#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v3f n SER 2 N 0.00 -8.25 -4.69 1.61 7.64 -1.26 -4.80 113.62 103.86 1v3f n SER 2 Ca 0.00 1.07 -0.29 0.00 1.01 0.00 0.00 58.87 60.65 1v3f n SER 2 Cb 0.00 -4.56 0.12 0.00 -1.01 0.00 0.00 64.21 58.75 1v3f n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1v3f s SER 3 N -7.17 4.12 0.06 6.43 0.01 -1.26 -4.66 113.70 111.24 1v3f s SER 3 Ca 0.00 0.64 0.00 0.00 1.31 0.00 0.00 55.95 57.90 1v3f s SER 3 Cb 0.00 -1.01 0.00 0.00 0.21 0.00 0.00 66.02 65.22 1v3f s SER 3 CO 0.00 -2.14 0.00 0.61 0.41 0.00 0.00 173.24 172.12 1v3f n GLY 4 N -3.44 1.74 3.61 3.44 0.00 -1.26 -4.92 105.19 104.36 1v3f n GLY 4 Ca 0.10 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 1v3f n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1v3f n SER 5 N 5.20 1.31 0.00 1.61 3.41 -1.26 -4.62 113.62 119.27 1v3f n SER 5 Ca 0.00 1.06 0.00 0.00 -0.26 0.00 0.00 58.87 59.67 1v3f n SER 5 Cb 0.00 -1.35 0.00 0.00 -0.26 0.00 0.00 64.21 62.60 1v3f n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1v3f n SER 6 N 0.61 0.00 -0.13 4.04 3.41 -1.26 -4.88 113.62 115.41 1v3f n SER 6 Ca 0.09 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.60 1v3f n SER 6 Cb 0.38 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.36 1v3f n SER 6 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1v3f h GLY 7 N 0.00 0.98 -0.66 5.00 0.00 -2.02 -2.71 103.07 103.67 1v3f h GLY 7 Ca 0.00 -0.88 0.31 0.00 0.00 0.00 0.00 47.33 46.76 1v3f h GLY 7 CO 0.00 0.80 1.03 1.41 0.00 0.00 0.00 176.54 179.78 1v3f h LEU 8 N 0.78 0.00 -0.25 3.11 3.38 -1.94 1.49 115.31 121.88 1v3f h LEU 8 Ca 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1v3f h LEU 8 Cb 0.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1v3f h LEU 8 CO 0.07 0.00 0.08 -0.74 0.09 0.00 0.00 178.44 177.94 1v3f h HIS 9 N 0.00 0.41 0.00 1.13 2.76 -1.89 0.32 115.15 117.87 1v3f h HIS 9 Ca 0.51 -0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.62 1v3f h HIS 9 Cb 2.56 -0.12 -0.00 0.00 1.55 0.00 0.00 27.41 31.40 1v3f h HIS 9 CO 0.00 0.45 -0.10 0.07 -1.30 0.00 0.00 177.93 177.05 1v3f h ARG 10 N 0.24 0.00 0.10 5.26 -0.00 0.19 -1.59 114.38 118.59 1v3f h ARG 10 Ca 0.08 0.00 -0.14 0.00 -0.00 0.00 0.00 59.98 59.92 1v3f h ARG 10 Cb 0.23 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 30.22 1v3f h ARG 10 CO -0.00 0.10 -0.63 0.82 -0.00 0.00 0.00 179.97 180.25 1v3f h ILE 11 N 0.00 1.56 -0.16 0.08 2.04 -0.77 -3.07 117.51 117.19 1v3f h ILE 11 Ca -0.00 -2.48 0.04 0.00 1.00 0.00 0.00 64.86 63.41 1v3f h ILE 11 Cb 0.38 3.23 -0.04 0.00 -0.74 0.00 0.00 36.82 39.65 1v3f h ILE 11 CO 0.01 0.69 -0.06 0.58 0.00 0.00 0.00 178.15 179.36 1v3f h VAL 12 N -0.54 0.78 -0.57 1.67 2.07 -0.04 0.14 116.25 119.76 1v3f h VAL 12 Ca -0.11 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.52 1v3f h VAL 12 Cb 1.48 0.78 -0.09 0.00 -1.52 0.00 0.00 31.29 31.94 1v3f h VAL 12 CO 0.11 0.00 0.04 0.44 0.02 0.00 0.00 177.57 178.18 1v3f h ASP 13 N -0.04 -0.17 -0.24 0.57 3.32 -1.41 0.93 116.42 119.39 1v3f h ASP 13 Ca 0.09 0.13 0.01 0.00 0.02 0.00 0.00 57.03 57.28 1v3f h ASP 13 Cb 0.17 0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 1v3f h ASP 13 CO -0.19 -0.06 0.12 0.50 -1.72 0.00 0.00 179.24 177.88 1v3f h LYS 14 N 0.16 0.24 0.00 3.56 3.64 -1.20 -1.35 116.57 121.62 1v3f h LYS 14 Ca 0.30 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.63 1v3f h LYS 14 Cb 0.46 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1v3f h LYS 14 CO -0.45 0.16 -0.15 0.52 -2.27 0.00 0.00 179.45 177.25 1v3f h MET 15 N 0.25 0.00 0.00 1.90 2.86 0.13 -0.53 114.93 119.54 1v3f h MET 15 Ca 0.10 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1v3f h MET 15 Cb 0.02 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 1v3f h MET 15 CO -0.07 0.15 -0.02 0.45 1.06 0.00 0.00 176.91 178.49 1v3f h HIS 16 N 0.00 0.00 -4.01 -0.22 3.86 0.20 -3.30 115.15 111.68 1v3f h HIS 16 Ca -0.00 0.00 -0.46 0.00 -1.16 0.00 0.00 60.37 58.75 1v3f h HIS 16 Cb 0.27 0.00 0.09 0.00 1.06 0.00 0.00 27.41 28.83 