#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fj4 s ARG 3 N 0.00 3.63 -0.08 1.64 0.52 -1.26 -4.42 118.95 118.98 1fj4 s ARG 3 Ca 0.00 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 54.89 1fj4 s ARG 3 Cb 0.00 -3.09 -0.03 0.00 0.52 0.00 0.00 34.95 32.35 1fj4 s ARG 3 CO 0.00 0.47 -0.08 0.00 0.02 0.00 0.00 175.30 175.70 1fj4 s ALA 4 N -0.18 2.90 0.14 2.13 0.00 -1.26 0.66 121.76 126.14 1fj4 s ALA 4 Ca 0.07 -0.90 0.04 0.00 0.00 0.00 0.00 51.96 51.17 1fj4 s ALA 4 Cb -0.12 -1.22 -0.04 0.00 0.00 0.00 0.00 23.12 21.74 1fj4 s ALA 4 CO 0.01 0.50 -0.09 0.14 0.00 0.00 0.00 175.76 176.32 1fj4 s VAL 5 N -0.56 1.07 -0.32 0.00 -7.23 0.77 -1.74 120.40 112.39 1fj4 s VAL 5 Ca 0.08 -2.03 -0.12 0.00 -1.81 0.00 0.00 61.98 58.10 1fj4 s VAL 5 Cb -0.12 -1.80 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 1fj4 s VAL 5 CO 0.02 -0.77 0.22 -0.63 -0.31 0.00 0.00 175.10 173.63 1fj4 s ILE 6 N -3.36 5.29 -0.45 -0.62 -1.09 -0.26 0.04 121.20 120.75 1fj4 s ILE 6 Ca 0.15 -0.10 0.12 0.00 -2.23 0.00 0.00 60.65 58.59 1fj4 s ILE 6 Cb 0.03 -3.66 0.33 0.00 -1.58 0.00 0.00 42.46 37.59 1fj4 s ILE 6 CO -0.01 0.07 1.26 0.35 -1.23 0.00 0.00 174.94 175.38 1fj4 n THR 7 N 5.09 1.53 0.00 2.92 -2.24 -0.55 -0.51 114.28 120.52 1fj4 n THR 7 Ca -0.13 -1.43 0.00 0.00 -2.27 0.00 0.00 64.05 60.22 1fj4 n THR 7 Cb 0.50 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 1fj4 n THR 7 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fj4 n GLY 8 N -0.19 1.09 3.18 3.38 0.00 -1.26 -3.55 105.19 107.83 1fj4 n GLY 8 Ca 0.14 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 1fj4 n GLY 8 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1fj4 s LEU 9 N 0.00 1.39 -0.03 0.99 0.05 -1.26 -0.78 118.68 119.04 1fj4 s LEU 9 Ca 0.00 -0.43 -0.10 0.00 0.05 0.00 0.00 54.13 53.65 1fj4 s LEU 9 Cb 0.00 0.96 0.02 0.00 -2.05 0.00 0.00 46.19 45.11 1fj4 s LEU 9 CO 0.00 -0.59 0.23 -0.83 -0.55 0.00 0.00 176.35 174.61 1fj4 s GLY 10 N -2.23 -0.09 -0.26 -3.48 0.00 0.31 -3.37 107.32 98.20 1fj4 s GLY 10 Ca -0.03 0.26 -0.22 0.00 0.00 0.00 0.00 44.72 44.73 1fj4 s GLY 10 CO -0.05 0.12 0.68 -1.50 0.00 0.00 0.00 173.10 172.35 1fj4 s ILE 11 N -0.92 -0.00 -0.27 0.90 2.07 -1.26 -1.12 121.20 120.61 1fj4 s ILE 11 Ca -0.10 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.15 1fj4 s ILE 11 Cb -0.05 -0.96 0.08 0.00 0.13 0.00 0.00 42.46 41.66 1fj4 s ILE 11 CO 0.02 0.00 0.00 -0.69 -1.91 0.00 0.00 174.94 172.36 1fj4 s VAL 12 N 0.59 1.48 0.31 4.00 1.01 -0.79 -2.91 120.40 124.09 1fj4 s VAL 12 Ca -0.02 -1.43 0.05 0.00 0.00 0.00 0.00 61.98 60.58 1fj4 s VAL 12 Cb -0.05 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.41 1fj4 s VAL 12 CO -0.03 -0.32 0.23 -0.94 0.00 0.00 0.00 175.10 174.04 1fj4 s SER 13 N 1.37 1.52 0.61 3.32 1.04 0.11 -0.77 113.70 120.92 1fj4 s SER 13 Ca 0.01 -1.67 0.40 0.00 0.48 0.00 0.00 55.95 55.17 1fj4 s SER 13 Cb -0.18 0.50 2.03 0.00 0.10 0.00 0.00 66.02 68.47 1fj4 s SER 13 CO -0.11 -0.99 2.22 0.77 0.98 0.00 0.00 173.24 176.11 1fj4 h SER 14 N 2.19 0.00 -0.23 7.02 4.64 -1.77 -2.44 113.55 122.97 1fj4 h SER 14 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1fj4 h SER 14 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1fj4 h SER 14 CO 0.43 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.69 1fj4 n ILE 15 N -3.05 1.45 0.00 0.95 -5.35 -1.26 -4.33 119.36 107.76 1fj4 n ILE 15 Ca -0.02 -1.37 0.00 0.00 -0.27 0.00 0.00 62.75 61.09 1fj4 n ILE 15 Cb 0.15 0.22 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 1fj4 n ILE 15 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1fj4 n GLY 16 N -0.14 3.02 0.58 3.28 0.00 -0.92 -3.67 105.19 107.35 1fj4 n GLY 16 Ca 0.13 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.18 1fj4 n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fj4 n ASN 17 N 0.00 1.76 -3.32 1.61 3.02 -1.26 0.08 115.26 117.16 1fj4 n ASN 17 Ca 0.00 -1.67 -0.06 0.00 -0.03 0.00 0.00 54.58 52.81 1fj4 n ASN 17 Cb 0.00 -0.08 0.01 0.00 -0.61 0.00 0.00 39.78 39.10 1fj4 n ASN 17 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1fj4 s ASN 18 N -1.70 -0.07 0.33 6.41 6.03 -1.14 -4.54 114.94 120.25 1fj4 s ASN 18 Ca 0.34 -0.83 0.10 0.00 -1.03 0.00 0.00 52.86 51.44 1fj4 s ASN 18 Cb 0.19 0.69 0.57 0.00 -3.03 0.00 0.00 41.25 39.67 1fj4 s ASN 18 CO 0.29 -1.35 1.75 0.06 -2.03 0.00 0.00 177.10 175.82 1fj4 h GLN 19 N 2.00 0.09 -0.57 3.55 3.07 -1.91 -1.05 115.11 120.29 1fj4 h GLN 19 Ca -0.28 -0.04 -0.10 0.00 0.09 0.00 0.00 58.65 58.32 1fj4 h GLN 19 Cb 1.24 -0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.78 1fj4 h GLN 19 CO 0.34 0.49 -0.05 -0.56 0.09 0.00 0.00 178.83 179.15 1fj4 h GLN 20 N 0.08 1.03 0.02 0.06 -0.00 -1.98 0.06 115.11 114.38 1fj4 h GLN 20 Ca 0.01 -0.35 -0.00 0.00 -0.00 0.00 0.00 58.65 58.31 1fj4 h GLN 20 Cb 0.77 -0.08 0.00 0.00 -0.00 0.00 0.00 27.48 28.17 1fj4 h GLN 20 CO 0.06 1.04 -0.01 0.93 -0.00 0.00 0.00 178.83 180.85 1fj4 h GLU 21 N 0.93 -0.02 -0.54 0.06 5.08 -1.85 -2.54 114.58 115.70 1fj4 h GLU 21 Ca 0.16 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.63 1fj4 h GLU 21 Cb 0.61 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.77 1fj4 h GLU 21 CO 0.04 0.55 0.01 0.28 -1.00 0.00 0.00 179.01 178.89 1fj4 h VAL 22 N -0.61 0.58 -0.67 3.13 2.07 -1.17 -0.19 116.25 119.39 1fj4 h VAL 22 Ca -0.00 -0.05 0.08 0.00 0.82 0.00 0.00 66.70 67.55 1fj4 h VAL 22 Cb 0.58 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 1fj4 h VAL 22 CO 0.00 0.02 0.34 0.25 0.02 0.00 0.00 177.57 178.21 1fj4 h LEU 23 N 0.13 0.47 -0.83 2.57 6.46 -0.98 0.15 115.31 123.28 1fj4 h LEU 23 Ca 0.28 0.05 -0.11 0.00 -0.12 0.00 0.00 57.88 57.98 1fj4 h LEU 23 Cb 0.43 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.31 1fj4 h LEU 23 CO -0.45 0.29 -0.28 0.00 -0.62 0.00 0.00 178.44 177.38 1fj4 h ALA 24 N 1.39 1.00 -0.08 1.25 0.00 -0.73 -2.05 119.26 120.03 1fj4 h ALA 24 Ca 0.32 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1fj4 h ALA 24 Cb 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1fj4 h ALA 24 CO -0.23 0.59 -0.18 0.77 0.00 0.00 0.00 179.25 180.20 1fj4 h SER 25 N 0.48 0.30 -0.75 0.00 0.02 -0.43 -0.32 113.55 112.86 1fj4 h SER 25 Ca 0.06 -0.57 0.08 0.00 -0.84 0.00 0.00 61.79 60.53 1fj4 h SER 25 Cb 0.74 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.12 1fj4 h SER 25 CO 0.06 0.82 0.41 -0.07 -1.14 0.00 0.00 176.83 176.91 1fj4 h LEU 26 N -0.20 0.59 -0.46 5.07 3.38 -0.67 0.35 115.31 123.38 1fj4 h LEU 26 Ca 0.00 0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 1fj4 h LEU 26 Cb 0.77 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1fj4 h LEU 26 CO 0.04 0.36 -0.61 0.03 0.09 0.00 0.00 178.44 178.35 1fj4 h ARG 27 N 0.72 0.54 0.00 1.13 3.08 -1.35 -3.01 114.38 115.50 1fj4 h ARG 27 Ca 0.35 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1fj4 h ARG 27 Cb 0.29 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1fj4 h ARG 27 CO -0.23 0.99 0.00 0.93 -1.07 0.00 0.00 179.97 180.59 1fj4 h GLU 28 N 0.40 0.00 -0.95 0.04 4.39 -0.17 -3.44 114.58 114.85 1fj4 h GLU 28 Ca -0.01 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 1fj4 h GLU 28 Cb 1.17 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.80 1fj4 h GLU 28 CO 0.11 0.00 -0.19 0.41 -1.16 0.00 0.00 179.01 178.18 1fj4 n GLY 29 N 0.82 0.31 3.68 -3.84 0.00 0.11 -4.97 105.19 101.31 1fj4 n GLY 29 Ca 0.04 -0.58 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1fj4 n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1fj4 s ARG 30 N -3.93 4.35 0.32 1.61 3.52 -0.62 -5.00 118.95 119.20 1fj4 s ARG 30 Ca 0.00 1.58 -0.28 0.00 -0.13 0.00 0.00 55.73 56.90 1fj4 s ARG 30 Cb 0.00 -3.58 -0.09 0.00 -1.56 0.00 0.00 34.95 29.71 1fj4 s ARG 30 CO 0.00 -0.46 1.14 0.45 -0.81 0.00 0.00 175.30 175.62 1fj4 s SER 31 N 1.43 7.02 -0.04 -2.12 0.15 -1.26 -4.78 113.70 114.09 1fj4 s SER 31 Ca 0.53 2.33 0.14 0.00 0.70 0.00 0.00 55.95 59.65 1fj4 s SER 31 Cb -0.22 -2.62 0.44 0.00 -1.71 0.00 0.00 66.02 61.90 1fj4 s SER 31 CO 0.19 -0.33 1.36 0.61 1.20 0.00 0.00 173.24 176.28 1fj4 n GLY 32 N 0.95 2.92 3.76 9.45 0.00 0.23 -4.96 105.19 117.54 1fj4 n GLY 32 Ca 0.00 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.05 1fj4 n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fj4 s ILE 33 N -1.37 4.87 0.22 -0.61 -1.09 -1.26 -4.06 121.20 117.91 1fj4 s ILE 33 Ca 0.33 1.29 0.01 0.00 -2.23 0.00 0.00 60.65 60.05 1fj4 s ILE 33 Cb 0.20 -3.95 -0.05 0.00 -1.58 0.00 0.00 42.46 37.08 1fj4 s ILE 33 CO 0.18 0.42 0.08 0.42 -1.23 0.00 0.00 174.94 174.82 1fj4 s THR 34 N -0.26 0.43 0.26 2.92 -4.23 -0.03 -4.24 115.64 110.49 1fj4 s THR 34 Ca 0.32 -1.99 -0.29 0.00 -1.18 0.00 0.00 61.69 58.54 1fj4 s THR 34 Cb -0.19 -2.47 -0.09 0.00 1.34 0.00 0.00 72.50 71.09 1fj4 s THR 34 CO 0.18 -0.12 0.96 0.12 -0.54 0.00 0.00 174.62 175.22 1fj4 s PHE 35 N -3.84 3.89 -0.34 3.99 2.19 -1.26 0.88 117.98 123.48 1fj4 s PHE 35 Ca 0.35 1.87 -0.01 0.00 0.33 0.00 0.00 56.93 59.47 1fj4 s PHE 35 Cb 0.07 -3.02 0.08 0.00 -1.31 0.00 0.00 43.02 38.84 1fj4 s PHE 35 CO 0.11 0.28 0.06 0.45 1.83 0.00 0.00 175.22 177.95 1fj4 s SER 36 N -1.19 4.95 0.36 6.13 0.15 0.32 -4.77 113.70 119.65 1fj4 s SER 36 Ca 0.43 -1.68 0.05 0.00 0.70 0.00 0.00 55.95 55.45 1fj4 s SER 36 Cb -0.26 -1.72 0.69 0.00 -1.71 0.00 0.00 66.02 63.02 1fj4 s SER 36 CO 0.32 -0.37 1.94 -0.61 1.20 0.00 0.00 173.24 175.73 1fj4 h GLN 37 N 7.93 0.53 -0.73 5.44 5.75 -1.96 -1.57 115.11 130.50 1fj4 h GLN 37 Ca -0.15 -0.08 -0.06 0.00 -0.15 0.00 0.00 58.65 58.21 1fj4 h GLN 37 Cb 1.05 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.47 1fj4 h GLN 37 CO 0.58 0.48 0.23 1.49 -2.65 0.00 0.00 178.83 178.96 1fj4 h GLU 38 N 0.52 1.12 -0.14 1.69 4.81 -1.96 0.58 114.58 121.20 1fj4 h GLU 38 Ca 0.12 -0.23 -0.19 0.00 -0.13 0.00 0.00 59.36 58.93 1fj4 h GLU 38 Cb 0.19 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 1fj4 h GLU 38 CO -0.00 0.95 -0.67 -0.07 -0.73 0.00 0.00 179.01 178.48 1fj4 h LEU 39 N 1.08 0.66 -0.32 1.64 3.38 -1.70 -2.44 115.31 117.61 1fj4 h LEU 39 Ca 0.24 -0.40 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1fj4 h LEU 39 Cb 0.29 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1fj4 h LEU 39 CO -0.01 1.15 -0.07 0.50 0.09 0.00 0.00 178.44 180.10 1fj4 h LYS 40 N 0.41 0.61 -0.53 1.13 3.64 -1.12 -2.81 116.57 117.89 1fj4 h LYS 40 Ca -0.02 -0.23 -0.03 0.00 -1.27 0.00 0.00 60.65 59.11 1fj4 h LYS 40 Cb 1.25 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 33.01 1fj4 h LYS 40 CO 0.13 0.78 0.23 -0.44 -2.27 0.00 0.00 179.45 177.88 1fj4 h ASP 41 N 0.38 0.69 0.15 4.20 5.19 -0.86 -1.69 116.42 124.49 1fj4 h ASP 41 Ca 0.08 -0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 1fj4 h ASP 41 Cb 0.55 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.89 1fj4 h ASP 41 CO 0.03 0.61 -0.06 0.77 -3.12 0.00 0.00 179.24 177.47 1fj4 h SER 42 N 0.76 0.00 0.00 6.45 4.64 -1.38 -3.45 113.55 120.57 1fj4 h SER 42 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1fj4 h SER 42 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1fj4 h SER 42 CO -0.02 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 1fj4 n GLY 43 N -1.06 1.33 3.83 -0.77 0.00 -0.63 -5.11 105.19 102.78 1fj4 n GLY 43 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1fj4 n GLY 43 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fj4 s MET 44 N -0.30 2.93 0.14 1.61 -1.94 -1.07 -4.97 119.30 115.71 1fj4 s MET 44 Ca 0.00 0.83 0.17 0.00 -1.71 0.00 0.00 55.69 54.98 1fj4 s MET 44 Cb 0.00 -2.00 -0.06 0.00 2.01 0.00 0.00 34.83 34.78 1fj4 s MET 44 CO 0.00 -1.07 1.02 0.00 -0.01 0.00 0.00 175.02 174.96 1fj4 h ARG 45 N -0.69 0.00 -5.15 2.03 3.08 -1.94 -3.44 114.38 108.27 1fj4 h ARG 45 Ca -0.44 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 58.98 1fj4 h ARG 45 Cb 1.22 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 31.12 1fj4 h ARG 45 CO 0.59 0.28 -0.28 0.45 -1.07 0.00 0.00 179.97 179.93 1fj4 s SER 46 N -5.87 6.24 -0.16 7.04 0.15 -1.26 -4.63 113.70 115.21 1fj4 s SER 46 Ca -0.01 0.27 0.16 0.00 0.70 0.00 0.00 55.95 57.08 1fj4 s SER 46 Cb 0.08 -2.19 0.34 0.00 -1.71 0.00 0.00 66.02 62.54 1fj4 s SER 46 CO 0.79 -0.14 1.18 1.41 1.20 0.00 0.00 173.24 177.69 1fj4 n HIS 47 N 5.11 0.04 -4.66 3.44 8.25 -1.26 -4.51 115.22 121.63 1fj4 n HIS 47 Ca -0.10 -1.15 -0.33 0.00 -0.26 0.00 0.00 57.72 55.89 1fj4 n HIS 47 Cb 0.51 -0.19 -0.12 0.00 1.12 0.00 0.00 29.99 31.31 1fj4 n HIS 47 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1fj4 s VAL 48 N -2.99 3.39 0.19 1.59 -7.23 -1.26 0.12 120.40 114.20 1fj4 s VAL 48 Ca 0.34 -0.73 0.11 0.00 -1.81 0.00 0.00 61.98 59.89 1fj4 s VAL 48 Cb 0.31 -2.40 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 1fj4 s VAL 48 CO 0.00 0.50 -0.22 0.26 -0.31 0.00 0.00 175.10 175.33 1fj4 s TRP 49 N -0.86 2.15 -0.60 2.82 0.51 0.25 -4.50 118.94 118.71 1fj4 s TRP 49 Ca 0.14 -0.39 0.06 0.00 -2.12 0.00 0.00 56.10 53.79 1fj4 s TRP 49 Cb -0.11 -1.06 0.30 0.00 -0.81 0.00 0.00 33.47 31.79 1fj4 s TRP 49 CO 0.04 0.46 0.85 0.41 -0.51 0.00 0.00 176.95 178.19 1fj4 n GLY 50 N 0.22 5.16 3.88 0.98 0.00 -0.63 -0.85 105.19 113.94 1fj4 n GLY 50 Ca -0.12 -2.73 -0.30 0.00 0.00 0.00 0.00 46.02 42.87 1fj4 n GLY 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fj4 s ASN 51 N -2.97 6.32 -0.34 1.61 4.22 -1.26 -1.69 114.94 120.84 1fj4 s ASN 51 Ca 0.44 1.26 -0.18 0.00 -2.14 0.00 0.00 52.86 52.24 1fj4 s ASN 51 Cb 0.22 -2.39 -0.01 0.00 1.28 0.00 0.00 41.25 40.35 1fj4 s ASN 51 CO -0.08 -0.69 0.50 -0.69 -2.04 0.00 0.00 177.10 174.09 1fj4 s VAL 52 N -2.89 5.04 -1.15 3.54 1.01 -1.26 -3.93 120.40 120.76 1fj4 s VAL 52 Ca 0.53 0.38 -0.14 0.00 0.00 0.00 0.00 61.98 62.74 1fj4 s VAL 52 Cb -0.11 -3.93 0.18 0.00 0.00 0.00 0.00 36.38 32.52 1fj4 s VAL 52 CO 0.46 -0.16 