00 0.25 0.00 0.00 55.06 56.95 1ek4 s HIS 252 Cb -0.18 -2.84 -0.03 0.00 -1.18 0.00 0.00 32.58 28.35 1ek4 s HIS 252 CO 0.40 -0.12 0.07 0.42 -0.65 0.00 0.00 174.74 174.87 1ek4 s ILE 253 N 1.67 4.45 -0.03 0.89 1.01 -1.26 -4.41 121.20 123.52 1ek4 s ILE 253 Ca 0.33 -0.13 -0.21 0.00 0.00 0.00 0.00 60.65 60.63 1ek4 s ILE 253 Cb -0.16 -3.06 -0.28 0.00 0.01 0.00 0.00 42.46 38.96 1ek4 s ILE 253 CO 0.12 0.37 0.98 1.88 0.00 0.00 0.00 174.94 178.29 1ek4 h TYR 254 N 7.82 0.57 -1.52 3.97 0.05 -1.65 -3.48 116.97 122.73 1ek4 h TYR 254 Ca -0.37 -0.37 0.29 0.00 0.05 0.00 0.00 58.73 58.33 1ek4 h TYR 254 Cb 1.18 -0.04 -0.14 0.00 1.01 0.00 0.00 36.73 38.74 1ek4 h TYR 254 CO 0.65 1.24 0.80 0.00 -1.05 0.00 0.00 178.16 179.79 1ek4 s ALA 255 N -2.76 -2.15 -0.07 3.88 0.00 -1.25 -4.73 121.76 114.69 1ek4 s ALA 255 Ca -0.13 0.94 -0.03 0.00 0.00 0.00 0.00 51.96 52.73 1ek4 s ALA 255 Cb 0.02 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 1ek4 s ALA 255 CO 0.83 -0.91 0.08 -2.00 0.00 0.00 0.00 175.76 173.76 1ek4 s GLU 256 N -2.48 3.18 -0.53 0.00 2.12 0.76 -1.25 118.70 120.50 1ek4 s GLU 256 Ca 0.12 -0.33 -0.22 0.00 0.36 0.00 0.00 54.97 54.90 1ek4 s GLU 256 Cb 0.03 -2.96 0.05 0.00 0.26 0.00 0.00 34.13 31.50 1ek4 s GLU 256 CO -0.04 0.71 0.82 0.42 -0.54 0.00 0.00 175.26 176.63 1ek4 s ILE 257 N -1.04 4.58 -2.40 -3.70 1.01 -0.05 -1.04 121.20 118.56 1ek4 s ILE 257 Ca 0.17 -0.00 0.23 0.00 0.00 0.00 0.00 60.65 61.05 1ek4 s ILE 257 Cb -0.12 -4.44 0.07 0.00 0.01 0.00 0.00 42.46 37.98 1ek4 s ILE 257 CO 0.07 -0.98 1.16 1.33 0.00 0.00 0.00 174.94 176.52 1ek4 n VAL 258 N 5.98 0.00 -3.63 2.92 0.24 -0.58 -4.58 118.33 118.68 1ek4 n VAL 258 Ca -0.01 -0.35 -0.14 0.00 -2.04 0.00 0.00 64.34 61.80 1ek4 n VAL 258 Cb 0.47 1.33 -0.07 0.00 -1.47 0.00 0.00 33.84 34.10 1ek4 n VAL 258 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1ek4 s GLY 259 N -2.30 -0.51 -0.12 7.63 0.00 -1.12 -4.79 107.32 106.12 1ek4 s GLY 259 Ca 0.22 2.07 -0.04 0.00 0.00 0.00 0.00 44.72 46.97 1ek4 s GLY 259 CO 0.47 1.74 0.23 -0.47 0.00 0.00 0.00 173.10 175.07 1ek4 s TYR 260 N 0.34 -0.34 -0.04 1.90 5.04 -1.26 -1.07 117.35 121.92 1ek4 s TYR 260 Ca 0.00 0.83 0.05 0.00 -2.44 0.00 0.00 57.07 55.52 1ek4 s TYR 260 Cb -0.05 -0.12 -0.02 0.00 0.35 0.00 0.00 41.96 42.12 1ek4 s TYR 260 CO 0.01 -0.34 -0.20 0.20 -1.34 0.00 0.00 175.55 173.88 1ek4 s GLY 261 N 2.38 1.41 -0.16 8.97 0.00 0.12 -4.45 107.32 115.59 1ek4 s GLY 261 Ca 0.02 -1.04 -0.04 0.00 0.00 0.00 0.00 44.72 43.66 1ek4 s GLY 261 CO -0.08 -0.79 0.14 0.00 0.00 0.00 0.00 173.10 172.37 1ek4 s ALA 262 N -0.58 0.11 0.38 3.20 0.00 -1.26 -1.25 121.76 122.36 1ek4 s ALA 262 Ca 0.08 0.03 0.06 0.00 0.00 0.00 0.00 51.96 52.13 1ek4 s ALA 262 Cb -0.11 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.93 1ek4 s ALA 262 CO 0.00 -1.05 0.23 0.95 0.00 0.00 0.00 175.76 175.89 1ek4 s THR 263 N 2.22 0.22 0.01 0.00 -4.23 -0.86 -4.99 115.64 108.00 1ek4 s THR 263 Ca 0.04 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.56 1ek4 s THR 263 Cb -0.15 -2.39 -0.01 0.00 1.34 0.00 0.00 72.50 71.29 1ek4 s THR 263 CO -0.09 0.00 -0.05 -0.55 -0.54 0.00 0.00 174.62 173.39 1ek4 s SER 264 N -3.50 0.58 0.00 3.99 0.15 -1.26 -1.14 113.70 112.53 1ek4 s SER 264 Ca 0.32 -0.18 -0.20 0.00 0.70 0.00 0.00 55.95 56.60 1ek4 s SER 264 Cb 0.02 -0.04 -0.25 0.00 -1.71 0.00 0.00 66.02 64.04 1ek4 s SER 264 CO 0.23 -0.00 1.07 0.44 1.20 0.00 0.00 173.24 176.18 1ek4 h ASP 265 N 5.71 0.56 -5.70 5.45 3.32 -1.08 -3.44 116.42 121.25 1ek4 h ASP 265 Ca -0.29 -0.79 -0.38 0.00 0.02 0.00 0.00 57.03 55.58 1ek4 h ASP 265 Cb 1.20 -0.17 0.14 0.00 0.22 0.00 0.00 39.33 40.71 1ek4 h ASP 265 CO 0.48 1.29 -0.67 0.61 -1.72 0.00 0.00 179.24 179.24 1ek4 n GLY 266 N 1.18 -0.49 0.00 2.75 0.00 -1.26 -4.87 105.19 102.50 1ek4 n GLY 266 Ca -0.11 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1ek4 n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ek4 n ALA 267 N -4.88 1.21 -2.81 4.61 0.00 -1.26 -5.13 120.51 112.25 1ek4 n ALA 267 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.10 1ek4 n ALA 267 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.95 1ek4 n ALA 267 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ek4 s ASP 268 N 1.00 5.80 0.26 0.00 2.15 -1.26 -5.03 116.67 119.59 1ek4 s ASP 268 Ca 0.00 0.16 0.04 0.00 0.43 0.00 0.00 52.55 53.18 1ek4 s ASP 268 Cb 0.00 -1.68 0.33 0.00 -0.30 0.00 0.00 42.92 41.27 1ek4 s ASP 268 CO 0.00 0.25 1.63 -0.03 -0.17 0.00 0.00 175.17 176.85 1ek4 h MET 269 N 3.89 0.33 0.00 4.34 -1.53 -1.99 -3.33 114.93 116.64 1ek4 h MET 269 Ca -0.48 -0.18 -0.06 0.00 -3.44 0.00 0.00 59.70 55.53 1ek4 h MET 269 Cb 1.18 0.01 -0.01 0.00 -0.55 0.00 0.00 31.60 32.23 1ek4 h MET 269 CO 0.65 0.73 -1.24 0.28 0.14 0.00 0.00 176.91 177.46 1ek4 n VAL 270 N -3.98 0.24 -3.78 -5.77 0.31 -1.26 -0.10 118.33 103.99 1ek4 n VAL 270 Ca -0.02 -0.12 -0.35 0.00 -0.01 0.00 0.00 64.34 63.84 1ek4 n VAL 270 Cb 0.53 -0.77 -0.05 0.00 -0.91 0.00 0.00 33.84 32.63 1ek4 n VAL 270 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ek4 s ALA 271 N -2.09 3.85 0.41 3.52 0.00 -1.26 -4.72 121.76 121.48 1ek4 s ALA 271 Ca -0.04 -0.58 -0.24 0.00 0.00 0.00 0.00 51.96 51.11 1ek4 s ALA 271 Cb 0.01 -2.05 -0.09 0.00 0.00 0.00 0.00 23.12 20.99 1ek4 s ALA 271 CO 0.12 0.64 1.07 -1.25 0.00 0.00 0.00 175.76 176.34 