1v3f h HIS 16 CO 0.00 0.02 0.30 0.34 0.86 0.00 0.00 177.93 179.45 1v3f s ASP 17 N -5.55 4.58 -0.04 2.45 2.15 -0.21 -5.01 116.67 115.04 1v3f s ASP 17 Ca -0.03 0.52 0.01 0.00 0.43 0.00 0.00 52.55 53.48 1v3f s ASP 17 Cb 0.12 -1.07 -0.03 0.00 -0.30 0.00 0.00 42.92 41.64 1v3f s ASP 17 CO 0.49 -1.79 -0.03 1.07 -0.17 0.00 0.00 175.17 174.74 1v3f n THR 18 N -3.11 0.21 0.00 1.71 5.66 -1.26 -3.43 114.28 114.06 1v3f n THR 18 Ca 0.09 -0.09 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1v3f n THR 18 Cb 0.61 -0.66 0.00 0.00 -1.55 0.00 0.00 70.33 68.73 1v3f n THR 18 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1v3f n SER 19 N -2.56 0.00 0.04 1.09 7.64 -1.26 -3.99 113.62 114.58 1v3f n SER 19 Ca -0.06 0.95 0.02 0.00 1.01 0.00 0.00 58.87 60.78 1v3f n SER 19 Cb 0.57 -0.45 -0.07 0.00 -1.01 0.00 0.00 64.21 63.25 1v3f n SER 19 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1v3f n THR 20 N -1.89 1.09 -0.59 0.44 -2.24 -1.26 -4.93 114.28 104.90 1v3f n THR 20 Ca 0.00 -0.67 -0.10 0.00 -2.27 0.00 0.00 64.05 61.02 1v3f n THR 20 Cb 0.00 -0.66 0.08 0.00 -2.10 0.00 0.00 70.33 67.65 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 1.37 -2.73 3.07 3.38 0.00 -1.20 -4.95 105.19 104.14 1v3f n GLY 21 Ca -0.08 -1.43 -0.26 0.00 0.00 0.00 0.00 46.02 44.24 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 -3.34 0.00 -3.28 -0.61 3.06 -1.22 -4.65 119.36 109.31 1v3f n ILE 22 Ca 0.05 -0.44 -0.07 0.00 -2.50 0.00 0.00 62.75 59.78 1v3f n ILE 22 Cb 0.19 -1.22 -0.05 0.00 0.54 0.00 0.00 39.64 39.10 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 -5.18 0.61 -0.06 9.51 0.52 -1.26 -4.38 118.95 118.70 1v3f s ARG 23 Ca 0.62 -0.25 -0.10 0.00 -0.52 0.00 0.00 55.73 55.48 1v3f s ARG 23 Cb -0.06 -0.27 -0.06 0.00 0.52 0.00 0.00 34.95 35.08 1v3f s ARG 23 CO 0.47 -1.13 0.42 -1.00 0.02 0.00 0.00 175.30 174.08 1v3f h PRO 24 N 7.49 -0.31 -5.76 3.54 0.13 -1.98 -3.47 132.00 131.63 1v3f h PRO 24 Ca 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1v3f h PRO 24 Cb 1.12 0.07 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 1v3f h PRO 24 CO 0.19 -0.17 -0.78 0.43 -0.23 0.00 0.00 178.00 177.44 1v3f n SER 25 N -4.99 -5.57 -2.82 1.44 7.64 -1.26 -4.65 113.62 103.40 1v3f n SER 25 Ca -0.04 1.01 -0.22 0.00 1.01 0.00 0.00 58.87 60.63 1v3f n SER 25 Cb 0.15 -3.06 -0.06 0.00 -1.01 0.00 0.00 64.21 60.23 1v3f n SER 25 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1v3f n PRO 26 N 1.80 2.32 -1.28 1.43 -0.04 -1.26 -4.71 135.00 133.26 1v3f n PRO 26 Ca -0.11 -1.40 -0.35 0.00 -0.04 0.00 0.00 63.50 61.60 1v3f n PRO 26 Cb 0.28 -2.33 -0.05 0.00 -0.04 0.00 0.00 33.50 31.36 1v3f n PRO 26 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1v3f n ASN 27 N 3.44 8.26 -1.34 3.54 6.94 -1.26 -4.79 115.26 130.06 1v3f n ASN 27 Ca 0.49 -2.57 0.16 0.00 -0.02 0.00 0.00 54.58 52.64 1v3f n ASN 27 Cb 0.37 -1.53 -0.07 0.00 -2.36 0.00 0.00 39.78 36.18 1v3f n ASN 27 CO 0.00 0.00 0.00 0.80 -1.03 0.00 0.00 177.26 177.03 1v3f n MET 28 N 3.37 -2.85 0.05 -3.83 1.56 -1.26 -5.02 117.12 109.15 1v3f n MET 28 Ca 0.73 2.24 0.00 0.00 -0.27 0.00 0.00 57.70 60.41 1v3f n MET 28 Cb 0.33 -3.43 0.00 0.00 2.15 0.00 0.00 33.22 32.27 1v3f n MET 28 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 1v3f n GLU 29 N -4.11 0.00 -2.82 2.12 4.07 -1.25 -5.01 120.64 113.63 1v3f n GLU 29 Ca -0.06 0.00 -0.11 0.00 -0.06 0.00 0.00 57.16 56.93 1v3f n GLU 29 Cb 0.63 0.00 0.04 0.00 -0.06 0.00 0.00 31.44 32.06 1v3f n GLU 29 CO 0.00 0.00 0.00 0.94 -0.06 0.00 0.00 177.13 178.01 1v3f n GLN 30 N -2.73 0.86 0.00 5.31 -0.06 -1.26 -4.98 117.38 114.52 1v3f n GLN 30 Ca 0.00 -2.06 0.00 0.00 -2.00 0.00 0.00 57.00 52.94 1v3f n GLN 30 Cb 0.00 -1.32 0.00 0.00 -4.06 0.00 0.00 30.24 24.86 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 1.12 1.53 3.76 1.69 0.00 -1.26 -4.92 105.19 107.12 1v3f n GLY 31 Ca 0.10 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1v3f n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v3f s SER 32 N 0.00 7.51 -0.91 1.61 0.15 -1.26 -5.00 