1.34 -0.54 0.00 0.00 0.00 175.10 176.20 1fj4 s LYS 53 N 2.34 4.02 -0.29 2.72 -0.14 -1.26 -4.88 119.74 122.25 1fj4 s LYS 53 Ca 0.18 -2.52 -0.16 0.00 -1.36 0.00 0.00 55.97 52.11 1fj4 s LYS 53 Cb -0.16 -4.98 0.12 0.00 -1.68 0.00 0.00 37.83 31.14 1fj4 s LYS 53 CO 0.13 -1.70 0.87 -1.17 -0.76 0.00 0.00 175.35 172.71 1fj4 s LEU 54 N 1.42 -0.68 -0.36 3.17 2.96 -1.26 -4.91 118.68 119.02 1fj4 s LEU 54 Ca 0.39 1.08 -0.23 0.00 -0.22 0.00 0.00 54.13 55.16 1fj4 s LEU 54 Cb -0.04 1.98 0.01 0.00 0.50 0.00 0.00 46.19 48.64 1fj4 s LEU 54 CO -0.02 -0.17 0.75 -0.62 -1.32 0.00 0.00 176.35 174.97 1fj4 s ASP 55 N 1.50 6.53 0.26 3.68 3.68 -1.26 -4.90 116.67 126.16 1fj4 s ASP 55 Ca -0.09 0.33 0.24 0.00 2.13 0.00 0.00 52.55 55.15 1fj4 s ASP 55 Cb -0.04 -2.38 0.31 0.00 -1.45 0.00 0.00 42.92 39.36 1fj4 s ASP 55 CO -0.17 -0.70 1.41 0.71 0.13 0.00 0.00 175.17 176.55 1fj4 h THR 56 N 5.73 0.00 0.00 1.71 1.35 -2.00 -3.44 112.91 116.26 1fj4 h THR 56 Ca -0.25 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 1fj4 h THR 56 Cb 1.10 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 1fj4 h THR 56 CO 0.89 0.00 0.00 0.41 -0.25 0.00 0.00 175.52 176.57 1fj4 n THR 57 N -2.63 0.00 -0.77 6.82 -1.04 -1.26 -0.01 114.28 115.39 1fj4 n THR 57 Ca 0.03 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.11 1fj4 n THR 57 Cb 0.50 0.00 0.13 0.00 -1.82 0.00 0.00 70.33 69.14 1fj4 n THR 57 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1fj4 n GLY 58 N -0.67 4.20 0.13 3.41 0.00 -1.26 -4.71 105.19 106.29 1fj4 n GLY 58 Ca 0.00 -0.83 0.13 0.00 0.00 0.00 0.00 46.02 45.32 1fj4 n GLY 58 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fj4 h LEU 59 N 0.42 0.00 -8.26 0.99 4.07 -0.77 -3.45 115.31 108.32 1fj4 h LEU 59 Ca 0.00 0.00 -0.41 0.00 0.08 0.00 0.00 57.88 57.55 1fj4 h LEU 59 Cb 0.95 0.00 -0.25 0.00 1.08 0.00 0.00 40.66 42.44 1fj4 h LEU 59 CO 0.04 0.00 -0.78 -0.63 -1.08 0.00 0.00 178.44 175.98 1fj4 s ILE 60 N -3.26 0.97 0.20 1.22 1.01 -1.26 -5.08 121.20 115.00 1fj4 s ILE 60 Ca 0.06 -0.92 -0.32 0.00 0.00 0.00 0.00 60.65 59.47 1fj4 s ILE 60 Cb 0.10 -0.89 -0.13 0.00 0.01 0.00 0.00 42.46 41.55 1fj4 s ILE 60 CO 0.48 -0.02 1.64 0.47 0.00 0.00 0.00 174.94 177.51 1fj4 n ASP 61 N 1.98 3.60 -0.28 3.58 9.92 -1.26 -4.74 116.55 129.35 1fj4 n ASP 61 Ca -0.18 1.08 0.09 0.00 -0.53 0.00 0.00 54.79 55.26 1fj4 n ASP 61 Cb 0.55 -1.52 0.24 0.00 -0.64 0.00 0.00 41.12 39.75 1fj4 n ASP 61 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 1fj4 h ARG 62 N 6.11 0.31 0.00 -1.24 2.43 -1.97 0.90 114.38 120.92 1fj4 h ARG 62 Ca -0.44 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 58.67 1fj4 h ARG 62 Cb 1.23 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.70 1fj4 h ARG 62 CO 0.90 0.20 -0.18 0.87 -1.51 0.00 0.00 179.97 180.26 1fj4 h LYS 63 N 0.32 0.00 0.05 0.20 1.79 -2.01 -2.26 116.57 114.66 1fj4 h LYS 63 Ca 0.49 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.67 1fj4 h LYS 63 Cb 0.88 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.50 1fj4 h LYS 63 CO -0.53 0.18 -1.56 1.33 -1.08 0.00 0.00 179.45 177.79 1fj4 n VAL 64 N -4.04 1.63 0.32 0.50 0.24 -0.24 -4.28 118.33 112.46 1fj4 n VAL 64 Ca -0.02 -0.27 0.21 0.00 -2.04 0.00 0.00 64.34 62.22 1fj4 n VAL 64 Cb 0.26 -1.93 1.03 0.00 -1.47 0.00 0.00 33.84 31.74 1fj4 n VAL 64 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1fj4 h VAL 65 N -0.60 0.01 0.00 3.34 3.04 -0.88 -2.61 116.25 118.55 1fj4 h VAL 65 Ca -0.38 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.12 1fj4 h VAL 65 Cb 1.58 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 32.05 1fj4 h VAL 65 CO -0.10 0.00 0.00 -2.11 -1.01 0.00 0.00 177.57 174.35 1fj4 n ARG 66 N -3.10 0.06 -0.01 4.17 1.85 -0.85 -1.98 116.66 116.81 1fj4 n ARG 66 Ca -0.02 0.35 0.09 0.00 -1.00 0.00 0.00 57.85 57.28 1fj4 n ARG 66 Cb 0.15 -1.63 -0.13 0.00 -1.05 0.00 0.00 32.46 29.80 1fj4 n ARG 66 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1fj4 n PHE 67 N -1.75 0.00 -2.99 2.89 3.72 -0.98 -4.83 117.46 113.53 1fj4 n PHE 67 Ca 0.02 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.14 1fj4 n PHE 67 Cb 0.15 -0.27 -0.02 0.00 -0.94 0.00 0.00 39.48 38.40 1fj4 n PHE 67 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1fj4 s MET 68 N -3.10 3.65 0.50 -1.08 1.00 -0.84 -2.83 119.30 116.60 1fj4 s MET 68 Ca -0.02 0.20 0.05 0.00 0.00 0.00 0.00 55.69 55.92 1fj4 s MET 68 Cb 0.13 -2.49 0.00 0.00 0.00 0.00 0.00 34.83 32.48 1fj4 s MET 68 CO 0.78 0.01 0.26 -1.54 0.00 0.00 0.00 175.02 174.53 1fj4 s SER 69 N -3.47 4.48 0.24 3.03 1.04 -1.26 -4.88 113.70 112.88 1fj4 s SER 69 Ca 0.47 -1.29 -0.05 0.00 0.48 0.00 0.00 55.95 55.56 1fj4 s SER 69 Cb -0.10 0.21 0.38 0.00 0.10 0.00 0.00 66.02 66.60 1fj4 s SER 69 CO 0.35 -0.91 1.80 0.44 0.98 0.00 0.00 173.24 175.89 1fj4 h ASP 70 N 1.05 0.58 -0.85 7.02 3.45 -1.94 -1.25 116.42 124.48 1fj4 h ASP 70 Ca -0.40 0.05 0.05 0.00 0.43 0.00 0.00 57.03 57.17 1fj4 h ASP 70 Cb 1.29 -0.05 -0.06 0.00 -0.56 0.00 0.00 39.33 39.95 1fj4 h ASP 70 CO 0.64 0.33 0.53 0.00 -1.57 0.00 0.00 179.24 179.17 1fj4 h ALA 71 N 1.45 1.16 -0.46 3.45 0.00 -1.87 0.19 119.26 123.17 1fj4 h ALA 71 Ca 0.38 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.16 1fj4 h ALA 71 Cb 0.37 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1fj4 h ALA 71 CO -0.26 0.31 -0.16 0.77 0.00 0.00 0.00 179.25 179.91 1fj4 h SER 72 N 0.99 0.95 -0.27 0.00 0.02 -1.71 -2.22 113.55 111.31 1fj4 h SER 72 Ca 0.36 -0.38 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1fj4 h SER 72 Cb 0.12 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1fj4 h SER 72 CO -0.16 1.11 0.12 0.40 -1.14 0.00 0.00 176.83 177.17 1fj4 h ILE 73 N 0.77 1.16 -0.76 3.27 2.04 -0.64 0.14 117.51 123.49 1fj4 h ILE 73 Ca 0.11 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1fj4 h ILE 73 Cb 0.73 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 1fj4 h ILE 73 CO 0.06 0.16 0.42 1.88 0.00 0.00 0.00 178.15 180.67 1fj4 h TYR 74 N 0.30 1.04 -0.25 1.37 0.05 -0.93 -1.24 116.97 117.31 1fj4 h TYR 74 Ca 0.09 -0.02 -0.18 0.00 0.05 0.00 0.00 58.73 58.67 1fj4 h TYR 74 Cb 0.14 -0.33 -0.00 0.00 1.01 0.00 0.00 36.73 37.54 1fj4 h TYR 74 CO -0.02 0.73 -0.56 0.00 -1.05 0.00 0.00 178.16 177.26 1fj4 h ALA 75 N 1.22 0.53 -0.61 3.88 0.00 -1.25 -2.42 119.26 120.62 1fj4 h ALA 75 Ca 0.27 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1fj4 h ALA 75 Cb 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1fj4 h ALA 75 CO -0.04 0.69 0.30 0.35 0.00 0.00 0.00 179.25 180.54 1fj4 h PHE 76 N 0.59 0.87 -0.33 0.00 3.04 -0.42 -0.30 116.94 120.39 1fj4 h PHE 76 Ca 0.01 -0.04 -0.11 0.00 3.98 0.00 0.00 57.97 61.81 1fj4 h PHE 76 Cb 1.15 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 39.38 1fj4 h PHE 76 CO 0.06 0.65 -0.25 -0.07 -2.02 0.00 0.00 178.31 176.69 1fj4 h LEU 77 N 0.83 0.66 -0.82 0.59 3.38 -1.23 -2.30 115.31 116.42 1fj4 h LEU 77 Ca 0.21 -0.24 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1fj4 h LEU 77 Cb 0.10 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1fj4 h LEU 77 CO -0.03 0.89 -0.14 0.28 0.09 0.00 0.00 178.44 179.54 1fj4 h SER 78 N 0.57 0.73 -0.41 -0.43 0.02 -1.03 -2.58 113.55 110.42 1fj4 h SER 78 Ca 0.08 -0.22 -0.12 0.00 -0.84 0.00 0.00 61.79 60.69 1fj4 h SER 78 Cb 0.73 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 1fj4 h SER 78 CO 0.06 0.88 -0.20 -0.03 -1.14 0.00 0.00 176.83 176.40 1fj4 h MET 79 N 0.66 0.85 -0.57 3.45 1.85 -0.89 -1.75 114.93 118.54 1fj4 h MET 79 Ca 0.11 -0.37 0.07 0.00 -0.61 0.00 0.00 59.70 58.90 1fj4 h MET 79 Cb 0.61 -0.02 -0.06 0.00 0.43 0.00 0.00 31.60 32.55 1fj4 h MET 79 CO 0.04 1.01 0.24 0.93 -0.40 0.00 0.00 176.91 178.73 1fj4 h GLU 80 N 0.67 0.43 -0.70 0.39 5.08 -1.26 0.14 114.58 119.33 1fj4 h GLU 80 Ca 0.09 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1fj4 h GLU 80 Cb 0.76 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 1fj4 h GLU 80 CO 0.06 0.29 0.26 1.96 -1.00 0.00 0.00 179.01 180.58 1fj4 h GLN 81 N 0.45 1.04 -0.25 2.33 4.20 -1.28 -2.04 115.11 119.57 1fj4 h GLN 81 Ca 0.27 -0.19 -0.19 0.00 0.06 0.00 0.00 58.65 58.60 1fj4 h GLN 81 Cb 0.27 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1fj4 h GLN 81 CO -0.24 0.86 -0.60 0.00 -0.67 0.00 0.00 178.83 178.17 1fj4 h ALA 82 N 1.27 0.46 0.10 3.87 0.00 -0.46 0.50 119.26 125.00 1fj4 h ALA 82 Ca 0.23 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1fj4 h ALA 82 Cb 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1fj4 h ALA 82 CO -0.02 0.69 -0.05 0.82 0.00 0.00 0.00 179.25 180.69 1fj4 h ILE 83 N 0.61 0.94 -0.83 0.00 2.04 -0.64 0.29 117.51 119.92 1fj4 h ILE 83 Ca -0.00 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.73 1fj4 h ILE 83 Cb 1.21 1.02 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 1fj4 h ILE 83 CO 0.13 0.03 0.46 0.00 0.00 0.00 0.00 178.15 178.77 1fj4 h ALA 84 N 0.72 1.06 -0.42 1.87 0.00 -1.37 -1.69 119.26 119.42 1fj4 h ALA 84 Ca -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1fj4 h ALA 84 Cb 0.15 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1fj4 h ALA 84 CO 0.02 0.57 0.17 0.22 0.00 0.00 0.00 179.25 180.23 1fj4 h ASP 85 N 1.15 0.58 0.78 0.00 3.58 -0.53 -2.54 116.42 119.45 1fj4 h ASP 85 Ca 0.29 -0.17 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1fj4 h ASP 85 Cb 0.03 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 40.92 1fj4 h ASP 85 CO -0.05 0.59 0.00 0.00 -2.88 0.00 0.00 179.24 176.90 1fj4 h ALA 86 N 1.02 1.00 -0.39 -0.78 0.00 -0.16 -3.45 119.26 116.49 1fj4 h ALA 86 Ca 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1fj4 h ALA 86 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1fj4 h ALA 86 CO -0.01 0.00 -0.08 0.41 0.00 0.00 0.00 179.25 179.56 1fj4 n GLY 87 N -0.01 0.39 3.65 0.00 0.00 -0.80 -4.67 105.19 103.75 1fj4 n GLY 87 Ca 0.02 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 1fj4 n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fj4 s LEU 88 N -0.98 4.11 0.09 0.99 1.02 -0.70 -5.04 118.68 118.16 1fj4 s LEU 88 Ca 0.00 1.20 -0.12 0.00 0.02 0.00 0.00 54.13 55.23 1fj4 s LEU 88 Cb 0.00 -3.34 -0.06 0.00 0.02 0.00 0.00 46.19 42.81 1fj4 s LEU 88 CO 0.00 -0.55 0.45 -0.94 0.02 0.00 0.00 176.35 175.33 1fj4 s SER 89 N 1.25 6.72 0.20 2.29 1.04 -1.26 -4.70 113.70 119.24 1fj4 s SER 89 Ca 0.39 0.91 -0.22 0.00 0.48 0.00 0.00 55.95 57.51 1fj4 s SER 89 Cb -0.15 -2.22 0.12 0.00 0.10 0.00 0.00 66.02 63.87 1fj4 s SER 89 CO 0.08 0.17 1.56 -0.65 0.98 0.00 0.00 173.24 175.38 1fj4 h PRO 90 N 3.78 -0.10 -0.79 4.02 0.11 -1.98 0.38 132.00 137.43 1fj4 h PRO 90 Ca -0.49 0.01 0.23 0.00 0.11 0.00 0.00 66.00 65.85 1fj4 h PRO 90 Cb 1.20 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 1fj4 h PRO 90 CO 0.66 -0.07 0.64 1.05 -0.21 0.00 0.00 178.00 180.07 1fj4 h GLU 91 N -0.10 0.00 0.05 1.05 9.09 -1.95 0.53 114.58 123.25 1fj4 h GLU 91 Ca 0.25 0.00 -0.00 0.00 0.05 0.00 0.00 59.36 59.66 1fj4 h GLU 91 Cb 0.56 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 1fj4 h GLU 91 CO -0.83 0.00 -0.02 0.00 0.05 0.00 0.00 179.01 178.21 1fj4 h ALA 92 N 1.45 -0.07 0.00 1.06 0.00 -0.65 -3.40 119.26 117.65 1fj4 h ALA 92 Ca 0.37 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1fj4 h ALA 92 Cb 1.66 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1fj4 h ALA 92 CO -0.00 -0.10 -1.32 2.48 0.00 0.00 0.00 179.25 180.31 1fj4 n TYR 93 N -4.76 0.53 -2.76 0.00 0.18 -0.74 -4.80 117.16 104.82 1fj4 n TYR 93 Ca -0.06 0.16 -0.36 0.00 1.88 0.00 0.00 57.90 59.51 1fj4 n TYR 93 Cb 0.27 -0.72 -0.06 0.00 -0.38 0.00 0.00 39.34 38.45 1fj4 n TYR 93 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1fj4 s GLN 94 N -3.38 4.47 -1.49 -3.48 -0.21 0.18 -3.81 119.66 111.93 1fj4 s GLN 94 Ca -0.02 1.32 -0.14 0.00 0.02 0.00 0.00 55.36 56.54 1fj4 s GLN 94 Cb 0.12 -2.66 0.11 0.00 1.00 0.00 0.00 33.01 31.58 1fj4 s GLN 94 CO 0.83 0.17 0.70 0.09 -2.12 0.00 0.00 175.29 174.96 1fj4 n ASN 95 N 0.26 -3.82 -4.13 5.90 3.02 0.29 -4.85 115.26 111.92 1fj4 n ASN 95 Ca 0.03 -0.69 -0.34 0.00 -0.03 0.00 0.00 54.58 53.55 1fj4 n ASN 95 Cb 0.51 -3.12 -0.14 0.00 -0.61 0.00 0.00 39.78 36.41 1fj4 n ASN 95 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1fj4 s ASN 96 N -3.04 4.80 0.64 6.41 3.84 -1.25 -4.91 114.94 121.42 1fj4 s ASN 96 Ca 0.58 -1.41 0.33 0.00 0.21 0.00 0.00 52.86 52.58 1fj4 s ASN 96 Cb -0.31 -1.67 1.79 0.00 -0.55 0.00 0.00 41.25 40.51 1fj4 s ASN 96 CO 0.72 -0.27 2.00 1.55 -2.79 0.00 0.00 177.10 178.31 1fj4 h PRO 97 N 7.92 0.00 -0.26 0.43 0.13 -1.92 0.22 132.00 138.52 1fj4 h PRO 97 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1fj4 h PRO 97 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1fj4 h PRO 97 CO 0.52 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.83 1fj4 n ARG 98 N -2.87 1.99 -4.48 0.86 5.12 -1.26 -3.89 116.66 112.12 1fj4 n ARG 98 Ca -0.02 -1.49 -0.33 0.00 -1.93 0.00 0.00 57.85 54.08 1fj4 n ARG 98 Cb 0.28 -1.42 -0.16 0.00 -1.16 0.00 0.00 32.46 30.00 1fj4 n ARG 98 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1fj4 s VAL 99 N -1.66 2.36 0.43 1.55 1.01 0.78 -0.47 120.40 124.40 1fj4 s VAL 99 Ca 0.34 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.47 1fj4 s VAL 99 Cb 0.19 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 1fj4 s VAL 99 CO 0.27 0.53 0.09 0.61 0.00 0.00 0.00 175.10 176.59 1fj4 n GLY 100 N 4.20 3.39 2.81 4.51 0.00 0.29 -0.33 105.19 120.06 1fj4 n GLY 100 Ca -0.20 -2.21 -0.17 0.00 0.00 0.00 0.00 46.02 43.45 1fj4 n GLY 100 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fj4 s LEU 101 N 0.00 0.09 -0.30 0.99 1.98 0.28 -0.93 118.68 120.79 1fj4 s LEU 101 Ca 0.12 0.27 -0.00 0.00 -2.89 0.00 0.00 54.13 51.63 1fj4 s LEU 101 Cb 0.01 0.19 0.10 0.00 0.66 0.00 0.00 46.19 47.14 