#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v3f s SER 2 N 0.00 -0.16 0.61 1.61 0.15 -1.26 -5.14 113.70 109.52 1v3f s SER 2 Ca 0.00 0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.88 1v3f s SER 2 Cb 0.00 0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 1v3f s SER 2 CO 0.00 -0.11 0.00 -1.20 1.20 0.00 0.00 173.24 173.13 1v3f n SER 3 N 1.07 -7.67 -4.75 5.45 7.64 -1.26 -4.43 113.62 109.67 1v3f n SER 3 Ca -0.07 1.43 -0.38 0.00 1.01 0.00 0.00 58.87 60.87 1v3f n SER 3 Cb 0.58 -4.87 0.04 0.00 -1.01 0.00 0.00 64.21 58.96 1v3f n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v3f s GLY 4 N -7.19 2.87 -0.54 0.23 0.00 -1.26 -3.81 107.32 97.61 1v3f s GLY 4 Ca 0.00 1.27 -0.23 0.00 0.00 0.00 0.00 44.72 45.76 1v3f s GLY 4 CO 0.00 1.75 0.64 -1.14 0.00 0.00 0.00 173.10 174.36 1v3f n SER 5 N -1.25 -6.14 -0.09 1.64 3.41 -1.26 -4.95 113.62 104.98 1v3f n SER 5 Ca 0.12 -0.15 -0.16 0.00 -0.26 0.00 0.00 58.87 58.42 1v3f n SER 5 Cb 0.46 -2.84 -0.07 0.00 -0.26 0.00 0.00 64.21 61.50 1v3f n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1v3f n SER 6 N -0.82 1.98 -0.23 4.04 2.88 -1.25 -4.62 113.62 115.61 1v3f n SER 6 Ca -0.08 0.07 -0.01 0.00 -1.33 0.00 0.00 58.87 57.51 1v3f n SER 6 Cb 0.62 -0.40 0.05 0.00 -0.75 0.00 0.00 64.21 63.73 1v3f n SER 6 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1v3f h GLY 7 N 0.33 0.29 -1.02 0.46 0.00 -1.91 0.92 103.07 102.13 1v3f h GLY 7 Ca -0.42 0.30 0.43 0.00 0.00 0.00 0.00 47.33 47.64 1v3f h GLY 7 CO -0.17 -0.25 1.02 1.41 0.00 0.00 0.00 176.54 178.55 1v3f h LEU 8 N -0.06 0.09 -0.55 3.11 3.38 -1.99 1.35 115.31 120.65 1v3f h LEU 8 Ca 0.30 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.35 1v3f h LEU 8 Cb 0.52 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 1v3f h LEU 8 CO -0.70 -0.03 0.29 -0.74 0.09 0.00 0.00 178.44 177.35 1v3f h HIS 9 N 0.06 0.54 0.00 1.13 2.76 0.62 0.23 115.15 120.49 1v3f h HIS 9 Ca 0.74 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.93 1v3f h HIS 9 Cb 2.75 -0.16 -0.00 0.00 1.55 0.00 0.00 27.41 31.55 1v3f h HIS 9 CO -0.00 0.26 -0.02 0.07 -1.30 0.00 0.00 177.93 176.94 1v3f h ARG 10 N 0.56 0.00 0.19 5.26 -0.00 0.18 -1.31 114.38 119.26 1v3f h ARG 10 Ca 0.24 0.00 -0.30 0.00 -0.00 0.00 0.00 59.98 59.93 1v3f h ARG 10 Cb 0.14 0.00 0.02 0.00 -0.00 0.00 0.00 29.97 30.13 1v3f h ARG 10 CO -0.16 0.02 -1.38 0.82 -0.00 0.00 0.00 179.97 179.27 1v3f h ILE 11 N 0.00 1.22 -0.62 0.08 2.04 -0.44 -3.20 117.51 116.59 1v3f h ILE 11 Ca -0.00 -2.57 -0.00 0.00 1.00 0.00 0.00 64.86 63.28 1v3f h ILE 11 Cb 0.21 2.97 -0.03 0.00 -0.74 0.00 0.00 36.82 39.23 1v3f h ILE 11 CO 0.00 0.78 0.38 0.58 0.00 0.00 0.00 178.15 179.90 1v3f h VAL 12 N -0.05 1.18 -0.22 1.67 2.07 0.00 -0.98 116.25 119.92 1v3f h VAL 12 Ca -0.26 -0.38 0.06 0.00 0.82 0.00 0.00 66.70 66.94 1v3f h VAL 12 Cb 1.97 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.99 1v3f h VAL 12 CO 0.19 0.18 -0.21 0.44 0.02 0.00 0.00 177.57 178.20 1v3f h ASP 13 N 0.84 -0.66 -0.15 0.57 5.19 -1.37 0.49 116.42 121.33 1v3f h ASP 13 Ca 0.22 0.12 0.04 0.00 -0.62 0.00 0.00 57.03 56.80 1v3f h ASP 13 Cb -0.04 0.32 -0.04 0.00 0.18 0.00 0.00 39.33 39.75 1v3f h ASP 13 CO -0.04 -0.25 -0.09 0.50 -3.12 0.00 0.00 179.24 176.24 1v3f h LYS 14 N -0.22 -0.08 -0.88 3.56 3.64 -1.45 -1.50 116.57 119.64 1v3f h LYS 14 Ca 0.13 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.62 1v3f h LYS 14 Cb 0.41 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.17 1v3f h LYS 14 CO -0.35 -0.06 0.52 0.52 -2.27 0.00 0.00 179.45 177.81 1v3f h MET 15 N -0.09 0.81 -0.73 1.90 2.86 -0.11 0.15 114.93 119.72 1v3f h MET 15 Ca 0.09 -0.05 0.16 0.00 -2.06 0.00 0.00 59.70 57.84 1v3f h MET 15 Cb 0.22 -0.18 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 1v3f h MET 15 CO -0.21 0.53 0.50 0.45 1.06 0.00 0.00 176.91 179.25 1v3f h HIS 16 N 0.83 0.36 -4.12 -0.22 3.86 0.99 -3.26 115.15 113.60 1v3f h HIS 16 Ca 0.43 0.01 -0.48 0.00 -1.16 0.00 0.00 60.37 59.17 1v3f h HIS 16 Cb 0.43 -0.11 0.14 0.00 1.06 0.00 0.00 27.41 28.93 1v3f h HIS 16 CO -0.05 0.13 0.27 