113.70 115.80 1v3f s SER 32 Ca 0.00 1.95 -0.04 0.00 0.70 0.00 0.00 55.95 58.56 1v3f s SER 32 Cb 0.00 -2.60 0.23 0.00 -1.71 0.00 0.00 66.02 61.93 1v3f s SER 32 CO 0.00 0.05 0.81 -0.89 1.20 0.00 0.00 173.24 174.42 1v3f s THR 33 N -1.30 4.75 0.91 6.45 2.01 -1.26 -3.79 115.64 123.41 1v3f s THR 33 Ca 0.44 -3.56 -0.15 0.00 0.31 0.00 0.00 61.69 58.74 1v3f s THR 33 Cb -0.25 -3.93 -0.03 0.00 0.01 0.00 0.00 72.50 68.30 1v3f s THR 33 CO 0.31 -1.08 0.08 -1.22 -0.69 0.00 0.00 174.62 172.01 1v3f n TYR 34 N 2.67 -2.43 -3.63 4.92 4.02 -1.26 -4.94 117.16 116.52 1v3f n TYR 34 Ca 0.20 0.19 -0.40 0.00 -0.01 0.00 0.00 57.90 57.88 1v3f n TYR 34 Cb 0.38 -1.71 -0.11 0.00 -0.02 0.00 0.00 39.34 37.89 1v3f n TYR 34 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1v3f s LYS 35 N -2.96 2.69 -0.20 -0.72 1.02 -1.26 -4.66 119.74 113.64 1v3f s LYS 35 Ca 0.54 -1.26 -0.00 0.00 0.02 0.00 0.00 55.97 55.26 1v3f s LYS 35 Cb -0.23 -3.70 0.00 0.00 -0.52 0.00 0.00 37.83 33.37 1v3f s LYS 35 CO 0.70 -0.80 0.01 1.63 -0.92 0.00 0.00 175.35 175.97 1v3f n LYS 36 N 4.93 -2.35 -3.77 1.68 5.02 -1.26 -4.92 118.16 117.49 1v3f n LYS 36 Ca -0.11 2.07 -0.13 0.00 -2.02 0.00 0.00 58.31 58.12 1v3f n LYS 36 Cb 0.44 -3.83 -0.11 0.00 -0.02 0.00 0.00 35.03 31.52 1v3f n LYS 36 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1v3f s THR 37 N -1.42 0.00 -0.03 -0.18 -4.23 -1.26 -4.25 115.64 104.27 1v3f s THR 37 Ca 0.01 -0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.55 1v3f s THR 37 Cb -0.00 -0.40 0.00 0.00 1.34 0.00 0.00 72.50 73.44 1v3f s THR 37 CO 0.51 -0.00 -0.13 0.72 -0.54 0.00 0.00 174.62 175.18 1v3f s PHE 38 N 0.15 1.31 0.50 3.99 -0.12 -0.43 -4.27 117.98 119.10 1v3f s PHE 38 Ca -0.00 -0.36 -0.20 0.00 -0.05 0.00 0.00 56.93 56.32 1v3f s PHE 38 Cb -0.02 -0.90 -0.11 0.00 -0.63 0.00 0.00 43.02 41.36 1v3f s PHE 38 CO 0.00 -0.13 0.55 1.28 -0.05 0.00 0.00 175.22 176.88 1v3f n LEU 39 N 3.23 0.48 0.28 -1.99 4.77 -1.25 -2.46 117.00 120.06 1v3f n LEU 39 Ca -0.18 0.83 0.13 0.00 -0.03 0.00 0.00 56.01 56.76 1v3f n LEU 39 Cb 0.54 -1.16 0.83 0.00 -2.33 0.00 0.00 43.42 41.30 1v3f n LEU 39 CO 0.25 -2.91 1.08 1.23 -1.33 0.00 0.00 177.39 175.72 1v3f h GLY 40 N 0.57 0.00 1.37 -0.72 0.00 0.16 -1.50 103.07 102.95 1v3f h GLY 40 Ca -0.43 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.58 1v3f h GLY 40 CO 0.49 0.00 -1.42 0.23 0.00 0.00 0.00 176.54 175.84 1v3f h SER 41 N 0.00 0.69 -0.75 0.19 0.87 -1.63 -2.82 113.55 110.09 1v3f h SER 41 Ca -0.00 -0.75 0.11 0.00 -1.23 0.00 0.00 61.79 59.91 1v3f h SER 41 Cb 0.07 -0.22 -0.08 0.00 -0.44 0.00 0.00 62.40 61.73 1v3f h SER 41 CO 0.00 1.59 0.38 -1.28 -0.53 0.00 0.00 176.83 177.00 1v3f h SER 42 N 0.12 0.49 0.40 6.23 0.87 -1.55 0.42 113.55 120.54 1v3f h SER 42 Ca -0.22 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.39 1v3f h SER 42 Cb 2.10 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 64.05 1v3f h SER 42 CO 0.25 0.26 -0.19 0.25 -0.53 0.00 0.00 176.83 176.87 1v3f h LEU 43 N 0.62 -0.45 -0.16 2.23 5.85 -1.56 -0.12 115.31 121.71 1v3f h LEU 43 Ca 0.38 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 59.00 1v3f h LEU 43 Cb 0.43 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.54 1v3f h LEU 43 CO -0.29 -0.05 -0.31 0.58 -0.34 0.00 0.00 178.44 178.03 1v3f h VAL 44 N -0.94 0.00 -0.76 1.05 2.07 -1.18 1.23 116.25 117.73 1v3f h VAL 44 Ca -0.05 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.63 1v3f h VAL 44 Cb 0.55 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.21 1v3f h VAL 44 CO 0.09 0.00 0.19 -0.78 0.02 0.00 0.00 177.57 177.09 1v3f h ASP 45 N -0.27 0.02 0.19 0.57 1.82 -0.25 0.86 116.42 119.35 1v3f h ASP 45 Ca 0.03 0.15 -0.01 0.00 -0.39 0.00 0.00 57.03 56.82 1v3f h ASP 45 Cb 0.35 0.20 -0.00 0.00 0.68 0.00 0.00 39.33 40.56 1v3f h ASP 45 CO -0.29 -0.05 -0.14 -0.25 -1.61 0.00 0.00 179.24 176.89 1v3f h TRP 46 N 0.27 -0.39 -0.88 0.28 7.01 0.10 0.59 115.95 122.93 1v3f h TRP 46 Ca 0.43 -0.00 0.26 0.00 2.11 0.00 0.00 58.89 61.69 1v3f h TRP 46 Cb 0.76 0.15 -0.16 0.00 -2.10 0.00 