1fj4 s LEU 101 CO 0.09 -0.23 0.08 -0.63 -1.89 0.00 0.00 176.35 173.77 1fj4 s ILE 102 N 2.11 1.10 -0.03 6.68 1.01 0.21 -2.96 121.20 129.33 1fj4 s ILE 102 Ca 0.02 -1.49 -0.12 0.00 0.00 0.00 0.00 60.65 59.06 1fj4 s ILE 102 Cb -0.12 -1.79 0.02 0.00 0.01 0.00 0.00 42.46 40.57 1fj4 s ILE 102 CO -0.05 -0.61 0.26 0.00 0.00 0.00 0.00 174.94 174.54 1fj4 s ALA 103 N 1.51 -0.65 0.05 9.38 0.00 -1.17 -2.57 121.76 128.31 1fj4 s ALA 103 Ca 0.09 0.29 -0.01 0.00 0.00 0.00 0.00 51.96 52.33 1fj4 s ALA 103 Cb -0.18 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1fj4 s ALA 103 CO -0.21 -0.22 0.08 0.41 0.00 0.00 0.00 175.76 175.82 1fj4 n GLY 104 N 1.64 2.29 3.23 0.00 0.00 -1.04 -3.16 105.19 108.15 1fj4 n GLY 104 Ca -0.20 -1.18 -0.13 0.00 0.00 0.00 0.00 46.02 44.51 1fj4 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fj4 s SER 105 N -1.26 1.05 0.08 1.61 1.04 -1.26 -1.87 113.70 113.09 1fj4 s SER 105 Ca 0.03 -1.20 -0.12 0.00 0.48 0.00 0.00 55.95 55.14 1fj4 s SER 105 Cb -0.00 0.15 -0.22 0.00 0.10 0.00 0.00 66.02 66.05 1fj4 s SER 105 CO 0.02 -0.61 1.19 1.23 0.98 0.00 0.00 173.24 176.05 1fj4 h GLY 106 N 2.70 0.70 -0.43 7.32 0.00 -1.76 -3.40 103.07 108.20 1fj4 h GLY 106 Ca -0.37 -1.29 0.00 0.00 0.00 0.00 0.00 47.33 45.67 1fj4 h GLY 106 CO 0.62 1.14 -0.21 0.61 0.00 0.00 0.00 176.54 178.69 1fj4 n GLY 107 N 1.14 2.81 7.00 4.60 0.00 -1.26 -4.61 105.19 114.88 1fj4 n GLY 107 Ca -0.11 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1fj4 n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fj4 n GLY 108 N -0.77 3.79 2.49 -0.02 0.00 -1.26 -3.98 105.19 105.43 1fj4 n GLY 108 Ca 0.08 0.20 -0.23 0.00 0.00 0.00 0.00 46.02 46.07 1fj4 n GLY 108 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fj4 s SER 109 N -4.00 1.22 0.47 1.61 0.15 -1.25 -4.67 113.70 107.23 1fj4 s SER 109 Ca 0.00 -2.61 0.13 0.00 0.70 0.00 0.00 55.95 54.17 1fj4 s SER 109 Cb 0.00 -0.01 1.10 0.00 -1.71 0.00 0.00 66.02 65.40 1fj4 s SER 109 CO 0.00 -0.18 2.08 -0.65 1.20 0.00 0.00 173.24 175.69 1fj4 h PRO 110 N 5.90 0.24 -0.85 5.44 0.11 -1.90 -1.05 132.00 139.90 1fj4 h PRO 110 Ca 0.19 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 1fj4 h PRO 110 Cb 0.96 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.98 1fj4 h PRO 110 CO 0.29 0.16 0.44 -0.09 -0.21 0.00 0.00 178.00 178.59 1fj4 h ARG 111 N 0.25 1.20 0.00 1.05 2.43 -1.93 0.18 114.38 117.56 1fj4 h ARG 111 Ca 0.11 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1fj4 h ARG 111 Cb 0.13 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.45 1fj4 h ARG 111 CO -0.02 0.90 -0.73 0.74 -1.51 0.00 0.00 179.97 179.34 1fj4 h PHE 112 N 1.19 0.00 -0.04 2.20 -1.00 -1.76 -1.11 116.94 116.42 1fj4 h PHE 112 Ca 0.30 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 61.02 1fj4 h PHE 112 Cb 0.07 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.63 1fj4 h PHE 112 CO 0.01 0.07 -0.17 0.37 -1.61 0.00 0.00 178.31 176.98 1fj4 h GLN 113 N 0.00 0.19 -0.15 1.51 5.75 -1.00 -2.11 115.11 119.30 1fj4 h GLN 113 Ca -0.01 -0.15 -0.06 0.00 -0.15 0.00 0.00 58.65 58.28 1fj4 h GLN 113 Cb 1.06 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.63 1fj4 h GLN 113 CO 0.01 0.79 -0.16 0.28 -2.65 0.00 0.00 178.83 177.09 1fj4 h VAL 114 N -0.36 1.19 -0.24 2.39 2.07 -0.69 -2.18 116.25 118.44 1fj4 h VAL 114 Ca -0.01 -0.87 -0.19 0.00 0.82 0.00 0.00 66.70 66.45 1fj4 h VAL 114 Cb 0.81 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1fj4 h VAL 114 CO 0.04 0.27 -0.60 0.15 0.02 0.00 0.00 177.57 177.44 1fj4 h PHE 115 N 0.22 1.04 -0.59 1.57 3.57 -1.17 -2.00 116.94 119.58 1fj4 h PHE 115 Ca 0.04 -0.39 -0.06 0.00 3.53 0.00 0.00 57.97 61.10 1fj4 h PHE 115 Cb 0.42 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.95 1fj4 h PHE 115 CO 0.01 1.21 0.15 0.78 -2.23 0.00 0.00 178.31 178.23 1fj4 h GLY 116 N 0.72 1.01 0.93 2.40 0.00 -1.07 -0.19 103.07 106.87 1fj4 h GLY 116 Ca -0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 1fj4 h GLY 116 CO 0.13 0.59 -0.06 0.00 0.00 0.00 0.00 176.54 177.19 1fj4 h ALA 117 N 1.04 -0.17 0.48 3.60 0.00 -1.34 -0.15 119.26 122.71 1fj4 h ALA 117 Ca 0.19 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1fj4 h ALA 117 Cb 0.34 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1fj4 h ALA 117 CO 0.00 -0.56 -0.23 -0.44 0.00 0.00 0.00 179.25 178.02 1fj4 h ASP 118 N -0.25 -0.54 -0.80 0.00 3.45 -1.28 -1.54 116.42 115.46 1fj4 h ASP 118 Ca -0.02 0.02 0.17 0.00 0.43 0.00 0.00 57.03 57.63 1fj4 h ASP 118 Cb 0.20 0.14 -0.11 0.00 -0.56 0.00 0.00 39.33 39.00 1fj4 h ASP 118 CO 0.03 -0.39 0.29 0.00 -1.57 0.00 0.00 179.24 177.61 1fj4 h ALA 119 N -0.11 1.14 -0.54 3.45 0.00 -1.01 -1.06 119.26 121.14 1fj4 h ALA 119 Ca -0.07 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1fj4 h ALA 119 Cb 0.49 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1fj4 h ALA 119 CO 0.11 -0.28 0.34 1.98 0.00 0.00 0.00 179.25 181.39 1fj4 h MET 120 N 0.38 0.72 0.00 0.00 -1.53 -0.67 -2.70 114.93 111.13 1fj4 h MET 120 Ca 0.46 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.66 1fj4 h MET 120 Cb 0.78 -0.16 0.00 0.00 -0.55 0.00 0.00 31.60 31.67 1fj4 h MET 120 CO -0.47 0.51 0.00 0.54 0.14 0.00 0.00 176.91 177.62 1fj4 n ARG 121 N -4.68 0.02 -2.01 0.39 1.74 -0.42 -4.06 116.66 107.64 1fj4 n ARG 121 Ca 0.03 0.31 -0.29 0.00 -0.77 0.00 0.00 57.85 57.14 1fj4 n ARG 121 Cb 0.04 -1.54 0.14 0.00 -1.02 0.00 0.00 32.46 30.08 1fj4 n ARG 121 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1fj4 s GLY 122 N -3.06 1.71 0.49 -0.13 0.00 -1.02 -4.97 107.32 100.35 1fj4 s GLY 122 Ca 0.05 -1.04 0.16 0.00 0.00 0.00 0.00 44.72 43.89 1fj4 s GLY 122 CO 0.23 -0.42 2.09 -2.55 0.00 0.00 0.00 173.10 172.45 1fj4 h PRO 123 N -1.24 0.14 0.00 2.90 0.11 -1.86 -2.58 132.00 129.47 1fj4 h PRO 123 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1fj4 h PRO 123 Cb 1.28 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1fj4 h PRO 123 CO 0.49 0.09 -0.09 0.54 -0.21 0.00 0.00 178.00 178.83 1fj4 n ARG 124 N -4.49 0.23 0.00 1.05 5.12 -1.26 -4.99 116.66 112.32 1fj4 n ARG 124 Ca 0.02 0.17 0.00 0.00 -1.93 0.00 0.00 57.85 56.11 1fj4 n ARG 124 Cb 0.21 -1.75 0.00 0.00 -1.16 0.00 0.00 32.46 29.76 1fj4 n ARG 124 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1fj4 n GLY 125 N 1.34 3.46 0.36 -0.13 0.00 -0.97 -2.36 105.19 106.88 1fj4 n GLY 125 Ca 0.05 0.18 0.01 0.00 0.00 0.00 0.00 46.02 46.27 1fj4 n GLY 125 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fj4 h LEU 126 N 0.00 1.00 -1.71 0.99 4.07 -1.88 -2.33 115.31 115.46 1fj4 h LEU 126 Ca 0.00 0.00 0.08 0.00 0.08 0.00 0.00 57.88 58.04 1fj4 h LEU 126 Cb 0.00 -0.21 -0.03 0.00 1.08 0.00 0.00 40.66 41.50 1fj4 h LEU 126 CO 0.00 0.66 0.34 0.11 -1.08 0.00 0.00 178.44 178.46 1fj4 h LYS 127 N 1.15 0.34 -0.01 1.13 1.57 -1.86 -1.12 116.57 117.76 1fj4 h LYS 127 Ca 0.40 -0.02 -0.24 0.00 -1.87 0.00 0.00 60.65 58.92 1fj4 h LYS 127 Cb 0.11 -0.08 0.01 0.00 0.08 0.00 0.00 32.23 32.35 1fj4 h LYS 127 CO -0.16 0.22 -0.97 0.00 -0.57 0.00 0.00 179.45 177.98 1fj4 h ALA 128 N 1.74 0.28 0.17 3.86 0.00 -1.53 -3.34 119.26 120.44 1fj4 h ALA 128 Ca 0.23 -0.70 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1fj4 h ALA 128 Cb 0.44 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1fj4 h ALA 128 CO -0.05 0.76 -0.08 0.28 0.00 0.00 0.00 179.25 180.15 1fj4 h VAL 129 N 0.31 0.86 0.00 0.00 2.07 -0.97 -3.48 116.25 115.05 1fj4 h VAL 129 Ca -0.10 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.32 1fj4 h VAL 129 Cb 1.61 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 1fj4 h VAL 129 CO 0.18 0.03 0.00 0.61 0.02 0.00 0.00 177.57 178.40 1fj4 n GLY 130 N -1.05 0.15 1.10 2.17 0.00 -1.02 -4.64 105.19 101.89 1fj4 n GLY 130 Ca -0.09 -1.82 0.09 0.00 0.00 0.00 0.00 46.02 44.20 1fj4 n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fj4 n PRO 131 N 0.36 2.45 0.00 1.61 -0.04 -1.26 -4.38 135.00 133.75 1fj4 n PRO 131 Ca 0.00 -2.10 0.05 0.00 -0.04 0.00 0.00 63.50 61.42 1fj4 n PRO 131 Cb 0.00 -1.49 0.01 0.00 -0.04 0.00 0.00 33.50 31.98 1fj4 n PRO 131 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1fj4 n TYR 132 N 1.13 0.00 0.26 0.54 4.01 -1.26 -4.65 117.16 117.20 1fj4 n TYR 132 Ca 0.19 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 58.08 1fj4 n TYR 132 Cb 0.52 0.00 0.60 0.00 -0.31 0.00 0.00 39.34 40.16 1fj4 n TYR 132 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1fj4 h VAL 133 N 1.45 0.18 0.34 -0.72 2.07 -1.82 -2.77 116.25 114.98 1fj4 h VAL 133 Ca 0.00 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 1fj4 h VAL 133 Cb 0.38 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1fj4 h VAL 133 CO 0.00 0.07 -0.16 0.58 0.02 0.00 0.00 177.57 178.08 1fj4 h VAL 134 N 0.00 0.56 0.00 2.57 2.07 -1.91 -0.16 116.25 119.39 1fj4 h VAL 134 Ca -0.00 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 1fj4 h VAL 134 Cb 0.59 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.21 1fj4 h VAL 134 CO 0.01 0.11 -0.17 0.71 0.02 0.00 0.00 177.57 178.25 1fj4 h THR 135 N -0.88 1.06 0.02 2.57 1.35 -1.82 0.46 112.91 115.67 1fj4 h THR 135 Ca -0.05 -0.58 -0.00 0.00 -0.55 0.00 0.00 66.41 65.23 1fj4 h THR 135 Cb 0.53 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1fj4 h THR 135 CO 0.08 0.16 -0.01 0.11 -0.25 0.00 0.00 175.52 175.61 1fj4 h LYS 136 N 0.00 -0.02 0.00 4.72 1.57 -1.33 -3.35 116.57 118.15 1fj4 h LYS 136 Ca -0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1fj4 h LYS 136 Cb 0.30 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 1fj4 h LYS 136 CO 0.02 0.72 -0.12 0.00 -0.57 0.00 0.00 179.45 179.49 1fj4 h ALA 137 N 0.07 0.95 -2.93 3.86 0.00 -0.92 -3.39 119.26 116.90 1fj4 h ALA 137 Ca -0.00 -0.11 -0.53 0.00 0.00 0.00 0.00 54.91 54.26 1fj4 h ALA 137 Cb 0.75 -0.02 0.10 0.00 0.00 0.00 0.00 17.79 18.62 1fj4 h ALA 137 CO 0.00 0.15 0.71 0.00 0.00 0.00 0.00 179.25 180.12 1fj4 s MET 138 N -3.36 4.08 0.31 0.00 0.23 0.14 -3.88 119.30 116.84 1fj4 s MET 138 Ca 0.04 2.41 0.06 0.00 -1.03 0.00 0.00 55.69 57.17 1fj4 s MET 138 Cb 0.07 -2.92 0.73 0.00 -1.53 0.00 0.00 34.83 31.18 1fj4 s MET 138 CO 0.65 -0.49 1.81 0.00 -2.03 0.00 0.00 175.02 174.95 1fj4 h ALA 139 N 2.94 1.69 -0.01 3.16 0.00 -1.90 -0.97 119.26 124.18 1fj4 h ALA 139 Ca -0.50 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1fj4 h ALA 139 Cb 1.24 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1fj4 h ALA 139 CO 0.64 -0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.74 1fj4 n SER 140 N -4.68 0.19 -0.30 0.00 3.41 -1.26 -4.51 113.62 106.48 1fj4 n SER 140 Ca 0.21 -1.21 0.03 0.00 -0.26 0.00 0.00 58.87 57.64 1fj4 n SER 140 Cb 0.51 -0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.54 1fj4 n SER 140 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fj4 n GLY 141 N 0.95 -1.48 0.36 5.00 0.00 -0.37 -0.59 105.19 109.06 1fj4 n GLY 141 Ca 0.20 0.88 0.03 0.00 0.00 0.00 0.00 46.02 47.14 1fj4 n GLY 141 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fj4 h VAL 142 N 0.00 1.02 0.06 1.61 2.07 -1.84 -0.18 116.25 119.00 1fj4 h VAL 142 Ca 0.34 -0.37 -0.10 0.00 0.82 0.00 0.00 66.70 67.40 1fj4 h VAL 142 Cb 0.55 -0.14 0.01 0.00 -1.52 0.00 0.00 31.29 30.19 1fj4 h VAL 142 CO -0.82 0.19 -0.42 0.77 0.02 0.00 0.00 177.57 177.31 1fj4 h SER 143 N 1.07 0.26 -0.77 0.57 4.64 -0.80 -3.24 113.55 115.28 1fj4 h SER 143 Ca 0.44 -0.94 0.05 0.00 -0.47 0.00 0.00 61.79 60.86 1fj4 h SER 143 Cb 0.27 -0.08 -0.05 0.00 -0.31 0.00 0.00 62.40 62.22 1fj4 h SER 143 CO -0.20 1.18 0.47 0.00 -0.87 0.00 0.00 176.83 177.41 1fj4 h ALA 144 N 0.08 1.03 0.00 5.18 0.00 -1.03 -0.92 119.26 123.60 1fj4 h ALA 144 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1fj4 h ALA 144 Cb 1.31 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1fj4 h ALA 144 CO 0.08 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.56 1fj4 n LEU 146 N -1.89 2.84 -0.35 0.00 4.77 -0.99 -4.38 117.00 117.01 1fj4 n LEU 146 Ca 0.04 -0.07 -0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1fj4 n LEU 146 Cb 0.28 -0.65 0.13 0.00 -2.33 0.00 0.00 43.42 40.85 1fj4 n LEU 146 CO 0.22 0.78 1.25 0.00 -1.33 0.00 0.00 177.39 178.32 1fj4 h ALA 147 N -0.07 1.25 0.35 -1.18 0.00 -1.26 -2.28 119.26 116.08 1fj4 h ALA 147 Ca -0.43 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1fj4 h ALA 147 Cb 1.63 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1fj4 h ALA 147 CO -0.09 0.49 -0.17 1.15 0.00 0.00 0.00 179.25 180.63 1fj4 h THR 148 N 1.19 0.52 -0.43 0.00 2.02 -1.79 -1.89 112.91 112.53 1fj4 h THR 148 Ca 0.38 -0.67 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 1fj4 h THR 148 Cb 0.01 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1fj4 h THR 148 CO -0.12 0.10 0.12 1.55 0.37 0.00 0.00 175.52 177.54 1fj4 h PRO 149 N -0.91 0.63 -0.01 6.66 0.13 -1.76 -2.87 132.00 133.87 1fj4 h PRO 149 Ca -0.05 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 1fj4 h PRO 149 Cb 0.53 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.55 1fj4 h PRO 149 CO 0.08 0.57 0.00 1.19 -0.23 0.00 0.00 178.00 179.60 1fj4 n PHE 150 N -4.33 0.01 -3.08 1.56 3.72 -0.86 -4.92 117.46 109.57 1fj4 n PHE 150 Ca 0.03 -0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.25 1fj4 n PHE 150 Cb 0.19 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.77 1fj4 n PHE 150 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1fj4 n LYS 151 N -0.80 -4.82 -2.49 -1.08 4.01 -1.08 -4.62 118.16 107.28 1fj4 n LYS 151 Ca 0.20 0.64 -0.42 0.00 -0.51 0.00 0.00 58.31 58.22 1fj4 n LYS 151 Cb 0.12 -5.01 -0.03 0.00 -0.51 0.00 0.00 35.03 29.60 1fj4 n LYS 151 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1fj4 s ILE 152 N -3.13 4.20 -0.33 -0.18 -1.09 -0.72 -0.55 121.20 119.39 1fj4 s ILE 152 Ca 0.33 1.60 0.10 