1ek4 s PRO 272 N -1.59 4.07 0.23 0.00 0.04 -1.26 -4.28 135.00 132.21 1ek4 s PRO 272 Ca 0.25 1.54 0.17 0.00 0.04 0.00 0.00 61.00 63.00 1ek4 s PRO 272 Cb -0.13 -2.49 0.03 0.00 0.04 0.00 0.00 34.50 31.95 1ek4 s PRO 272 CO 0.14 -0.23 1.27 0.66 0.04 0.00 0.00 177.00 178.88 1ek4 h SER 273 N 2.36 0.00 0.00 6.66 4.64 -1.95 -3.48 113.55 121.78 1ek4 h SER 273 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1ek4 h SER 273 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1ek4 h SER 273 CO 0.62 0.44 0.00 0.61 -0.87 0.00 0.00 176.83 177.62 1ek4 n GLY 274 N 1.25 2.42 0.23 -0.77 0.00 -1.26 -4.74 105.19 102.33 1ek4 n GLY 274 Ca -0.01 -0.54 -0.07 0.00 0.00 0.00 0.00 46.02 45.40 1ek4 n GLY 274 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ek4 h GLU 275 N 0.00 0.76 -0.87 1.61 4.22 -1.93 -1.55 114.58 116.82 1ek4 h GLU 275 Ca 0.00 -0.07 -0.01 0.00 0.08 0.00 0.00 59.36 59.36 1ek4 h GLU 275 Cb 0.00 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 1ek4 h GLU 275 CO 0.00 0.55 0.51 0.78 -2.18 0.00 0.00 179.01 178.67 1ek4 h GLY 276 N 0.76 1.27 1.13 1.92 0.00 -1.85 -2.16 103.07 104.14 1ek4 h GLY 276 Ca 0.20 -0.54 -0.09 0.00 0.00 0.00 0.00 47.33 46.90 1ek4 h GLY 276 CO -0.04 0.52 0.01 0.00 0.00 0.00 0.00 176.54 177.04 1ek4 h ALA 277 N 1.36 0.88 0.32 3.60 0.00 -1.83 -1.07 119.26 122.52 1ek4 h ALA 277 Ca 0.31 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ek4 h ALA 277 Cb -0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1ek4 h ALA 277 CO -0.06 0.66 -0.19 0.28 0.00 0.00 0.00 179.25 179.95 1ek4 h VAL 278 N 0.96 0.61 -0.93 0.00 2.07 -0.84 -0.47 116.25 117.65 1ek4 h VAL 278 Ca 0.17 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.75 1ek4 h VAL 278 Cb 0.53 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 1ek4 h VAL 278 CO 0.03 0.00 0.61 0.03 0.02 0.00 0.00 177.57 178.26 1ek4 h ARG 279 N -0.48 1.08 -0.41 1.57 3.08 -1.28 -1.32 114.38 116.62 1ek4 h ARG 279 Ca -0.04 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 1ek4 h ARG 279 Cb 0.39 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1ek4 h ARG 279 CO 0.05 0.71 0.01 0.00 -1.07 0.00 0.00 179.97 179.67 1ek4 h MET 281 N 0.55 0.74 -0.79 0.00 2.86 -0.70 -2.27 114.93 115.31 1ek4 h MET 281 Ca 0.12 -0.29 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1ek4 h MET 281 Cb 0.46 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.05 1ek4 h MET 281 CO 0.02 0.89 0.44 0.87 1.06 0.00 0.00 176.91 180.20 1ek4 h LYS 282 N 0.54 1.09 -0.60 1.72 1.57 -1.19 -1.66 116.57 118.04 1ek4 h LYS 282 Ca 0.09 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.71 1ek4 h LYS 282 Cb 0.63 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.70 1ek4 h LYS 282 CO 0.04 0.79 0.18 1.98 -0.57 0.00 0.00 179.45 181.87 1ek4 h MET 283 N 1.10 0.95 0.00 3.15 4.05 -1.03 -2.24 114.93 120.90 1ek4 h MET 283 Ca 0.28 -0.21 -0.06 0.00 -0.28 0.00 0.00 59.70 59.43 1ek4 h MET 283 Cb 0.01 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.67 1ek4 h MET 283 CO -0.05 0.85 -0.27 0.00 0.23 0.00 0.00 176.91 177.68 1ek4 h ALA 284 N 1.05 1.05 0.00 0.39 0.00 -0.94 -3.06 119.26 117.75 1ek4 h ALA 284 Ca 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ek4 h ALA 284 Cb 0.31 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1ek4 h ALA 284 CO -0.00 0.33 -0.60 -1.33 0.00 0.00 0.00 179.25 177.65 1ek4 n MET 285 N -3.49 0.22 -1.67 0.00 2.00 -0.67 -4.15 117.12 109.35 1ek4 n MET 285 Ca -0.00 0.06 -0.47 0.00 0.00 0.00 0.00 57.70 57.28 1ek4 n MET 285 Cb 0.43 -1.63 -0.04 0.00 0.00 0.00 0.00 33.22 31.98 1ek4 n MET 285 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 175.97 177.55 1ek4 n HIS 286 N -1.94 2.30 0.00 2.03 -0.00 -0.87 -1.02 115.22 115.71 1ek4 n HIS 286 Ca 0.04 0.12 0.00 0.00 0.46 0.00 0.00 57.72 58.34 1ek4 n HIS 286 Cb 0.41 -2.61 0.00 0.00 -0.12 0.00 0.00 29.99 27.68 1ek4 n HIS 286 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1ek4 n GLY 287 N 3.93 2.19 3.60 1.57 0.00 -1.26 -4.97 105.19 110.24 1ek4 n GLY 287 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1ek4 n GLY 287 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ek4 s VAL 288 N -2.60 4.41 -1.73 1.61 1.01 -0.19 -4.91 120.40 117.99 1ek4 s VAL 288 Ca 0.00 1.16 0.08 0.00 0.00 0.00 0.00 61.98 63.22 1ek4 s VAL 288 Cb 0.00 -4.47 0.27 0.00 0.00 0.00 0.00 36.38 32.18 1ek4 s VAL 288 CO 0.00 -0.78 1.16 -0.90 0.00 0.00 0.00 175.10 174.58 1ek4 n ASP 289 N 7.28 1.80 -4.40 3.32 3.85 -1.26 -4.86 116.55 122.28 1ek4 n ASP 289 Ca 0.09 -2.07 -0.25 0.00 -0.71 0.00 0.00 54.79 51.85 1ek4 n ASP 289 Cb 0.48 -0.27 -0.11 0.00 -1.35 0.00 0.00 41.12 39.87 1ek4 n ASP 289 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 1ek4 s THR 290 N -1.63 2.18 0.57 2.12 -4.23 -1.26 -5.13 115.64 108.26 1ek4 s THR 290 Ca 0.20 -2.03 -0.15 0.00 -1.18 0.00 0.00 61.69 58.52 1ek4 s THR 290 Cb 0.11 -2.04 -0.05 0.00 1.34 0.00 0.00 72.50 71.86 1ek4 s THR 290 CO 0.12 -0.21 1.03 -2.16 -0.54 0.00 0.00 174.62 172.85 1ek4 s PRO 291 N -2.79 3.56 -0.29 3.99 0.04 -1.26 -4.99 135.00 133.26 1ek4 s PRO 291 Ca 0.20 1.06 -0.29 0.00 0.04 0.00 0.00 61.00 62.01 1ek4 s PRO 291 Cb -0.07 -2.07 0.01 0.00 0.04 0.00 0.00 34.50 32.41 1ek4 s PRO 291 CO 0.09 -0.60 1.05 0.42 0.04 0.00 0.00 177.00 178.00 1ek4 s ILE 292 N -2.62 4.58 0.03 0.56 -1.09 -1.26 -4.49 121.20 116.90 