0.00 29.16 27.80 1v3f h TRP 46 CO -0.26 -0.20 0.07 1.28 -2.79 0.00 0.00 178.44 176.54 1v3f n LEU 47 N -3.14 -0.06 0.27 0.65 4.77 0.40 0.20 117.00 120.09 1v3f n LEU 47 Ca -0.04 1.49 -0.16 0.00 -0.03 0.00 0.00 56.01 57.28 1v3f n LEU 47 Cb 0.14 -0.56 -0.08 0.00 -2.33 0.00 0.00 43.42 40.58 1v3f n LEU 47 CO 0.09 -1.53 0.62 0.40 -1.33 0.00 0.00 177.39 175.64 1v3f h ILE 48 N 0.00 0.49 -0.31 -0.08 2.04 -0.18 0.29 117.51 119.75 1v3f h ILE 48 Ca 0.56 -0.21 0.07 0.00 1.00 0.00 0.00 64.86 66.28 1v3f h ILE 48 Cb 1.20 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1v3f h ILE 48 CO -0.81 0.04 0.22 -1.28 0.00 0.00 0.00 178.15 176.31 1v3f h SER 49 N -0.79 0.09 0.86 1.72 0.87 0.67 0.61 113.55 117.58 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 0.56 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 1v3f h SER 49 CO 0.11 0.06 0.00 -1.20 -0.53 0.00 0.00 176.83 175.27 1v3f n SER 50 N -4.47 0.54 0.00 6.23 7.64 0.54 -4.85 113.62 119.25 1v3f n SER 50 Ca 0.04 0.61 0.00 0.00 1.01 0.00 0.00 58.87 60.53 1v3f n SER 50 Cb 0.32 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 1v3f n SER 50 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1v3f n ASN 51 N -2.07 -2.89 0.06 6.43 5.15 0.21 -4.92 115.26 117.24 1v3f n ASN 51 Ca 0.03 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 54.03 1v3f n ASN 51 Cb 0.27 -0.48 -0.06 0.00 -0.53 0.00 0.00 39.78 38.98 1v3f n ASN 51 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 1v3f h PHE 52 N 0.00 0.00 -3.33 1.20 0.04 -0.60 -3.47 116.94 110.78 1v3f h PHE 52 Ca 0.00 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.42 1v3f h PHE 52 Cb 0.00 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.00 1v3f h PHE 52 CO 0.00 0.52 -0.72 0.00 -0.60 0.00 0.00 178.31 177.50 1v3f s ALA 53 N -2.97 1.54 -0.19 2.45 0.00 -1.09 -4.90 121.76 116.61 1v3f s ALA 53 Ca -0.02 -1.49 0.15 0.00 0.00 0.00 0.00 51.96 50.60 1v3f s ALA 53 Cb 0.09 0.01 -0.22 0.00 0.00 0.00 0.00 23.12 23.00 1v3f s ALA 53 CO 0.80 -0.05 0.03 0.00 0.00 0.00 0.00 175.76 176.54 1v3f n ALA 54 N -0.14 1.54 -2.51 0.00 0.00 -1.26 -4.45 120.51 113.68 1v3f n ALA 54 Ca -0.10 -1.20 -0.09 0.00 0.00 0.00 0.00 53.44 52.05 1v3f n ALA 54 Cb 0.60 -0.13 -0.09 0.00 0.00 0.00 0.00 19.45 19.83 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 -5.38 0.23 0.48 0.00 0.15 -1.26 -5.01 113.70 102.91 1v3f s SER 55 Ca -0.12 -0.68 0.41 0.00 0.70 0.00 0.00 55.95 56.25 1v3f s SER 55 Cb 0.06 0.26 1.53 0.00 -1.71 0.00 0.00 66.02 66.16 1v3f s SER 55 CO 0.73 -0.61 1.45 0.54 1.20 0.00 0.00 173.24 176.56 1v3f n ARG 56 N 0.32 -0.01 0.06 5.44 3.00 -1.26 -0.06 116.66 124.15 1v3f n ARG 56 Ca -0.16 1.07 -0.02 0.00 -0.01 0.00 0.00 57.85 58.72 1v3f n ARG 56 Cb 0.60 -2.32 -0.01 0.00 0.00 0.00 0.00 32.46 30.73 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 -0.14 -1.81 0.55 7.12 -1.98 0.97 115.31 120.03 1v3f h LEU 57 Ca 0.86 0.00 0.49 0.00 0.13 0.00 0.00 57.88 59.36 1v3f h LEU 57 Cb 3.18 0.04 -0.09 0.00 -0.53 0.00 0.00 40.66 43.26 1v3f h LEU 57 CO -0.18 -0.09 1.15 -0.33 -0.13 0.00 0.00 178.44 178.87 1v3f h GLU 58 N -0.19 0.03 0.12 1.25 5.08 -0.86 1.54 114.58 121.54 1v3f h GLU 58 Ca -0.02 -0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.17 1v3f h GLU 58 Cb 0.12 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.39 1v3f h GLU 58 CO 0.03 0.02 -0.72 0.00 -1.00 0.00 0.00 179.01 177.33 1v3f h ALA 59 N 1.26 -0.07 -0.72 3.43 0.00 -1.06 -1.63 119.26 120.47 1v3f h ALA 59 Ca 0.84 -0.67 0.11 0.00 0.00 0.00 0.00 54.91 55.20 1v3f h ALA 59 Cb 3.16 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 20.95 1v3f h ALA 59 CO -0.14 0.34 0.32 0.28 0.00 0.00 0.00 179.25 180.05 1v3f h VAL 60 N -0.39 0.76 -0.21 0.00 2.07 1.01 0.31 116.25 119.80 1v3f h VAL 60 Ca -0.12 -0.18 -0.11 0.00 0.82 0.00 0.00 66.70 67.10 1v3f h VAL 60 Cb 1.55 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1v3f h VAL 60 CO 0.14 0.10 -0.32 0.74 0.02 0.00 0.00 177.57 178.24 1v3f h THR 61 N 0.52 1.33 -0.92 2.57 2.02 -0.81 -2.29 112.91 115.33 1v3f h THR 