#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oow s MET 2 N 0.00 0.90 -0.13 -0.52 1.75 -0.29 -1.01 119.30 120.00 2oow s MET 2 Ca 0.00 -0.05 0.03 0.00 -1.25 0.00 0.00 55.69 54.41 2oow s MET 2 Cb 0.00 -1.06 0.01 0.00 2.84 0.00 0.00 34.83 36.62 2oow s MET 2 CO 0.00 -0.21 -0.22 0.12 -0.65 0.00 0.00 175.02 174.07 2oow s PHE 3 N 1.51 2.56 -0.05 4.11 5.36 -0.13 -0.93 117.98 130.41 2oow s PHE 3 Ca -0.01 -1.22 0.05 0.00 -0.96 0.00 0.00 56.93 54.78 2oow s PHE 3 Cb -0.13 -1.74 -0.01 0.00 -0.34 0.00 0.00 43.02 40.80 2oow s PHE 3 CO -0.04 -0.55 -0.21 0.42 -1.46 0.00 0.00 175.22 173.39 2oow s ILE 4 N 0.71 1.71 -0.12 3.12 1.01 -0.46 -1.00 121.20 126.17 2oow s ILE 4 Ca -0.10 -0.87 0.01 0.00 0.00 0.00 0.00 60.65 59.68 2oow s ILE 4 Cb -0.16 -1.45 0.02 0.00 0.01 0.00 0.00 42.46 40.87 2oow s ILE 4 CO 0.01 0.48 -0.12 -0.69 0.00 0.00 0.00 174.94 174.62 2oow s VAL 5 N -0.05 1.34 -0.15 2.92 1.01 0.22 -1.53 120.40 124.17 2oow s VAL 5 Ca -0.04 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 2oow s VAL 5 Cb -0.12 -1.28 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2oow s VAL 5 CO 0.03 0.42 -0.09 0.20 0.00 0.00 0.00 175.10 175.66 2oow s ASN 6 N 1.37 4.34 0.05 3.32 0.01 -0.29 0.08 114.94 123.83 2oow s ASN 6 Ca 0.01 -0.25 -0.11 0.00 -0.71 0.00 0.00 52.86 51.79 2oow s ASN 6 Cb -0.13 -1.69 0.01 0.00 0.41 0.00 0.00 41.25 39.85 2oow s ASN 6 CO -0.07 0.15 0.24 0.28 -1.51 0.00 0.00 177.10 176.20 2oow s THR 7 N 0.43 0.10 -2.11 1.60 -1.32 -0.13 -0.92 115.64 113.28 2oow s THR 7 Ca -0.07 -0.82 0.28 0.00 -1.21 0.00 0.00 61.69 59.87 2oow s THR 7 Cb -0.15 -0.95 0.52 0.00 -1.51 0.00 0.00 72.50 70.41 2oow s THR 7 CO 0.04 -0.45 1.80 -0.46 -2.21 0.00 0.00 174.62 173.33 2oow n ASN 8 N 0.59 1.00 -4.76 8.08 6.94 -1.23 -1.08 115.26 124.79 2oow n ASN 8 Ca -0.18 -1.13 -0.41 0.00 -0.02 0.00 0.00 54.58 52.84 2oow n ASN 8 Cb 0.59 0.01 -0.02 0.00 -2.36 0.00 0.00 39.78 38.01 2oow n ASN 8 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2oow s VAL 9 N -2.19 2.66 0.54 3.53 1.01 -1.26 -4.25 120.40 120.43 2oow s VAL 9 Ca 0.35 0.63 -0.22 0.00 0.00 0.00 0.00 61.98 62.74 2oow s VAL 9 Cb 0.21 -3.40 -0.05 0.00 0.00 0.00 0.00 36.38 33.14 2oow s VAL 9 CO 0.40 0.13 1.30 -2.84 0.00 0.00 0.00 175.10 174.10 2oow s PRO 10 N -1.34 3.23 0.27 2.72 0.02 -1.26 -1.10 135.00 137.54 2oow s PRO 10 Ca 0.53 2.10 -0.00 0.00 0.02 0.00 0.00 61.00 63.64 2oow s PRO 10 Cb -0.41 -2.24 0.54 0.00 0.02 0.00 0.00 34.50 32.41 2oow s PRO 10 CO 0.50 -1.08 1.80 -0.09 -0.33 0.00 0.00 177.00 177.81 2oow h ARG 11 N 1.49 0.78 0.00 5.54 1.12 -1.93 0.87 114.38 122.26 2oow h ARG 11 Ca -0.51 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 58.32 2oow h ARG 11 Cb 1.29 -0.18 0.00 0.00 -0.01 0.00 0.00 29.97 31.07 2oow h ARG 11 CO 0.57 0.52 0.00 0.00 -3.11 0.00 0.00 179.97 177.95 2oow h ALA 12 N 1.54 1.00 -0.01 2.80 0.00 -2.03 -1.36 119.26 121.20 2oow h ALA 12 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2oow h ALA 12 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2oow h ALA 12 CO -0.31 0.00 -0.14 0.43 0.00 0.00 0.00 179.25 179.23 2oow n SER 13 N -2.94 1.03 -4.58 0.00 7.64 0.30 -4.74 113.62 110.34 2oow n SER 13 Ca -0.02 -1.03 -0.42 0.00 1.01 0.00 0.00 58.87 58.42 2oow n SER 13 Cb 0.12 0.05 -0.06 0.00 -1.01 0.00 0.00 64.21 63.31 2oow n SER 13 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2oow