1ek4 s ILE 292 Ca 0.61 1.83 -0.03 0.00 -2.23 0.00 0.00 60.65 60.83 1ek4 s ILE 292 Cb -0.13 -4.37 -0.28 0.00 -1.58 0.00 0.00 42.46 36.10 1ek4 s ILE 292 CO 0.37 -0.37 0.96 0.44 -1.23 0.00 0.00 174.94 175.12 1ek4 h ASP 293 N 7.87 0.38 -3.89 3.58 3.32 -1.30 -3.40 116.42 122.97 1ek4 h ASP 293 Ca -0.20 -0.48 -0.18 0.00 0.02 0.00 0.00 57.03 56.19 1ek4 h ASP 293 Cb 1.06 -0.12 -0.26 0.00 0.22 0.00 0.00 39.33 40.23 1ek4 h ASP 293 CO 1.01 1.39 -0.52 -0.47 -1.72 0.00 0.00 179.24 178.93 1ek4 s TYR 294 N -2.63 -0.17 -0.17 4.55 5.04 -1.19 -2.42 117.35 120.36 1ek4 s TYR 294 Ca -0.07 0.40 0.00 0.00 -2.44 0.00 0.00 57.07 54.97 1ek4 s TYR 294 Cb 0.07 0.05 0.03 0.00 0.35 0.00 0.00 41.96 42.47 1ek4 s TYR 294 CO 0.86 -0.10 -0.11 -1.17 -1.34 0.00 0.00 175.55 173.69 1ek4 s LEU 295 N -0.03 1.93 -0.54 6.97 0.20 0.01 -1.12 118.68 126.09 1ek4 s LEU 295 Ca -0.01 -0.69 -0.21 0.00 0.69 0.00 0.00 54.13 53.91 1ek4 s LEU 295 Cb -0.02 -1.15 0.05 0.00 -0.43 0.00 0.00 46.19 44.64 1ek4 s LEU 295 CO 0.00 -0.12 0.78 0.21 -0.29 0.00 0.00 176.35 176.94 1ek4 s ASN 296 N 1.47 6.26 0.74 3.68 3.84 0.73 -3.04 114.94 128.63 1ek4 s ASN 296 Ca 0.02 -0.73 -0.11 0.00 0.21 0.00 0.00 52.86 52.25 1ek4 s ASN 296 Cb -0.15 -2.36 0.03 0.00 -0.55 0.00 0.00 41.25 38.23 1ek4 s ASN 296 CO -0.09 -1.08 1.07 -0.94 -2.79 0.00 0.00 177.10 173.28 1ek4 s SER 297 N 2.88 4.98 0.09 -4.21 1.04 -1.16 -1.90 113.70 115.42 1ek4 s SER 297 Ca 0.21 1.56 -0.17 0.00 0.48 0.00 0.00 55.95 58.03 1ek4 s SER 297 Cb -0.17 -2.37 -0.08 0.00 0.10 0.00 0.00 66.02 63.51 1ek4 s SER 297 CO 0.14 -1.69 1.47 -0.74 0.98 0.00 0.00 173.24 173.40 1ek4 h HIS 298 N -0.89 0.63 -0.59 5.02 2.76 -1.92 -3.43 115.15 116.72 1ek4 h HIS 298 Ca -0.45 -0.15 0.00 0.00 -2.20 0.00 0.00 60.37 57.58 1ek4 h HIS 298 Cb 1.23 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 30.04 1ek4 h HIS 298 CO 0.57 0.78 0.00 0.41 -1.30 0.00 0.00 177.93 178.39 1ek4 n GLY 299 N -0.11 0.00 0.23 5.26 0.00 -1.26 -4.86 105.19 104.45 1ek4 n GLY 299 Ca -0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.12 1ek4 n GLY 299 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ek4 n THR 300 N 0.22 0.00 -2.12 2.61 -2.24 -1.26 -4.54 114.28 106.95 1ek4 n THR 300 Ca 0.00 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1ek4 n THR 300 Cb 0.00 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 1ek4 n THR 300 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ek4 n SER 301 N -0.69 -1.53 -4.60 3.42 2.88 -1.26 -3.80 113.62 108.03 1ek4 n SER 301 Ca 0.13 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.36 1ek4 n SER 301 Cb 0.33 -0.45 -0.10 0.00 -0.75 0.00 0.00 64.21 63.25 1ek4 n SER 301 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1ek4 s THR 302 N -2.63 3.59 0.12 2.46 -4.23 -1.26 -1.85 115.64 111.83 1ek4 s THR 302 Ca 0.00 -1.02 -0.33 0.00 -1.18 0.00 0.00 61.69 59.16 1ek4 s THR 302 Cb 0.00 -2.64 -0.12 0.00 1.34 0.00 0.00 72.50 71.08 1ek4 s THR 302 CO 0.00 0.23 1.56 -0.65 -0.54 0.00 0.00 174.62 175.22 1ek4 h PRO 303 N 3.95 -0.59 0.07 3.99 0.11 -1.95 -2.69 132.00 134.90 1ek4 h PRO 303 Ca -0.48 0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 1ek4 h PRO 303 Cb 1.17 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1ek4 h PRO 303 CO 0.54 -0.39 -0.03 0.28 -0.21 0.00 0.00 178.00 178.18 1ek4 h VAL 304 N -0.61 1.21 -0.31 3.15 2.07 -2.00 -3.36 116.25 116.40 1ek4 h VAL 304 Ca 0.03 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.28 1ek4 h VAL 304 Cb 0.70 2.04 -0.08 0.00 -1.52 0.00 0.00 31.29 32.43 1ek4 h VAL 304 CO -0.39 0.32 -0.23 1.23 0.02 0.00 0.00 177.57 178.52 1ek4 h GLY 305 N -0.74 -0.06 0.14 2.17 0.00 -1.96 -2.28 103.07 100.33 1ek4 h GLY 305 Ca -0.01 0.29 0.11 0.00 0.00 0.00 0.00 47.33 47.71 1ek4 h GLY 305 CO 0.02 -0.20 0.03 -0.55 0.00 0.00 0.00 176.54 175.84 1ek4 h ASP 306 N -0.20 -0.17 0.99 0.19 5.19 -1.64 -2.36 116.42 118.43 1ek4 h ASP 306 Ca 0.16 0.12 -0.16 0.00 -0.62 0.00 0.00 57.03 56.54 1ek4 h ASP 306 Cb 0.45 0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.14 1ek4 h ASP 306 CO -0.43 -0.06 -0.75 -0.37 -3.12 0.00 0.00 179.24 174.51 1ek4 h VAL 307 N 0.15 1.40 -0.68 -1.35 -1.51 -1.67 -2.59 116.25 110.01 1ek4 h VAL 307 Ca 0.28 -2.70 -0.05 0.00 -1.23 0.00 0.00 66.70 63.00 1ek4 h VAL 307 Cb 0.43 2.51 -0.03 0.00 -2.13 0.00 0.00 31.29 32.07 1ek4 h VAL 307 CO -0.43 0.74 0.22 0.11 -1.23 0.00 0.00 177.57 176.97 1ek4 h LYS 308 N 0.00 1.04 -0.40 5.19 1.79 -1.03 -0.00 116.57 123.16 1ek4 h LYS 308 Ca -0.01 -0.22 -0.13 0.00 -2.18 0.00 0.00 60.65 58.11 1ek4 h LYS 308 Cb 1.45 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.93 1ek4 h LYS 308 CO 0.10 0.90 -0.27 1.49 -1.08 0.00 0.00 179.45 180.59 1ek4 h GLU 309 N 0.98 0.86 -0.78 3.15 4.81 -1.42 -2.13 114.58 120.06 1ek4 h GLU 309 Ca 0.22 -0.38 -0.04 0.00 -0.13 0.00 0.00 59.36 59.02 1ek4 h GLU 309 Cb 0.28 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1ek4 h GLU 309 CO -0.01 1.02 0.31 -0.07 -0.73 0.00 0.00 179.01 179.54 1ek4 h LEU 310 N 0.73 1.07 -0.86 1.64 3.38 -1.05 -0.22 115.31 120.01 1ek4 h LEU 310 Ca 0.09 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1ek4 h LEU 310 Cb 0.82 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1ek4 h LEU 310 CO 0.07 0.95 0.17 0.00 0.09 0.00 0.00 178.44 179.72 1ek4 h ALA 311 N 1.16 1.07 -0.40 1.53 0.00 -0.84 -0.20 119.26 121.58 1ek4 h ALA 311 Ca 0.26 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1ek4 h ALA 311 Cb 0.21 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1ek4 h ALA 311 CO -0.02 0.62 -0.05 0.00 0.00 0.00 0.00 179.25 179.80 1ek4 h ALA 312 N 1.21 0.54 -0.41 0.00 0.00 -0.94 -0.73 119.26 118.93 1ek4 h ALA 312 Ca 0.21 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1ek4 h ALA 312 Cb 0.33 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1ek4 h ALA 312 CO -0.00 0.37 0.27 0.82 0.00 0.00 0.00 179.25 180.70 1ek4 h ILE 313 N 0.55 1.09 -0.85 0.00 2.04 -0.73 -0.51 117.51 119.10 1ek4 h ILE 313 Ca 0.11 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 1ek4 h ILE 313 Cb 0.55 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 1ek4 h ILE 313 CO 0.03 0.10 0.47 -0.09 0.00 0.00 0.00 178.15 178.66 1ek4 h ARG 314 N 0.54 1.18 -0.74 2.37 2.43 -0.86 0.11 114.38 119.41 1ek4 h ARG 314 Ca 0.16 -0.13 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 1ek4 h ARG 314 Cb -0.04 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.24 1ek4 h ARG 314 CO -0.05 0.86 0.23 0.93 -1.51 0.00 0.00 179.97 180.43 1ek4 h GLU 315 N 1.19 1.16 0.00 0.20 4.39 -0.47 0.65 114.58 121.70 1ek4 h GLU 315 Ca 0.30 -0.25 -0.09 0.00 0.34 0.00 0.00 59.36 59.66 1ek4 h GLU 315 Cb 0.02 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1ek4 h GLU 315 CO -0.05 0.99 -0.34 0.28 -1.16 0.00 0.00 179.01 178.73 1ek4 h VAL 316 N 1.11 1.52 0.00 3.13 2.07 -0.49 -3.38 116.25 120.21 1ek4 h VAL 316 Ca 0.24 -1.99 0.00 0.00 0.82 0.00 0.00 66.70 65.77 1ek4 h VAL 316 Cb 0.32 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.83 1ek4 h VAL 316 CO -0.01 0.55 -1.58 0.49 0.02 0.00 0.00 177.57 177.05 1ek4 n PHE 317 N -4.43 0.00 0.00 1.57 3.01 0.33 -5.06 117.46 112.88 1ek4 n PHE 317 Ca -0.10 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.36 1ek4 n PHE 317 Cb 0.55 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.72 1ek4 n PHE 317 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ek4 n GLY 318 N 1.38 3.51 0.01 1.37 0.00 0.23 -1.94 105.19 109.76 1ek4 n GLY 318 Ca -0.01 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1ek4 n GLY 318 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ek4 n ASP 319 N 6.85 0.48 -3.18 1.61 10.43 -1.26 -4.19 116.55 127.29 1ek4 n ASP 319 Ca 0.00 -0.21 -0.38 0.00 2.57 0.00 0.00 54.79 56.77 1ek4 n ASP 319 Cb 0.00 0.17 0.02 0.00 1.84 0.00 0.00 41.12 43.14 1ek4 n ASP 319 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1ek4 n LYS 320 N -1.45 4.00 -2.61 -1.24 0.00 -0.82 -5.04 118.16 111.01 1ek4 n LYS 320 Ca 0.06 -4.24 -0.33 0.00 0.00 0.00 0.00 58.31 53.80 1ek4 n LYS 320 Cb 0.34 -2.35 -0.05 0.00 0.00 0.00 0.00 35.03 32.97 1ek4 n LYS 320 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1ek4 s SER 321 N -1.69 6.74 0.85 3.14 1.04 -1.26 -4.88 113.70 117.64 1ek4 s SER 321 Ca 0.46 1.66 -0.13 0.00 0.48 0.00 0.00 55.95 58.42 1ek4 s SER 321 Cb 0.31 -2.53 0.11 0.00 0.10 0.00 0.00 66.02 64.02 1ek4 s SER 321 CO -0.25 -0.50 1.22 -2.16 0.98 0.00 0.00 173.24 172.53 1ek4 s PRO 322 N -3.57 1.57 0.30 4.02 0.04 -1.26 -4.71 135.00 131.39 1ek4 s PRO 322 Ca 0.61 -0.02 -0.29 0.00 0.04 0.00 0.00 61.00 61.34 1ek4 s PRO 322 Cb -0.10 -1.92 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 1ek4 s PRO 322 CO 0.22 -1.84 1.39 0.00 0.04 0.00 0.00 177.00 176.81 1ek4 s ALA 323 N -3.65 3.57 0.02 8.56 0.00 -1.02 -4.33 121.76 124.92 1ek4 s ALA 323 Ca 0.65 1.33 0.05 0.00 0.00 0.00 0.00 51.96 54.00 1ek4 s ALA 323 Cb -0.09 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 1ek4 s ALA 323 CO 0.50 -0.74 -0.16 0.42 0.00 0.00 0.00 175.76 175.78 1ek4 s ILE 324 N -0.59 1.29 -0.22 0.00 1.01 0.60 -0.81 121.20 122.47 1ek4 s ILE 324 Ca 0.54 -0.92 -0.22 0.00 0.00 0.00 0.00 60.65 60.06 1ek4 s ILE 324 Cb -0.42 -1.12 0.06 0.00 0.01 0.00 0.00 42.46 40.99 1ek4 s ILE 324 CO 0.50 0.18 0.61 -0.94 0.00 0.00 0.00 174.94 175.29 1ek4 s SER 325 N -0.86 -0.64 -0.45 3.58 1.04 -1.17 -0.49 113.70 114.72 1ek4 s SER 325 Ca 0.05 1.21 -0.11 0.00 0.48 0.00 0.00 55.95 57.58 1ek4 s SER 325 Cb -0.07 1.23 0.08 0.00 0.10 0.00 0.00 66.02 67.36 1ek4 s SER 325 CO 0.01 -0.23 0.32 0.00 0.98 0.00 0.00 173.24 174.32 1ek4 s ALA 326 N 0.27 3.40 -0.76 5.32 0.00 -1.26 -2.98 121.76 125.75 1ek4 s ALA 326 Ca -0.00 -2.19 0.18 0.00 0.00 0.00 0.00 51.96 49.94 1ek4 s ALA 326 Cb -0.04 -2.82 0.77 0.00 0.00 0.00 0.00 23.12 21.02 1ek4 s ALA 326 CO 0.01 -1.71 1.56 0.25 0.00 0.00 0.00 175.76 175.86 1ek4 n THR 327 N 5.02 0.97 0.31 0.00 -2.24 -1.26 -2.37 114.28 114.70 1ek4 n THR 327 Ca -0.11 0.26 0.16 0.00 -2.27 0.00 0.00 64.05 62.09 1ek4 n THR 327 Cb 0.43 -1.11 0.70 0.00 -2.10 0.00 0.00 70.33 68.25 1ek4 n THR 327 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1ek4 h LYS 328 N 0.00 0.00 -0.08 -0.78 1.57 -1.82 -0.58 116.57 114.88 1ek4 h LYS 328 Ca 0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1ek4 h LYS 328 Cb 0.28 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1ek4 h LYS 328 CO 0.00 0.00 -0.25 0.00 -0.57 0.00 0.00 179.45 178.63 1ek4 h ALA 329 N 2.09 1.44 0.03 3.86 0.00 -1.73 -0.11 119.26 124.85 1ek4 h ALA 329 Ca 0.00 -0.27 -0.26 0.00 0.00 0.00 0.00 54.91 54.38 1ek4 h ALA 329 Cb 0.29 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1ek4 h ALA 329 CO 