61 Ca 0.37 -1.53 0.11 0.00 0.77 0.00 0.00 66.41 66.14 1v3f h THR 61 Cb 0.48 1.81 -0.07 0.00 -1.74 0.00 0.00 68.15 68.63 1v3f h THR 61 CO -0.33 0.47 0.59 -0.07 0.37 0.00 0.00 175.52 176.56 1v3f h LEU 62 N 0.26 0.80 0.58 2.58 3.38 -0.21 0.33 115.31 123.04 1v3f h LEU 62 Ca 0.02 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1v3f h LEU 62 Cb 0.90 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.52 1v3f h LEU 62 CO 0.07 0.45 -0.28 0.00 0.09 0.00 0.00 178.44 178.77 1v3f h ALA 63 N 1.56 -0.78 -0.75 1.53 0.00 -0.31 -1.82 119.26 118.69 1v3f h ALA 63 Ca 0.44 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.35 1v3f h ALA 63 Cb 0.50 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1v3f h ALA 63 CO -0.21 -0.80 0.52 0.66 0.00 0.00 0.00 179.25 179.42 1v3f h SER 64 N -1.05 0.15 -0.27 0.00 4.64 -0.80 0.67 113.55 116.89 1v3f h SER 64 Ca -0.08 0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 1v3f h SER 64 Cb 0.66 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 1v3f h SER 64 CO 0.13 0.07 0.03 0.24 -0.87 0.00 0.00 176.83 176.43 1v3f h MET 65 N 0.16 0.47 -0.39 4.77 2.07 -0.08 -1.54 114.93 120.38 1v3f h MET 65 Ca 0.37 -0.13 0.00 0.00 -2.07 0.00 0.00 59.70 57.86 1v3f h MET 65 Cb 1.21 -0.05 -0.02 0.00 -1.87 0.00 0.00 31.60 30.87 1v3f h MET 65 CO -0.06 0.60 0.25 -0.07 1.07 0.00 0.00 176.91 178.70 1v3f h LEU 66 N 0.27 0.45 -0.73 1.22 3.38 -0.04 -1.27 115.31 118.59 1v3f h LEU 66 Ca 0.08 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.09 1v3f h LEU 66 Cb 0.37 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 1v3f h LEU 66 CO 0.01 0.35 0.42 0.24 0.09 0.00 0.00 178.44 179.54 1v3f h MET 67 N 0.52 0.73 -0.24 1.13 2.86 -1.18 0.21 114.93 118.97 1v3f h MET 67 Ca 0.14 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1v3f h MET 67 Cb -0.04 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.44 1v3f h MET 67 CO -0.03 0.49 0.15 0.93 1.06 0.00 0.00 176.91 179.50 1v3f h GLU 68 N 0.76 0.32 0.00 1.72 4.39 -0.74 -0.37 114.58 120.66 1v3f h GLU 68 Ca 0.33 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.00 1v3f h GLU 68 Cb 0.21 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1v3f h GLU 68 CO -0.19 0.25 0.00 0.39 -1.16 0.00 0.00 179.01 178.30 1v3f n GLU 69 N -4.90 0.07 -1.74 2.33 -0.58 -0.53 -4.79 120.64 110.51 1v3f n GLU 69 Ca -0.03 0.52 0.00 0.00 -0.42 0.00 0.00 57.16 57.23 1v3f n GLU 69 Cb 0.05 -1.71 0.00 0.00 -0.57 0.00 0.00 31.44 29.21 1v3f n GLU 69 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1v3f n ASN 70 N -1.85 -1.25 -0.01 1.62 5.15 -0.15 -4.97 115.26 113.81 1v3f n ASN 70 Ca 0.00 0.00 0.09 0.00 -0.60 0.00 0.00 54.58 54.07 1v3f n ASN 70 Cb 0.05 -0.37 -0.13 0.00 -0.53 0.00 0.00 39.78 38.80 1v3f n ASN 70 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1v3f n PHE 71 N -2.30 0.00 -3.87 1.20 3.72 0.66 -4.41 117.46 112.46 1v3f n PHE 71 Ca 0.00 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.32 1v3f n PHE 71 Cb 0.37 -0.34 -0.03 0.00 -0.94 0.00 0.00 39.48 38.54 1v3f n PHE 71 CO 0.00 0.00 0.00 -0.48 -0.05 0.00 0.00 176.76 176.23 1v3f s LEU 72 N -4.01 -0.15 0.06 4.37 2.34 -1.23 -1.56 118.68 118.49 1v3f s LEU 72 Ca -0.04 -0.66 -0.08 0.00 0.06 0.00 0.00 54.13 53.41 1v3f s LEU 72 Cb 0.12 2.53 -0.00 0.00 -0.56 0.00 0.00 46.19 48.28 1v3f s LEU 72 CO 0.74 -1.30 0.16 0.00 -1.06 0.00 0.00 176.35 174.90 1v3f s ARG 73 N -3.93 0.72 0.10 1.48 1.70 0.24 -4.08 118.95 115.18 1v3f s ARG 73 Ca 0.13 -0.81 -0.30 0.00 -0.47 0.00 0.00 55.73 54.28 1v3f s ARG 73 Cb -0.05 0.29 -0.06 0.00 -0.57 0.00 0.00 34.95 34.56 1v3f s ARG 73 CO 0.07 -0.21 1.15 -1.25 -1.08 0.00 0.00 175.30 173.98 1v3f s PRO 74 N -3.12 4.50 0.19 3.89 0.04 -1.26 -1.55 135.00 137.69 1v3f s PRO 74 Ca -0.01 1.73 0.05 0.00 0.04 0.00 0.00 61.00 62.81 1v3f s PRO 74 Cb 0.02 -3.32 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 1v3f s PRO 74 CO -0.07 -0.12 -0.07 0.08 0.04 0.00 0.00 177.00 176.86 1v3f s VAL 75 N 0.53 1.24 0.00 -0.36 1.01 0.30 -4.58 120.40 118.54 1v3f s VAL 75 Ca 0.55 -2.08 0.00 0.00 