0.00 -2.23 0.00 0.00 60.65 60.45 1fj4 s ILE 152 Cb -0.15 -4.02 -0.12 0.00 -1.58 0.00 0.00 42.46 36.59 1fj4 s ILE 152 CO 0.41 0.14 0.35 1.41 -1.23 0.00 0.00 174.94 176.03 1fj4 n HIS 153 N 3.78 0.00 0.00 3.97 8.25 -1.24 -4.87 115.22 125.11 1fj4 n HIS 153 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 1fj4 n HIS 153 Cb 0.47 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.52 1fj4 n HIS 153 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fj4 n GLY 154 N 1.41 1.04 3.76 -1.41 0.00 0.55 -4.62 105.19 105.92 1fj4 n GLY 154 Ca 0.01 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.36 1fj4 n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fj4 s VAL 155 N 0.84 2.50 -0.29 1.61 -7.23 -1.26 -4.85 120.40 111.72 1fj4 s VAL 155 Ca 0.00 0.37 0.02 0.00 -1.81 0.00 0.00 61.98 60.56 1fj4 s VAL 155 Cb 0.00 -3.18 0.16 0.00 0.56 0.00 0.00 36.38 33.92 1fj4 s VAL 155 CO 0.00 -0.02 0.40 0.21 -0.31 0.00 0.00 175.10 175.39 1fj4 s ASN 156 N -1.20 0.47 0.05 4.85 2.47 -1.25 -0.55 114.94 119.78 1fj4 s ASN 156 Ca 0.70 -0.43 -0.28 0.00 0.42 0.00 0.00 52.86 53.28 1fj4 s ASN 156 Cb -0.35 1.07 0.10 0.00 -1.45 0.00 0.00 41.25 40.62 1fj4 s ASN 156 CO 0.41 -0.36 1.17 -0.72 -3.72 0.00 0.00 177.10 173.88 1fj4 s TYR 157 N 2.52 -0.06 0.24 0.43 -0.85 -1.16 -4.99 117.35 113.48 1fj4 s TYR 157 Ca 0.10 -0.13 0.10 0.00 -0.52 0.00 0.00 57.07 56.62 1fj4 s TYR 157 Cb -0.12 0.59 -0.04 0.00 0.38 0.00 0.00 41.96 42.76 1fj4 s TYR 157 CO -0.30 -0.50 -0.10 -1.12 -1.52 0.00 0.00 175.55 172.01 1fj4 s SER 158 N -3.04 4.10 -0.07 -0.18 0.01 -1.26 -3.03 113.70 110.23 1fj4 s SER 158 Ca 0.15 -0.76 0.04 0.00 1.31 0.00 0.00 55.95 56.69 1fj4 s SER 158 Cb 0.02 -0.61 -0.02 0.00 0.21 0.00 0.00 66.02 65.63 1fj4 s SER 158 CO -0.01 0.05 -0.18 -0.63 0.41 0.00 0.00 173.24 172.88 1fj4 s ILE 159 N -2.16 2.73 -0.16 1.44 -1.09 -1.26 -4.96 121.20 115.74 1fj4 s ILE 159 Ca 0.28 -0.82 -0.00 0.00 -2.23 0.00 0.00 60.65 57.88 1fj4 s ILE 159 Cb -0.07 -2.06 0.04 0.00 -1.58 0.00 0.00 42.46 38.79 1fj4 s ILE 159 CO 0.16 0.57 -0.07 -0.44 -1.23 0.00 0.00 174.94 173.93 1fj4 s SER 160 N -0.33 2.79 -0.29 3.58 0.01 -1.26 -4.35 113.70 113.84 1fj4 s SER 160 Ca 0.02 -0.62 0.20 0.00 1.31 0.00 0.00 55.95 56.86 1fj4 s SER 160 Cb -0.13 -0.97 0.48 0.00 0.21 0.00 0.00 66.02 65.62 1fj4 s SER 160 CO 0.02 -0.16 1.03 -1.54 0.41 0.00 0.00 173.24 173.00 1fj4 n SER 161 N 4.85 1.45 0.00 2.44 3.41 -1.26 -4.93 113.62 119.57 1fj4 n SER 161 Ca -0.13 -2.41 0.00 0.00 -0.26 0.00 0.00 58.87 56.08 1fj4 n SER 161 Cb 0.48 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1fj4 n SER 161 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fj4 n ALA 162 N -0.31 0.00 1.56 7.33 0.00 -1.26 -1.17 120.51 126.65 1fj4 n ALA 162 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 1fj4 n ALA 162 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.26 1fj4 n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fj4 n ALA 164 N -0.47 1.94 -0.10 0.00 0.00 -0.32 -4.14 120.51 117.43 1fj4 n ALA 164 Ca 0.00 -0.37 -0.08 0.00 0.00 0.00 0.00 53.44 52.99 1fj4 n ALA 164 Cb 0.01 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 1fj4 n ALA 164 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1fj4 h THR 165 N 0.20 0.24 0.00 0.00 1.35 -1.47 -1.69 112.91 111.54 1fj4 h THR 165 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1fj4 h THR 165 Cb 0.10 0.24 -0.00 0.00 -1.73 0.00 0.00 68.15 66.76 1fj4 h THR 165 CO 0.00 0.00 -0.01 0.77 -0.25 0.00 0.00 175.52 176.03 1fj4 h SER 166 N -0.28 0.00 -0.07 5.36 4.64 -1.67 -0.56 113.55 120.97 1fj4 h SER 166 Ca 0.16 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.33 1fj4 h SER 166 Cb 0.54 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1fj4 h SER 166 CO -0.51 0.01 -0.55 0.00 -0.87 0.00 0.00 176.83 174.92 1fj4 h ALA 167 N 1.99 0.17 0.00 5.18 0.00 -1.59 -2.72 119.26 122.29 1fj4 h ALA 167 Ca -0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 54.91 54.32 1fj4 h ALA 167 Cb 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1fj4 h ALA 167 CO 0.00 0.39 -0.28 0.45 0.00 0.00 0.00 179.25 179.81 1fj4 h HIS 168 N 0.08 0.00 -0.38 0.00 -0.00 -0.92 -2.00 115.15 111.92 1fj4 h HIS 168 Ca -0.05 0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.27 1fj4 h HIS 168 Cb 1.21 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.60 1fj4 h HIS 168 CO 0.12 0.28 0.03 0.00 -0.00 0.00 0.00 177.93 178.36 1fj4 h ILE 170 N 0.48 1.27 -0.58 0.00 2.04 -1.16 -2.05 117.51 117.51 1fj4 h ILE 170 Ca 0.11 -1.31 -0.04 0.00 1.00 0.00 0.00 64.86 64.62 1fj4 h ILE 170 Cb 0.41 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 1fj4 h ILE 170 CO 0.01 0.45 0.20 1.23 0.00 0.00 0.00 178.15 180.04 1fj4 h GLY 171 N 0.74 0.92 1.37 5.37 0.00 -1.23 -1.64 103.07 108.61 1fj4 h GLY 171 Ca 0.11 -0.49 -0.14 0.00 0.00 0.00 0.00 47.33 46.80 1fj4 h GLY 171 CO 0.06 0.47 -0.39 -0.57 0.00 0.00 0.00 176.54 176.11 1fj4 h ASN 172 N 0.84 0.73 -0.70 0.19 -1.24 -0.93 -2.48 115.58 112.00 1fj4 h ASN 172 Ca 0.19 -0.33 -0.05 0.00 0.71 0.00 0.00 56.30 56.83 1fj4 h ASN 172 Cb 0.22 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 39.03 1fj4 h ASN 172 CO -0.01 1.04 0.25 0.00 -1.29 0.00 0.00 177.43 177.42 1fj4 h ALA 173 N 1.00 1.09 -0.86 1.57 0.00 -0.90 -2.11 119.26 119.05 1fj4 h ALA 173 Ca 0.05 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1fj4 h ALA 173 Cb 0.92 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1fj4 h ALA 173 CO 0.08 0.63 0.42 0.28 0.00 0.00 0.00 179.25 180.67 1fj4 h VAL 174 N 1.05 1.26 -0.16 0.00 2.07 -1.10 -2.44 116.25 116.93 1fj4 h VAL 174 Ca 0.24 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.97 1fj4 h VAL 174 Cb 0.25 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1fj4 h VAL 174 CO -0.01 0.31 -0.22 -0.33 0.02 0.00 0.00 177.57 177.33 1fj4 h GLU 175 N 1.22 0.29 -0.50 1.57 5.08 -0.97 -0.69 114.58 120.58 1fj4 h GLU 175 Ca 0.30 -0.09 -0.09 0.00 -1.00 0.00 0.00 59.36 58.47 1fj4 h GLU 175 Cb 0.10 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1fj4 h GLU 175 CO -0.04 0.50 -0.06 1.96 -1.00 0.00 0.00 179.01 180.37 1fj4 h GLN 176 N 0.26 0.87 -0.19 2.33 1.08 -0.93 0.70 115.11 119.24 1fj4 h GLN 176 Ca 0.04 -0.28 -0.16 0.00 -1.45 0.00 0.00 58.65 56.81 1fj4 h GLN 176 Cb 0.55 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 1fj4 h GLN 176 CO 0.04 0.91 -0.49 0.82 -0.95 0.00 0.00 178.83 179.16 1fj4 h ILE 177 N 0.80 1.32 -0.41 2.54 5.03 -1.15 0.11 117.51 125.74 1fj4 h ILE 177 Ca 0.14 -1.73 -0.05 0.00 -0.12 0.00 0.00 64.86 63.10 1fj4 h ILE 177 Cb 0.56 1.91 -0.02 0.00 -3.03 0.00 0.00 36.82 36.24 1fj4 h ILE 177 CO 0.03 0.54 0.05 1.56 -0.68 0.00 0.00 178.15 179.65 1fj4 h GLN 178 N 0.35 0.64 -0.00 2.37 4.20 -0.90 -0.62 115.11 121.14 1fj4 h GLN 178 Ca -0.01 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.57 1fj4 h GLN 178 Cb 1.10 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.79 1fj4 h GLN 178 CO 0.11 0.62 -0.00 1.28 -0.67 0.00 0.00 178.83 180.17 1fj4 n LEU 179 N -4.28 0.05 -0.19 1.46 4.77 0.22 -4.47 117.00 114.56 1fj4 n LEU 179 Ca 0.02 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.98 1fj4 n LEU 179 Cb 0.24 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 1fj4 n LEU 179 CO 0.39 0.01 -0.02 0.61 -1.33 0.00 0.00 177.39 177.05 1fj4 n GLY 180 N 1.03 0.48 0.08 -0.72 0.00 -0.24 -4.89 105.19 100.92 1fj4 n GLY 180 Ca 0.23 -0.14 -0.05 0.00 0.00 0.00 0.00 46.02 46.05 1fj4 n GLY 180 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fj4 h LYS 181 N 0.40 0.00 -4.50 1.61 1.57 -1.19 -3.47 116.57 110.99 1fj4 h LYS 181 Ca -0.05 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.49 1fj4 h LYS 181 Cb 0.52 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.63 1fj4 h LYS 181 CO 0.07 0.90 -0.72 -0.65 -0.57 0.00 0.00 179.45 178.48 1fj4 s GLN 182 N -2.88 0.58 -0.20 3.15 -1.52 -1.01 -4.77 119.66 113.01 1fj4 s GLN 182 Ca 0.01 -0.92 0.09 0.00 -1.95 0.00 0.00 55.36 52.60 1fj4 s GLN 182 Cb 0.10 -0.19 -0.22 0.00 -0.22 0.00 0.00 33.01 32.49 1fj4 s GLN 182 CO 0.80 0.01 0.04 -0.25 -0.25 0.00 0.00 175.29 175.64 1fj4 n ASP 183 N 1.01 1.02 -3.89 5.90 8.00 0.38 -4.19 116.55 124.78 1fj4 n ASP 183 Ca -0.20 0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.16 1fj4 n ASP 183 Cb 0.57 0.20 -0.15 0.00 -0.02 0.00 0.00 41.12 41.72 1fj4 n ASP 183 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1fj4 s ILE 184 N -2.52 0.22 -0.03 0.53 1.01 -1.03 -0.75 121.20 118.63 1fj4 s ILE 184 Ca -0.20 -0.06 -0.01 0.00 0.00 0.00 0.00 60.65 60.38 1fj4 s ILE 184 Cb 0.07 -0.23 0.03 0.00 0.01 0.00 0.00 42.46 42.35 1fj4 s ILE 184 CO 0.74 0.09 0.04 -0.69 0.00 0.00 0.00 174.94 175.12 1fj4 s VAL 185 N 0.26 -0.04 -0.25 2.92 1.01 0.52 -0.55 120.40 124.27 1fj4 s VAL 185 Ca -0.02 0.31 -0.25 0.00 0.00 0.00 0.00 61.98 62.02 1fj4 s VAL 185 Cb -0.05 -0.16 -0.00 0.00 0.00 0.00 0.00 36.38 36.17 1fj4 s VAL 185 CO -0.01 0.15 0.84 -0.36 0.00 0.00 0.00 175.10 175.72 1fj4 s PHE 186 N 1.68 3.29 0.06 5.22 0.40 -0.11 -0.97 117.98 127.56 1fj4 s PHE 186 Ca -0.01 1.11 0.08 0.00 -0.60 0.00 0.00 56.93 57.50 1fj4 s PHE 186 Cb -0.12 -3.09 -0.03 0.00 0.51 0.00 0.00 43.02 40.28 1fj4 s PHE 186 CO -0.03 -0.43 -0.22 0.00 0.70 0.00 0.00 175.22 175.24 1fj4 s ALA 187 N 2.89 1.84 0.00 5.36 0.00 -0.52 -0.61 121.76 130.71 1fj4 s ALA 187 Ca 0.35 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1fj4 s ALA 187 Cb -0.15 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.63 1fj4 s ALA 187 CO 0.08 0.41 0.00 0.41 0.00 0.00 0.00 175.76 176.66 1fj4 n GLY 188 N 1.64 -0.36 0.00 0.00 0.00 -1.06 -0.63 105.19 104.78 1fj4 n GLY 188 Ca -0.18 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.21 1fj4 n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fj4 n GLY 189 N 0.00 -1.38 3.39 -0.02 0.00 -0.71 -2.51 105.19 103.97 1fj4 n GLY 189 Ca 0.00 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 1fj4 n GLY 189 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fj4 s GLY 190 N 0.00 0.02 -0.19 -0.02 0.00 -0.78 -1.96 107.32 104.38 1fj4 s GLY 190 Ca 0.00 -0.38 -0.11 0.00 0.00 0.00 0.00 44.72 44.23 1fj4 s GLY 190 CO 0.00 -0.47 0.47 1.85 0.00 0.00 0.00 173.10 174.95 1fj4 s GLU 191 N -3.88 0.47 0.60 2.90 2.56 -0.10 -4.12 118.70 117.13 1fj4 s GLU 191 Ca 0.09 0.88 -0.10 0.00 0.00 0.00 0.00 54.97 55.84 1fj4 s GLU 191 Cb 0.01 0.03 -0.03 0.00 2.00 0.00 0.00 34.13 36.14 1fj4 s GLU 191 CO -0.05 -0.15 0.98 -1.83 -0.56 0.00 0.00 175.26 173.64 1fj4 s GLU 192 N 1.39 3.48 -0.23 4.30 -1.05 -1.26 -1.29 118.70 124.04 1fj4 s GLU 192 Ca -0.09 0.56 0.01 0.00 -0.15 0.00 0.00 54.97 55.30 1fj4 s GLU 192 Cb -0.07 -2.15 0.04 0.00 -0.44 0.00 0.00 34.13 31.51 1fj4 s GLU 192 CO -0.14 -0.54 -0.13 -1.17 0.95 0.00 0.00 175.26 174.23 1fj4 s LEU 193 N -5.09 2.93 -0.05 1.83 2.96 -1.26 -4.67 118.68 115.32 1fj4 s LEU 193 Ca 0.54 -1.01 -0.29 0.00 -0.22 0.00 0.00 54.13 53.14 1fj4 s LEU 193 Cb -0.11 -1.55 0.07 0.00 0.50 0.00 0.00 46.19 45.09 1fj4 s LEU 193 CO 0.51 -0.11 0.64 0.00 -1.32 0.00 0.00 176.35 176.08 1fj4 h TRP 195 N 3.15 0.51 -0.55 0.00 5.08 -1.96 0.20 115.95 122.38 1fj4 h TRP 195 Ca -0.27 -0.00 0.11 0.00 1.08 0.00 0.00 58.89 59.81 1fj4 h TRP 195 Cb 1.14 -0.17 -0.09 0.00 -3.00 0.00 0.00 29.16 27.04 1fj4 h TRP 195 CO 0.39 0.36 -0.01 0.93 -1.28 0.00 0.00 178.44 178.84 1fj4 h GLU 196 N 0.54 0.11 0.08 0.12 3.07 -1.95 0.17 114.58 116.72 1fj4 h GLU 196 Ca 0.14 -0.01 -0.20 0.00 -0.50 0.00 0.00 59.36 58.79 1fj4 h GLU 196 Cb 0.02 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.90 1fj4 h GLU 196 CO -0.02 0.07 -1.01 1.98 -1.40 0.00 0.00 179.01 178.63 1fj4 h MET 197 N 0.11 0.17 -0.50 2.33 4.05 -1.82 -3.38 114.93 115.89 1fj4 h MET 197 Ca 0.28 -0.30 0.11 0.00 -0.28 0.00 0.00 59.70 59.51 1fj4 h MET 197 Cb 0.44 0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.32 1fj4 h MET 197 CO -0.47 1.14 0.35 0.00 0.23 0.00 0.00 176.91 178.16 1fj4 h ALA 198 N -0.08 2.19 -0.02 0.39 0.00 -0.41 -2.04 119.26 119.28 1fj4 h ALA 198 Ca -0.22 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1fj4 h ALA 198 Cb 1.53 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1fj4 h ALA 198 CO 0.03 -0.31 -0.35 0.00 0.00 0.00 0.00 179.25 178.61 1fj4 h GLU 200 N 0.04 1.07 0.01 0.00 5.08 -1.56 0.16 114.58 119.38 1fj4 h GLU 200 Ca 0.00 -0.15 -0.22 0.00 -1.00 0.00 0.00 59.36 57.99 1fj4 h GLU 200 Cb 0.64 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1fj4 h GLU 200 CO 0.05 0.83 -0.95 0.74 -1.00 0.00 0.00 179.01 178.68 1fj4 h PHE 201 N 1.07 0.51 -0.52 4.33 -1.00 -1.60 -3.07 116.94 116.66 1fj4 h PHE 201 Ca 0.26 -0.29 -0.06 0.00 2.81 0.00 0.00 57.97 60.69 1fj4 h PHE 201 Cb 0.11 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 39.59 1fj4 h PHE 201 CO 0.01 1.11 0.09 0.22 -1.61 0.00 0.00 178.31 178.14 1fj4 h ASP 202 N 0.19 0.83 -0.14 2.17 1.82 -1.14 -0.22 116.42 119.92 1fj4 h ASP 202 Ca -0.07 -0.26 0.04 0.00 -0.39 0.00 0.00 57.03 56.35 1fj4 h ASP 202 Cb 1.59 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 41.37 1fj4 h ASP 202 CO 0.16 0.87 0.13 0.00 -1.61 0.00 0.00 179.24 178.79 1fj4 h ALA 203 N 0.99 1.87 -0.60 -0.78 0.00 -0.63 0.31 119.26 120.42 1fj4 h ALA 203 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1fj4 h ALA 203 Cb 0.39 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1fj4 h ALA 203 CO 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.05 1fj4 n MET 204 N -4.04 3.52 -1.95 0.00 -0.00 -0.85 -4.92 117.12 108.88 1fj4 n MET 204 Ca 0.01 -2.63 -0.18 0.00 -0.00 0.00 0.00 57.70 54.89 1fj4 n MET 204 Cb 0.25 -1.85 -0.04 0.00 -0.00 0.00 0.00 33.22 31.58 1fj4 n MET 204 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1fj4 n GLY 205 N 1.09 0.67 0.17 3.17 0.00 0.11 -4.90 105.19 105.50 1fj4 n GLY 205 Ca 0.24 -0.13 0.09 0.00 0.00 0.00 0.00 46.02 46.22 1fj4 n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fj4 h ALA 206 N 0.45 0.80 -2.54 4.61 0.00 -1.23 -3.47 119.26 117.88 1fj4 h ALA 206 Ca -0.41 -0.18 -0.54 0.00 0.00 0.00 0.00 54.91 53.79 1fj4 h ALA 206 Cb 1.26 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1fj4 h ALA 206 CO 0.53 0.22 -0.31 -0.51 0.00 0.00 0.00 179.25 179.19 1fj4 s LEU 207 N -6.09 4.21 0.22 0.00 1.43 -1.25 -1.44 118.68 115.76 1fj4 s LEU 207 Ca 0.04 0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 53.31 1fj4 s LEU 207 Cb 0.07 -3.23 -0.09 0.00 0.03 0.00 0.00 46.19 42.97 1fj4 s LEU 207 CO 0.72 -0.05 1.27 -0.55 0.23 0.00 0.00 176.35 177.97 1fj4 s SER 208 N -3.06 6.96 0.00 2.29 0.15 -0.78 -4.58 113.70 114.67 1fj4 s SER 208 Ca 0.39 2.39 0.00 0.00 0.70 0.00 0.00 55.95 59.43 1fj4 s SER 208 Cb -0.11 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 1fj4 s SER 208 CO 0.29 -0.46 0.06 0.35 1.20 0.00 0.00 173.24 174.67 1fj4 n THR 209 N 2.27 0.00 1.23 6.45 -2.24 -1.26 -4.29 114.28 116.44 1fj4 n THR 209 Ca 0.04 -0.16 0.13 0.00 -2.27 0.00 0.00 64.05 61.80 1fj4 n THR 209 Cb 0.43 1.25 0.29 0.00 -2.10 0.00 0.00 70.33 70.21 1fj4 n THR 209 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1fj4 n LYS 210 N -0.20 1.55 -0.77 -0.78 4.76 -1.26 -4.36 118.16 117.11 1fj4 n LYS 210 Ca 0.00 -1.09 0.06 0.00 -2.87 0.00 0.00 58.31 54.40 1fj4 n LYS 210 Cb 0.06 -1.48 0.17 0.00 -1.84 0.00 0.00 35.03 31.95 1fj4 n LYS 210 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1fj4 n TYR 211 N 0.23 0.00 0.26 2.13 4.02 -1.26 -4.79 117.16 117.75 1fj4 n TYR 211 Ca 0.14 -1.29 0.10 0.00 -0.01 0.00 0.00 57.90 56.84 1fj4 n TYR 211 Cb 0.43 -0.23 0.69 0.00 -0.02 0.00 0.00 39.34 40.21 1fj4 n TYR 211 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1fj4 h ASN 212 N 0.98 0.00 1.07 7.72 2.35 -1.92 -1.48 115.58 124.29 1fj4 h ASN 212 Ca -0.05 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.66 1fj4 h ASN 212 Cb 1.18 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.54 1fj4 h ASN 212 CO 0.02 0.08 -0.20 0.44 -1.65 0.00 0.00 177.43 176.12 1fj4 h ASP 213 N 0.00 0.00 -2.33 5.81 3.32 -1.95 -3.34 116.42 117.94 1fj4 h ASP 213 Ca -0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 1fj4 h ASP 213 Cb 0.16 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 39.32 1fj4 h ASP 213 CO 0.01 0.20 -0.91 0.35 -1.72 0.00 0.00 179.24 177.17 1fj4 n THR 214 N -3.31 -0.11 -0.31 0.35 -2.24 -0.57 -5.01 114.28 103.08 1fj4 n THR 214 Ca 0.01 -4.09 0.14 0.00 -2.27 0.00 0.00 64.05 57.84 1fj4 n THR 214 Cb 0.44 -1.90 0.30 0.00 -2.10 0.00 0.00 70.33 67.07 1fj4 n THR 214 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1fj4 h PRO 215 N 4.84 0.13 0.00 -0.78 0.11 -1.67 -1.10 132.00 133.54 1fj4 h PRO 215 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1fj4 h PRO 215 Cb 0.84 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1fj4 h PRO 215 CO 0.52 0.09 0.00 0.39 -0.21 0.00 0.00 178.00 178.79 1fj4 n GLU 216 N -5.30 0.11 0.00 1.05 1.02 -1.26 -2.44 120.64 113.82 1fj4 n GLU 216 Ca 0.22 0.20 0.06 0.00 -0.02 0.00 0.00 57.16 57.62 1fj4 n GLU 216 Cb 0.72 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.64 1fj4 n GLU 216 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1fj4 n LYS 217 N -1.38 2.02 0.01 3.49 4.76 -0.42 -4.66 118.16 121.98 1fj4 n LYS 217 Ca 0.05 -0.63 -0.12 0.00 -2.87 0.00 0.00 58.31 54.74 1fj4 n LYS 217 Cb 0.14 -1.13 -0.07 0.00 -1.84 0.00 0.00 35.03 32.13 1fj4 n LYS 217 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1fj4 h ALA 218 N 2.02 0.06 -1.76 7.82 0.00 -1.45 -3.38 119.26 122.57 1fj4 h ALA 218 Ca 0.00 -0.05 -0.58 0.00 0.00 0.00 0.00 54.91 54.28 1fj4 h ALA 218 Cb 0.39 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.08 1fj4 h ALA 218 CO 0.00 -0.39 0.79 0.45 0.00 0.00 0.00 179.25 180.10 1fj4 s SER 219 N -5.34 6.51 -0.40 0.00 0.15 -1.26 -4.73 113.70 108.63 1fj4 s SER 219 Ca -0.14 0.16 0.11 0.00 0.70 0.00 0.00 55.95 56.79 1fj4 s SER 219 Cb 0.06 -2.51 0.36 0.00 -1.71 0.00 0.00 66.02 62.23 1fj4 s SER 219 CO 0.67 -1.25 0.80 -2.11 1.20 0.00 0.00 173.24 172.56 1fj4 n ARG 220 N 7.75 1.43 -1.55 5.44 1.85 -1.26 -4.54 116.66 125.78 1fj4 n ARG 220 Ca 0.08 -3.64 -0.53 0.00 -1.00 0.00 0.00 57.85 52.76 1fj4 n ARG 220 Cb 0.49 -1.75 -0.06 0.00 -1.05 0.00 0.00 32.46 30.08 1fj4 n ARG 220 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1fj4 n THR 221 N 0.13 0.30 0.00 8.89 -1.04 -1.26 -0.79 114.28 120.50 1fj4 n THR 221 Ca 0.24 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 1fj4 n THR 221 Cb 0.64 -0.54 0.00 0.00 -1.82 0.00 0.00 70.33 68.60 1fj4 n THR 221 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1fj4 n TYR 222 N 1.87 0.00 -2.35 -1.42 0.53 -1.26 -4.69 117.16 109.83 1fj4 n TYR 222 Ca 0.18 0.00 -0.41 0.00 -1.02 0.00 0.00 57.90 56.65 1fj4 n TYR 222 Cb 0.17 -0.15 -0.03 0.00 -1.03 0.00 0.00 39.34 38.30 1fj4 n TYR 222 CO 0.00 0.00 0.00 0.34 -1.02 0.00 0.00 176.86 176.18 1fj4 s ASP 223 N -3.56 7.07 0.32 7.72 2.15 0.03 -0.17 116.67 130.22 1fj4 s ASP 223 Ca 0.00 2.31 0.17 0.00 0.43 0.00 0.00 52.55 55.46 1fj4 s ASP 223 Cb 0.00 -2.62 0.92 0.00 -0.30 0.00 0.00 42.92 40.93 1fj4 s ASP 223 CO 0.00 -0.36 1.47 0.00 -0.17 0.00 0.00 175.17 176.11 1fj4 n ALA 224 N 2.07 0.82 -1.36 3.66 0.00 -1.26 -1.90 120.51 122.54 1fj4 n ALA 224 Ca 0.03 0.16 0.05 0.00 0.00 0.00 0.00 53.44 53.68 1fj4 n ALA 224 Cb 0.44 -1.04 0.19 0.00 0.00 0.00 0.00 19.45 19.05 1fj4 n ALA 224 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1fj4 n HIS 225 N -2.14 0.31 -2.07 0.00 8.25 -1.26 -4.97 115.22 113.34 1fj4 n HIS 225 Ca -0.01 -1.32 -0.35 0.00 -0.26 0.00 0.00 57.72 55.78 1fj4 n HIS 225 Cb 0.18 -0.28 0.02 0.00 1.12 0.00 0.00 29.99 31.04 1fj4 n HIS 225 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 1fj4 s ARG 226 N -3.10 3.08 -0.27 -0.41 1.70 -0.80 -4.97 118.95 114.18 1fj4 s ARG 226 Ca 0.38 1.72 0.22 0.00 -0.47 0.00 0.00 55.73 57.58 1fj4 s ARG 226 Cb 0.35 -1.96 0.50 0.00 -0.57 0.00 0.00 34.95 33.27 1fj4 s ARG 226 CO -0.01 -1.10 1.16 -0.40 -1.08 0.00 0.00 175.30 173.88 1fj4 n ASP 227 N -1.56 1.17 0.00 -2.89 5.75 -1.25 -4.66 116.55 113.11 1fj4 n ASP 227 Ca 0.13 -2.06 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 1fj4 n ASP 227 Cb 0.50 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1fj4 n ASP 227 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fj4 n GLY 228 N -0.71 2.75 3.91 6.12 0.00 -0.84 -3.46 105.19 112.96 1fj4 n GLY 228 Ca 0.04 -2.04 -0.27 0.00 0.00 0.00 0.00 46.02 43.75 1fj4 n GLY 228 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1fj4 s PHE 229 N -2.54 3.56 -0.34 1.61 -0.12 -0.52 -3.77 117.98 115.86 1fj4 s PHE 229 Ca 0.00 0.77 -0.11 0.00 -0.05 0.00 0.00 56.93 57.54 1fj4 s PHE 229 Cb 0.00 -2.27 -0.00 0.00 -0.63 0.00 0.00 43.02 40.12 1fj4 s PHE 229 CO 0.00 -0.24 0.20 0.08 -0.05 0.00 0.00 175.22 175.21 1fj4 s VAL 230 N -2.71 4.86 0.61 -2.49 1.01 -1.26 -1.87 120.40 118.55 1fj4 s VAL 230 Ca 0.47 -0.47 -0.19 0.00 0.00 0.00 0.00 61.98 61.78 1fj4 s VAL 230 Cb -0.10 -3.55 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1fj4 s VAL 230 CO 0.44 -0.05 1.26 -0.51 0.00 0.00 0.00 175.10 176.24 1fj4 s ILE 231 N 1.64 2.32 0.22 2.22 2.07 -1.26 0.04 121.20 128.45 1fj4 s ILE 231 Ca 0.05 0.21 -0.10 0.00 -1.41 0.00 0.00 60.65 59.39 1fj4 s ILE 231 Cb -0.18 -3.09 -0.01 0.00 0.13 0.00 0.00 42.46 39.32 1fj4 s ILE 231 CO 0.08 -0.04 0.38 0.00 -1.91 0.00 0.00 174.94 173.45 1fj4 s ALA 232 N -1.47 -0.03 0.18 1.50 0.00 -0.08 -1.61 121.76 120.25 1fj4 s ALA 232 Ca 0.79 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.82 1fj4 s ALA 232 Cb -0.34 1.05 -0.05 0.00 0.00 0.00 0.00 23.12 23.78 1fj4 s ALA 232 CO 0.37 -0.76 0.00 0.20 0.00 0.00 0.00 175.76 175.57 1fj4 s GLY 233 N -3.02 1.29 0.00 0.00 0.00 -0.68 -4.17 107.32 100.74 1fj4 s GLY 233 Ca 0.23 -1.63 0.00 0.00 0.00 0.00 0.00 44.72 43.32 1fj4 s GLY 233 CO 0.06 -1.55 0.00 0.61 0.00 0.00 0.00 173.10 172.22 1fj4 n GLY 234 N -0.28 -0.14 3.42 0.20 0.00 -0.41 -4.38 105.19 103.60 1fj4 n GLY 234 Ca -0.06 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.28 1fj4 n GLY 234 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1fj4 s GLY 235 N 0.00 0.63 -0.11 -0.02 0.00 0.05 -0.92 107.32 106.96 1fj4 s GLY 235 Ca 0.00 -0.99 -0.29 0.00 0.00 0.00 0.00 44.72 43.44 1fj4 s GLY 235 CO 0.00 -0.82 0.71 -0.32 0.00 0.00 0.00 173.10 172.67 1fj4 s GLY 236 N -3.01 -0.55 -0.19 0.20 0.00 -0.83 -1.89 107.32 101.05 1fj4 s GLY 236 Ca 0.22 1.55 -0.14 0.00 0.00 0.00 0.00 44.72 46.35 1fj4 s GLY 236 CO 0.05 1.17 0.49 -0.29 0.00 0.00 0.00 173.10 174.52 1fj4 s MET 237 N -0.79 0.53 0.14 2.90 1.75 -0.27 -1.74 119.30 121.82 1fj4 s MET 237 Ca -0.08 0.79 0.08 0.00 -1.25 0.00 0.00 55.69 55.23 1fj4 s MET 237 Cb -0.01 0.16 -0.04 0.00 2.84 0.00 0.00 34.83 37.78 1fj4 s MET 237 CO 0.07 -0.11 -0.19 0.14 -0.65 0.00 0.00 175.02 174.29 1fj4 s VAL 238 N 0.82 1.76 -0.45 10.11 -7.23 0.20 -0.53 120.40 125.08 1fj4 s VAL 238 Ca -0.04 -1.80 -0.16 0.00 -1.81 0.00 0.00 61.98 58.16 1fj4 s VAL 238 Cb -0.05 -1.75 0.05 0.00 0.56 0.00 0.00 36.38 35.19 1fj4 s VAL 238 CO -0.06 -0.25 0.40 -0.69 -0.31 0.00 0.00 175.10 174.18 1fj4 s VAL 239 N -1.81 5.19 -0.25 1.32 1.01 0.04 -1.44 120.40 124.46 1fj4 s VAL 239 Ca 0.13 -0.83 -0.19 0.00 0.00 0.00 0.00 61.98 61.08 1fj4 s VAL 239 Cb -0.07 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 1fj4 s VAL 239 CO 0.06 -0.52 0.58 -0.69 0.00 0.00 0.00 175.10 174.53 1fj4 s VAL 240 N 1.80 5.03 0.02 2.92 1.01 -0.14 -1.48 120.40 129.55 1fj4 s VAL 240 Ca 0.06 1.02 0.04 0.00 0.00 0.00 0.00 61.98 63.10 1fj4 s VAL 240 Cb -0.22 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.26 1fj4 s VAL 240 CO 0.09 0.06 -0.12 -0.70 0.00 0.00 0.00 175.10 174.43 1fj4 s GLU 241 N 2.39 0.86 0.17 2.72 2.12 0.11 -0.35 118.70 126.71 1fj4 s GLU 241 Ca 0.24 -0.59 -0.31 0.00 0.36 0.00 0.00 54.97 54.67 1fj4 s GLU 241 Cb -0.16 -0.84 -0.09 0.00 0.26 0.00 0.00 34.13 33.31 1fj4 s GLU 241 CO 0.09 0.21 1.44 -2.00 -0.54 0.00 0.00 175.26 174.46 1fj4 s GLU 242 N -0.78 4.29 0.11 4.30 -6.30 0.07 -0.16 118.70 120.23 1fj4 s GLU 242 Ca 0.02 2.20 -0.21 0.00 -2.50 0.00 0.00 54.97 54.47 1fj4 s GLU 242 Cb -0.06 -3.19 -0.05 0.00 0.00 0.00 0.00 34.13 30.83 1fj4 s GLU 242 CO 0.00 -0.45 1.32 -0.11 0.02 0.00 0.00 175.26 176.04 1fj4 n LEU 243 N 3.41 -0.73 -0.27 2.70 7.94 0.21 -1.00 117.00 129.26 1fj4 n LEU 243 Ca 0.10 1.48 0.04 0.00 -1.11 0.00 0.00 56.01 56.53 1fj4 n LEU 243 Cb 0.41 -0.29 0.18 0.00 0.53 0.00 0.00 43.42 44.25 1fj4 n LEU 243 CO 0.60 -1.13 1.08 -0.33 -1.11 0.00 0.00 177.39 176.50 1fj4 h GLU 244 N 0.00 0.60 -0.36 1.96 4.39 -1.91 0.34 114.58 119.60 1fj4 h GLU 244 Ca 0.11 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.73 1fj4 h GLU 244 Cb 0.28 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1fj4 h GLU 244 CO -0.65 0.39 0.04 1.25 -1.16 0.00 0.00 179.01 178.89 1fj4 h HIS 245 N 0.61 0.64 0.55 4.33 2.76 -1.74 0.15 115.15 122.46 1fj4 h HIS 245 Ca 0.40 -0.10 -0.03 0.00 -2.20 0.00 0.00 60.37 58.45 1fj4 h HIS 245 Cb 0.49 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 29.28 1fj4 h HIS 245 CO -0.10 0.67 -0.28 0.00 -1.30 0.00 0.00 177.93 176.92 1fj4 h ALA 246 N 0.89 -0.76 -0.77 5.26 0.00 -0.14 -2.74 119.26 121.00 1fj4 h ALA 246 Ca 0.11 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 55.00 1fj4 h ALA 246 Cb 0.38 0.31 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1fj4 h ALA 246 CO 0.01 -0.93 0.31 -0.07 0.00 0.00 0.00 179.25 178.57 1fj4 h LEU 247 N -0.76 0.29 -1.34 0.00 4.07 -0.30 -1.64 115.31 115.62 1fj4 h LEU 247 Ca -0.07 0.11 0.04 0.00 0.08 0.00 0.00 57.88 58.04 1fj4 h LEU 247 Cb 0.59 0.09 -0.04 0.00 1.08 0.00 0.00 40.66 42.38 1fj4 h LEU 247 CO 0.11 0.10 0.47 0.00 -1.08 0.00 0.00 178.44 178.05 1fj4 h ALA 248 N 1.56 1.62 -0.55 1.53 0.00 -0.67 -1.41 119.26 121.34 1fj4 h ALA 248 Ca 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1fj4 h ALA 248 Cb 0.66 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1fj4 h ALA 248 CO -0.41 0.30 0.00 2.89 0.00 0.00 0.00 179.25 182.03 1fj4 n ARG 249 N -4.46 3.29 -3.61 0.00 1.85 -0.83 -4.92 116.66 107.97 1fj4 n ARG 249 Ca 0.09 -2.40 -0.20 0.00 -1.00 0.00 0.00 57.85 54.35 1fj4 n ARG 249 Cb 0.15 -1.79 0.05 0.00 -1.05 0.00 0.00 32.46 29.82 1fj4 n ARG 249 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1fj4 n GLY 250 N 1.02 -0.37 3.84 2.89 0.00 -0.53 -4.96 105.19 107.09 1fj4 n GLY 250 Ca 0.22 0.15 -0.31 0.00 0.00 0.00 0.00 46.02 46.07 1fj4 n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fj4 s ALA 251 N -3.57 2.93 -0.47 4.61 0.00 -0.68 -5.01 121.76 119.57 1fj4 s ALA 251 Ca 0.04 0.06 -0.22 0.00 0.00 0.00 0.00 51.96 51.84 1fj4 s ALA 251 Cb -0.01 -3.13 0.03 0.00 0.00 0.00 0.00 23.12 20.01 1fj4 s ALA 251 CO 0.79 -0.79 0.73 -1.58 0.00 0.00 0.00 175.76 174.91 1fj4 s HIS 252 N -2.97 2.99 -0.29 0.00 5.65 -1.26 -4.86 115.29 114.55 1fj4 s HIS 252 Ca 0.57 -0.06 -0.17 0.00 0.25 0.00 0.00 55.06 55.65 1fj4 s HIS 252 Cb -0.12 -3.60 -0.02 0.00 -1.18 0.00 0.00 32.58 27.65 1fj4 s HIS 252 CO 0.49 -1.02 0.48 0.42 -0.65 0.00 0.00 174.74 174.46 1fj4 s ILE 253 N 3.13 5.08 -0.05 0.89 1.01 -1.26 -4.17 121.20 125.83 1fj4 s ILE 253 Ca 0.25 0.63 -0.24 0.00 0.00 0.00 0.00 60.65 61.29 1fj4 s ILE 253 Cb -0.14 -3.83 -0.23 0.00 0.01 0.00 0.00 42.46 38.27 1fj4 s ILE 253 CO 0.19 0.01 1.05 1.88 0.00 0.00 0.00 174.94 178.08 1fj4 h TYR 254 N 8.19 0.25 -2.16 3.97 0.05 -1.16 -3.48 116.97 122.65 1fj4 h TYR 254 Ca -0.29 -0.13 0.30 0.00 0.05 0.00 0.00 58.73 58.66 1fj4 h TYR 254 Cb 1.14 -0.03 -0.07 0.00 1.01 0.00 0.00 36.73 38.78 1fj4 h TYR 254 CO 0.75 0.91 0.82 0.00 -1.05 0.00 0.00 178.16 179.58 1fj4 s ALA 255 N -3.24 -2.24 -0.07 3.88 0.00 -1.25 -4.71 121.76 114.13 1fj4 s ALA 255 Ca -0.16 0.01 0.02 0.00 0.00 0.00 0.00 51.96 51.83 1fj4 s ALA 255 Cb 0.01 0.81 -0.03 0.00 0.00 0.00 0.00 23.12 23.91 1fj4 s ALA 255 CO 0.74 -1.12 -0.11 -2.00 0.00 0.00 0.00 175.76 173.27 1fj4 s GLU 256 N -2.10 2.75 -0.85 0.00 2.12 0.10 -1.10 118.70 119.62 1fj4 s GLU 256 Ca 0.26 -0.63 -0.25 0.00 0.36 0.00 0.00 54.97 54.71 1fj4 s GLU 256 Cb -0.00 -2.52 0.04 0.00 0.26 0.00 0.00 34.13 31.91 1fj4 s GLU 256 CO 0.00 0.58 1.36 0.42 -0.54 0.00 0.00 175.26 177.08 1fj4 s ILE 257 N -0.60 3.80 -1.96 -3.70 -1.09 -0.71 -1.00 121.20 115.94 1fj4 s ILE 257 Ca 0.09 -0.06 0.27 0.00 -2.23 0.00 0.00 60.65 58.71 1fj4 s ILE 257 Cb -0.11 -4.96 0.36 0.00 -1.58 0.00 0.00 42.46 36.17 1fj4 s ILE 257 CO 0.02 -1.88 1.64 1.33 -1.23 0.00 0.00 174.94 174.81 1fj4 n VAL 258 N 6.60 0.00 -3.65 2.92 0.24 -0.11 -4.70 118.33 119.63 1fj4 n VAL 258 Ca 0.15 -0.16 -0.12 0.00 -2.04 0.00 0.00 64.34 62.17 1fj4 n VAL 258 Cb 0.50 0.39 -0.08 0.00 -1.47 0.00 0.00 33.84 33.18 1fj4 n VAL 258 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1fj4 s GLY 259 N -2.36 -0.51 -0.13 7.63 0.00 -1.00 -4.74 107.32 106.22 1fj4 s GLY 259 Ca 0.29 1.93 -0.04 0.00 0.00 0.00 0.00 44.72 46.90 1fj4 s GLY 259 CO 0.46 1.75 0.19 -0.47 0.00 0.00 0.00 173.10 175.03 1fj4 s TYR 260 N 0.67 -0.22 -0.05 1.90 5.04 -1.26 -0.69 117.35 122.74 1fj4 s TYR 260 Ca -0.03 0.48 0.03 0.00 -2.44 0.00 0.00 57.07 55.11 1fj4 s TYR 260 Cb -0.05 -0.29 -0.03 0.00 0.35 0.00 0.00 41.96 41.95 1fj4 s TYR 260 CO -0.04 -0.41 -0.14 0.20 -1.34 0.00 0.00 175.55 173.83 1fj4 s GLY 261 N 2.31 1.54 -0.21 8.97 0.00 0.56 -4.50 107.32 115.99 1fj4 s GLY 261 Ca 0.04 -0.97 -0.04 0.00 0.00 0.00 0.00 44.72 43.75 1fj4 s GLY 261 CO -0.08 -0.75 0.17 0.00 0.00 0.00 0.00 173.10 172.44 1fj4 s ALA 262 N -0.71 0.09 0.29 3.20 0.00 -1.26 -0.90 121.76 122.48 1fj4 s ALA 262 Ca 0.11 -0.19 0.02 0.00 0.00 0.00 0.00 51.96 51.90 1fj4 s ALA 262 Cb -0.11 -1.27 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 1fj4 s ALA 262 CO 0.01 -1.30 0.07 0.25 0.00 0.00 0.00 175.76 174.79 1fj4 n THR 263 N 5.29 0.00 -3.98 0.00 -2.24 -0.84 -4.99 114.28 107.53 1fj4 n THR 263 Ca -0.06 -1.62 -0.12 0.00 -2.27 0.00 0.00 64.05 59.98 1fj4 n THR 263 Cb 0.48 0.52 -0.13 0.00 -2.10 0.00 0.00 70.33 69.09 1fj4 n THR 263 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1fj4 s SER 264 N -2.75 0.27 -0.05 3.42 0.15 -1.26 -1.91 113.70 111.57 1fj4 s SER 264 Ca 0.11 -0.18 -0.20 0.00 0.70 0.00 0.00 55.95 56.37 1fj4 s SER 264 Cb 0.01 0.01 -0.31 0.00 -1.71 0.00 0.00 66.02 64.01 1fj4 s SER 264 CO 0.07 -0.07 0.86 0.44 1.20 0.00 0.00 173.24 175.74 1fj4 h ASP 265 N 5.64 0.50 -4.81 5.45 5.19 -0.91 -3.42 116.42 124.06 1fj4 h ASP 265 Ca -0.28 -0.94 -0.40 0.00 -0.62 0.00 0.00 57.03 54.79 1fj4 h ASP 265 Cb 1.21 -0.16 0.04 0.00 0.18 0.00 0.00 39.33 40.59 1fj4 h ASP 265 CO 0.48 1.46 -0.61 0.61 -3.12 0.00 0.00 179.24 178.06 1fj4 n GLY 266 N 1.69 -0.52 0.00 2.75 0.00 -1.26 -4.85 105.19 103.00 1fj4 n GLY 266 Ca -0.16 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1fj4 n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fj4 n ALA 267 N -3.70 1.29 -2.46 4.61 0.00 -1.26 -5.14 120.51 113.85 1fj4 n ALA 267 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.11 1fj4 n ALA 267 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 1fj4 n ALA 267 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fj4 s ASP 268 N 1.00 3.59 0.45 0.00 1.01 -1.26 -5.11 116.67 116.36 1fj4 s ASP 268 Ca 0.00 -0.96 -0.01 0.00 0.71 0.00 0.00 52.55 52.29 1fj4 s ASP 268 Cb 0.00 -0.32 -0.01 0.00 1.01 0.00 0.00 42.92 43.61 1fj4 s ASP 268 CO 0.00 0.06 0.69 -0.04 0.21 0.00 0.00 175.17 176.09 1fj4 s MET 269 N -3.26 3.15 0.00 8.23 -1.94 -1.26 -3.98 119.30 120.24 1fj4 s MET 269 Ca 0.27 -0.36 0.00 0.00 -1.71 0.00 0.00 55.69 53.90 1fj4 s MET 269 Cb -0.06 -2.53 0.00 0.00 2.01 0.00 0.00 34.83 34.25 1fj4 s MET 269 CO 0.14 -0.25 0.00 1.33 -0.01 0.00 0.00 175.02 176.22 1fj4 n VAL 270 N -2.11 0.00 -3.71 -6.03 0.24 -1.26 -4.82 118.33 100.64 1fj4 n VAL 270 Ca 0.01 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.16 1fj4 n VAL 270 Cb 0.57 -0.27 -0.15 0.00 -1.47 0.00 0.00 33.84 32.53 1fj4 n VAL 270 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fj4 s ALA 271 N -0.50 -0.30 0.44 2.33 0.00 -1.26 -5.04 121.76 117.43 1fj4 s ALA 271 Ca 0.00 0.71 -0.22 0.00 0.00 0.00 0.00 51.96 52.45 1fj4 s ALA 271 Cb 0.00 -0.68 -0.09 0.00 0.00 0.00 0.00 23.12 22.36 1fj4 s ALA 271 CO 0.00 -0.37 1.04 -1.25 0.00 0.00 0.00 175.76 175.18 1fj4 s PRO 272 N 1.74 4.00 -0.06 0.00 0.04 -1.26 -4.26 135.00 135.19 1fj4 s PRO 272 Ca -0.04 1.43 0.17 0.00 0.04 0.00 0.00 61.00 62.60 1fj4 s PRO 272 Cb -0.12 -2.32 -0.22 0.00 0.04 0.00 0.00 34.50 31.89 1fj4 s PRO 272 CO -0.07 -0.27 0.49 -1.13 0.04 0.00 0.00 177.00 176.07 1fj4 n SER 273 N -0.51 0.45 0.00 6.66 3.41 -1.26 -4.99 113.62 117.38 1fj4 n SER 273 Ca 0.07 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.88 1fj4 n SER 273 Cb 0.51 0.67 0.00 0.00 -0.26 0.00 0.00 64.21 65.13 1fj4 n SER 273 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fj4 n GLY 274 N 1.52 2.42 0.29 5.00 0.00 -1.26 -4.76 105.19 108.40 1fj4 n GLY 274 Ca -0.18 -0.50 0.04 0.00 0.00 0.00 0.00 46.02 45.39 1fj4 n GLY 274 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1fj4 h GLU 275 N 0.00 0.56 -0.51 1.61 4.22 -1.94 1.00 114.58 119.52 1fj4 h GLU 275 Ca 0.00 -0.03 -0.05 0.00 0.08 0.00 0.00 59.36 59.35 1fj4 h GLU 275 Cb 0.00 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1fj4 h GLU 275 CO 0.00 0.37 0.11 0.78 -2.18 0.00 0.00 179.01 178.09 1fj4 h GLY 276 N 0.58 0.84 1.57 1.92 0.00 -1.86 -2.36 103.07 103.76 1fj4 h GLY 276 Ca 0.41 -0.49 -0.16 0.00 0.00 0.00 0.00 47.33 47.09 1fj4 h GLY 276 CO -0.34 0.46 -0.61 0.00 0.00 0.00 0.00 176.54 176.05 1fj4 h ALA 277 N 1.36 0.70 -0.24 3.60 0.00 -1.43 -1.45 119.26 121.81 1fj4 h ALA 277 Ca 0.16 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1fj4 h ALA 277 Cb 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1fj4 h ALA 277 CO 0.00 0.71 0.08 0.28 0.00 0.00 0.00 179.25 180.33 1fj4 h VAL 278 N 0.33 1.18 -0.55 0.00 2.07 -0.68 -2.12 116.25 116.49 1fj4 h VAL 278 Ca -0.01 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 66.90 1fj4 h VAL 278 Cb 1.15 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1fj4 h VAL 278 CO 0.11 0.19 0.18 0.03 0.02 0.00 0.00 177.57 178.09 1fj4 h ARG 279 N 0.22 0.84 -0.61 1.57 3.08 -1.39 -2.54 114.38 115.56 1fj4 h ARG 279 Ca 0.08 -0.18 0.07 0.00 0.07 0.00 0.00 59.98 60.03 1fj4 h ARG 279 Cb 0.21 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.08 1fj4 h ARG 279 CO -0.00 0.76 0.28 0.00 -1.07 0.00 0.00 179.97 179.94 1fj4 h MET 281 N 0.51 0.12 -0.88 0.00 2.86 -1.30 -2.53 114.93 113.71 1fj4 h MET 281 Ca 0.29 -0.06 0.08 0.00 -2.06 0.00 0.00 59.70 57.95 1fj4 h MET 281 Cb 0.28 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 31.88 1fj4 h MET 281 CO -0.24 0.57 0.57 0.87 1.06 0.00 0.00 176.91 179.74 1fj4 h LYS 282 N -0.32 0.90 -0.04 1.72 1.57 -1.29 0.31 116.57 119.41 1fj4 h LYS 282 Ca 0.01 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 1fj4 h LYS 282 Cb 0.55 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1fj4 h LYS 282 CO 0.01 0.60 -0.21 1.98 -0.57 0.00 0.00 179.45 181.26 1fj4 h MET 283 N 0.93 0.07 0.00 3.15 4.05 -0.75 0.11 114.93 122.49 1fj4 h MET 283 Ca 0.40 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.80 1fj4 h MET 283 Cb 0.32 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 1fj4 h MET 283 CO -0.16 0.28 -0.57 0.00 0.23 0.00 0.00 176.91 176.69 1fj4 n ALA 284 N -2.49 3.07 0.09 0.39 0.00 -0.01 -3.63 120.51 117.92 1fj4 n ALA 284 Ca -0.02 -0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.26 1fj4 n ALA 284 Cb 0.28 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 1fj4 n ALA 284 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1fj4 n MET 285 N -1.91 0.61 -1.68 0.00 2.00 0.87 -4.28 117.12 112.73 1fj4 n MET 285 Ca 0.04 0.09 -0.45 0.00 0.00 0.00 0.00 57.70 57.39 1fj4 n MET 285 Cb 0.41 -1.79 -0.04 0.00 0.00 0.00 0.00 33.22 31.80 1fj4 n MET 285 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 175.97 177.55 1fj4 n HIS 286 N -2.64 2.39 0.00 2.03 -0.00 0.26 -0.98 115.22 116.28 1fj4 n HIS 286 Ca -0.01 0.25 0.00 0.00 0.46 0.00 0.00 57.72 58.42 1fj4 n HIS 286 Cb 0.58 -2.56 0.00 0.00 -0.12 0.00 0.00 29.99 27.89 1fj4 n HIS 286 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1fj4 n GLY 287 N 3.22 2.73 3.52 1.57 0.00 -1.26 -4.93 105.19 110.03 1fj4 n GLY 287 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1fj4 n GLY 287 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fj4 s VAL 288 N -2.53 4.59 -0.54 1.61 1.01 -0.16 -4.91 120.40 119.47 1fj4 s VAL 288 Ca 0.00 0.20 0.26 0.00 0.00 0.00 0.00 61.98 62.43 1fj4 s VAL 288 Cb 0.00 -4.40 0.30 0.00 0.00 0.00 0.00 36.38 32.28 1fj4 s VAL 288 CO 0.00 -0.89 1.75 -2.24 0.00 0.00 0.00 175.10 173.72 1fj4 h ASP 289 N 9.11 0.00 -3.16 3.32 3.04 -1.94 -3.45 116.42 123.35 1fj4 h ASP 289 Ca -0.26 0.00 -0.57 0.00 -3.24 0.00 0.00 57.03 52.96 1fj4 h ASP 289 Cb 1.08 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.34 1fj4 h ASP 289 CO 1.01 0.00 -0.29 0.42 -2.04 0.00 0.00 179.24 178.34 1fj4 s THR 290 N -3.22 5.15 0.68 1.15 -4.23 -1.26 -5.09 115.64 108.81 1fj4 s THR 290 Ca 0.08 0.03 -0.11 0.00 -1.18 0.00 0.00 61.69 60.50 1fj4 s THR 290 Cb 0.10 -3.64 -0.00 0.00 1.34 0.00 0.00 72.50 70.30 1fj4 s THR 290 CO 0.56 -0.00 1.06 -2.16 -0.54 0.00 0.00 174.62 173.53 1fj4 s PRO 291 N -2.77 3.11 -0.25 3.99 0.04 -1.26 -4.99 135.00 132.87 1fj4 s PRO 291 Ca 0.41 0.73 -0.28 0.00 0.04 0.00 0.00 61.00 61.90 1fj4 s PRO 291 Cb -0.12 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.40 1fj4 s PRO 291 CO 0.25 -0.92 1.00 0.42 0.04 0.00 0.00 177.00 177.79 1fj4 s ILE 292 N -3.18 4.68 0.03 0.56 -1.09 -1.26 -4.46 121.20 116.48 1fj4 s ILE 292 Ca 0.57 1.89 -0.04 0.00 -2.23 0.00 0.00 60.65 60.84 1fj4 s ILE 292 Cb -0.12 -4.29 -0.28 0.00 -1.58 0.00 0.00 42.46 36.19 1fj4 s ILE 292 CO 0.54 -0.21 0.97 0.44 -1.23 0.00 0.00 174.94 175.45 1fj4 h ASP 293 N 7.60 0.42 -3.93 3.58 3.32 -0.73 -3.41 116.42 123.27 1fj4 h ASP 293 Ca -0.20 -0.52 -0.19 0.00 0.02 0.00 0.00 57.03 56.14 1fj4 h ASP 293 Cb 1.07 -0.14 -0.26 0.00 0.22 0.00 0.00 39.33 40.22 1fj4 h ASP 293 CO 0.97 1.42 -0.57 -0.47 -1.72 0.00 0.00 179.24 178.88 1fj4 s TYR 294 N -2.63 -0.11 -0.22 4.55 5.04 -1.19 -3.12 117.35 119.67 1fj4 s TYR 294 Ca -0.07 0.27 0.01 0.00 -2.44 0.00 0.00 57.07 54.84 1fj4 s TYR 294 Cb 0.07 0.03 0.05 0.00 0.35 0.00 0.00 41.96 42.46 1fj4 s TYR 294 CO 0.87 -0.09 -0.10 -1.17 -1.34 0.00 0.00 175.55 173.72 1fj4 s LEU 295 N -0.12 2.64 -0.67 6.97 0.20 0.52 -0.59 118.68 127.63 1fj4 s LEU 295 Ca -0.02 -1.07 -0.22 0.00 0.69 0.00 0.00 54.13 53.51 1fj4 s LEU 295 Cb -0.02 -1.32 0.08 0.00 -0.43 0.00 0.00 46.19 44.50 1fj4 s LEU 295 CO 0.00 -0.17 0.95 0.21 -0.29 0.00 0.00 176.35 177.05 1fj4 s ASN 296 N 1.31 6.21 0.79 3.68 3.84 0.11 -2.85 114.94 128.04 1fj4 s ASN 296 Ca -0.04 -1.12 -0.11 0.00 0.21 0.00 0.00 52.86 51.80 1fj4 s ASN 296 Cb -0.18 -2.40 0.07 0.00 -0.55 0.00 0.00 41.25 38.19 1fj4 s ASN 296 CO -0.07 -1.38 1.09 -0.94 -2.79 0.00 0.00 177.10 173.01 1fj4 s SER 297 N 3.68 4.43 0.31 -4.21 1.04 -1.17 -1.78 113.70 116.01 1fj4 s SER 297 Ca 0.22 1.64 0.13 0.00 0.48 0.00 0.00 55.95 58.41 1fj4 s SER 297 Cb -0.17 -2.37 0.49 0.00 0.10 0.00 0.00 66.02 64.07 1fj4 s SER 297 CO 0.08 -2.05 1.67 -0.74 0.98 0.00 0.00 173.24 173.18 1fj4 h HIS 298 N -1.14 0.00 -0.69 5.02 2.76 -1.92 -3.44 115.15 115.73 1fj4 h HIS 298 Ca -0.45 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.72 1fj4 h HIS 298 Cb 1.24 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.20 1fj4 h HIS 298 CO 0.54 0.52 0.00 0.41 -1.30 0.00 0.00 177.93 178.10 1fj4 n GLY 299 N 0.17 0.00 0.06 5.26 0.00 -1.26 -4.82 105.19 104.59 1fj4 n GLY 299 Ca -0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.14 1fj4 n GLY 299 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fj4 n THR 300 N 0.05 0.36 -1.62 2.61 -2.24 -1.26 -4.53 114.28 107.64 1fj4 n THR 300 Ca 0.00 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1fj4 n THR 300 Cb 0.00 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 67.64 1fj4 n THR 300 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1fj4 n SER 301 N -1.90 -1.13 -4.65 3.42 2.88 -1.26 -3.83 113.62 107.15 1fj4 n SER 301 Ca 0.06 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.26 1fj4 n SER 301 Cb 0.37 -0.44 -0.10 0.00 -0.75 0.00 0.00 64.21 63.29 1fj4 n SER 301 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1fj4 s THR 302 N -2.00 4.08 0.18 2.46 -4.23 -1.26 -1.98 115.64 112.88 1fj4 s THR 302 Ca 0.00 -0.38 -0.26 0.00 -1.18 0.00 0.00 61.69 59.87 1fj4 s THR 302 Cb 0.00 -2.71 0.04 0.00 1.34 0.00 0.00 72.50 71.16 1fj4 s THR 302 CO 0.00 0.57 1.55 -0.65 -0.54 0.00 0.00 174.62 175.55 1fj4 h PRO 303 N 5.07 -0.10 0.19 3.99 0.11 -1.95 -2.40 132.00 136.90 1fj4 h PRO 303 Ca -0.50 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1fj4 h PRO 303 Cb 1.18 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1fj4 h PRO 303 CO 0.54 -0.07 -0.09 0.28 -0.21 0.00 0.00 178.00 178.45 1fj4 h VAL 304 N -0.11 0.44 -0.63 3.15 2.07 -1.99 -3.34 116.25 115.84 1fj4 h VAL 304 Ca 0.20 -1.03 0.08 0.00 0.82 0.00 0.00 66.70 66.78 1fj4 h VAL 304 Cb 0.52 0.77 -0.10 0.00 -1.52 0.00 0.00 31.29 30.95 1fj4 h VAL 304 CO -0.85 0.13 -0.50 1.23 0.02 0.00 0.00 177.57 177.60 1fj4 h GLY 305 N -1.00 -0.67 -0.45 2.17 0.00 -1.96 -0.27 103.07 100.90 1fj4 h GLY 305 Ca -0.03 0.65 0.07 0.00 0.00 0.00 0.00 47.33 48.03 1fj4 h GLY 305 CO 0.04 -0.11 -0.47 -0.55 0.00 0.00 