0.00 0.40 -1.43 0.52 0.00 0.00 0.00 179.25 178.74 1ek4 h MET 330 N 0.12 0.07 0.00 0.00 2.86 -1.38 -3.43 114.93 113.18 1ek4 h MET 330 Ca 0.02 -0.12 -0.10 0.00 -2.06 0.00 0.00 59.70 57.44 1ek4 h MET 330 Cb 0.51 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.20 1ek4 h MET 330 CO 0.04 1.06 -1.31 0.25 1.06 0.00 0.00 176.91 178.00 1ek4 n THR 331 N -4.20 0.90 0.00 2.22 -2.24 -0.51 -0.80 114.28 109.65 1ek4 n THR 331 Ca -0.32 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 60.83 1ek4 n THR 331 Cb 0.77 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 68.47 1ek4 n THR 331 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ek4 n GLY 332 N 1.31 -0.41 3.38 3.38 0.00 -0.06 -4.59 105.19 108.20 1ek4 n GLY 332 Ca -0.06 -1.82 -0.43 0.00 0.00 0.00 0.00 46.02 43.70 1ek4 n GLY 332 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ek4 s HIS 333 N -1.08 3.26 -1.03 1.61 2.46 0.17 -4.65 115.29 116.03 1ek4 s HIS 333 Ca 0.00 -0.97 0.05 0.00 0.47 0.00 0.00 55.06 54.61 1ek4 s HIS 333 Cb 0.00 -2.95 0.26 0.00 -0.13 0.00 0.00 32.58 29.76 1ek4 s HIS 333 CO 0.00 -0.75 0.97 -1.13 -2.47 0.00 0.00 174.74 171.36 1ek4 n SER 334 N 5.12 2.30 0.00 9.88 3.41 -1.26 -0.88 113.62 132.19 1ek4 n SER 334 Ca -0.12 -2.24 0.00 0.00 -0.26 0.00 0.00 58.87 56.25 1ek4 n SER 334 Cb 0.44 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 1ek4 n SER 334 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ek4 n LEU 335 N 0.21 0.00 0.30 1.04 4.77 -1.26 -1.28 117.00 120.78 1ek4 n LEU 335 Ca 0.09 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.23 1ek4 n LEU 335 Cb 0.49 0.00 0.94 0.00 -2.33 0.00 0.00 43.42 42.52 1ek4 n LEU 335 CO 0.10 0.00 1.11 1.23 -1.33 0.00 0.00 177.39 178.49 1ek4 h GLY 336 N 0.00 0.00 -0.04 -0.72 0.00 -1.86 -1.86 103.07 98.58 1ek4 h GLY 336 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ek4 h GLY 336 CO 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 176.54 176.15 1ek4 n ALA 337 N -2.25 3.36 -0.16 3.60 0.00 -0.41 -2.49 120.51 122.16 1ek4 n ALA 337 Ca -0.03 -0.48 -0.07 0.00 0.00 0.00 0.00 53.44 52.87 1ek4 n ALA 337 Cb 0.12 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 18.57 1ek4 n ALA 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ek4 h ALA 338 N 3.63 0.62 -0.04 0.00 0.00 -1.39 -2.41 119.26 119.67 1ek4 h ALA 338 Ca 0.00 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ek4 h ALA 338 Cb 0.57 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1ek4 h ALA 338 CO 0.00 0.02 -0.19 0.78 0.00 0.00 0.00 179.25 179.86 1ek4 h GLY 339 N 0.62 -0.23 1.37 0.00 0.00 -1.77 -0.89 103.07 102.18 1ek4 h GLY 339 Ca 0.19 0.23 -0.20 0.00 0.00 0.00 0.00 47.33 47.54 1ek4 h GLY 339 CO -0.07 -0.17 -0.72 -0.24 0.00 0.00 0.00 176.54 175.34 1ek4 h VAL 340 N -0.29 1.32 -0.58 4.60 3.04 -1.71 -2.12 116.25 120.51 1ek4 h VAL 340 Ca 0.07 -2.01 -0.04 0.00 -1.01 0.00 0.00 66.70 63.71 1ek4 h VAL 340 Cb 0.38 1.99 -0.03 0.00 -2.01 0.00 0.00 31.29 31.63 1ek4 h VAL 340 CO -0.20 0.62 0.21 1.56 -1.01 0.00 0.00 177.57 178.75 1ek4 h GLN 341 N 0.43 0.89 0.00 4.17 4.20 -1.36 -0.85 115.11 122.60 1ek4 h GLN 341 Ca -0.03 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.41 1ek4 h GLN 341 Cb 1.32 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.95 1ek4 h GLN 341 CO 0.14 0.78 -0.41 0.93 -0.67 0.00 0.00 178.83 179.60 1ek4 h GLU 342 N 0.82 0.00 -0.44 1.46 5.08 -1.17 0.13 114.58 120.45 1ek4 h GLU 342 Ca 0.19 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.41 1ek4 h GLU 342 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1ek4 h GLU 342 CO -0.01 0.41 -0.29 0.00 -1.00 0.00 0.00 179.01 178.11 1ek4 h ALA 343 N 1.59 0.62 -0.47 3.43 0.00 -1.00 -1.86 119.26 121.58 1ek4 h ALA 343 Ca -0.00 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 1ek4 h ALA 343 Cb 0.89 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1ek4 h ALA 343 CO 0.05 0.67 0.01 0.82 0.00 0.00 0.00 179.25 180.80 1ek4 h ILE 344 N 0.81 1.26 -0.72 0.00 2.04 -0.50 -0.45 117.51 119.95 1ek4 h ILE 344 Ca 0.09 -1.04 0.01 0.00 1.00 0.00 0.00 64.86 64.91 1ek4 h ILE 344 Cb 0.88 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 1ek4 h ILE 344 CO 0.08 0.36 0.48 1.88 0.00 0.00 0.00 178.15 180.95 1ek4 h TYR 345 N 0.67 0.91 -0.72 1.37 0.05 -0.88 -1.16 116.97 117.22 1ek4 h TYR 345 Ca 0.13 0.02 -0.05 0.00 0.05 0.00 0.00 58.73 58.89 1ek4 h TYR 345 Cb 0.49 -0.31 -0.03 0.00 1.01 0.00 0.00 36.73 37.89 1ek4 h TYR 345 CO 0.04 0.57 0.27 0.77 -1.05 0.00 0.00 178.16 178.76 1ek4 h SER 346 N 0.98 0.99 -0.15 3.88 0.02 -1.06 -1.62 113.55 116.59 1ek4 h SER 346 Ca 0.26 -0.16 -0.10 0.00 -0.84 0.00 0.00 61.79 60.96 1ek4 h SER 346 Cb -0.11 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.15 1ek4 h SER 346 CO -0.06 0.90 -0.21 -0.07 -1.14 0.00 0.00 176.83 176.25 1ek4 h LEU 347 N 1.05 0.58 -0.64 5.07 3.38 -0.54 -1.55 115.31 122.66 1ek4 h LEU 347 Ca 0.24 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 1ek4 h LEU 347 Cb 0.23 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1ek4 h LEU 347 CO -0.02 0.79 -0.38 -0.07 0.09 0.00 0.00 178.44 178.86 1ek4 h LEU 348 N 0.52 0.68 -0.80 1.67 3.38 -0.81 0.21 115.31 120.15 1ek4 h LEU 348 Ca 0.08 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.65 1ek4 h LEU 348 Cb 0.65 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1ek4 