0.00 0.00 0.00 61.98 60.45 1v3f s VAL 75 Cb -0.29 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.02 1v3f s VAL 75 CO 0.32 -0.56 0.00 0.61 0.00 0.00 0.00 175.10 175.46 1v3f n GLY 76 N -0.32 -1.01 0.15 4.51 0.00 -1.26 -2.01 105.19 105.26 1v3f n GLY 76 Ca -0.08 -1.63 -0.03 0.00 0.00 0.00 0.00 46.02 44.28 1v3f n GLY 76 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1v3f h VAL 77 N 0.00 1.41 0.71 1.61 -1.51 -1.96 -3.28 116.25 113.23 1v3f h VAL 77 Ca 0.00 -2.02 -0.03 0.00 -1.23 0.00 0.00 66.70 63.42 1v3f h VAL 77 Cb 0.00 2.06 0.01 0.00 -2.13 0.00 0.00 31.29 31.22 1v3f h VAL 77 CO 0.00 0.59 -0.34 -0.09 -1.23 0.00 0.00 177.57 176.49 1v3f h ARG 78 N 0.08 -0.92 0.00 5.19 9.65 -1.88 -3.45 114.38 123.06 1v3f h ARG 78 Ca -0.01 0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.94 1v3f h ARG 78 Cb 1.08 0.21 0.00 0.00 -1.39 0.00 0.00 29.97 29.87 1v3f h ARG 78 CO 0.09 -0.61 0.00 0.45 2.80 0.00 0.00 179.97 182.69 1v3f n SER 79 N -4.64 -0.70 -0.03 -3.80 2.88 -1.24 -4.89 113.62 101.21 1v3f n SER 79 Ca -0.12 -0.53 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 1v3f n SER 79 Cb 0.38 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1v3f n SER 79 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 1v3f n MET 80 N -1.23 0.00 0.00 -1.46 0.00 -1.26 -4.79 117.12 108.38 1v3f n MET 80 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1v3f n MET 80 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1v3f n MET 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1v3f n GLY 81 N 0.00 1.68 1.09 3.17 0.00 -1.26 -4.79 105.19 105.08 1v3f n GLY 81 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 0.00 -0.03 4.61 0.00 -1.26 -5.12 120.51 118.71 1v3f n ALA 82 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1v3f n ALA 82 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1v3f n ALA 82 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1v3f n ILE 83 N -2.10 0.00 -1.35 0.00 -0.00 -1.26 -4.75 119.36 109.90 1v3f n ILE 83 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 62.75 62.63 1v3f n ILE 83 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 39.64 39.59 1v3f n ILE 83 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1v3f n ARG 84 N 14.00 -1.32 -3.62 0.38 5.12 -1.26 -4.91 116.66 125.06 1v3f n ARG 84 Ca 0.00 0.90 -0.36 0.00 -1.93 0.00 0.00 57.85 56.46 1v3f n ARG 84 Cb 0.00 -5.13 -0.06 0.00 -1.16 0.00 0.00 32.46 26.11 1v3f n ARG 84 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1v3f n SER 85 N -0.78 4.26 0.00 0.55 7.64 -1.26 -5.00 113.62 119.03 1v3f n SER 85 Ca -0.12 -3.15 0.00 0.00 1.01 0.00 0.00 58.87 56.61 1v3f n SER 85 Cb 0.52 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.67 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 2.24 -1.98 6.65 0.23 0.00 -1.26 -4.40 105.19 106.67 1v3f n GLY 86 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1v3f n GLY 86 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1v3f n ASP 87 N 0.00 0.00 -1.51 1.61 5.75 -1.26 -2.00 116.55 119.15 1v3f n ASP 87 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 54.79 54.73 1v3f n ASP 87 Cb 0.00 0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.25 1v3f n ASP 87 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1v3f n LEU 88 N 0.00 4.45 -4.17 -2.12 -0.00 -1.26 -4.95 117.00 108.95 1v3f n LEU 88 Ca 0.00 -2.31 -0.26 0.00 -0.00 0.00 0.00 56.01 53.45 1v3f n LEU 88 Cb 0.00 -0.65 0.20 0.00 -0.00 0.00 0.00 43.42 42.97 1v3f n LEU 88 CO 0.00 0.65 -0.02 0.00 -0.00 0.00 0.00 177.39 178.02 1v3f n ALA 89 N -0.07 -2.91 -2.64 1.96 0.00 -0.84 -4.97 120.51 111.04 1v3f n ALA 89 Ca 0.25 -1.34 -0.10 0.00 0.00 0.00 0.00 53.44 52.25 1v3f n ALA 89 Cb 0.99 -1.31 0.03 0.00 0.00 0.00 0.00 19.45 19.16 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 -3.08 1.79 -1.44 0.00 1.02 -1.26 -4.87 120.64 112.80 1v3f n GLU 90 Ca 0.06 -3.56 -0.26 0.00 -0.02 0.00 0.00 57.16 53.37 1v3f n GLU 90 Cb 0.50 -1.55 -0.10 0.00 -0.02 0.00 0.00 31.44 30.27 1v3f n GLU 90 