s VAL 14 N -2.32 4.83 0.48 0.44 1.01 -0.51 -4.71 120.40 119.61 2oow s VAL 14 Ca 0.30 0.74 -0.23 0.00 0.00 0.00 0.00 61.98 62.79 2oow s VAL 14 Cb 0.20 -4.13 -0.07 0.00 0.00 0.00 0.00 36.38 32.39 2oow s VAL 14 CO 0.45 -0.35 1.24 -2.16 0.00 0.00 0.00 175.10 174.28 2oow s PRO 15 N 2.86 3.58 0.40 2.72 0.04 -1.26 -4.96 135.00 138.38 2oow s PRO 15 Ca 0.27 1.96 -0.27 0.00 0.04 0.00 0.00 61.00 63.01 2oow s PRO 15 Cb -0.14 -2.40 -0.09 0.00 0.04 0.00 0.00 34.50 31.91 2oow s PRO 15 CO 0.15 -0.75 1.39 -0.51 0.04 0.00 0.00 177.00 177.33 2oow s ASP 16 N -1.16 6.23 0.00 6.66 -0.00 -1.26 -2.03 116.67 125.10 2oow s ASP 16 Ca 0.65 2.85 0.00 0.00 -0.00 0.00 0.00 52.55 56.06 2oow s ASP 16 Cb -0.33 -2.65 0.00 0.00 -0.00 0.00 0.00 42.92 39.93 2oow s ASP 16 CO 0.40 -0.93 0.00 0.61 -0.00 0.00 0.00 175.17 175.25 2oow n GLY 17 N 0.60 0.93 0.22 0.21 0.00 -1.26 -4.96 105.19 100.93 2oow n GLY 17 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.98 2oow n GLY 17 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2oow h PHE 18 N 0.00 0.69 -0.64 1.61 3.57 -1.79 -0.31 116.94 120.07 2oow h PHE 18 Ca 0.00 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.45 2oow h PHE 18 Cb 0.00 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 2oow h PHE 18 CO 0.00 0.45 0.14 -0.07 -2.23 0.00 0.00 178.31 176.60 2oow h LEU 19 N 0.73 0.95 -0.67 0.59 3.38 -1.93 -1.36 115.31 117.00 2oow h LEU 19 Ca 0.20 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2oow h LEU 19 Cb -0.06 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 2oow h LEU 19 CO -0.04 0.93 0.00 0.28 0.09 0.00 0.00 178.44 179.70 2oow h SER 20 N 0.96 1.01 -0.39 -0.43 0.02 -1.89 -1.35 113.55 111.48 2oow h SER 20 Ca 0.20 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 2oow h SER 20 Cb 0.36 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 2oow h SER 20 CO 0.00 1.06 0.09 -0.08 -1.14 0.00 0.00 176.83 176.76 2oow h GLU 21 N 0.95 0.63 -0.67 3.45 4.81 -0.74 -1.23 114.58 121.78 2oow h GLU 21 Ca 0.17 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2oow h GLU 21 Cb 0.54 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 2oow h GLU 21 CO 0.03 0.66 0.44 -0.07 -0.73 0.00 0.00 179.01 179.34 2oow h LEU 22 N 0.49 0.77 0.14 1.64 3.38 -1.11 -0.12 115.31 120.51 2oow h LEU 22 Ca 0.12 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2oow h LEU 22 Cb 0.32 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2oow h LEU 22 CO 0.00 0.56 -0.12 0.74 0.09 0.00 0.00 178.44 179.72 2oow h THR 23 N 0.91 0.74 -0.31 0.22 2.02 -1.00 0.15 112.91 115.64 2oow h THR 23 Ca 0.24 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.42 2oow h THR 23 Cb -0.10 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2oow h THR 23 CO -0.05 0.00 0.17 -0.61 0.37 0.00 0.00 175.52 175.40 2oow h GLN 24 N -0.27 0.42 -0.63 6.66 -0.00 -1.01 -0.98 115.11 119.29 2oow h GLN 24 Ca -0.00 -0.05 -0.07 0.00 -0.00 0.00 0.00 58.65 58.53 2oow h GLN 24 Cb 0.25 -0.08 -0.03 0.00 0.00 0.00 0.00 27.48 27.62 2oow h GLN 24 CO -0.01 0.35 0.12 1.96 0.00 0.00 0.00 178.83 181.25 2oow h GLN 25 N 0.38 1.01 -0.19 1.69 1.08 -0.93 -2.01 115.11 116.14 2oow h GLN 25 Ca 0.11 -0.25 -0.15 0.00 -1.45 0.00 0.00 58.65 56.91 2oow h GLN 25 Cb 0.05 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 2oow h GLN 25 CO -0.02 0.92 -0.50 -0.07 -0.95 0.00 0.00 178.83 178.21 2oow h LEU 26 N 0.96 0.57 -0.45 1.46 3.38 -0.82 -0.19 115.31 120.21 2oow h LEU 26 Ca 0.20 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 2oow h LEU 26 Cb 0.39 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 2oow h LEU 26 CO 0.01 0.97 0.21 0.00 0.09 0.00 0.00 178.44 179.72 2oow h ALA 27 N 1.04 0.58 -0.25 1.53 0.00 -0.95 -0.02 119.26 121.20 2oow h ALA 27 Ca 0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2oow h ALA 27 Cb 1.