0.34 0.86 0.00 0.00 177.93 179.48 1v3f s ASP 17 N -5.95 3.68 -0.05 2.45 -1.08 0.51 -4.98 116.67 111.25 1v3f s ASP 17 Ca -0.07 1.43 0.04 0.00 -0.52 0.00 0.00 52.55 53.42 1v3f s ASP 17 Cb 0.21 -2.12 -0.06 0.00 -1.46 0.00 0.00 42.92 39.50 1v3f s ASP 17 CO 0.76 -2.50 0.00 1.07 0.52 0.00 0.00 175.17 175.03 1v3f n THR 18 N -3.79 0.34 0.11 1.71 5.66 -1.26 -3.55 114.28 113.51 1v3f n THR 18 Ca 0.07 -0.19 -0.08 0.00 -3.05 0.00 0.00 64.05 60.79 1v3f n THR 18 Cb 0.56 -0.84 -0.05 0.00 -1.55 0.00 0.00 70.33 68.45 1v3f n THR 18 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1v3f h SER 19 N 0.00 -0.31 0.13 1.09 0.02 -1.92 -3.36 113.55 109.19 1v3f h SER 19 Ca -0.13 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1v3f h SER 19 Cb 1.29 0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.91 1v3f h SER 19 CO 0.00 0.17 -1.29 0.35 -1.14 0.00 0.00 176.83 174.92 1v3f n THR 20 N -5.02 0.05 -1.10 -2.27 -2.24 -1.26 -4.96 114.28 97.48 1v3f n THR 20 Ca -0.06 -0.22 -0.05 0.00 -2.27 0.00 0.00 64.05 61.46 1v3f n THR 20 Cb 0.20 0.47 0.03 0.00 -2.10 0.00 0.00 70.33 68.93 1v3f n THR 20 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v3f n GLY 21 N 1.39 -1.28 3.01 3.38 0.00 -1.14 -4.85 105.19 105.70 1v3f n GLY 21 Ca 0.01 -1.66 -0.25 0.00 0.00 0.00 0.00 46.02 44.12 1v3f n GLY 21 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1v3f n ILE 22 N -2.33 0.00 -3.29 -0.61 3.06 -1.23 -4.71 119.36 110.25 1v3f n ILE 22 Ca 0.03 -0.45 -0.09 0.00 -2.50 0.00 0.00 62.75 59.74 1v3f n ILE 22 Cb 0.09 -1.24 -0.05 0.00 0.54 0.00 0.00 39.64 38.98 1v3f n ILE 22 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1v3f s ARG 23 N -5.15 0.66 0.09 9.51 0.52 -1.26 -4.57 118.95 118.75 1v3f s ARG 23 Ca 0.61 -0.44 -0.30 0.00 -0.52 0.00 0.00 55.73 55.07 1v3f s ARG 23 Cb -0.06 -0.35 -0.06 0.00 0.52 0.00 0.00 34.95 35.00 1v3f s ARG 23 CO 0.46 -1.16 1.15 -1.25 0.02 0.00 0.00 175.30 174.52 1v3f s PRO 24 N 1.81 4.49 0.24 3.54 0.04 -1.26 -4.84 135.00 139.01 1v3f s PRO 24 Ca 0.15 1.73 0.10 0.00 0.04 0.00 0.00 61.00 63.02 1v3f s PRO 24 Cb -0.11 -3.33 -0.05 0.00 0.04 0.00 0.00 34.50 31.05 1v3f s PRO 24 CO -0.10 -0.14 -0.18 -1.54 0.04 0.00 0.00 177.00 175.08 1v3f s SER 25 N 0.69 3.14 0.64 6.66 1.04 0.57 -4.57 113.70 121.88 1v3f s SER 25 Ca 0.55 -1.00 -0.13 0.00 0.48 0.00 0.00 55.95 55.85 1v3f s SER 25 Cb -0.29 -0.23 -0.01 0.00 0.10 0.00 0.00 66.02 65.59 1v3f s SER 25 CO 0.31 -0.04 1.05 -2.16 0.98 0.00 0.00 173.24 173.39 1v3f s PRO 26 N -3.45 3.15 -0.30 4.02 0.04 -1.25 -4.32 135.00 132.88 1v3f s PRO 26 Ca 0.26 1.06 -0.14 0.00 0.04 0.00 0.00 61.00 62.21 1v3f s PRO 26 Cb -0.04 -2.01 0.18 0.00 0.04 0.00 0.00 34.50 32.67 1v3f s PRO 26 CO 0.11 -0.94 1.13 1.21 0.04 0.00 0.00 177.00 178.56 1v3f s ASN 27 N -3.35 -0.16 0.39 6.66 2.47 -1.24 -4.97 114.94 114.73 1v3f s ASN 27 Ca 0.60 0.00 -0.26 0.00 0.42 0.00 0.00 52.86 53.63 1v3f s ASN 27 Cb -0.15 0.95 -0.11 0.00 -1.45 0.00 0.00 41.25 40.50 1v3f s ASN 27 CO 0.46 -0.03 1.19 0.23 -3.72 0.00 0.00 177.10 175.23 1v3f n MET 28 N 4.80 1.78 0.09 0.43 2.81 -1.26 -4.64 117.12 121.13 1v3f n MET 28 Ca 0.09 0.63 0.00 0.00 -1.81 0.00 0.00 57.70 56.62 1v3f n MET 28 Cb 0.59 -2.23 0.00 0.00 -0.71 0.00 0.00 33.22 30.87 1v3f n MET 28 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1v3f n GLU 29 N 0.26 0.00 0.05 0.03 2.13 -1.26 -5.04 120.64 116.81 1v3f n GLU 29 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 1v3f n GLU 29 Cb 0.38 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.09 1v3f n GLU 29 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1v3f n GLN 30 N -3.05 0.00 0.00 5.31 -0.06 -1.26 -5.12 117.38 113.20 1v3f n GLN 30 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1v3f n GLN 30 Cb 0.00 -0.48 0.00 0.00 -4.06 0.00 0.00 30.24 25.70 1v3f n GLN 30 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1v3f n GLY 31 N 3.46 -0.25 3.45 1.69 0.00 -1.26 -5.08 105.19 107.20 1v3f n GLY 31 Ca 0.00 0.30 -0.63 0.00 0.00 0.00 0.00 46.02 45.69 1v3f n GLY 31 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v3f n SER 32 N 0.00 