h LEU 348 CO 0.05 0.99 -0.26 0.24 0.09 0.00 0.00 178.44 179.54 1ek4 h MET 349 N 0.53 0.61 -0.11 1.13 2.86 -1.03 0.71 114.93 119.63 1ek4 h MET 349 Ca 0.05 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.36 1ek4 h MET 349 Cb 0.89 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.53 1ek4 h MET 349 CO 0.08 0.81 -0.26 1.25 1.06 0.00 0.00 176.91 179.84 1ek4 h LEU 350 N 0.53 0.42 -0.74 1.22 5.85 -1.03 -0.77 115.31 120.78 1ek4 h LEU 350 Ca 0.07 -0.58 -0.08 0.00 0.84 0.00 0.00 57.88 58.12 1ek4 h LEU 350 Cb 0.73 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1ek4 h LEU 350 CO 0.06 0.93 0.05 -0.08 -0.34 0.00 0.00 178.44 179.05 1ek4 h GLU 351 N -0.08 1.01 -0.30 1.25 4.57 -0.45 -3.23 114.58 117.35 1ek4 h GLU 351 Ca -0.00 -0.28 0.00 0.00 -1.18 0.00 0.00 59.36 57.89 1ek4 h GLU 351 Cb 0.87 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.35 1ek4 h GLU 351 CO 0.06 0.96 0.00 0.72 -1.18 0.00 0.00 179.01 179.57 1ek4 n HIS 352 N -4.20 0.39 -3.36 0.92 8.25 0.23 -5.02 115.22 112.42 1ek4 n HIS 352 Ca 0.04 -0.22 -0.17 0.00 -0.26 0.00 0.00 57.72 57.11 1ek4 n HIS 352 Cb 0.31 -0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.49 1ek4 n HIS 352 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ek4 n GLY 353 N 1.30 -0.78 3.33 -1.41 0.00 -0.34 -4.97 105.19 102.32 1ek4 n GLY 353 Ca 0.17 0.36 -0.11 0.00 0.00 0.00 0.00 46.02 46.43 1ek4 n GLY 353 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ek4 s PHE 354 N -3.39 -0.26 -0.22 1.61 -0.12 -0.95 -1.93 117.98 112.72 1ek4 s PHE 354 Ca 0.25 -0.00 -0.03 0.00 -0.05 0.00 0.00 56.93 57.09 1ek4 s PHE 354 Cb -0.04 0.29 -0.00 0.00 -0.63 0.00 0.00 43.02 42.64 1ek4 s PHE 354 CO 0.74 -0.70 -0.05 0.42 -0.05 0.00 0.00 175.22 175.58 1ek4 s ILE 355 N -3.60 3.26 0.40 -4.49 1.01 0.26 -4.59 121.20 113.45 1ek4 s ILE 355 Ca 0.01 -0.56 -0.26 0.00 0.00 0.00 0.00 60.65 59.84 1ek4 s ILE 355 Cb 0.01 -2.50 -0.09 0.00 0.01 0.00 0.00 42.46 39.90 1ek4 s ILE 355 CO -0.11 0.41 1.25 0.00 0.00 0.00 0.00 174.94 176.49 1ek4 s ALA 356 N 1.46 3.22 0.46 9.38 0.00 -1.26 -2.30 121.76 132.72 1ek4 s ALA 356 Ca 0.05 1.13 -0.21 0.00 0.00 0.00 0.00 51.96 52.94 1ek4 s ALA 356 Cb -0.14 -3.45 -0.09 0.00 0.00 0.00 0.00 23.12 19.44 1ek4 s ALA 356 CO -0.04 -0.71 1.02 -1.25 0.00 0.00 0.00 175.76 174.78 1ek4 s PRO 357 N -2.24 3.95 -0.56 0.00 0.04 -1.26 -4.78 135.00 130.16 1ek4 s PRO 357 Ca 0.57 1.33 -0.19 0.00 0.04 0.00 0.00 61.00 62.75 1ek4 s PRO 357 Cb -0.35 -2.18 0.09 0.00 0.04 0.00 0.00 34.50 32.10 1ek4 s PRO 357 CO 0.45 -0.30 0.65 0.45 0.04 0.00 0.00 177.00 178.29 1ek4 s SER 358 N -1.96 6.19 0.73 6.66 0.15 0.18 -4.75 113.70 120.90 1ek4 s SER 358 Ca 0.65 -1.30 -0.05 0.00 0.70 0.00 0.00 55.95 55.94 1ek4 s SER 358 Cb -0.16 -2.28 0.10 0.00 -1.71 0.00 0.00 66.02 61.97 1ek4 s SER 358 CO 0.20 -1.01 1.02 0.27 1.20 0.00 0.00 173.24 174.92 1ek4 s ILE 359 N 2.53 2.25 -1.69 6.45 -4.36 -1.26 -4.48 121.20 120.64 1ek4 s ILE 359 Ca 0.11 -0.37 0.00 0.00 -0.26 0.00 0.00 60.65 60.13 1ek4 s ILE 359 Cb -0.23 -2.88 0.00 0.00 1.25 0.00 0.00 42.46 40.60 1ek4 s ILE 359 CO 0.08 0.00 0.00 0.59 0.24 0.00 0.00 174.94 175.85 1ek4 n ASN 360 N -2.94 -5.00 -4.44 4.36 3.02 -1.26 -4.54 115.26 104.45 1ek4 n ASN 360 Ca 0.11 0.39 -0.44 0.00 -0.03 0.00 0.00 54.58 54.62 1ek4 n ASN 360 Cb 0.60 -3.91 -0.05 0.00 -0.61 0.00 0.00 39.78 35.82 1ek4 n ASN 360 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ek4 s ILE 361 N -2.56 4.61 -0.13 2.41 1.01 -1.26 -4.78 121.20 120.50 1ek4 s ILE 361 Ca 0.00 -0.46 0.17 0.00 0.00 0.00 0.00 60.65 60.35 1ek4 s ILE 361 Cb 0.00 -4.51 -0.24 0.00 0.01 0.00 0.00 42.46 37.72 1ek4 s ILE 361 CO 0.00 -1.14 0.35 -0.62 0.00 0.00 0.00 174.94 173.53 1ek4 n GLU 362 N 6.90 0.66 -3.44 2.79 1.02 -1.26 -4.77 120.64 122.53 1ek4 n GLU 362 Ca -0.05 0.09 -0.22 0.00 -0.02 0.00 0.00 57.16 56.96 1ek4 n GLU 362 Cb 0.45 -1.63 -0.11 0.00 -0.02 0.00 0.00 31.44 30.13 1ek4 n GLU 362 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1ek4 s GLU 363 N -2.64 0.39 0.21 3.49 2.12 -1.26 -5.05 118.70 115.96 1ek4 s GLU 363 Ca -0.08 -0.57 -0.32 0.00 0.36 0.00 0.00 54.97 54.36 1ek4 s GLU 363 Cb 0.07 -0.90 -0.13 0.00 0.26 0.00 0.00 34.13 33.43 1ek4 s GLU 363 CO 0.83 -1.09 1.52 -0.11 -0.54 0.00 0.00 175.26 175.87 1ek4 n LEU 364 N 4.88 3.31 -4.76 2.70 7.94 -1.26 0.24 117.00 130.05 1ek4 n LEU 364 Ca 0.02 1.11 -0.41 0.00 -1.11 0.00 0.00 56.01 55.62 1ek4 n LEU 364 Cb 0.43 -1.46 -0.01 0.00 0.53 0.00 0.00 43.42 42.92 1ek4 n LEU 364 CO 0.05 -0.29 1.17 -0.62 -1.11 0.00 0.00 177.39 176.59 1ek4 s ASP 365 N 0.62 6.42 0.45 1.96 -1.08 -0.47 -4.71 116.67 119.86 1ek4 s ASP 365 Ca 0.72 2.94 0.15 0.00 -0.52 0.00 0.00 52.55 55.84 1ek4 s ASP 365 Cb -0.63 -2.65 1.07 0.00 -1.46 0.00 0.00 42.92 39.24 1ek4 s ASP 365 CO 0.44 -0.85 2.00 -0.33 0.52 0.00 0.00 175.17 176.95 1ek4 h GLU 366 N 4.05 0.35 0.00 4.34 5.08 -1.91 -1.10 114.58 125.39 1ek4 h GLU 366 Ca -0.48 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1ek4 h GLU 366 Cb 1.23 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1ek4 h GLU 366 CO 0.72 0.23 0.00 1.04 -1.00 0.00 0.00 179.01 180.00 1ek4 n GLN 367 N -4.47 0.45 0.00 2.33 6.02 -1.26 -2.22 117.38 118.24 1ek4 n GLN 367 Ca 0.09 0.05 0.12 0.00 -0.01 0.00 0.00 57.00 57.24 1ek4 n GLN 367 Cb 0.35 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 