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1v3f n GLN 91 N -0.30 0.56 -3.91 3.49 1.13 -1.26 -4.74 117.38 112.35 1v3f n GLN 91 Ca 0.15 -1.76 -0.09 0.00 -1.94 0.00 0.00 57.00 53.36 1v3f n GLN 91 Cb 0.80 -3.52 -0.02 0.00 0.11 0.00 0.00 30.24 27.61 1v3f n GLN 91 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 1v3f s PHE 92 N 12.78 0.16 0.26 1.08 5.36 -1.26 -4.81 117.98 131.54 1v3f s PHE 92 Ca 0.74 -0.62 0.01 0.00 -0.96 0.00 0.00 56.93 56.10 1v3f s PHE 92 Cb 0.02 0.51 -0.03 0.00 -0.34 0.00 0.00 43.02 43.18 1v3f s PHE 92 CO 0.20 -1.24 0.24 -0.51 -1.46 0.00 0.00 175.22 172.45 1v3f s LEU 93 N -3.01 1.26 -0.42 6.12 1.43 -1.26 -5.11 118.68 117.68 1v3f s LEU 93 Ca 0.17 -1.48 0.06 0.00 -1.03 0.00 0.00 54.13 51.85 1v3f s LEU 93 Cb -0.04 0.65 0.22 0.00 0.03 0.00 0.00 46.19 47.05 1v3f s LEU 93 CO 0.10 -0.98 0.54 -0.67 0.23 0.00 0.00 176.35 175.57 1v3f n ASP 94 N -0.80 -0.87 -2.67 2.29 2.03 -1.26 -4.54 116.55 110.73 1v3f n ASP 94 Ca 0.03 -2.70 -0.14 0.00 0.52 0.00 0.00 54.79 52.50 1v3f n ASP 94 Cb 0.64 0.00 -0.05 0.00 -0.72 0.00 0.00 41.12 40.99 1v3f n ASP 94 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1v3f n ASP 95 N 2.07 -0.73 -1.82 1.67 8.00 -1.26 -4.65 116.55 119.83 1v3f n ASP 95 Ca 0.22 -2.63 -0.16 0.00 0.71 0.00 0.00 54.79 52.93 1v3f n ASP 95 Cb 0.53 1.54 0.10 0.00 -0.02 0.00 0.00 41.12 43.27 1v3f n ASP 95 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1v3f n SER 96 N -1.90 4.05 0.01 -2.24 3.41 -1.26 -1.95 113.62 113.74 1v3f n SER 96 Ca 0.04 -3.06 0.00 0.00 -0.26 0.00 0.00 58.87 55.59 1v3f n SER 96 Cb 0.47 -0.77 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 1v3f n SER 96 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1v3f n THR 97 N -0.45 0.04 -1.67 6.66 -2.24 -1.26 -5.00 114.28 110.36 1v3f n THR 97 Ca 0.38 0.01 -0.58 0.00 -2.27 0.00 0.00 64.05 61.59 1v3f n THR 97 Cb 1.13 -0.80 -0.07 0.00 -2.10 0.00 0.00 70.33 68.49 1v3f n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1v3f n ALA 98 N -2.74 -0.81 -2.66 6.98 0.00 -1.26 -4.76 120.51 115.27 1v3f n ALA 98 Ca 0.00 0.45 -0.32 0.00 0.00 0.00 0.00 53.44 53.57 1v3f n ALA 98 Cb 0.13 -2.11 -0.09 0.00 0.00 0.00 0.00 19.45 17.38 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 2.48 3.41 -0.07 0.00 1.43 -0.85 0.16 118.68 125.23 1v3f s LEU 99 Ca 0.96 -0.06 -0.06 0.00 -1.03 0.00 0.00 54.13 53.93 1v3f s LEU 99 Cb -1.12 -1.97 0.02 0.00 0.03 0.00 0.00 46.19 43.15 1v3f s LEU 99 CO 0.63 0.27 0.19 -0.31 0.23 0.00 0.00 176.35 177.36 1v3f s TYR 100 N -1.07 -0.21 0.27 0.29 2.02 -1.03 0.11 117.35 117.73 1v3f s TYR 100 Ca 0.19 0.52 0.05 0.00 -0.37 0.00 0.00 57.07 57.47 1v3f s TYR 100 Cb -0.11 0.06 -0.06 0.00 -0.40 0.00 0.00 41.96 41.45 1v3f s TYR 100 CO 0.10 -0.11 -0.02 -0.08 -1.57 0.00 0.00 175.55 173.86 1v3f s THR 101 N 0.25 1.40 -0.08 -0.71 -1.32 -0.59 -1.32 115.64 113.26 1v3f s THR 101 Ca -0.01 -2.08 -0.27 0.00 -1.21 0.00 0.00 61.69 58.12 1v3f s THR 101 Cb -0.03 -2.47 -0.02 0.00 -1.51 0.00 0.00 72.50 68.47 1v3f s THR 101 CO -0.01 -0.26 0.88 -0.36 -2.21 0.00 0.00 174.62 172.66 1v3f s PHE 102 N -3.17 3.55 0.51 9.09 0.08 -1.26 0.81 117.98 127.58 1v3f s PHE 102 Ca 0.30 1.45 -0.21 0.00 0.12 0.00 0.00 56.93 58.60 1v3f s PHE 102 Cb 0.05 -3.03 -0.07 0.00 -0.57 0.00 0.00 43.02 39.40 1v3f s PHE 102 CO 0.11 -0.09 1.11 0.00 -0.10 0.00 0.00 175.22 176.25 1v3f s ALA 103 N 1.47 2.81 0.00 5.36 0.00 -0.60 -3.44 121.76 127.37 1v3f s ALA 103 Ca 0.44 0.79 0.00 0.00 0.00 0.00 0.00 51.96 53.19 1v3f s ALA 103 Cb -0.18 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1v3f s ALA 103 CO 0.19 -0.61 0.00 0.39 0.00 0.00 0.00 175.76 175.73 1v3f n GLU 104 N -1.00 0.00 0.00 0.00 1.02 -1.26 -4.71 120.64 114.69 1v3f n GLU 104 Ca 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1v3f n GLU 104 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.93 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 3.20 0.00 -1.00 1.62 7.64 -1.22 -5.11 113.62 118.74 1v3f n SER 105 Ca 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.88 1v3f n SER 105 Cb 0.00 