0.97 -4.56 1.61 2.88 -1.26 -4.74 113.62 108.52 1v3f n SER 32 Ca 0.00 0.87 -0.34 0.00 -1.33 0.00 0.00 58.87 58.07 1v3f n SER 32 Cb 0.00 -0.90 -0.04 0.00 -0.75 0.00 0.00 64.21 62.52 1v3f n SER 32 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1v3f s THR 33 N 4.86 3.52 -0.85 2.46 2.01 -1.26 -4.81 115.64 121.57 1v3f s THR 33 Ca 1.14 -0.19 -0.25 0.00 0.31 0.00 0.00 61.69 62.70 1v3f s THR 33 Cb -1.48 -4.25 -0.06 0.00 0.01 0.00 0.00 72.50 66.72 1v3f s THR 33 CO 0.72 -1.19 2.00 -0.31 -0.69 0.00 0.00 174.62 175.15 1v3f s TYR 34 N 8.54 1.69 -0.87 4.92 2.02 -1.26 -4.68 117.35 127.71 1v3f s TYR 34 Ca 0.62 0.83 0.24 0.00 -0.37 0.00 0.00 57.07 58.39 1v3f s TYR 34 Cb -0.07 -3.97 0.36 0.00 -0.40 0.00 0.00 41.96 37.88 1v3f s TYR 34 CO 0.06 -1.80 1.31 0.36 -1.57 0.00 0.00 175.55 173.90 1v3f n LYS 35 N 8.89 0.10 -2.35 -0.62 -0.00 -1.26 -3.68 118.16 119.25 1v3f n LYS 35 Ca 0.39 0.02 -0.32 0.00 -0.00 0.00 0.00 58.31 58.40 1v3f n LYS 35 Cb 0.47 -1.55 0.01 0.00 -0.00 0.00 0.00 35.03 33.96 1v3f n LYS 35 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1v3f n LYS 36 N -1.69 3.29 -3.84 -1.58 4.81 -1.26 -4.07 118.16 113.82 1v3f n LYS 36 Ca 0.04 -4.24 -0.10 0.00 -0.87 0.00 0.00 58.31 53.14 1v3f n LYS 36 Cb 0.37 -2.26 -0.08 0.00 0.02 0.00 0.00 35.03 33.07 1v3f n LYS 36 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1v3f s THR 37 N -5.27 0.11 -0.00 3.15 -4.23 -1.26 -4.70 115.64 103.44 1v3f s THR 37 Ca 0.49 -0.91 0.07 0.00 -1.18 0.00 0.00 61.69 60.16 1v3f s THR 37 Cb 0.39 -0.95 -0.02 0.00 1.34 0.00 0.00 72.50 73.27 1v3f s THR 37 CO -0.25 -0.50 -0.21 0.72 -0.54 0.00 0.00 174.62 173.83 1v3f s PHE 38 N -2.67 1.91 0.57 3.99 -0.12 -0.52 -0.32 117.98 120.83 1v3f s PHE 38 Ca -0.04 -0.37 -0.20 0.00 -0.05 0.00 0.00 56.93 56.27 1v3f s PHE 38 Cb -0.01 -1.21 -0.04 0.00 -0.63 0.00 0.00 43.02 41.13 1v3f s PHE 38 CO -0.04 -0.00 1.29 -0.51 -0.05 0.00 0.00 175.22 175.90 1v3f s LEU 39 N -0.66 3.76 0.36 -1.99 1.43 -1.26 -1.53 118.68 118.79 1v3f s LEU 39 Ca 0.08 2.59 0.08 0.00 -1.03 0.00 0.00 54.13 55.86 1v3f s LEU 39 Cb -0.08 -4.43 0.80 0.00 0.03 0.00 0.00 46.19 42.50 1v3f s LEU 39 CO -0.00 -1.61 1.91 1.23 0.23 0.00 0.00 176.35 178.11 1v3f h GLY 40 N 1.17 1.05 1.40 -3.19 0.00 0.23 0.38 103.07 104.12 1v3f h GLY 40 Ca -0.51 -0.29 -0.11 0.00 0.00 0.00 0.00 47.33 46.42 1v3f h GLY 40 CO 0.56 0.15 -0.25 0.23 0.00 0.00 0.00 176.54 177.23 1v3f h SER 41 N 0.71 0.71 -0.16 0.19 0.87 -1.63 -1.79 113.55 112.43 1v3f h SER 41 Ca 0.38 -0.26 0.01 0.00 -1.23 0.00 0.00 61.79 60.70 1v3f h SER 41 Cb 0.52 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.27 1v3f h SER 41 CO -0.15 0.93 0.07 -1.28 -0.53 0.00 0.00 176.83 175.86 1v3f h SER 42 N 0.60 0.09 0.38 6.23 0.87 -1.24 0.08 113.55 120.57 1v3f h SER 42 Ca 0.08 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 1v3f h SER 42 Cb 0.74 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1v3f h SER 42 CO 0.06 0.08 -0.18 0.25 -0.53 0.00 0.00 176.83 176.50 1v3f h LEU 43 N 0.15 -0.43 0.00 2.23 5.85 -1.28 0.24 115.31 122.07 1v3f h LEU 43 Ca 0.07 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1v3f h LEU 43 Cb 0.03 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1v3f h LEU 43 CO -0.06 -0.29 0.00 0.52 -0.34 0.00 0.00 178.44 178.27 1v3f n VAL 44 N -5.30 0.00 -0.27 1.05 0.31 -0.69 0.19 118.33 113.62 1v3f n VAL 44 Ca -0.11 1.50 0.08 0.00 -0.01 0.00 0.00 64.34 65.80 1v3f n VAL 44 Cb 0.23 -2.18 0.21 0.00 -0.91 0.00 0.00 33.84 31.19 1v3f n VAL 44 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1v3f h ASP 45 N 0.00 -0.22 0.37 4.52 3.58 -0.99 0.16 116.42 123.84 1v3f h ASP 45 Ca 0.00 0.20 -0.01 0.00 0.42 0.00 0.00 57.03 57.64 1v3f h ASP 45 Cb 0.00 0.32 -0.02 0.00 1.72 0.00 0.00 39.33 41.34 1v3f h ASP 45 CO 0.00 -0.17 -0.45 -0.25 -2.88 0.00 0.00 179.24 175.48 1v3f h TRP 46 N 0.14 -1.27 -0.76 0.28 7.01 0.10 0.96 115.95 122.41 1v3f h TRP 46 Ca 0.47 0.02 0.13 0.00 2.11 0.00 0.00 58.89 61.61 1v3f h TRP 46 Cb 0.87 0.51 -0.13 0.00 -2.10 0.00 0.00 29.16 28.30 1v3f h TRP 46 CO -0.37 -0.58 -0.35 -0.07 -2.79 0.00 