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2oow h ALA 27 CO 0.09 0.16 0.05 0.37 0.00 0.00 0.00 179.25 179.92 2oow h GLN 28 N 0.59 0.41 -0.52 0.00 4.15 -1.18 -0.39 115.11 118.18 2oow h GLN 28 Ca 0.15 -0.11 -0.08 0.00 0.77 0.00 0.00 58.65 59.39 2oow h GLN 28 Cb 0.13 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 2oow h GLN 28 CO -0.02 0.53 0.01 0.00 -1.93 0.00 0.00 178.83 177.43 2oow h ALA 29 N 0.87 0.70 0.00 3.38 0.00 -0.87 -3.21 119.26 120.12 2oow h ALA 29 Ca 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2oow h ALA 29 Cb 0.31 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2oow h ALA 29 CO 0.00 0.50 -0.71 1.79 0.00 0.00 0.00 179.25 180.84 2oow h THR 30 N 0.78 0.10 0.00 0.00 1.35 -1.04 -3.48 112.91 110.62 2oow h THR 30 Ca 0.15 -1.17 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 2oow h THR 30 Cb 0.51 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 2oow h THR 30 CO 0.02 0.06 0.00 0.61 -0.25 0.00 0.00 175.52 175.96 2oow n GLY 31 N 1.18 0.49 3.74 5.82 0.00 -0.17 -4.99 105.19 111.25 2oow n GLY 31 Ca 0.00 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.16 2oow n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oow s LYS 32 N -1.13 2.69 0.44 1.61 1.02 -1.10 -5.03 119.74 118.23 2oow s LYS 32 Ca 0.00 -0.95 -0.26 0.00 0.02 0.00 0.00 55.97 54.79 2oow s LYS 32 Cb 0.00 -2.54 -0.09 0.00 -0.52 0.00 0.00 37.83 34.69 2oow s LYS 32 CO 0.00 0.48 1.45 -2.14 -0.92 0.00 0.00 175.35 174.22 2oow s PRO 33 N -2.94 3.76 0.62 -1.68 0.02 -1.26 -4.55 135.00 128.97 2oow s PRO 33 Ca 0.29 2.47 0.34 0.00 0.02 0.00 0.00 61.00 64.12 2oow s PRO 33 Cb -0.10 -2.72 1.95 0.00 0.02 0.00 0.00 34.50 33.65 2oow s PRO 33 CO 0.21 -0.78 2.21 -1.00 -0.33 0.00 0.00 177.00 177.31 2oow h PRO 34 N 2.45 0.00 0.00 5.54 0.13 -1.92 -1.33 132.00 136.87 2oow h PRO 34 Ca -0.51 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2oow h PRO 34 Cb 1.26 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 2oow h PRO 34 CO 0.62 0.00 -0.01 1.96 -0.23 0.00 0.00 178.00 180.33 2oow h GLN 35 N 0.00 0.00 -0.01 0.86 7.50 -1.98 -2.01 115.11 119.47 2oow h GLN 35 Ca 0.03 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.18 2oow h GLN 35 Cb 0.23 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.76 2oow h GLN 35 CO -0.00 0.01 -0.52 0.66 -1.50 0.00 0.00 178.83 177.48 2oow n TYR 36 N -3.20 0.00 -3.03 2.96 4.01 -0.50 -4.93 117.16 112.47 2oow n TYR 36 Ca -0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.32 2oow n TYR 36 Cb 0.14 -0.04 -0.05 0.00 -0.31 0.00 0.00 39.34 39.08 2oow n TYR 36 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2oow s ILE 37 N -2.59 5.00 -0.05 -0.72 -1.09 -0.76 -2.68 121.20 118.31 2oow s ILE 37 Ca 0.18 1.41 0.05 0.00 -2.23 0.00 0.00 60.65 60.06 2oow s ILE 37 Cb 0.18 -4.03 -0.02 0.00 -1.58 0.00 0.00 42.46 37.01 2oow s ILE 37 CO 0.61 0.15 -0.19 0.00 -1.23 0.00 0.00 174.94 174.28 2oow s ALA 