0.60 -0.00 0.00 -1.01 0.00 0.00 64.21 63.80 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 -1.56 -0.59 -1.52 1.43 0.18 -1.26 -5.07 117.16 108.77 1v3f n TYR 106 Ca 0.00 -0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.39 1v3f n TYR 106 Cb 0.00 0.00 -0.09 0.00 -0.38 0.00 0.00 39.34 38.87 1v3f n TYR 106 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 1v3f n LYS 107 N -0.00 0.53 -2.94 -3.48 4.76 -1.26 -4.75 118.16 111.02 1v3f n LYS 107 Ca -0.00 -0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.42 1v3f n LYS 107 Cb 0.00 -2.49 0.00 0.00 -1.84 0.00 0.00 35.03 30.71 1v3f n LYS 107 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 1v3f s LYS 108 N 8.62 0.91 0.38 1.97 2.20 -1.26 -5.14 119.74 127.42 1v3f s LYS 108 Ca 1.17 -0.67 -0.25 0.00 -0.36 0.00 0.00 55.97 55.85 1v3f s LYS 108 Cb -0.71 0.02 -0.09 0.00 -1.51 0.00 0.00 37.83 35.53 1v3f s LYS 108 CO 0.38 -1.19 1.12 0.21 -0.36 0.00 0.00 175.35 175.50 1v3f s LYS 109 N 1.31 4.16 -0.07 4.03 2.20 -1.26 -5.04 119.74 125.08 1v3f s LYS 109 Ca 0.24 1.72 -0.03 0.00 -0.36 0.00 0.00 55.97 57.54 1v3f s LYS 109 Cb -0.01 -2.69 0.04 0.00 -1.51 0.00 0.00 37.83 33.66 1v3f s LYS 109 CO -0.06 -0.19 0.13 0.08 -0.36 0.00 0.00 175.35 174.94 1v3f s VAL 110 N -1.46 -0.18 0.21 4.02 1.01 -1.26 -5.15 120.40 117.58 1v3f s VAL 110 Ca 0.56 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.87 1v3f s VAL 110 Cb -0.28 -0.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 1v3f s VAL 110 CO 0.35 0.14 0.39 -0.55 0.00 0.00 0.00 175.10 175.43 1v3f s SER 111 N 2.00 6.37 0.00 3.32 0.15 -1.26 -5.09 113.70 119.19 1v3f s SER 111 Ca 0.01 0.36 0.00 0.00 0.70 0.00 0.00 55.95 57.01 1v3f s SER 111 Cb -0.12 -1.99 0.00 0.00 -1.71 0.00 0.00 66.02 62.20 1v3f s SER 111 CO -0.05 -0.05 0.00 -0.24 1.20 0.00 0.00 173.24 174.10 1v3f n SER 112 N -0.77 0.00 -3.55 5.45 2.88 -1.26 -5.08 113.62 111.30 1v3f n SER 112 Ca -0.05 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.34 1v3f n SER 112 Cb 0.54 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.95 1v3f n SER 112 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1v3f s LYS 113 N -2.00 0.84 0.00 -1.46 2.36 -1.26 -5.07 119.74 113.16 1v3f s LYS 113 Ca 0.00 0.20 0.00 0.00 -2.55 0.00 0.00 55.97 53.62 1v3f s LYS 113 Cb 0.00 0.40 0.00 0.00 -1.05 0.00 0.00 37.83 37.18 1v3f s LYS 113 CO 0.00 -0.26 0.00 -1.91 1.55 0.00 0.00 175.35 174.73 1v3f n GLU 114 N 0.81 0.00 -0.99 4.03 2.13 -1.26 -5.15 120.64 120.21 1v3f n GLU 114 Ca -0.15 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.32 1v3f n GLU 114 Cb 0.58 0.00 0.05 0.00 0.27 0.00 0.00 31.44 32.34 1v3f n GLU 114 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 1v3f n SER 115 N -2.76 -5.05 -3.61 4.31 3.41 -1.26 -5.01 113.62 103.66 1v3f n SER 115 Ca 0.00 0.25 -0.05 0.00 -0.26 0.00 0.00 58.87 58.81 1v3f n SER 115 Cb 0.00 -0.86 -0.04 0.00 -0.26 0.00 0.00 64.21 63.05 1v3f n SER 115 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1v3f s GLY 116 N -1.19 -0.12 -0.13 5.00 0.00 -1.26 -5.13 107.32 104.49 1v3f s GLY 116 Ca 0.45 2.27 -0.29 0.00 0.00 0.00 0.00 44.72 47.15 1v3f s GLY 116 CO 0.78 0.95 1.26 2.56 0.00 0.00 0.00 173.10 178.65 1v3f s PRO 117 N -1.37 4.26 -0.16 2.90 0.04 -1.26 -4.98 135.00 134.42 1v3f s PRO 117 Ca 0.05 1.69 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 1v3f s PRO 117 Cb -0.01 -3.71 0.12 0.00 0.04 0.00 0.00 34.50 30.94 1v3f s PRO 117 CO -0.04 -0.64 0.96 0.45 0.04 0.00 0.00 177.00 177.77 1v3f s SER 118 N 1.87 -0.42 -0.52 6.66 0.15 -1.26 -5.11 113.70 115.06 1v3f s SER 118 Ca 0.56 0.51 0.04 0.00 0.70 0.00 0.00 55.95 57.75 1v3f s SER 118 Cb -0.23 0.42 0.14 0.00 -1.71 0.00 0.00 66.02 64.63 1v3f s SER 118 CO 0.17 -0.35 0.29 -0.44 1.20 0.00 0.00 173.24 174.12 1v3f s SER 119 N -0.93 4.15 0.00 5.45 0.01 -1.26 -5.31 113.70 115.81 1v3f s SER 119 Ca -0.02 -3.05 0.08 0.00 1.31 0.00 0.00 55.95 54.27 1v3f s SER 119 Cb -0.01 -1.45 0.49 0.00 0.21 0.00 0.00 66.02 65.25 1v3f s SER 119 CO 0.02 -0.22 0.94 0.61 0.41 0.00 0.00 173.24 175.00