0.00 178.44 174.28 1v3f h LEU 47 N -0.84 -1.25 0.55 0.65 3.38 0.44 1.80 115.31 120.03 1v3f h LEU 47 Ca -0.04 0.26 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1v3f h LEU 47 Cb 0.75 0.64 -0.02 0.00 0.09 0.00 0.00 40.66 42.13 1v3f h LEU 47 CO -0.10 -0.30 -0.47 0.40 0.09 0.00 0.00 178.44 178.06 1v3f h ILE 48 N -0.09 0.07 -0.44 1.22 2.04 -0.15 0.36 117.51 120.52 1v3f h ILE 48 Ca 0.28 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.27 1v3f h ILE 48 Cb 0.57 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1v3f h ILE 48 CO -0.81 0.00 0.40 -1.28 0.00 0.00 0.00 178.15 176.46 1v3f h SER 49 N -1.00 0.00 -0.09 1.72 0.87 0.30 1.45 113.55 116.79 1v3f h SER 49 Ca -0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.49 1v3f h SER 49 Cb 0.85 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 1v3f h SER 49 CO -0.02 0.00 0.00 -0.24 -0.53 0.00 0.00 176.83 176.04 1v3f n SER 50 N -3.96 0.56 -1.26 6.23 2.88 0.59 -4.83 113.62 113.83 1v3f n SER 50 Ca 0.08 -1.82 -0.16 0.00 -1.33 0.00 0.00 58.87 55.64 1v3f n SER 50 Cb 0.59 -0.06 -0.07 0.00 -0.75 0.00 0.00 64.21 63.92 1v3f n SER 50 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1v3f n ASN 51 N -0.28 -5.46 0.07 -3.46 5.15 0.49 -4.80 115.26 106.97 1v3f n ASN 51 Ca 0.08 0.41 0.12 0.00 -0.60 0.00 0.00 54.58 54.58 1v3f n ASN 51 Cb 0.11 -4.41 0.06 0.00 -0.53 0.00 0.00 39.78 35.02 1v3f n ASN 51 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1v3f n PHE 52 N -2.36 0.65 -4.11 1.20 3.72 0.11 -4.90 117.46 111.77 1v3f n PHE 52 Ca -0.16 0.19 -0.13 0.00 -0.05 0.00 0.00 57.45 57.29 1v3f n PHE 52 Cb 0.62 -0.73 -0.11 0.00 -0.94 0.00 0.00 39.48 38.32 1v3f n PHE 52 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1v3f s ALA 53 N -3.26 0.77 -0.16 4.37 0.00 -1.11 -4.87 121.76 117.51 1v3f s ALA 53 Ca 0.03 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.04 1v3f s ALA 53 Cb 0.12 0.06 -0.23 0.00 0.00 0.00 0.00 23.12 23.07 1v3f s ALA 53 CO 0.77 -0.06 0.21 0.00 0.00 0.00 0.00 175.76 176.69 1v3f n ALA 54 N 1.02 1.20 -2.28 0.00 0.00 -1.26 -4.41 120.51 114.77 1v3f n ALA 54 Ca -0.20 -0.84 -0.08 0.00 0.00 0.00 0.00 53.44 52.32 1v3f n ALA 54 Cb 0.56 -0.49 -0.09 0.00 0.00 0.00 0.00 19.45 19.43 1v3f n ALA 54 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1v3f s SER 55 N -6.59 0.32 0.38 0.00 0.15 -1.26 -5.01 113.70 101.69 1v3f s SER 55 Ca -0.22 -0.92 0.24 0.00 0.70 0.00 0.00 55.95 55.75 1v3f s SER 55 Cb 0.07 0.27 1.36 0.00 -1.71 0.00 0.00 66.02 66.02 1v3f s SER 55 CO 0.74 -0.68 1.54 0.54 1.20 0.00 0.00 173.24 176.58 1v3f n ARG 56 N 0.01 -0.05 0.16 5.44 3.00 -1.26 -0.17 116.66 123.78 1v3f n ARG 56 Ca -0.13 1.31 -0.07 0.00 -0.01 0.00 0.00 57.85 58.96 1v3f n ARG 56 Cb 0.62 -2.43 -0.04 0.00 0.00 0.00 0.00 32.46 30.62 1v3f n ARG 56 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1v3f h LEU 57 N 0.00 -0.45 -0.98 0.55 7.12 -1.98 0.12 115.31 119.69 1v3f h LEU 57 Ca 0.84 0.02 0.29 0.00 0.13 0.00 0.00 57.88 59.17 1v3f h LEU 57 Cb 2.38 0.13 -0.18 0.00 -0.53 0.00 0.00 40.66 42.46 1v3f h LEU 57 CO -0.66 -0.27 0.13 -0.33 -0.13 0.00 0.00 178.44 177.18 1v3f h GLU 58 N -0.44 0.02 -0.53 1.25 4.39 -0.96 1.65 114.58 119.97 1v3f h GLU 58 Ca -0.04 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1v3f h GLU 58 Cb 0.35 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 1v3f h GLU 58 CO 0.04 0.02 0.32 0.00 -1.16 0.00 0.00 179.01 178.23 1v3f h ALA 59 N 1.97 0.67 -0.99 3.43 0.00 -0.97 0.77 119.26 124.14 1v3f h ALA 59 Ca 0.64 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.52 1v3f h ALA 59 Cb 1.39 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.91 1v3f h ALA 59 CO -0.87 0.15 0.65 0.28 0.00 0.00 0.00 179.25 179.45 1v3f h VAL 60 N 0.71 1.15 -0.17 0.00 2.07 0.50 0.59 116.25 121.10 1v3f h VAL 60 Ca 0.19 -0.42 -0.19 0.00 0.82 0.00 0.00 66.70 67.09 1v3f h VAL 60 Cb -0.02 -0.19 0.01 0.00 -1.52 0.00 0.00 31.29 29.57 1v3f h VAL 60 CO -0.04 0.23 -0.64 0.00 0.02 0.00 0.00 177.57 177.14 1v3f h THR 61 N 1.24 1.30 -0.34 2.57 1.03 0.13 -2.38 112.91 116.46 1v3f h THR 61 Ca 0.40 -1.86 -0.05 