30.17 1ek4 n GLN 367 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ek4 n ALA 368 N -1.18 3.14 -1.80 -1.58 0.00 -0.42 -4.85 120.51 113.83 1ek4 n ALA 368 Ca 0.13 -0.65 -0.41 0.00 0.00 0.00 0.00 53.44 52.51 1ek4 n ALA 368 Cb 0.14 -0.82 -0.01 0.00 0.00 0.00 0.00 19.45 18.75 1ek4 n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ek4 s ALA 369 N -2.30 3.66 0.00 0.00 0.00 -0.94 -2.50 121.76 119.67 1ek4 s ALA 369 Ca 0.22 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.67 1ek4 s ALA 369 Cb 0.19 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.71 1ek4 s ALA 369 CO 0.47 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.73 1ek4 n GLY 370 N 1.69 1.05 3.91 0.00 0.00 -1.26 -5.05 105.19 105.53 1ek4 n GLY 370 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1ek4 n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ek4 s LEU 371 N 0.00 4.35 -1.52 0.99 1.43 -1.04 -4.93 118.68 117.96 1ek4 s LEU 371 Ca 0.00 0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 53.32 1ek4 s LEU 371 Cb 0.00 -2.96 -0.00 0.00 0.03 0.00 0.00 46.19 43.26 1ek4 s LEU 371 CO 0.00 0.17 2.51 -3.20 0.23 0.00 0.00 176.35 176.06 1ek4 n ASN 372 N 0.37 5.95 -4.70 2.29 5.15 -1.26 -4.95 115.26 118.11 1ek4 n ASN 372 Ca -0.06 -2.75 -0.41 0.00 -0.60 0.00 0.00 54.58 50.76 1ek4 n ASN 372 Cb 0.51 -1.61 -0.04 0.00 -0.53 0.00 0.00 39.78 38.12 1ek4 n ASN 372 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1ek4 s ILE 373 N 2.57 4.92 -0.24 -1.44 1.01 -1.26 -0.29 121.20 126.46 1ek4 s ILE 373 Ca 0.56 1.76 -0.11 0.00 0.00 0.00 0.00 60.65 62.86 1ek4 s ILE 373 Cb 0.16 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.39 1ek4 s ILE 373 CO -0.07 0.13 0.18 -0.69 0.00 0.00 0.00 174.94 174.49 1ek4 s VAL 374 N 1.36 5.34 -0.80 2.92 1.01 0.36 -4.88 120.40 125.71 1ek4 s VAL 374 Ca 0.44 0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.72 1ek4 s VAL 374 Cb -0.19 -3.52 0.14 0.00 0.00 0.00 0.00 36.38 32.82 1ek4 s VAL 374 CO 0.20 0.32 0.98 0.35 0.00 0.00 0.00 175.10 176.95 1ek4 n THR 375 N 4.39 0.54 -4.03 3.92 -2.24 -1.26 -0.64 114.28 114.96 1ek4 n THR 375 Ca -0.14 -0.77 -0.15 0.00 -2.27 0.00 0.00 64.05 60.72 1ek4 n THR 375 Cb 0.52 0.80 -0.15 0.00 -2.10 0.00 0.00 70.33 69.41 1ek4 n THR 375 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1ek4 s GLU 376 N -0.84 0.27 -0.05 -0.78 -1.05 -1.26 -4.54 118.70 110.45 1ek4 s GLU 376 Ca 0.13 -0.08 -0.36 0.00 -0.15 0.00 0.00 54.97 54.51 1ek4 s GLU 376 Cb 0.08 -0.30 -0.14 0.00 -0.44 0.00 0.00 34.13 33.33 1ek4 s GLU 376 CO 0.10 0.03 1.72 2.41 0.95 0.00 0.00 175.26 180.47 1ek4 n THR 377 N 3.20 0.32 -3.95 1.83 -1.04 -1.26 -4.59 114.28 108.79 1ek4 n THR 377 Ca -0.15 -0.06 -0.30 0.00 -2.04 0.00 0.00 64.05 61.51 1ek4 n THR 377 Cb 0.57 -1.54 -0.16 0.00 -1.82 0.00 0.00 70.33 67.39 1ek4 n THR 377 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ek4 s THR 378 N 2.79 1.42 0.13 12.58 2.01 -0.97 -4.97 115.64 128.63 1ek4 s THR 378 Ca 0.90 -0.86 -0.31 0.00 0.31 0.00 0.00 61.69 61.73 1ek4 s THR 378 Cb -0.80 -1.54 -0.07 0.00 0.01 0.00 0.00 72.50 70.10 1ek4 s THR 378 CO 0.51 0.15 1.27 -1.81 -0.69 0.00 0.00 174.62 174.04 1ek4 s ASP 379 N 1.49 6.98 -0.28 3.53 1.01 -1.26 -0.58 116.67 127.56 1ek4 s ASP 379 Ca -0.01 2.22 -0.22 0.00 0.71 0.00 0.00 52.55 55.26 1ek4 s ASP 379 Cb -0.16 -2.59 0.12 0.00 1.01 0.00 0.00 42.92 41.30 1ek4 s ASP 379 CO -0.08 -0.51 0.97 -0.60 0.21 0.00 0.00 175.17 175.17 1ek4 s ARG 380 N 0.56 0.50 -0.36 8.23 3.52 -0.81 -4.93 118.95 125.66 1ek4 s ARG 380 Ca 0.59 0.68 -0.29 0.00 -0.13 0.00 0.00 55.73 56.58 1ek4 s ARG 380 Cb -0.33 0.19 0.01 0.00 -1.56 0.00 0.00 34.95 33.26 1ek4 s ARG 380 CO 0.33 -0.07 1.32 -2.00 -0.81 0.00 0.00 175.30 174.06 1ek4 s GLU 381 N 0.68 3.78 0.14 5.12 2.12 -1.26 -3.43 118.70 125.84 1ek4 s GLU 381 Ca -0.02 1.07 0.00 0.00 0.36 0.00 0.00 54.97 56.39 1ek4 s GLU 381 Cb -0.05 -3.93 -0.04 0.00 0.26 0.00 0.00 34.13 30.38 1ek4 s GLU 381 CO -0.10 -1.29 0.30 -0.51 -0.54 0.00 0.00 175.26 173.12 1ek4 s LEU 382 N 4.73 4.31 0.00 2.70 1.43 -1.26 -5.01 118.68 125.58 1ek4 s LEU 382 Ca 0.57 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.96 1ek4 s LEU 382 Cb -0.15 -3.02 0.00 0.00 0.03 0.00 0.00 46.19 43.05 1ek4 s LEU 382 CO 0.27 0.06 0.00 0.41 0.23 0.00 0.00 176.35 177.32 1ek4 n THR 383 N -0.31 0.00 -4.35 5.49 -1.04 -1.26 -4.94 114.28 107.87 1ek4 n THR 383 Ca -0.06 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.71 1ek4 n THR 383 Cb 0.53 -0.32 -0.17 0.00 -1.82 0.00 0.00 70.33 68.56 1ek4 n THR 383 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ek4 s THR 384 N -1.61 1.00 0.12 12.58 2.01 -1.26 -1.66 115.64 126.82 1ek4 s THR 384 Ca 0.00 -0.37 0.07 0.00 0.31 0.00 0.00 61.69 61.71 1ek4 s THR 384 Cb 0.00 -0.95 -0.04 0.00 0.01 0.00 0.00 72.50 71.52 1ek4 s THR 384 CO 0.00 0.33 -0.18 0.68 -0.69 0.00 0.00 174.62 174.76 1ek4 s VAL 385 N 0.96 1.60 0.02 3.82 -7.23 0.47 -0.71 120.40 119.32 1ek4 s VAL 385 Ca -0.09 -1.65 0.05 0.00 -1.81 0.00 0.00 61.98 58.48 1ek4 s VAL 385 Cb -0.15 -1.57 -0.02 0.00 0.56 0.00 0.00 36.38 35.20 1ek4 s VAL 385 CO 0.00 -0.21 -0.16 -0.32 -0.31 0.00 0.00 175.10 174.10 1ek4 s MET 386 N -2.27 1.15 -0.06 4.82 -2.45 -0.28 -0.58 119.30 119.64 1ek4 s MET 386 Ca 0.08 -0.70 -0.00 0.00 -1.25 0.00 0.00 55.69 53.83 1ek4 s MET 386 Cb -0.08 -1.16 0.02 0.00 