38 N 1.50 2.43 0.04 9.38 0.00 -0.18 -4.99 121.76 129.94 2oow s ALA 38 Ca 0.35 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 51.33 2oow s ALA 38 Cb -0.17 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.10 2oow s ALA 38 CO 0.14 0.48 -0.12 0.14 0.00 0.00 0.00 175.76 176.40 2oow s VAL 39 N -0.46 0.94 -0.12 0.00 -7.23 -1.26 -0.96 120.40 111.31 2oow s VAL 39 Ca 0.05 -0.98 -0.05 0.00 -1.81 0.00 0.00 61.98 59.19 2oow s VAL 39 Cb -0.12 -0.88 0.06 0.00 0.56 0.00 0.00 36.38 36.00 2oow s VAL 39 CO 0.01 -0.09 0.27 -2.28 -0.31 0.00 0.00 175.10 172.70 2oow s HIS 40 N -0.93 -0.40 -0.11 2.82 5.04 -0.17 -4.96 115.29 116.57 2oow s HIS 40 Ca -0.01 0.93 0.03 0.00 -1.54 0.00 0.00 55.06 54.47 2oow s HIS 40 Cb -0.08 0.01 0.00 0.00 0.04 0.00 0.00 32.58 32.56 2oow s HIS 40 CO 0.01 -0.31 -0.22 0.08 -2.34 0.00 0.00 174.74 171.96 2oow s VAL 41 N 1.95 1.96 -0.37 0.89 1.01 -1.26 -0.61 120.40 123.97 2oow s VAL 41 Ca -0.03 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.03 2oow s VAL 41 Cb -0.11 -1.72 0.11 0.00 0.00 0.00 0.00 36.38 34.66 2oow s VAL 41 CO -0.09 0.54 0.11 -0.69 0.00 0.00 0.00 175.10 174.97 2oow s VAL 42 N 0.54 1.99 0.82 2.92 1.01 0.11 -4.98 120.40 122.82 2oow s VAL 42 Ca -0.14 -2.34 -0.07 0.00 0.00 0.00 0.00 61.98 59.43 2oow s VAL 42 Cb -0.17 -2.46 0.17 0.00 0.00 0.00 0.00 36.38 33.93 2oow s VAL 42 CO 0.05 -0.67 1.11 -0.81 0.00 0.00 0.00 175.10 174.78 2oow n PRO 43 N 4.13 -0.57 -2.43 2.72 -0.04 -1.26 -0.96 135.00 136.58 2oow n PRO 43 Ca 0.03 -2.42 -0.18 0.00 -0.04 0.00 0.00 63.50 60.89 2oow n PRO 43 Cb 0.40 -0.93 -0.01 0.00 -0.04 0.00 0.00 33.50 32.92 2oow n PRO 43 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2oow n ASP 44 N -3.28 -5.27 -4.84 3.54 8.00 -0.26 -4.83 116.55 109.60 2oow n ASP 44 Ca 0.16 0.04 -0.32 0.00 0.71 0.00 0.00 54.79 55.38 2oow n ASP 44 Cb 0.58 -4.41 -0.06 0.00 -0.02 0.00 0.00 41.12 37.21 2oow n ASP 44 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2oow s GLN 45 N -5.06 4.03 -0.78 -1.24 -1.52 -0.24 -4.94 119.66 109.91 2oow s GLN 45 Ca 0.01 0.80 -0.21 0.00 -1.95 0.00 0.00 55.36 54.01 2oow s GLN 45 Cb -0.00 -2.33 0.10 0.00 -0.22 0.00 0.00 33.01 30.56 2oow s GLN 45 CO 0.01 0.04 1.02 -0.51 -0.25 0.00 0.00 175.29 175.61 2oow s LEU 46 N -3.25 4.75 0.15 2.90 1.43 -1.26 -4.12 118.68 119.28 2oow s LEU 46 Ca 0.56 -1.51 -0.06 0.00 -1.03 0.00 0.00 54.13 52.10 2oow s LEU 46 Cb -0.10 -2.40 -0.02 0.00 0.03 0.00 0.00 46.19 43.70 2oow s LEU 46 CO 0.19 -1.25 0.19 0.00 0.23 0.00 0.00 176.35 175.72 2oow s MET 47 N 3.35 1.06 0.01 1.70 0.23 -1.26 -5.09 119.30 119.30 2oow s MET 47 Ca 0.26 -1.27 -0.05 0.00 -1.03 0.00 0.00 55.69 53.60 2oow s MET 47 Cb -0.12 0.32 -0.00 0.00 -1.53 0.00 0.00 34.83 33.50 2oow s MET 47 CO 0.01 -0.36 0.09 0.00 -2.03 0.00 0.00 175.02 172.73 2oow s ALA 48 N -4.00 -0.20 -0.12 3.16 0.00 -1.26 -4.66 121.76 114.69 2oow s ALA 48 Ca 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 51.96 51.89 2oow s ALA 48 Cb 0.05 0.12 0.03 0.00 0.00 0.00 0.00 23.12 23.32 2oow s ALA 48 CO 0.00 -0.19 -0.04 0.12 0.00 0.00 0.00 175.76 175.65 2oow s PHE 49 N -1.39 1.26 -1.33 0.00 5.36 -0.26 -4.69 117.98 116.93 2oow s PHE 49 Ca -0.15 -0.64 0.00 0.00 -0.96 0.00 0.00 56.93 55.18 2oow s PHE 49 Cb -0.08 -1.11 0.00 0.00 -0.34 0.00 0.00 43.02 41.48 2oow s PHE 49 CO 0.01 -0.49 0.00 0.41 -1.46 0.00 0.00 175.22 173.69 2oow