0.00 -0.01 0.00 0.00 66.41 64.89 1v3f h THR 61 Cb 0.03 1.95 -0.02 0.00 -1.07 0.00 0.00 68.15 69.05 1v3f h THR 61 CO -0.13 0.59 -0.01 -0.07 -0.01 0.00 0.00 175.52 175.88 1v3f h LEU 62 N 0.45 0.49 0.69 0.00 4.07 0.13 -0.88 115.31 120.26 1v3f h LEU 62 Ca -0.03 -0.10 -0.03 0.00 0.08 0.00 0.00 57.88 57.80 1v3f h LEU 62 Cb 1.27 -0.13 0.01 0.00 1.08 0.00 0.00 40.66 42.88 1v3f h LEU 62 CO 0.13 0.57 -0.33 0.00 -1.08 0.00 0.00 178.44 177.74 1v3f h ALA 63 N 1.49 -1.04 -0.72 1.53 0.00 0.26 -2.11 119.26 118.67 1v3f h ALA 63 Ca 0.11 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 54.97 1v3f h ALA 63 Cb 0.35 0.36 -0.11 0.00 0.00 0.00 0.00 17.79 18.38 1v3f h ALA 63 CO 0.01 -0.98 0.12 0.66 0.00 0.00 0.00 179.25 179.07 1v3f h SER 64 N -1.10 -0.09 -0.43 0.00 4.64 -1.33 0.19 113.55 115.43 1v3f h SER 64 Ca -0.09 0.15 0.09 0.00 -0.47 0.00 0.00 61.79 61.47 1v3f h SER 64 Cb 0.71 0.23 -0.09 0.00 -0.31 0.00 0.00 62.40 62.94 1v3f h SER 64 CO 0.16 -0.07 -0.15 0.24 -0.87 0.00 0.00 176.83 176.13 1v3f h MET 65 N 0.22 -0.06 -0.37 4.77 2.07 -1.08 -0.20 114.93 120.28 1v3f h MET 65 Ca 0.40 0.00 0.06 0.00 -2.07 0.00 0.00 59.70 58.09 1v3f h MET 65 Cb 0.69 0.01 -0.05 0.00 -1.87 0.00 0.00 31.60 30.38 1v3f h MET 65 CO -0.54 -0.04 0.05 -0.07 1.07 0.00 0.00 176.91 177.39 1v3f h LEU 66 N -0.06 -0.04 -1.23 1.22 3.38 -0.28 -0.17 115.31 118.13 1v3f h LEU 66 Ca 0.21 0.07 0.15 0.00 0.09 0.00 0.00 57.88 58.39 1v3f h LEU 66 Cb 0.38 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.16 1v3f h LEU 66 CO -0.48 0.02 0.59 0.24 0.09 0.00 0.00 178.44 178.90 1v3f h MET 67 N 0.16 0.71 -0.50 1.13 2.86 -0.26 0.46 114.93 119.50 1v3f h MET 67 Ca 0.18 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1v3f h MET 67 Cb 0.22 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 1v3f h MET 67 CO -0.25 0.47 0.06 0.93 1.06 0.00 0.00 176.91 179.18 1v3f h GLU 68 N 0.74 0.84 0.00 1.72 4.39 0.57 -1.51 114.58 121.32 1v3f h GLU 68 Ca 0.47 -0.24 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1v3f h GLU 68 Cb 0.72 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1v3f h GLU 68 CO -0.23 0.85 0.00 0.39 -1.16 0.00 0.00 179.01 178.86 1v3f n GLU 69 N -4.39 0.18 -1.02 2.33 1.02 -0.08 -4.79 120.64 113.89 1v3f n GLU 69 Ca 0.01 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1v3f n GLU 69 Cb 0.27 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 1v3f n GLU 69 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1v3f n ASN 70 N -1.29 -2.67 0.09 1.62 2.85 -0.57 -4.92 115.26 110.39 1v3f n ASN 70 Ca 0.06 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.65 1v3f n ASN 70 Cb 0.10 -0.47 0.17 0.00 1.24 0.00 0.00 39.78 40.82 1v3f n ASN 70 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1v3f h PHE 71 N 0.00 0.00 -3.07 1.20 0.04 -1.16 -3.29 116.94 110.66 1v3f h PHE 71 Ca 0.00 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.79 1v3f h PHE 71 Cb 0.08 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.19 1v3f h PHE 71 CO 0.00 0.00 0.21 -0.48 -0.60 0.00 0.00 178.31 177.44 1v3f s LEU 72 N -4.75 -0.10 0.07 1.54 2.34 -1.24 -2.28 118.68 114.27 1v3f s LEU 72 Ca 0.05 -0.83 -0.17 0.00 0.06 0.00 0.00 54.13 53.24 1v3f s LEU 72 Cb 0.11 2.67 0.03 0.00 -0.56 0.00 0.00 46.19 48.45 1v3f s LEU 72 CO 0.71 -1.45 0.40 0.00 -1.06 0.00 0.00 176.35 174.96 1v3f s ARG 73 N -3.37 0.96 0.05 1.48 3.03 0.20 -4.18 118.95 117.13 1v3f s ARG 73 Ca 0.14 -0.48 -0.30 0.00 2.03 0.00 0.00 55.73 57.11 1v3f s ARG 73 Cb -0.05 0.43 -0.05 0.00 -1.03 0.00 0.00 34.95 34.24 1v3f s ARG 73 CO 0.09 -0.34 1.17 -1.25 -1.13 0.00 0.00 175.30 173.83 1v3f s PRO 74 N -2.90 4.45 0.22 3.89 0.04 -1.26 -1.16 135.00 138.27 1v3f s PRO 74 Ca -0.03 1.72 0.11 0.00 0.04 0.00 0.00 61.00 62.84 1v3f s PRO 74 Cb 0.00 -3.36 -0.05 0.00 0.04 0.00 0.00 34.50 31.13 1v3f s PRO 74 CO -0.05 -0.23 -0.18 0.08 0.04 0.00 0.00 177.00 176.66 1v3f s VAL 75 N 1.05 2.65 0.20 -0.36 1.01 -0.60 -4.88 120.40 119.46 1v3f s VAL 75 Ca 0.58 -2.04 0.00 0.00 0.00 0.00 0.00 61.98 60.51 1v3f s VAL 75 Cb -0.28 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.77 