0.00 176.54 175.44 1fj4 h ASP 306 N -0.23 -1.61 -0.54 0.19 5.19 -1.61 -2.03 116.42 115.78 1fj4 h ASP 306 Ca 0.15 0.24 -0.02 0.00 -0.62 0.00 0.00 57.03 56.79 1fj4 h ASP 306 Cb 0.55 0.70 -0.03 0.00 0.18 0.00 0.00 39.33 40.74 1fj4 h ASP 306 CO -0.72 -0.36 0.28 0.58 -3.12 0.00 0.00 179.24 175.90 1fj4 h VAL 307 N -0.29 1.19 -0.54 -1.35 2.07 -1.61 -2.79 116.25 112.93 1fj4 h VAL 307 Ca 0.14 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 1fj4 h VAL 307 Cb 0.57 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1fj4 h VAL 307 CO -0.65 0.21 0.33 0.50 0.02 0.00 0.00 177.57 177.98 1fj4 h LYS 308 N 0.73 0.72 -0.05 1.57 1.63 -0.46 -2.26 116.57 118.44 1fj4 h LYS 308 Ca 0.19 -0.06 -0.21 0.00 -0.85 0.00 0.00 60.65 59.72 1fj4 h LYS 308 Cb 0.08 -0.16 0.01 0.00 -0.60 0.00 0.00 32.23 31.57 1fj4 h LYS 308 CO -0.03 0.50 -0.80 1.49 -3.45 0.00 0.00 179.45 177.17 1fj4 h GLU 309 N 0.74 0.63 -0.82 1.90 4.81 -1.28 -2.71 114.58 117.84 1fj4 h GLU 309 Ca 0.20 -0.61 0.03 0.00 -0.13 0.00 0.00 59.36 58.84 1fj4 h GLU 309 Cb -0.04 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1fj4 h GLU 309 CO -0.04 1.22 0.54 -0.07 -0.73 0.00 0.00 179.01 179.93 1fj4 h LEU 310 N 0.27 0.90 -0.28 1.64 3.38 -1.21 0.41 115.31 120.40 1fj4 h LEU 310 Ca -0.08 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1fj4 h LEU 310 Cb 1.46 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1fj4 h LEU 310 CO 0.16 0.63 0.07 0.00 0.09 0.00 0.00 178.44 179.39 1fj4 h ALA 311 N 1.51 0.37 -0.82 1.53 0.00 -1.41 0.22 119.26 120.66 1fj4 h ALA 311 Ca 0.32 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1fj4 h ALA 311 Cb -0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1fj4 h ALA 311 CO -0.09 0.03 0.42 0.00 0.00 0.00 0.00 179.25 179.61 1fj4 h ALA 312 N 0.90 1.20 0.02 0.00 0.00 -0.97 -0.53 119.26 119.88 1fj4 h ALA 312 Ca 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1fj4 h ALA 312 Cb 0.28 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1fj4 h ALA 312 CO 0.00 0.63 -0.01 0.82 0.00 0.00 0.00 179.25 180.69 1fj4 h ILE 313 N 1.16 1.08 -0.21 0.00 2.04 0.14 -1.00 117.51 120.72 1fj4 h ILE 313 Ca 0.29 -0.32 0.06 0.00 1.00 0.00 0.00 64.86 65.88 1fj4 h ILE 313 Cb 0.07 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 1fj4 h ILE 313 CO -0.04 0.08 -0.22 0.03 0.00 0.00 0.00 178.15 178.00 1fj4 h ARG 314 N -0.17 -0.23 -0.50 2.37 3.08 -0.08 -1.73 114.38 117.12 1fj4 h ARG 314 Ca -0.00 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.14 1fj4 h ARG 314 Cb 0.16 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.20 1fj4 h ARG 314 CO 0.01 -0.15 0.14 1.49 -1.07 0.00 0.00 179.97 180.38 1fj4 h GLU 315 N -0.24 0.28 -0.77 0.04 4.81 -0.86 0.38 114.58 118.23 1fj4 h GLU 315 Ca 0.13 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1fj4 h GLU 315 Cb 0.43 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.72 1fj4 h GLU 315 CO -0.35 0.18 0.29 0.28 -0.73 0.00 0.00 179.01 178.68 1fj4 h VAL 316 N 0.29 1.26 0.00 0.32 2.07 -0.63 -3.28 116.25 116.28 1fj4 h VAL 316 Ca 0.25 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.92 1fj4 h VAL 316 Cb 0.30 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1fj4 h VAL 316 CO -0.29 0.34 -1.30 0.49 0.02 0.00 0.00 177.57 176.83 1fj4 n PHE 317 N -4.29 0.09 0.00 1.57 3.01 -0.70 -5.03 117.46 112.11 1fj4 n PHE 317 Ca 0.07 0.03 0.00 0.00 1.01 0.00 0.00 57.45 58.55 1fj4 n PHE 317 Cb 0.20 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.37 1fj4 n PHE 317 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1fj4 n GLY 318 N 1.38 4.15 1.85 1.37 0.00 0.13 -2.11 105.19 111.97 1fj4 n GLY 318 Ca 0.01 0.15 0.01 0.00 0.00 0.00 0.00 46.02 46.19 1fj4 n GLY 318 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fj4 n ASP 319 N 9.18 5.09 -3.23 1.61 10.43 -1.26 -4.41 116.55 133.95 1fj4 n ASP 319 Ca 0.00 -2.97 -0.25 0.00 2.57 0.00 0.00 54.79 54.14 1fj4 n ASP 319 Cb 0.00 -0.70 -0.08 0.00 1.84 0.00 0.00 41.12 42.18 1fj4 n ASP 319 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1fj4 n LYS 320 N 0.29 0.63 -3.13 -1.24 4.81 -0.90 -5.12 118.16 113.50 1fj4 n LYS 320 Ca 0.31 -3.23 -0.37 0.00 -0.87 0.00 0.00 58.31 54.15 1fj4 n LYS 320 Cb 1.21 -1.31 -0.06 0.00 0.02 0.00 0.00 35.03 34.89 1fj4 n LYS 320 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1fj4 s SER 321 N -0.95 7.10 0.77 3.14 1.04 -1.26 -4.78 113.70 118.75 1fj4 s SER 321 Ca 0.35 1.40 -0.10 0.00 0.48 0.00 0.00 55.95 58.07 1fj4 s SER 321 Cb 0.14 -2.41 0.07 0.00 0.10 0.00 0.00 66.02 63.93 1fj4 s SER 321 CO -0.13 0.11 1.12 -2.16 0.98 0.00 0.00 173.24 173.17 1fj4 s PRO 322 N -1.68 2.05 0.27 4.02 0.04 -1.26 -4.92 135.00 133.52 1fj4 s PRO 322 Ca 0.39 -0.01 -0.29 0.00 0.04 0.00 0.00 61.00 61.12 1fj4 s PRO 322 Cb -0.18 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 1fj4 s PRO 322 CO 0.21 -1.47 1.26 0.00 0.04 0.00 0.00 177.00 177.04 1fj4 s ALA 323 N -3.47 3.49 0.08 8.56 0.00 -1.18 -4.54 121.76 124.69 1fj4 s ALA 323 Ca 0.61 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.75 1fj4 s ALA 323 Cb -0.11 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 1fj4 s ALA 323 CO 0.48 -0.49 -0.18 0.42 0.00 0.00 0.00 175.76 175.99 1fj4 s ILE 324 N -0.66 1.45 -0.27 0.00 1.01 -0.30 -0.35 121.20 122.08 1fj4 s ILE 324 Ca 0.51 -1.36 -0.24 0.00 0.00 0.00 0.00 60.65 59.56 1fj4 s ILE 324 Cb -0.37 -1.33 0.07 0.00 0.01 0.00 0.00 42.46 40.85 1fj4 s ILE 324 CO 0.44 -0.07 0.71 -0.94 0.00 0.00 0.00 174.94 175.09 1fj4 s SER 325 N -1.67 -0.76 -0.48 3.58 1.04 -1.13 0.66 113.70 114.94 1fj4 s SER 325 Ca 0.03 1.45 -0.08 0.00 0.48 0.00 0.00 55.95 57.83 1fj4 s SER 325 Cb -0.10 1.45 0.12 0.00 0.10 0.00 0.00 66.02 67.60 1fj4 s SER 325 CO 0.03 -0.25 0.34 0.00 0.98 0.00 0.00 173.24 174.34 1fj4 s ALA 326 N 0.50 3.38 -1.68 5.32 0.00 -1.26 -3.03 121.76 124.99 1fj4 s ALA 326 Ca -0.01 -2.59 0.12 0.00 0.00 0.00 0.00 51.96 49.49 1fj4 s ALA 326 Cb -0.05 -2.78 0.66 0.00 0.00 0.00 0.00 23.12 20.96 1fj4 s ALA 326 CO -0.01 -1.91 1.24 0.25 0.00 0.00 0.00 175.76 175.33 1fj4 n THR 327 N 4.79 0.39 0.20 0.00 -2.24 -1.26 -2.51 114.28 113.65 1fj4 n THR 327 Ca -0.06 0.10 0.07 0.00 -2.27 0.00 0.00 64.05 61.89 1fj4 n THR 327 Cb 0.41 -0.90 0.36 0.00 -2.10 0.00 0.00 70.33 68.09 1fj4 n THR 327 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1fj4 h LYS 328 N 0.00 0.00 0.00 -0.78 1.57 -1.83 -0.75 116.57 114.79 1fj4 h LYS 328 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fj4 h LYS 328 Cb 0.06 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1fj4 h LYS 328 CO 0.00 0.33 -0.02 0.00 -0.57 0.00 0.00 179.45 179.18 1fj4 h ALA 329 N 1.67 1.15 0.00 3.86 0.00 -1.73 0.24 119.26 124.45 1fj4 h ALA 329 Ca -0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.61 1fj4 h ALA 329 Cb 0.88 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 1fj4 h ALA 329 CO 0.04 0.03 -1.78 -1.33 0.00 0.00 0.00 179.25 176.21 1fj4 n MET 330 N -3.32 0.56 0.03 0.00 2.81 -0.83 -4.62 117.12 111.74 1fj4 n MET 330 Ca -0.02 0.32 -0.05 0.00 -1.81 0.00 0.00 57.70 56.14 1fj4 n MET 330 Cb 0.14 -1.54 -0.10 0.00 -0.71 0.00 0.00 33.22 31.01 1fj4 n MET 330 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1fj4 h THR 331 N -1.00 0.92 0.00 2.03 1.35 -1.10 0.67 112.91 115.78 1fj4 h THR 331 Ca -0.41 -2.60 0.00 0.00 -0.55 0.00 0.00 66.41 62.85 1fj4 h THR 331 Cb 1.32 2.40 0.00 0.00 -1.73 0.00 0.00 68.15 70.13 1fj4 h THR 331 CO -0.25 0.53 0.00 0.61 -0.25 0.00 0.00 175.52 176.16 1fj4 n GLY 332 N 1.44 0.08 3.32 5.82 0.00 0.82 -4.71 105.19 111.96 1fj4 n GLY 332 Ca -0.10 -1.95 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 1fj4 n GLY 332 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1fj4 s HIS 333 N -1.20 3.30 -1.13 1.61 2.46 0.11 -4.66 115.29 115.77 1fj4 s HIS 333 Ca 0.00 -1.28 0.03 0.00 0.47 0.00 0.00 55.06 54.28 1fj4 s HIS 333 Cb 0.00 -3.19 0.15 0.00 -0.13 0.00 0.00 32.58 29.41 1fj4 s HIS 333 CO 0.00 -0.86 0.82 -1.13 -2.47 0.00 0.00 174.74 171.10 1fj4 n SER 334 N 5.08 1.62 0.00 9.88 3.41 -1.26 -0.90 113.62 131.44 1fj4 n SER 334 Ca -0.11 -2.13 0.00 0.00 -0.26 0.00 0.00 58.87 56.36 1fj4 n SER 334 Cb 0.43 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1fj4 n SER 334 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1fj4 n LEU 335 N 0.07 0.00 0.30 1.04 4.77 -1.26 -1.91 117.00 120.01 1fj4 n LEU 335 Ca 0.05 0.00 0.19 0.00 -0.03 0.00 0.00 56.01 56.22 1fj4 n LEU 335 Cb 0.35 0.00 0.96 0.00 -2.33 0.00 0.00 43.42 42.40 1fj4 n LEU 335 CO 0.05 0.00 1.09 1.23 -1.33 0.00 0.00 177.39 178.43 1fj4 h GLY 336 N 0.00 0.00 0.82 -0.72 0.00 -1.85 -2.29 103.07 99.02 1fj4 h GLY 336 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1fj4 h GLY 336 CO 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 176.54 175.87 1fj4 n ALA 337 N -2.14 3.62 -0.25 3.60 0.00 -0.80 -2.10 120.51 122.44 1fj4 n ALA 337 Ca -0.02 -0.38 0.02 0.00 0.00 0.00 0.00 53.44 53.06 1fj4 n ALA 337 Cb 0.17 -1.05 0.14 0.00 0.00 0.00 0.00 19.45 18.71 1fj4 n ALA 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fj4 h ALA 338 N 2.87 0.98 0.07 0.00 0.00 -1.53 -1.95 119.26 119.71 1fj4 h ALA 338 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1fj4 h ALA 338 Cb 0.57 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1fj4 h ALA 338 CO 0.00 -0.06 -0.13 0.78 0.00 0.00 0.00 179.25 179.84 1fj4 h GLY 339 N 0.59 -0.22 1.17 0.00 0.00 -1.76 -0.95 103.07 101.91 1fj4 h GLY 339 Ca 0.35 0.15 -0.21 0.00 0.00 0.00 0.00 47.33 47.62 1fj4 h GLY 339 CO -0.28 -0.13 -0.69 -0.24 0.00 0.00 0.00 176.54 175.20 1fj4 h VAL 340 N -0.26 1.27 -0.74 4.60 3.04 -1.72 -2.26 116.25 120.19 1fj4 h VAL 340 Ca 0.02 -1.88 0.00 0.00 -1.01 0.00 0.00 66.70 63.84 1fj4 h VAL 340 Cb 0.28 1.84 -0.04 0.00 -2.01 0.00 0.00 31.29 31.36 1fj4 h VAL 340 CO -0.08 0.60 0.47 1.56 -1.01 0.00 0.00 177.57 179.12 1fj4 h GLN 341 N 0.60 0.99 0.00 4.17 4.20 -1.31 -1.18 115.11 122.58 1fj4 h GLN 341 Ca -0.03 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.53 1fj4 h GLN 341 Cb 1.32 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.87 1fj4 h GLN 341 CO 0.15 0.67 -0.38 0.93 -0.67 0.00 0.00 178.83 179.53 1fj4 h GLU 342 N 1.01 0.00 -0.28 1.46 5.08 -1.19 -1.73 114.58 118.93 1fj4 h GLU 342 Ca 0.27 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.49 1fj4 h GLU 342 Cb -0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1fj4 h GLU 342 CO -0.05 0.38 -0.40 0.00 -1.00 0.00 0.00 179.01 177.93 1fj4 h ALA 343 N 1.62 0.77 -0.41 3.43 0.00 -0.88 -1.62 119.26 122.17 1fj4 h ALA 343 Ca -0.00 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 1fj4 h ALA 343 Cb 1.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1fj4 h ALA 343 CO 0.05 0.66 -0.21 0.82 0.00 0.00 0.00 179.25 180.56 1fj4 h ILE 344 N 0.55 1.27 -0.60 0.00 2.04 -0.87 0.14 117.51 120.04 1fj4 h ILE 344 Ca 0.05 -1.33 -0.09 0.00 1.00 0.00 0.00 64.86 64.49 1fj4 h ILE 344 Cb 0.93 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 1fj4 h ILE 344 CO 0.08 0.45 0.02 1.88 0.00 0.00 0.00 178.15 180.59 1fj4 h TYR 345 N 0.71 1.13 -0.64 1.37 0.05 -1.11 0.56 116.97 119.04 1fj4 h TYR 345 Ca 0.10 -0.19 -0.07 0.00 0.05 0.00 0.00 58.73 58.62 1fj4 h TYR 345 Cb 0.73 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 38.15 1fj4 h TYR 345 CO 0.04 0.99 0.13 0.77 -1.05 0.00 0.00 178.16 179.04 1fj4 h SER 346 N 0.94 1.00 -0.49 3.88 0.02 -1.05 -1.12 113.55 116.73 1fj4 h SER 346 Ca 0.17 -0.25 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1fj4 h SER 346 Cb 0.53 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.78 1fj4 h SER 346 CO 0.03 0.99 0.07 -0.07 -1.14 0.00 0.00 176.83 176.71 1fj4 h LEU 347 N 0.96 0.83 -0.72 5.07 4.07 -0.33 -1.11 115.31 124.08 1fj4 h LEU 347 Ca 0.20 -0.18 -0.13 0.00 0.08 0.00 0.00 57.88 57.85 1fj4 h LEU 347 Cb 0.40 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.91 1fj4 h LEU 347 CO 0.01 0.85 -0.41 -0.07 -1.08 0.00 0.00 178.44 177.74 1fj4 h LEU 348 N 0.83 0.54 -0.57 1.67 3.38 -0.53 -0.94 115.31 119.68 1fj4 h LEU 348 Ca 0.17 -0.24 -0.16 0.00 0.09 0.00 0.00 57.88 57.75 1fj4 h LEU 348 Cb 0.39 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1fj4 h LEU 348 CO 0.01 0.88 -0.61 0.24 0.09 0.00 0.00 178.44 179.05 1fj4 h MET 349 N 0.42 0.36 -0.30 1.13 2.86 -0.88 -1.29 114.93 117.23 1fj4 h MET 349 Ca 0.04 -0.25 -0.12 0.00 -2.06 0.00 0.00 59.70 57.31 1fj4 h MET 349 Cb 0.89 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 1fj4 h MET 349 CO 0.08 0.86 -0.27 1.25 1.06 0.00 0.00 176.91 179.89 1fj4 h LEU 350 N 0.27 0.75 -0.31 1.22 6.46 -1.04 -1.07 115.31 121.60 1fj4 h LEU 350 Ca -0.01 -0.46 -0.16 0.00 -0.12 0.00 0.00 57.88 57.13 1fj4 h LEU 350 Cb 1.14 -0.21 -0.00 0.00 -0.73 0.00 0.00 40.66 40.85 1fj4 h LEU 350 CO 0.10 1.06 -0.44 -0.33 -0.62 0.00 0.00 178.44 178.21 1fj4 h GLU 351 N 0.46 0.84 -0.09 1.25 4.39 -1.09 -3.31 114.58 117.03 1fj4 h GLU 351 Ca 0.05 -0.49 0.00 0.00 0.34 0.00 0.00 59.36 59.26 1fj4 h GLU 351 Cb 0.83 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.53 1fj4 h GLU 351 CO 0.07 1.13 0.00 0.72 -1.16 0.00 0.00 179.01 179.77 1fj4 n HIS 352 N -4.10 0.08 -2.88 4.33 8.25 -0.49 -5.03 115.22 115.38 1fj4 n HIS 352 Ca -0.04 -0.04 -0.02 0.00 -0.26 0.00 0.00 57.72 57.37 1fj4 n HIS 352 Cb 0.57 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.68 1fj4 n HIS 352 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fj4 n GLY 353 N 1.36 -1.18 3.55 -1.41 0.00 -0.45 -4.92 105.19 102.13 1fj4 n GLY 353 Ca 0.15 0.57 -0.08 0.00 0.00 0.00 0.00 46.02 46.66 1fj4 n GLY 353 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1fj4 s PHE 354 N -2.89 -0.28 -0.20 1.61 -0.12 -0.90 -1.84 117.98 113.36 1fj4 s PHE 354 Ca 0.05 0.26 -0.03 0.00 -0.05 0.00 0.00 56.93 57.16 1fj4 s PHE 354 Cb -0.01 0.51 -0.01 