n GLY 50 N 5.00 0.90 2.36 13.12 0.00 -1.26 -1.83 105.19 123.48 2oow n GLY 50 Ca -0.11 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2oow n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oow n GLY 51 N -1.23 1.61 3.85 -0.02 0.00 -1.26 -5.03 105.19 103.11 2oow n GLY 51 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 2oow n GLY 51 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oow s SER 52 N -3.28 6.14 -0.14 1.61 0.15 -0.76 -5.01 113.70 112.41 2oow s SER 52 Ca 0.00 0.33 0.14 0.00 0.70 0.00 0.00 55.95 57.12 2oow s SER 52 Cb 0.00 -1.91 0.66 0.00 -1.71 0.00 0.00 66.02 63.06 2oow s SER 52 CO 0.00 0.32 1.54 -1.54 1.20 0.00 0.00 173.24 174.76 2oow n SER 53 N 1.45 4.56 -4.72 5.45 3.41 -1.26 -1.10 113.62 121.41 2oow n SER 53 Ca -0.15 -2.56 -0.30 0.00 -0.26 0.00 0.00 58.87 55.60 2oow n SER 53 Cb 0.54 -0.59 0.13 0.00 -0.26 0.00 0.00 64.21 64.03 2oow n SER 53 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2oow s GLU 54 N -2.11 1.49 0.09 4.33 0.41 -1.26 -4.87 118.70 116.78 2oow s GLU 54 Ca 0.45 1.06 -0.36 0.00 -0.41 0.00 0.00 54.97 55.71 2oow s GLU 54 Cb 0.32 -1.82 -0.17 0.00 -1.78 0.00 0.00 34.13 30.68 2oow s GLU 54 CO 0.18 -2.15 1.24 -2.30 -0.49 0.00 0.00 175.26 171.75 2oow n PRO 55 N -3.85 0.92 -3.97 0.39 -0.02 -1.26 -4.83 135.00 122.37 2oow n PRO 55 Ca 0.08 0.33 -0.09 0.00 -2.02 0.00 0.00 63.50 61.80 2oow n PRO 55 Cb 0.54 -1.91 -0.04 0.00 -0.02 0.00 0.00 33.50 32.07 2oow n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oow s ALA 57 N -3.77 -1.04 -0.20 0.00 0.00 -0.61 -3.55 121.76 112.60 2oow s ALA 57 Ca 0.21 1.18 -0.00 0.00 0.00 0.00 0.00 51.96 53.35 2oow s ALA 57 Cb -0.02 -0.68 0.02 0.00 0.00 0.00 0.00 23.12 22.43 2oow s ALA 57 CO 0.10 -0.20 -0.15 -0.51 0.00 0.00 0.00 175.76 175.00 2oow s LEU 58 N 0.22 2.42 0.33 0.00 1.43 -0.09 -1.80 118.68 121.19 2oow s LEU 58 Ca -0.00 -0.66 0.04 0.00 -1.03 0.00 0.00 54.13 52.48 2oow s LEU 58 Cb -0.03 -1.55 -0.06 0.00 0.03 0.00 0.00 46.19 44.58 2oow s LEU 58 CO 0.01 -0.02 0.06 0.00 0.23 0.00 0.00 176.35 176.62 2oow s SER 60 N -3.49 -0.27 -0.13 0.00 1.04 -0.58 -1.00 113.70 109.27 2oow s SER 60 Ca 0.36 0.41 -0.01 0.00 0.48 0.00 0.00 55.95 57.19 2oow s SER 60 Cb 0.08 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.75 2oow s SER 60 CO 0.15 -0.25 -0.05 -0.22 0.98 0.00 0.00 173.24 173.86 2oow s LEU 61 N -0.45 1.25 -0.11 2.42 2.96 -0.06 -1.35 118.68 123.34 2oow s LEU 61 Ca -0.06 -0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 53.40 2oow s LEU 61 Cb -0.04 -0.79 -0.03 0.00 0.50 0.00 0.00 46.19 45.83 2oow s LEU 61 CO 0.02 -0.17 -0.03 -1.00 -1.32 0.00 0.00 176.35 173.85 2oow s HIS 62 N 1.73 3.06 -0.07 5.38 3.76 -0.11 -1.23 115.29 127.81 2oow s HIS 62 Ca 0.03 -0.03 -0.19 0.00 -0.15 0.00 0.00 55.06 54.72 2oow s HIS 62 Cb -0.14 -1.84 0.04 0.00 1.11 0.00 0.00 32.58 31.76 2oow s HIS 62 CO -0.08 0.25 0.45 0.45 -0.85 0.00 0.00 174.74 174.96 2oow s SER 63 N -0.39 -0.39 -0.69 1.40 0.15 -0.61 -1.14 113.70 112.03 2oow s SER 63 Ca 0.07 0.47 -0.22 0.00 0.70 0.00 0.00 55.95 56.97 2oow s SER 63 Cb -0.12 0.54 0.08 0.00 -1.71 0.00 0.00 66.02 64.80 2oow s SER 63 CO 0.02 -0.42 0.98 -0.63 1.20 0.00 0.00 173.24 174.40 2oow s ILE 64 N -0.88 4.37 0.00 6.45 1.01 -1.26 -0.67 121.20 130.21 2oow s ILE 64 Ca -0.09 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.06 2oow s ILE 64 Cb -0.03 -4.69 