1v3f s VAL 75 CO 0.29 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.79 1v3f n GLY 76 N -0.11 -1.25 0.00 4.51 0.00 -1.26 -3.23 105.19 103.85 1v3f n GLY 76 Ca -0.10 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1v3f n GLY 76 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1v3f n VAL 77 N -2.93 0.00 0.00 1.61 0.24 -1.26 -3.73 118.33 112.26 1v3f n VAL 77 Ca 0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 1v3f n VAL 77 Cb 0.39 -1.25 0.00 0.00 -1.47 0.00 0.00 33.84 31.52 1v3f n VAL 77 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1v3f n ARG 78 N -0.90 0.00 -0.02 7.34 3.00 -1.26 -4.12 116.66 120.70 1v3f n ARG 78 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.85 57.69 1v3f n ARG 78 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.36 1v3f n ARG 78 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 1v3f h SER 79 N 0.00 0.47 0.13 6.15 0.02 -1.80 -3.01 113.55 115.51 1v3f h SER 79 Ca 0.00 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 60.27 1v3f h SER 79 Cb 0.00 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1v3f h SER 79 CO 0.00 1.08 0.00 0.24 -1.14 0.00 0.00 176.83 177.01 1v3f h MET 80 N -0.10 0.00 -5.28 3.45 2.86 -1.71 -3.42 114.93 110.74 1v3f h MET 80 Ca -0.04 0.00 -0.24 0.00 -2.06 0.00 0.00 59.70 57.37 1v3f h MET 80 Cb 1.09 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.72 1v3f h MET 80 CO 0.09 0.00 1.03 0.41 1.06 0.00 0.00 176.91 179.49 1v3f n GLY 81 N -1.05 -0.20 2.66 8.32 0.00 -1.14 -3.20 105.19 110.58 1v3f n GLY 81 Ca -0.01 0.40 -0.00 0.00 0.00 0.00 0.00 46.02 46.41 1v3f n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v3f n ALA 82 N 14.10 -3.48 -2.51 4.61 0.00 -1.26 -4.99 120.51 126.98 1v3f n ALA 82 Ca 0.52 0.52 -0.34 0.00 0.00 0.00 0.00 53.44 54.14 1v3f n ALA 82 Cb 0.34 -1.03 -0.05 0.00 0.00 0.00 0.00 19.45 18.70 1v3f n ALA 82 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1v3f s ILE 83 N -1.55 5.02 0.62 0.00 -1.09 -1.19 -4.88 121.20 118.13 1v3f s ILE 83 Ca -0.01 0.52 -0.18 0.00 -2.23 0.00 0.00 60.65 58.75 1v3f s ILE 83 Cb 0.00 -3.66 -0.13 0.00 -1.58 0.00 0.00 42.46 37.09 1v3f s ILE 83 CO 0.76 0.21 -0.08 -2.11 -1.23 0.00 0.00 174.94 172.49 1v3f n ARG 84 N 0.67 0.10 -2.69 2.79 -4.01 -1.26 -4.94 116.66 107.31 1v3f n ARG 84 Ca -0.06 0.04 -0.07 0.00 -1.04 0.00 0.00 57.85 56.72 1v3f n ARG 84 Cb 0.52 -1.19 0.10 0.00 -3.04 0.00 0.00 32.46 28.86 1v3f n ARG 84 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 1v3f n SER 85 N 2.07 -1.30 0.00 2.89 7.64 -1.26 -4.98 113.62 118.69 1v3f n SER 85 Ca 0.07 -2.49 0.00 0.00 1.01 0.00 0.00 58.87 57.46 1v3f n SER 85 Cb 0.49 0.73 0.00 0.00 -1.01 0.00 0.00 64.21 64.42 1v3f n SER 85 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v3f n GLY 86 N -0.54 -0.10 0.00 0.23 0.00 -1.26 -5.17 105.19 98.36 1v3f n GLY 86 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1v3f n GLY 86 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1v3f n ASP 87 N 0.00 0.00 -0.33 1.61 8.00 -1.26 -4.99 116.55 119.58 1v3f n ASP 87 Ca 0.00 0.00 0.22 0.00 0.71 0.00 0.00 54.79 55.72 1v3f n ASP 87 Cb 0.00 0.00 0.48 0.00 -0.02 0.00 0.00 41.12 41.58 1v3f n ASP 87 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1v3f h LEU 88 N 0.00 0.50 -7.30 0.64 7.12 -2.02 -3.42 115.31 110.83 1v3f h LEU 88 Ca 0.00 0.10 -0.53 0.00 0.13 0.00 0.00 57.88 57.58 1v3f h LEU 88 Cb 0.00 0.02 0.10 0.00 -0.53 0.00 0.00 40.66 40.26 1v3f h LEU 88 CO 0.00 0.08 -0.55 0.00 -0.13 0.00 0.00 178.44 177.84 1v3f n ALA 89 N -2.43 -2.58 -0.65 1.25 0.00 -1.26 -4.87 120.51 109.97 1v3f n ALA 89 Ca 0.26 0.27 0.01 0.00 0.00 0.00 0.00 53.44 53.98 1v3f n ALA 89 Cb 0.87 -1.27 0.02 0.00 0.00 0.00 0.00 19.45 19.07 1v3f n ALA 89 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1v3f n GLU 90 N 0.90 1.54 -2.49 0.00 4.71 -1.26 -4.58 120.64 119.45 1v3f n GLU 90 Ca 0.13 -1.29 0.00 0.00 -0.01 0.00 0.00 57.16 55.99 1v3f n GLU 90 Cb 0.24 -0.87 0.00 0.00 -1.01 0.00 0.00 31.44 29.81 1v3f n GLU 90 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1v3f n GLN 