1.25 0.00 0.00 34.83 34.87 1ek4 s MET 386 CO 0.04 0.30 -0.03 0.45 1.05 0.00 0.00 175.02 176.84 1ek4 s SER 387 N -0.80 1.33 -0.05 1.11 0.15 -0.33 -0.19 113.70 114.91 1ek4 s SER 387 Ca 0.05 -0.13 -0.03 0.00 0.70 0.00 0.00 55.95 56.53 1ek4 s SER 387 Cb -0.07 -0.49 -0.04 0.00 -1.71 0.00 0.00 66.02 63.71 1ek4 s SER 387 CO 0.01 -0.11 0.12 0.20 1.20 0.00 0.00 173.24 174.65 1ek4 s ASN 388 N 1.41 6.07 -0.09 5.45 0.01 -0.80 -1.70 114.94 125.30 1ek4 s ASN 388 Ca -0.03 0.31 -0.03 0.00 -0.71 0.00 0.00 52.86 52.40 1ek4 s ASN 388 Cb -0.13 -1.87 0.05 0.00 0.41 0.00 0.00 41.25 39.70 1ek4 s ASN 388 CO -0.03 0.33 0.14 -0.44 -1.51 0.00 0.00 177.10 175.58 1ek4 s SER 389 N -1.48 1.02 0.12 -1.22 0.01 0.06 -3.39 113.70 108.83 1ek4 s SER 389 Ca 0.21 0.15 0.10 0.00 1.31 0.00 0.00 55.95 57.72 1ek4 s SER 389 Cb -0.12 0.14 -0.04 0.00 0.21 0.00 0.00 66.02 66.22 1ek4 s SER 389 CO 0.11 -0.26 -0.24 -0.36 0.41 0.00 0.00 173.24 172.90 1ek4 s PHE 390 N 2.25 2.07 0.12 2.43 0.08 -1.26 -0.65 117.98 123.02 1ek4 s PHE 390 Ca 0.04 -0.40 -0.02 0.00 0.12 0.00 0.00 56.93 56.67 1ek4 s PHE 390 Cb -0.13 -1.12 -0.04 0.00 -0.57 0.00 0.00 43.02 41.17 1ek4 s PHE 390 CO -0.06 0.28 0.07 0.20 -0.10 0.00 0.00 175.22 175.62 1ek4 s GLY 391 N -2.02 0.84 0.55 4.36 0.00 -0.02 -4.15 107.32 106.88 1ek4 s GLY 391 Ca 0.11 -1.35 -0.20 0.00 0.00 0.00 0.00 44.72 43.28 1ek4 s GLY 391 CO 0.05 -1.28 0.90 0.69 0.00 0.00 0.00 173.10 173.45 1ek4 n PHE 392 N -0.08 0.64 -0.48 1.90 0.99 -1.26 -2.33 117.46 116.84 1ek4 n PHE 392 Ca -0.07 0.46 0.00 0.00 -0.00 0.00 0.00 57.45 57.84 1ek4 n PHE 392 Cb 0.63 -2.13 0.00 0.00 -1.00 0.00 0.00 39.48 36.98 1ek4 n PHE 392 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ek4 n GLY 393 N 1.35 0.76 3.28 1.37 0.00 0.85 -4.20 105.19 108.60 1ek4 n GLY 393 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 1ek4 n GLY 393 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ek4 n GLY 394 N -2.41 -0.33 3.70 -0.02 0.00 -0.99 -4.74 105.19 100.42 1ek4 n GLY 394 Ca 0.00 0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1ek4 n GLY 394 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ek4 s THR 395 N -3.27 5.21 0.05 2.61 -1.32 -0.98 -0.49 115.64 117.43 1ek4 s THR 395 Ca 0.48 0.12 0.09 0.00 -1.21 0.00 0.00 61.69 61.17 1ek4 s THR 395 Cb -0.21 -3.36 -0.03 0.00 -1.51 0.00 0.00 72.50 67.39 1ek4 s THR 395 CO 0.62 0.45 -0.25 0.20 -2.21 0.00 0.00 174.62 173.44 1ek4 s ASN 396 N 0.30 2.96 -0.07 8.08 0.01 -0.29 -0.84 114.94 125.10 1ek4 s ASN 396 Ca 0.07 -0.57 -0.05 0.00 -0.71 0.00 0.00 52.86 51.60 1ek4 s ASN 396 Cb -0.11 -0.26 0.03 0.00 0.41 0.00 0.00 41.25 41.31 1ek4 s ASN 396 CO -0.01 0.23 0.17 0.00 -1.51 0.00 0.00 177.10 175.98 1ek4 s ALA 397 N -0.80 -0.39 -0.02 0.60 0.00 0.17 -2.03 121.76 119.29 1ek4 s ALA 397 Ca 0.11 0.63 0.01 0.00 0.00 0.00 0.00 51.96 52.70 1ek4 s ALA 397 Cb -0.10 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.64 1ek4 s ALA 397 CO 0.02 -0.12 -0.03 0.99 0.00 0.00 0.00 175.76 176.62 1ek4 s THR 398 N 0.65 0.33 -0.04 0.00 2.01 -0.38 -0.76 115.64 117.45 1ek4 s THR 398 Ca -0.05 -0.07 0.07 0.00 0.31 0.00 0.00 61.69 61.96 1ek4 s THR 398 Cb -0.06 -0.35 -0.02 0.00 0.01 0.00 0.00 72.50 72.08 1ek4 s THR 398 CO -0.03 0.15 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.03 1ek4 s LEU 399 N 0.57 2.06 -0.15 4.42 1.43 -0.69 -0.70 118.68 125.61 1ek4 s LEU 399 Ca -0.06 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 52.56 1ek4 s LEU 399 Cb -0.09 -1.35 0.02 0.00 0.03 0.00 0.00 46.19 44.79 1ek4 s LEU 399 CO -0.01 0.29 -0.19 -0.69 0.23 0.00 0.00 176.35 175.98 1ek4 s VAL 400 N -0.41 1.92 -0.03 -1.59 1.01 -0.23 -1.19 120.40 119.87 1ek4 s VAL 400 Ca 0.04 -0.87 0.07 0.00 0.00 0.00 0.00 61.98 61.22 1ek4 s VAL 400 Cb -0.12 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.52 1ek4 s VAL 400 CO 0.01 0.52 -0.24 -0.04 0.00 0.00 0.00 175.10 175.35 1ek4 s MET 401 N 1.12 2.14 0.02 2.72 -1.94 0.25 -1.53 119.30 122.08 1ek4 s MET 401 Ca -0.01 -0.87 0.01 0.00 -1.71 0.00 0.00 55.69 53.12 1ek4 s MET 401 Cb -0.14 -1.97 -0.02 0.00 2.01 0.00 0.00 34.83 34.72 1ek4 s MET 401 CO -0.07 0.47 -0.05 0.50 -0.01 0.00 0.00 175.02 175.85 1ek4 s ARG 402 N -0.42 0.38 0.60 2.03 3.52 -0.21 -0.40 118.95 124.46 1ek4 s ARG 402 Ca 0.05 -0.51 -0.19 0.00 -0.13 0.00 0.00 55.73 54.94 1ek4 s ARG 402 Cb -0.11 -0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.09 1ek4 s ARG 402 CO 0.01 0.03 1.29 0.15 -0.81 0.00 0.00 175.30 175.96 1ek4 s LYS 403 N -1.07 2.83 -0.11 5.12 1.02 -0.66 -0.17 119.74 126.70 1ek4 s LYS 403 Ca -0.08 2.05 -0.20 0.00 0.02 0.00 0.00 55.97 57.76 1ek4 s LYS 403 Cb -0.07 -1.99 -0.04 0.00 -0.52 0.00 0.00 37.83 35.21 1ek4 s LYS 403 CO -0.00 -1.38 0.56 -1.17 -0.92 0.00 0.00 175.35 172.44 1ek4 s LEU 404 N -4.04 4.28 -0.29 3.17 2.96 -1.26 -4.76 118.68 118.73 1ek4 s LEU 404 Ca 0.78 0.93 -0.25 0.00 -0.22 0.00 0.00 54.13 55.37 1ek4 s LEU 404 Cb -0.36 -2.83 -0.11 0.00 0.50 0.00 0.00 46.19 43.38 1ek4 s LEU 404 CO 0.40 -0.06 1.24 0.29 -1.32 0.00 0.00 176.35 176.90 1ek4 n LYS 405 N 3.81 0.00 -0.27 1.98 4.01 -1.26 -5.10 118.16 121.33 1ek4 n LYS 405 Ca -0.05 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.75 1ek4 n LYS 405 Cb 0.51 -0.86 0.00 0.00 -0.51 0.00 0.00 35.03 34.17 1ek4 n LYS 405 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89