0.00 0.00 0.01 0.00 0.00 42.46 37.74 2oow s ILE 64 CO 0.05 -1.46 0.00 0.61 0.00 0.00 0.00 174.94 174.14 2oow n GLY 65 N 5.36 -2.24 2.32 6.18 0.00 -1.26 -4.94 105.19 110.62 2oow n GLY 65 Ca -0.01 -1.52 -0.14 0.00 0.00 0.00 0.00 46.02 44.35 2oow n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oow n LYS 66 N -0.88 -1.08 -4.85 1.61 4.76 -1.26 -4.92 118.16 111.54 2oow n LYS 66 Ca 0.00 0.81 -0.28 0.00 -2.87 0.00 0.00 58.31 55.97 2oow n LYS 66 Cb 0.01 -5.03 -0.17 0.00 -1.84 0.00 0.00 35.03 28.00 2oow n LYS 66 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2oow s ILE 67 N -2.64 1.55 0.00 -0.18 -1.09 -1.26 -4.85 121.20 112.73 2oow s ILE 67 Ca 0.00 -0.72 0.00 0.00 -2.23 0.00 0.00 60.65 57.70 2oow s ILE 67 Cb 0.00 -1.37 0.00 0.00 -1.58 0.00 0.00 42.46 39.51 2oow s ILE 67 CO 0.00 0.45 0.00 0.61 -1.23 0.00 0.00 174.94 174.77 2oow n GLY 68 N 3.71 -0.43 0.31 6.18 0.00 -1.26 -4.99 105.19 108.70 2oow n GLY 68 Ca -0.21 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.78 2oow n GLY 68 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2oow h GLY 69 N 0.00 -1.30 0.96 -0.02 0.00 -1.99 0.24 103.07 100.96 2oow h GLY 69 Ca 0.00 0.73 -0.07 0.00 0.00 0.00 0.00 47.33 48.00 2oow h GLY 69 CO 0.00 -0.33 0.01 0.00 0.00 0.00 0.00 176.54 176.22 2oow h ALA 70 N -0.54 0.57 -0.58 3.60 0.00 -2.00 -2.61 119.26 117.71 2oow h ALA 70 Ca 0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 2oow h ALA 70 Cb 0.42 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2oow h ALA 70 CO -0.36 0.35 0.30 1.96 0.00 0.00 0.00 179.25 181.50 2oow h GLN 71 N 0.58 0.82 -0.33 0.00 4.20 -1.89 -2.04 115.11 116.45 2oow h GLN 71 Ca 0.12 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 2oow h GLN 71 Cb 0.47 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 2oow h GLN 71 CO 0.02 0.65 -0.02 -0.91 -0.67 0.00 0.00 178.83 177.90 2oow h ASN 72 N 0.79 0.49 -0.58 1.46 2.35 -0.48 0.83 115.58 120.44 2oow h ASN 72 Ca 0.20 -0.10 -0.08 0.00 -0.55 0.00 0.00 56.30 55.78 2oow h ASN 72 Cb 0.08 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 2oow h ASN 72 CO -0.03 0.58 0.05 0.03 -1.65 0.00 0.00 177.43 176.41 2oow h ARG 73 N 0.50 1.00 -0.49 0.81 3.08 -1.07 -0.28 114.38 117.93 2oow h ARG 73 Ca 0.11 -0.29 -0.07 0.00 0.07 0.00 0.00 59.98 59.79 2oow h ARG 73 Cb 0.35 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 2oow h ARG 73 CO 0.01 0.96 0.03 1.03 -1.07 0.00 0.00 179.97 180.93 2oow h SER 74 N 0.89 0.83 -0.63 7.04 0.87 -0.67 -1.87 113.55 120.01 2oow h SER 74 Ca 0.17 -0.29 -0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2oow h SER 74 Cb 0.48 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.19 2oow h SER 74 CO 0.02 0.91 0.38 1.88 -0.53 0.00 0.00 176.83 179.50 2oow h TYR 75 N 0.71 0.83 -0.78 2.24 0.99 -0.63 -1.84 116.97 118.49 2oow h TYR 75 Ca 0.14 -0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.84 2oow h TYR 75 Cb 0.47 -0.27 -0.04 0.00 1.00 0.00 0.00 36.73 37.90 2oow h TYR 75 CO 0.04 0.56 0.37 0.77 -0.00 0.00 0.00 178.16 179.90 2oow h SER 76 N 0.86 1.02 -0.27 3.88 0.02 -0.82 0.71 113.55 118.94 2oow h SER 76 Ca 0.23 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 2oow h SER 76 Cb -0.03 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.24 2oow h SER 76 CO -0.04 0.87 0.09 0.50 -1.14 0.00 0.00 176.83 177.11 2oow h LYS 77 N 1.10 0.42 0.28 3.45 3.64 -1.05 0.16 116.57 124.57 2oow h LYS 77 Ca 0.27 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 2oow h LYS 77 Cb 0.12 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2oow h LYS 77 CO -0.03 0.47 -0.13 1.25 -2.27 0.00 0.00 179.45 178.74 2oow h LEU 78 N 0.28 -0.32 -0.35 5.20 5.85 -1.04 -1.47 115.31 123.47 2oow h LEU 78 Ca 0.09 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.69 2oow h LEU 78 Cb 0.22 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2oow h LEU 78 CO -0.00 -0.22 -0.24 -0.07 -0.34 0.00 0.00 178.44 177.57 2oow h LEU 79 N -0.39 0.82 -0.93 2.25 3.38 -0.84 -1.52 115.31 118.07 2oow h LEU 79 Ca -0.04 -0.43 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 2oow h LEU 79 Cb 0.30 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2oow h LEU 79 CO 0.06 1.07 0.14 0.00 0.09 0.00 0.00 178.44 179.80 2oow h GLY 81 N 1.01 0.74 1.02 0.00 0.00 -1.06 0.26 103.07 105.05 2oow h GLY 81 Ca 0.19 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 2oow h GLY 81 CO 0.00 0.30 -0.02 1.41 0.00 0.00 0.00 176.54 178.23 2oow h LEU 82 N 0.68 0.88 -0.92 3.11 3.38 -0.86 -0.63 115.31 120.95 2oow h LEU 82 Ca 0.18 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 2oow h LEU 82 Cb -0.00 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2oow h LEU 82 CO -0.03 0.99 -0.09 -0.07 0.09 0.00 0.00 178.44 179.32 2oow h LEU 83 N 0.75 0.68 -0.10 1.67 3.38 -0.81 0.96 115.31 121.84 2oow h LEU 83 Ca 0.14 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 2oow h LEU 83 Cb 0.55 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2oow h LEU 83 CO 0.03 0.81 -0.13 0.00 0.09 0.00 0.00 178.44 179.23 2oow h ALA 84 N 1.26 0.15 -0.22 1.53 0.00 -0.78 -0.39 119.26 120.82 2oow h ALA 84 Ca 0.12 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2oow h ALA 84 Cb 0.53 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2oow h ALA 84 CO 0.03 0.03 -0.24 1.49 0.00 0.00 0.00 179.25 180.56 2oow h GLU 85 N -0.16 0.55 0.10 0.00 4.81 -1.02 -2.02 114.58 116.84 2oow h GLU 85 Ca 0.01 -0.30 -0.33 0.00 -0.13 0.00 0.00 59.36 58.61 2oow h GLU 85 Cb 0.68 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 2oow h GLU 85 CO 0.03 0.89 -1.79 0.00 -0.73 0.00 0.00 179.01 177.42 2oow h ARG 86 N 0.24 0.22 -0.01 1.92 2.47 -0.91 -3.39 114.38 114.92 2oow h ARG 86 Ca 0.03 -0.38 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 2oow h ARG 86 Cb 0.80 0.14 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 2oow h ARG 86 CO 0.06 1.05 -0.05 1.28 0.56 0.00 0.00 179.97 182.86 2oow n LEU 87 N -3.39 1.85 -3.26 3.04 4.77 -0.23 -4.58 117.00 115.19 2oow n LEU 87 Ca -0.24 -0.95 -0.23 0.00 -0.03 0.00 0.00 56.01 54.56 2oow n LEU 87 Cb 1.05 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.20 2oow n LEU 87 CO 0.46 0.35 0.10 0.54 -1.33 0.00 0.00 177.39 177.52 2oow n ARG 88 N 0.48 -6.24 -3.76 3.23 5.12 -0.74 -4.95 116.66 109.80 2oow n ARG 88 Ca 0.07 0.88 -0.36 0.00 -1.93 0.00 0.00 57.85 56.51 2oow n ARG 88 Cb 0.29 -5.83 -0.09 0.00 -1.16 0.00 0.00 32.46 25.67 2oow n ARG 88 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2oow s ILE 89 N -3.24 5.21 0.21 0.55 1.01 -1.02 -4.94 121.20 118.98 2oow s ILE 89 Ca 0.43 0.12 -0.31 0.00 0.00 0.00 0.00 60.65 60.89 2oow s ILE 89 Cb -0.19 -3.40 -0.10 0.00 0.01 0.00 0.00 42.46 38.78 2oow s ILE 89 CO 0.53 0.40 1.53 -0.55 0.00 0.00 0.00 174.94 