91 N -0.43 -0.30 -4.51 3.49 0.00 -1.26 -4.73 117.38 109.65 1v3f n GLN 91 Ca 0.02 0.62 -0.29 0.00 -0.00 0.00 0.00 57.00 57.35 1v3f n GLN 91 Cb 0.43 -0.71 -0.17 0.00 0.00 0.00 0.00 30.24 29.79 1v3f n GLN 91 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.06 177.18 1v3f s PHE 92 N -0.65 2.11 0.68 3.69 2.19 -1.26 -4.94 117.98 119.80 1v3f s PHE 92 Ca 0.00 -1.00 0.01 0.00 0.33 0.00 0.00 56.93 56.27 1v3f s PHE 92 Cb 0.00 -1.50 0.11 0.00 -1.31 0.00 0.00 43.02 40.32 1v3f s PHE 92 CO 0.00 -0.50 0.93 -0.51 1.83 0.00 0.00 175.22 176.98 1v3f s LEU 93 N 0.94 3.04 -0.46 6.12 1.02 -1.26 -4.89 118.68 123.18 1v3f s LEU 93 Ca -0.07 -0.39 0.07 0.00 0.02 0.00 0.00 54.13 53.76 1v3f s LEU 93 Cb -0.15 -2.05 0.24 0.00 0.02 0.00 0.00 46.19 44.25 1v3f s LEU 93 CO -0.01 -1.69 0.54 -0.67 0.02 0.00 0.00 176.35 174.54 1v3f n ASP 94 N -2.68 0.96 -4.14 2.29 2.03 -1.26 -4.71 116.55 109.03 1v3f n ASP 94 Ca 0.14 -2.83 -0.11 0.00 0.52 0.00 0.00 54.79 52.51 1v3f n ASP 94 Cb 0.61 -0.64 -0.09 0.00 -0.72 0.00 0.00 41.12 40.28 1v3f n ASP 94 CO 0.00 0.00 0.00 -1.81 -1.92 0.00 0.00 177.20 173.47 1v3f s ASP 95 N -1.30 0.12 0.04 1.67 1.11 -1.26 -4.60 116.67 112.44 1v3f s ASP 95 Ca 0.35 -1.25 -0.29 0.00 0.18 0.00 0.00 52.55 51.54 1v3f s ASP 95 Cb 0.14 0.41 -0.17 0.00 1.07 0.00 0.00 42.92 44.37 1v3f s ASP 95 CO -0.10 -0.89 1.42 0.77 1.18 0.00 0.00 175.17 177.55 1v3f h SER 96 N 2.57 -0.65 -0.09 0.27 4.64 -1.95 -2.13 113.55 116.22 1v3f h SER 96 Ca -0.34 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 60.96 1v3f h SER 96 Cb 1.24 0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 63.49 1v3f h SER 96 CO 0.50 -0.36 -0.08 0.71 -0.87 0.00 0.00 176.83 176.73 1v3f h THR 97 N -0.92 0.00 0.00 2.95 1.35 -1.97 -3.37 112.91 110.95 1v3f h THR 97 Ca -0.08 0.00 -0.75 0.00 -0.55 0.00 0.00 66.41 65.03 1v3f h THR 97 Cb 0.64 0.00 -0.04 0.00 -1.73 0.00 0.00 68.15 67.01 1v3f h THR 97 CO 0.13 0.00 1.34 0.00 -0.25 0.00 0.00 175.52 176.74 1v3f n ALA 98 N -2.87 0.22 -2.42 6.62 0.00 -1.24 -4.76 120.51 116.07 1v3f n ALA 98 Ca -0.00 0.16 -0.19 0.00 0.00 0.00 0.00 53.44 53.40 1v3f n ALA 98 Cb 0.04 -2.08 -0.01 0.00 0.00 0.00 0.00 19.45 17.40 1v3f n ALA 98 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1v3f s LEU 99 N 6.16 3.84 -0.27 0.00 1.43 -1.20 0.18 118.68 128.82 1v3f s LEU 99 Ca 1.20 -0.30 -0.23 0.00 -1.03 0.00 0.00 54.13 53.78 1v3f s LEU 99 Cb -1.48 -2.61 0.08 0.00 0.03 0.00 0.00 46.19 42.22 1v3f s LEU 99 CO 0.65 -0.46 0.75 -0.31 0.23 0.00 0.00 176.35 177.21 1v3f s TYR 100 N -2.23 -0.81 0.46 0.29 2.02 -0.58 -1.56 117.35 114.94 1v3f s TYR 100 Ca 0.45 1.87 0.03 0.00 -0.37 0.00 0.00 57.07 59.05 1v3f s TYR 100 Cb -0.09 0.35 -0.03 0.00 -0.40 0.00 0.00 41.96 41.80 1v3f s TYR 100 CO 0.30 -0.39 0.04 -0.08 -1.57 0.00 0.00 175.55 173.85 1v3f s THR 101 N 0.63 1.17 0.06 -0.71 -1.32 -0.31 -1.44 115.64 113.72 1v3f s THR 101 Ca -0.02 -2.00 -0.27 0.00 -1.21 0.00 0.00 61.69 58.19 1v3f s THR 101 Cb -0.05 -2.39 -0.05 0.00 -1.51 0.00 0.00 72.50 68.50 1v3f s THR 101 CO -0.04 0.00 0.86 -0.36 -2.21 0.00 0.00 174.62 172.86 1v3f s PHE 102 N -2.96 3.75 0.17 9.09 0.08 -1.26 0.60 117.98 127.45 1v3f s PHE 102 Ca 0.17 1.61 -0.22 0.00 0.12 0.00 0.00 56.93 58.61 1v3f s PHE 102 Cb 0.04 -2.94 -0.08 0.00 -0.57 0.00 0.00 43.02 39.47 1v3f s PHE 102 CO 0.09 0.21 0.72 0.00 -0.10 0.00 0.00 175.22 176.14 1v3f s ALA 103 N 0.10 3.46 0.00 5.36 0.00 -0.96 -4.73 121.76 124.99 1v3f s ALA 103 Ca 0.43 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.61 1v3f s ALA 103 Cb -0.21 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.06 1v3f s ALA 103 CO 0.26 0.33 0.00 0.39 0.00 0.00 0.00 175.76 176.73 1v3f n GLU 104 N 1.27 0.00 0.00 0.00 1.02 -1.26 -4.51 120.64 117.17 1v3f n GLU 104 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1v3f n GLU 104 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.92 1v3f n GLU 104 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1v3f n SER 105 N 2.86 0.00 -3.13 1.62 7.64 -1.26 -5.13 113.62 116.21 1v3f n SER 105 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 