0.00 -0.63 0.00 0.00 43.02 42.88 1fj4 s PHE 354 CO 0.69 -0.40 -0.08 0.42 -0.05 0.00 0.00 175.22 175.80 1fj4 s ILE 355 N -2.46 3.17 0.40 -4.49 1.01 0.95 -4.56 121.20 115.22 1fj4 s ILE 355 Ca 0.05 -0.57 -0.25 0.00 0.00 0.00 0.00 60.65 59.88 1fj4 s ILE 355 Cb -0.01 -2.41 -0.08 0.00 0.01 0.00 0.00 42.46 39.96 1fj4 s ILE 355 CO -0.06 0.46 1.18 0.00 0.00 0.00 0.00 174.94 176.52 1fj4 s ALA 356 N 1.25 3.16 0.53 9.38 0.00 -1.26 -2.31 121.76 132.50 1fj4 s ALA 356 Ca 0.03 0.98 -0.17 0.00 0.00 0.00 0.00 51.96 52.80 1fj4 s ALA 356 Cb -0.14 -3.39 -0.07 0.00 0.00 0.00 0.00 23.12 19.52 1fj4 s ALA 356 CO -0.03 -0.54 1.01 -1.25 0.00 0.00 0.00 175.76 174.94 1fj4 s PRO 357 N -2.30 3.78 -0.66 0.00 0.04 -1.26 -4.77 135.00 129.83 1fj4 s PRO 357 Ca 0.57 1.08 -0.17 0.00 0.04 0.00 0.00 61.00 62.53 1fj4 s PRO 357 Cb -0.31 -2.11 0.15 0.00 0.04 0.00 0.00 34.50 32.27 1fj4 s PRO 357 CO 0.39 -0.42 0.68 0.45 0.04 0.00 0.00 177.00 178.14 1fj4 s SER 358 N -2.79 6.37 0.70 6.66 0.15 0.20 -4.67 113.70 120.32 1fj4 s SER 358 Ca 0.61 -1.94 -0.09 0.00 0.70 0.00 0.00 55.95 55.24 1fj4 s SER 358 Cb -0.12 -2.25 0.04 0.00 -1.71 0.00 0.00 66.02 61.97 1fj4 s SER 358 CO 0.30 -0.88 1.04 0.27 1.20 0.00 0.00 173.24 175.17 1fj4 s ILE 359 N 1.64 2.90 -0.81 6.45 -4.36 -1.26 -4.41 121.20 121.35 1fj4 s ILE 359 Ca 0.12 0.07 0.00 0.00 -0.26 0.00 0.00 60.65 60.57 1fj4 s ILE 359 Cb -0.21 -3.25 0.00 0.00 1.25 0.00 0.00 42.46 40.25 1fj4 s ILE 359 CO -0.00 -0.29 0.00 0.59 0.24 0.00 0.00 174.94 175.48 1fj4 n ASN 360 N -2.95 -4.43 -4.46 4.36 3.02 -1.26 -4.52 115.26 105.02 1fj4 n ASN 360 Ca 0.07 0.19 -0.44 0.00 -0.03 0.00 0.00 54.58 54.37 1fj4 n ASN 360 Cb 0.59 -2.60 0.00 0.00 -0.61 0.00 0.00 39.78 37.16 1fj4 n ASN 360 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1fj4 n ILE 361 N -2.61 4.16 0.14 2.41 5.41 -1.26 -4.70 119.36 122.91 1fj4 n ILE 361 Ca -0.08 -4.53 -0.00 0.00 1.00 0.00 0.00 62.75 59.14 1fj4 n ILE 361 Cb 0.34 -2.43 0.17 0.00 -0.71 0.00 0.00 39.64 37.01 1fj4 n ILE 361 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1fj4 h GLU 362 N 7.18 0.00 0.00 0.38 5.08 -1.94 -3.42 114.58 121.86 1fj4 h GLU 362 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1fj4 h GLU 362 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1fj4 h GLU 362 CO 1.33 0.60 -0.12 0.39 -1.00 0.00 0.00 179.01 180.21 1fj4 n GLU 363 N -3.70 0.06 0.00 2.33 1.02 -1.26 -5.05 120.64 114.04 1fj4 n GLU 363 Ca -0.01 0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1fj4 n GLU 363 Cb 0.63 -0.43 0.00 0.00 -0.02 0.00 0.00 31.44 31.62 1fj4 n GLU 363 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1fj4 n LEU 364 N -3.17 0.00 -4.72 -4.62 -0.00 -1.26 -4.87 117.00 98.37 1fj4 n LEU 364 Ca -0.02 0.00 -0.42 0.00 -0.00 0.00 0.00 56.01 55.58 1fj4 n LEU 364 Cb 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.48 1fj4 n LEU 364 CO 0.02 0.00 0.96 -0.67 -0.00 0.00 0.00 177.39 177.71 1fj4 n ASP 365 N 0.00 3.01 0.13 1.96 2.03 0.76 -4.60 116.55 119.84 1fj4 n ASP 365 Ca 0.00 1.20 0.18 0.00 0.52 0.00 0.00 54.79 56.69 1fj4 n ASP 365 Cb 0.00 -1.52 0.77 0.00 -0.72 0.00 0.00 41.12 39.64 1fj4 n ASP 365 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1fj4 h GLU 366 N 2.58 0.00 -0.62 -0.67 4.11 -1.96 -0.86 114.58 117.16 1fj4 h GLU 366 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 1fj4 h GLU 366 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1fj4 h GLU 366 CO 0.62 0.00 0.00 1.04 0.07 0.00 0.00 179.01 180.74 1fj4 n GLN 367 N -3.94 1.55 0.00 1.06 6.02 -1.26 -2.60 117.38 118.20 1fj4 n GLN 367 Ca 0.05 -0.53 0.00 0.00 -0.01 0.00 0.00 57.00 56.51 1fj4 n GLN 367 Cb 0.46 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.29 1fj4 n GLN 367 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fj4 n ALA 368 N 0.03 1.75 -0.58 -1.58 0.00 -0.33 -4.81 120.51 114.99 1fj4 n ALA 368 Ca 0.05 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1fj4 n ALA 368 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.75 1fj4 n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fj4 n ALA 369 N -0.10 0.00 1.35 0.00 0.00 -1.07 -2.30 120.51 118.39 1fj4 n ALA 369 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1fj4 n ALA 369 Cb 0.14 0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.72 1fj4 n ALA 369 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fj4 n GLY 370 N -0.67 -0.03 3.92 0.00 0.00 -1.26 -4.86 105.19 102.28 1fj4 n GLY 370 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1fj4 n GLY 370 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fj4 s LEU 371 N -0.61 3.97 -1.10 0.99 1.43 -0.97 -5.02 118.68 117.36 1fj4 s LEU 371 Ca 0.00 0.66 -0.04 0.00 -1.03 0.00 0.00 54.13 53.72 1fj4 s LEU 371 Cb 0.00 -3.51 0.29 0.00 0.03 0.00 0.00 46.19 42.99 1fj4 s LEU 371 CO 0.00 -0.29 1.62 -3.20 0.23 0.00 0.00 176.35 174.70 1fj4 n ASN 372 N -1.45 6.46 -4.63 2.29 4.05 -1.26 -4.97 115.26 115.74 1fj4 n ASN 372 Ca -0.02 -3.41 -0.42 0.00 0.45 0.00 0.00 54.58 51.17 1fj4 n ASN 372 Cb 0.55 -1.28 -0.03 0.00 1.23 0.00 0.00 39.78 40.24 1fj4 n ASN 372 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 1fj4 s ILE 373 N -2.60 4.65 -0.02 -1.44 -0.00 -1.26 -1.15 121.20 119.39 1fj4 s ILE 373 Ca 0.34 1.52 -0.30 0.00 -0.00 0.00 0.00 60.65 62.21 1fj4 s ILE 373 Cb 0.08 -4.29 -0.06 0.00 -0.00 0.00 0.00 42.46 38.19 1fj4 s ILE 373 CO 0.06 -0.36 1.49 -0.69 -0.00 0.00 0.00 174.94 175.44 1fj4 s VAL 374 N 3.31 3.63 -1.04 8.37 1.01 0.21 -4.90 120.40 131.00 1fj4 s VAL 374 Ca 0.40 0.94 0.11 0.00 0.00 0.00 0.00 61.98 63.42 1fj4 s VAL 374 Cb -0.13 -3.61 0.24 0.00 0.00 0.00 0.00 36.38 32.88 1fj4 s VAL 374 CO 0.13 -0.03 1.14 0.35 0.00 0.00 0.00 175.10 176.69 1fj4 n THR 375 N 4.96 0.73 -3.85 3.92 -2.24 -1.26 0.60 114.28 117.14 1fj4 n THR 375 Ca 0.15 -0.86 -0.12 0.00 -2.27 0.00 0.00 64.05 60.94 1fj4 n THR 375 Cb 0.43 0.70 -0.14 0.00 -2.10 0.00 0.00 70.33 69.22 1fj4 n THR 375 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1fj4 s GLU 376 N -0.98 0.04 0.19 -0.78 8.01 -1.26 -4.58 118.70 119.34 1fj4 s GLU 376 Ca 0.20 0.06 -0.33 0.00 0.01 0.00 0.00 54.97 54.91 1fj4 s GLU 376 Cb 0.11 0.00 -0.14 0.00 -4.31 0.00 0.00 34.13 29.79 1fj4 s GLU 376 CO 0.15 -0.02 1.47 2.41 0.01 0.00 0.00 175.26 179.29 1fj4 n THR 377 N 3.13 0.43 -3.77 3.63 -1.04 -1.26 -4.52 114.28 110.88 1fj4 n THR 377 Ca -0.13 -0.11 -0.14 0.00 -2.04 0.00 0.00 64.05 61.63 1fj4 n THR 377 Cb 0.59 -1.43 -0.15 0.00 -1.82 0.00 0.00 70.33 67.53 1fj4 n THR 377 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1fj4 s THR 378 N 0.43 -0.05 0.19 12.58 -1.32 -0.98 -4.98 115.64 121.51 1fj4 s THR 378 Ca 0.75 0.17 -0.30 0.00 -1.21 0.00 0.00 61.69 61.09 1fj4 s THR 378 Cb -0.70 -0.17 -0.08 0.00 -1.51 0.00 0.00 72.50 70.04 1fj4 s THR 378 CO 0.44 0.07 1.17 -1.81 -2.21 0.00 0.00 174.62 172.28 1fj4 s ASP 379 N 0.97 7.13 -0.30 8.08 1.01 -1.26 -0.03 116.67 132.27 1fj4 s ASP 379 Ca -0.08 2.21 -0.16 0.00 0.71 0.00 0.00 52.55 55.23 1fj4 s ASP 379 Cb -0.10 -2.61 0.17 0.00 1.01 0.00 0.00 42.92 41.39 1fj4 s ASP 379 CO -0.04 -0.33 1.07 -0.60 0.21 0.00 0.00 175.17 175.48 1fj4 s ARG 380 N -0.34 0.24 -0.27 8.23 3.52 -0.76 -4.89 118.95 124.67 1fj4 s ARG 380 Ca 0.52 0.50 -0.28 0.00 -0.13 0.00 0.00 55.73 56.33 1fj4 s ARG 380 Cb -0.32 0.17 -0.04 0.00 -1.56 0.00 0.00 34.95 33.20 1fj4 s ARG 380 CO 0.37 -0.06 2.07 -2.00 -0.81 0.00 0.00 175.30 174.87 1fj4 s GLU 381 N 1.72 3.17 0.12 5.12 2.12 -1.26 -3.08 118.70 126.60 1fj4 s GLU 381 Ca -0.06 1.79 0.02 0.00 0.36 0.00 0.00 54.97 57.09 1fj4 s GLU 381 Cb -0.04 -4.32 -0.04 0.00 0.26 0.00 0.00 34.13 30.00 1fj4 s GLU 381 CO -0.15 -2.06 0.20 -0.51 -0.54 0.00 0.00 175.26 172.20 1fj4 s LEU 382 N 7.94 4.14 0.00 2.70 1.43 -1.26 -5.03 118.68 128.60 1fj4 s LEU 382 Ca 0.93 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 1fj4 s LEU 382 Cb -0.29 -2.74 0.00 0.00 0.03 0.00 0.00 46.19 43.19 1fj4 s LEU 382 CO 0.34 0.11 0.00 0.41 0.23 0.00 0.00 176.35 177.44 1fj4 n THR 383 N -0.12 0.00 -4.14 5.49 -1.04 -1.26 -4.90 114.28 108.30 1fj4 n THR 383 Ca -0.07 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.69 1fj4 n THR 383 Cb 0.53 -0.60 -0.17 0.00 -1.82 0.00 0.00 70.33 68.27 1fj4 n THR 383 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1fj4 s THR 384 N -1.78 0.97 0.09 12.58 2.01 -1.26 -1.35 115.64 126.89 1fj4 s THR 384 Ca 0.00 -0.31 0.08 0.00 0.31 0.00 0.00 61.69 61.77 1fj4 s THR 384 Cb 0.00 -0.96 -0.03 0.00 0.01 0.00 0.00 72.50 71.51 1fj4 s THR 384 CO 0.00 0.34 -0.21 0.68 -0.69 0.00 0.00 174.62 174.74 1fj4 s VAL 385 N 1.30 1.71 -0.02 3.82 -7.23 -0.03 0.09 120.40 120.04 1fj4 s VAL 385 Ca -0.03 -1.46 0.06 0.00 -1.81 0.00 0.00 61.98 58.74 1fj4 s VAL 385 Cb -0.14 -1.54 -0.01 0.00 0.56 0.00 0.00 36.38 35.25 1fj4 s VAL 385 CO -0.03 0.01 -0.20 -0.32 -0.31 0.00 0.00 175.10 174.25 1fj4 s MET 386 N -1.72 1.70 -0.09 4.82 -2.45 0.24 -0.79 119.30 121.01 1fj4 s MET 386 Ca 0.07 -0.72 0.02 0.00 -1.25 0.00 0.00 55.69 53.80 1fj4 s MET 386 Cb -0.10 -1.61 0.02 0.00 1.25 0.00 0.00 34.83 34.38 1fj4 s MET 386 CO 0.04 0.42 -0.13 0.45 1.05 0.00 0.00 175.02 176.85 1fj4 s SER 387 N -0.41 2.11 -0.03 1.11 0.15 0.10 0.08 113.70 116.81 1fj4 s SER 387 Ca 0.06 -0.35 -0.02 0.00 0.70 0.00 0.00 55.95 56.34 1fj4 s SER 387 Cb -0.08 -0.93 -0.04 0.00 -1.71 0.00 0.00 66.02 63.26 1fj4 s SER 387 CO -0.00 -0.00 0.10 0.20 1.20 0.00 0.00 173.24 174.74 1fj4 s ASN 388 N 0.98 5.87 -0.08 5.45 0.01 -0.73 -1.50 114.94 124.93 1fj4 s ASN 388 Ca -0.08 0.23 -0.03 0.00 -0.71 0.00 0.00 52.86 52.27 1fj4 s ASN 388 Cb -0.15 -1.75 0.04 0.00 0.41 0.00 0.00 41.25 39.81 1fj4 s ASN 388 CO -0.00 0.30 0.16 -0.44 -1.51 0.00 0.00 177.10 175.61 1fj4 s SER 389 N -1.59 0.26 0.13 -1.22 0.01 -0.33 -3.47 113.70 107.49 1fj4 s SER 389 Ca 0.22 0.35 0.05 0.00 1.31 0.00 0.00 55.95 57.87 1fj4 s SER 389 Cb -0.12 0.27 -0.04 0.00 0.21 0.00 0.00 66.02 66.34 1fj4 s SER 389 CO 0.12 -0.19 -0.11 -0.36 0.41 0.00 0.00 173.24 173.11 1fj4 s PHE 390 N 1.71 1.24 0.13 2.43 0.08 -1.26 -0.49 117.98 121.82 1fj4 s PHE 390 Ca -0.04 -0.70 -0.12 0.00 0.12 0.00 0.00 56.93 56.20 1fj4 s PHE 390 Cb -0.12 -0.64 0.01 0.00 -0.57 0.00 0.00 43.02 41.70 1fj4 s PHE 390 CO -0.06 0.07 0.31 0.20 -0.10 0.00 0.00 175.22 175.64 1fj4 s GLY 391 N -2.87 0.09 0.43 4.36 0.00 -0.62 -3.78 107.32 104.93 1fj4 s GLY 391 Ca 0.13 -0.51 -0.23 0.00 0.00 0.00 0.00 44.72 44.11 1fj4 s GLY 391 CO 0.01 -0.62 0.89 0.69 0.00 0.00 0.00 173.10 174.07 1fj4 n PHE 392 N -0.18 0.74 -0.11 1.90 3.72 -1.26 -2.64 117.46 119.63 1fj4 n PHE 392 Ca -0.12 0.56 0.00 0.00 -0.05 0.00 0.00 57.45 57.84 1fj4 n PHE 392 Cb 0.63 -2.16 0.00 0.00 -0.94 0.00 0.00 39.48 37.01 1fj4 n PHE 392 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fj4 n GLY 393 N 1.34 0.74 2.68 1.37 0.00 -1.26 -4.38 105.19 105.68 1fj4 n GLY 393 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 1fj4 n GLY 393 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fj4 n GLY 394 N -2.05 0.04 3.53 -0.02 0.00 -1.11 -4.70 105.19 100.88 1fj4 n GLY 394 Ca 0.00 -0.13 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 1fj4 n GLY 394 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1fj4 s THR 395 N -3.19 4.52 0.07 2.61 -1.32 -1.08 -0.25 115.64 116.99 1fj4 s THR 395 Ca 0.28 -0.11 0.09 0.00 -1.21 0.00 0.00 61.69 60.73 1fj4 s THR 395 Cb -0.12 -3.08 -0.03 0.00 -1.51 0.00 0.00 72.50 67.76 1fj4 s THR 395 CO 0.43 0.39 -0.24 0.20 -2.21 0.00 0.00 174.62 173.19 1fj4 s ASN 396 N 1.08 2.88 0.01 8.08 0.01 -0.80 -1.60 114.94 124.60 1fj4 s ASN 396 Ca 0.04 -0.61 -0.01 0.00 -0.71 0.00 0.00 52.86 51.57 1fj4 s ASN 396 Cb -0.14 -0.23 -0.01 0.00 0.41 0.00 0.00 41.25 41.28 1fj4 s ASN 396 CO 0.03 0.18 0.00 0.00 -1.51 0.00 0.00 177.10 175.81 1fj4 s ALA 397 N -0.90 0.02 -0.07 0.60 0.00 0.36 -1.99 121.76 119.78 1fj4 s ALA 397 Ca 0.10 -0.27 -0.05 0.00 0.00 0.00 0.00 51.96 51.75 1fj4 s ALA 397 Cb -0.10 0.06 0.03 0.00 0.00 0.00 0.00 23.12 23.12 1fj4 s ALA 397 CO 0.03 -0.09 0.18 0.99 0.00 0.00 0.00 175.76 176.87 1fj4 s THR 398 N -0.78 -0.03 -0.06 0.00 2.01 -0.08 -1.18 115.64 115.53 1fj4 s THR 398 Ca -0.09 0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.06 1fj4 s THR 398 Cb -0.05 -0.28 -0.00 0.00 0.01 0.00 0.00 72.50 72.18 1fj4 s THR 398 CO -0.00 0.04 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.01 1fj4 s LEU 399 N 0.75 1.94 -0.16 4.42 1.43 -0.56 -0.33 118.68 126.17 1fj4 s LEU 399 Ca -0.05 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 1fj4 s LEU 399 Cb -0.07 -1.10 0.02 0.00 0.03 0.00 0.00 46.19 45.07 1fj4 s LEU 399 CO -0.04 0.16 -0.21 -0.69 0.23 0.00 0.00 176.35 175.80 1fj4 s VAL 400 N 0.11 2.04 -0.06 -1.59 1.01 0.13 -0.73 120.40 121.31 1fj4 s VAL 400 Ca -0.07 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.01 1fj4 s VAL 400 Cb -0.13 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 1fj4 s VAL 400 CO 0.04 0.54 -0.19 -0.04 0.00 0.00 0.00 175.10 175.45 1fj4 s MET 401 N 1.08 2.56 0.03 2.72 -1.94 0.03 -0.94 119.30 122.84 1fj4 s MET 401 Ca -0.01 -0.79 0.03 0.00 -1.71 0.00 0.00 55.69 53.22 1fj4 s MET 401 Cb -0.14 -2.29 -0.02 0.00 2.01 0.00 0.00 34.83 34.39 1fj4 s MET 401 CO -0.08 0.50 -0.10 0.50 -0.01 0.00 0.00 175.02 175.83 1fj4 s ARG 402 N -0.42 0.67 0.88 2.03 3.52 -0.17 -0.85 118.95 124.60 1fj4 s ARG 402 Ca 0.05 -0.59 -0.11 0.00 -0.13 0.00 0.00 55.73 54.94 1fj4 s ARG 402 Cb -0.12 -0.59 0.12 0.00 -1.56 0.00 0.00 34.95 32.80 1fj4 s ARG 402 CO 0.02 0.14 1.10 0.15 -0.81 0.00 0.00 175.30 175.90 1fj4 s LYS 403 N -0.98 1.38 0.00 5.12 1.02 -0.46 0.01 119.74 125.83 1fj4 s LYS 403 Ca -0.02 1.19 0.23 0.00 0.02 0.00 0.00 55.97 57.39 1fj4 s LYS 403 Cb -0.07 -1.79 0.18 0.00 -0.52 0.00 0.00 37.83 35.63 1fj4 s LYS 403 CO 0.01 -2.27 1.23 1.28 -0.92 0.00 0.00 175.35 174.68