1v3f n SER 105 Cb 0.00 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.26 1v3f n SER 105 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1v3f n TYR 106 N 0.00 -1.80 -1.87 1.43 4.11 -1.26 -4.81 117.16 112.95 1v3f n TYR 106 Ca 0.00 -0.09 -0.42 0.00 -0.00 0.00 0.00 57.90 57.39 1v3f n TYR 106 Cb 0.00 -0.42 -0.03 0.00 -0.00 0.00 0.00 39.34 38.90 1v3f n TYR 106 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 1v3f s LYS 107 N -2.58 4.19 -0.23 -3.48 1.02 -1.26 -4.97 119.74 112.42 1v3f s LYS 107 Ca 0.14 2.44 -0.28 0.00 0.02 0.00 0.00 55.97 58.29 1v3f s LYS 107 Cb -0.02 -3.12 0.15 0.00 -0.52 0.00 0.00 37.83 34.32 1v3f s LYS 107 CO 0.12 -0.64 1.15 0.21 -0.92 0.00 0.00 175.35 175.27 1v3f s LYS 108 N 0.95 0.38 0.07 1.68 2.36 -1.26 -5.15 119.74 118.77 1v3f s LYS 108 Ca 0.70 0.19 -0.26 0.00 -2.55 0.00 0.00 55.97 54.06 1v3f s LYS 108 Cb -0.46 0.18 -0.06 0.00 -1.05 0.00 0.00 37.83 36.45 1v3f s LYS 108 CO 0.33 -0.10 0.80 0.21 1.55 0.00 0.00 175.35 178.15 1v3f s LYS 109 N -0.68 4.54 -0.04 4.03 2.36 -1.26 -4.63 119.74 124.06 1v3f s LYS 109 Ca 0.03 1.15 -0.04 0.00 -2.55 0.00 0.00 55.97 54.56 1v3f s LYS 109 Cb -0.02 -3.35 0.01 0.00 -1.05 0.00 0.00 37.83 33.42 1v3f s LYS 109 CO -0.04 0.30 0.07 0.28 1.55 0.00 0.00 175.35 177.51 1v3f n VAL 110 N 2.66-11.17 -3.34 4.02 0.31 -1.26 -5.08 118.33 104.47 1v3f n VAL 110 Ca -0.02 2.46 0.02 0.00 -0.01 0.00 0.00 64.34 66.79 1v3f n VAL 110 Cb 0.50 -5.67 -0.03 0.00 -0.91 0.00 0.00 33.84 27.73 1v3f n VAL 110 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1v3f s SER 111 N -0.50 -0.85 0.09 4.52 0.15 -1.26 -5.03 113.70 110.82 1v3f s SER 111 Ca -0.08 0.86 0.00 0.00 0.70 0.00 0.00 55.95 57.42 1v3f s SER 111 Cb 0.01 1.84 0.00 0.00 -1.71 0.00 0.00 66.02 66.16 1v3f s SER 111 CO 0.23 -0.16 0.00 -0.24 1.20 0.00 0.00 173.24 174.27 1v3f n SER 112 N 5.28 -0.84 -1.26 5.45 2.88 -1.26 -5.15 113.62 118.72 1v3f n SER 112 Ca -0.07 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 1v3f n SER 112 Cb 0.52 1.11 0.00 0.00 -0.75 0.00 0.00 64.21 65.08 1v3f n SER 112 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1v3f n LYS 113 N -2.93 -3.55 -3.93 -1.46 0.00 -1.26 -5.08 118.16 99.94 1v3f n LYS 113 Ca 0.00 2.57 -0.09 0.00 0.00 0.00 0.00 58.31 60.79 1v3f n LYS 113 Cb 0.00 -2.84 -0.07 0.00 0.00 0.00 0.00 35.03 32.12 1v3f n LYS 113 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1v3f s GLU 114 N -2.94 1.12 0.06 1.64 2.12 -1.26 -5.13 118.70 114.31 1v3f s GLU 114 Ca 0.00 -1.12 -0.31 0.00 0.36 0.00 0.00 54.97 53.90 1v3f s GLU 114 Cb 0.00 0.38 -0.07 0.00 0.26 0.00 0.00 34.13 34.70 1v3f s GLU 114 CO 0.00 -0.41 1.37 0.45 -0.54 0.00 0.00 175.26 176.13 1v3f s SER 115 N -2.95 6.87 0.00 -1.70 0.15 -1.26 -4.38 113.70 110.43 1v3f s SER 115 Ca 0.15 2.20 0.00 0.00 0.70 0.00 0.00 55.95 59.00 1v3f s SER 115 Cb 0.03 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1v3f s SER 115 CO -0.02 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.38 1v3f n GLY 116 N 3.52 1.04 2.36 9.45 0.00 -1.26 -4.92 105.19 115.38 1v3f n GLY 116 Ca 0.12 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 1v3f n GLY 116 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v3f n PRO 117 N 0.00 2.34 -3.79 1.61 -0.04 -1.26 -4.75 135.00 129.11 1v3f n PRO 117 Ca 0.00 -1.42 -0.13 0.00 -0.04 0.00 0.00 63.50 61.91 1v3f n PRO 117 Cb 0.00 -2.35 -0.12 0.00 -0.04 0.00 0.00 33.50 30.99 1v3f n PRO 117 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1v3f s SER 118 N 2.66 -0.21 0.00 3.54 0.15 -1.26 -4.94 113.70 113.63 1v3f s SER 118 Ca 0.52 0.42 0.01 0.00 0.70 0.00 0.00 55.95 57.60 1v3f s SER 118 Cb 0.17 0.41 -0.01 0.00 -1.71 0.00 0.00 66.02 64.88 1v3f s SER 118 CO -0.03 -0.08 -0.05 -0.44 1.20 0.00 0.00 173.24 173.84 1v3f s SER 119 N 0.25 0.57 0.00 5.45 0.01 -1.26 -5.07 113.70 113.66 1v3f s SER 119 Ca -0.01 -0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.11 1v3f s SER 119 Cb -0.03 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.15 1v3f s SER 119 CO -0.01 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.28