176.85 2oow s SER 90 N 0.73 6.58 0.49 3.58 0.15 -1.26 -3.43 113.70 120.54 2oow s SER 90 Ca 0.07 2.68 0.25 0.00 0.70 0.00 0.00 55.95 59.65 2oow s SER 90 Cb -0.13 -2.61 1.30 0.00 -1.71 0.00 0.00 66.02 62.88 2oow s SER 90 CO 0.02 -0.80 1.89 -0.65 1.20 0.00 0.00 173.24 174.90 2oow h PRO 91 N 5.97 0.16 0.00 5.44 0.11 -1.97 0.64 132.00 142.35 2oow h PRO 91 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2oow h PRO 91 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2oow h PRO 91 CO 0.85 0.11 0.00 -0.40 -0.21 0.00 0.00 178.00 178.35 2oow n ASP 92 N -4.39 0.00 -1.00 -2.05 5.68 -1.26 -2.65 116.55 110.89 2oow n ASP 92 Ca 0.17 -1.85 0.03 0.00 -0.50 0.00 0.00 54.79 52.64 2oow n ASP 92 Cb 0.79 0.00 0.14 0.00 -1.14 0.00 0.00 41.12 40.92 2oow n ASP 92 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2oow n ARG 93 N -0.55 1.35 -4.56 0.11 1.74 0.22 -5.01 116.66 109.95 2oow n ARG 93 Ca 0.02 -3.06 -0.23 0.00 -0.77 0.00 0.00 57.85 53.82 2oow n ARG 93 Cb 0.01 -1.27 -0.16 0.00 -1.02 0.00 0.00 32.46 30.02 2oow n ARG 93 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2oow s VAL 94 N -2.55 1.06 -0.05 1.55 1.01 -1.08 -1.58 120.40 118.75 2oow s VAL 94 Ca 0.38 -0.48 0.06 0.00 0.00 0.00 0.00 61.98 61.93 2oow s VAL 94 Cb 0.38 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.80 2oow s VAL 94 CO -0.09 0.33 -0.23 -0.31 0.00 0.00 0.00 175.10 174.80 2oow s TYR 95 N 0.35 2.24 -0.16 5.22 4.12 -0.74 -5.00 117.35 123.38 2oow s TYR 95 Ca -0.08 -0.66 -0.01 0.00 0.02 0.00 0.00 57.07 56.35 2oow s TYR 95 Cb -0.12 -1.48 0.04 0.00 -1.52 0.00 0.00 41.96 38.88 2oow s TYR 95 CO 0.02 -0.20 -0.04 0.42 0.02 0.00 0.00 175.55 175.77 2oow s ILE 96 N -0.12 0.96 -0.13 2.71 1.01 -1.26 -0.32 121.20 124.06 2oow s ILE 96 Ca -0.03 -0.54 -0.20 0.00 0.00 0.00 0.00 60.65 59.88 2oow s ILE 96 Cb -0.13 -1.17 -0.04 0.00 0.01 0.00 0.00 42.46 41.13 2oow s ILE 96 CO 0.03 0.10 0.55 0.20 0.00 0.00 0.00 174.94 175.82 2oow s ASN 97 N 1.70 6.72 -0.12 3.58 0.02 -0.17 -4.93 114.94 121.73 2oow s ASN 97 Ca 0.01 0.86 -0.05 0.00 -1.02 0.00 0.00 52.86 52.67 2oow s ASN 97 Cb -0.15 -2.32 -0.04 0.00 0.02 0.00 0.00 41.25 38.76 2oow s ASN 97 CO -0.07 -0.09 0.05 -0.31 0.02 0.00 0.00 177.10 176.69 2oow s TYR 98 N 1.02 3.29 -0.10 2.20 1.51 -1.26 -0.88 117.35 123.12 2oow s TYR 98 Ca 0.28 0.22 0.00 0.00 -1.01 0.00 0.00 57.07 56.57 2oow s TYR 98 Cb -0.16 -1.91 0.02 0.00 -0.11 0.00 0.00 41.96 39.80 2oow s TYR 98 CO 0.12 0.43 -0.09 0.71 -1.11 0.00 0.00 175.55 175.60 2oow s TYR 99 N -0.52 1.48 -0.58 2.71 1.51 -0.37 -4.97 117.35 116.61 2oow s TYR 99 Ca 0.10 -0.69 -0.19 0.00 -1.01 0.00 0.00 57.07 55.28 2oow s TYR 99 Cb -0.12 -1.19 0.09 0.00 -0.11 0.00 0.00 41.96 40.63 2oow s TYR 99 CO 0.02 -0.45 0.72 0.34 -1.11 0.00 0.00 175.55 175.07 2oow s ASP 100 N 1.43 6.19 0.19 2.29 -1.08 -1.26 -1.58 116.67 122.86 2oow s ASP 100 Ca -0.00 -1.28 -0.23 0.00 -0.52 0.00 0.00 52.55 50.52 2oow s ASP 100 Cb -0.13 -2.31 -0.08 0.00 -1.46 0.00 0.00 42.92 38.93 2oow s ASP 100 CO -0.05 -1.11 0.75 -0.04 0.52 0.00 0.00 175.17 175.24 2oow s MET 101 N 2.83 4.42 0.21 4.34 -1.94 0.15 -4.89 119.30 124.42 2oow s MET 101 Ca 0.13 1.03 -0.28 0.00 -1.71 0.00 0.00 55.69 54.86 2oow s MET 101 Cb -0.22 -3.08 -0.09 0.00 2.01 0.00 0.00 34.83 33.45 2oow s MET 101 CO 0.08 0.49 0.88 1.21 -0.01 0.00 0.00 175.02 177.67 2oow s ASN 102 N -1.38 7.56 0.42 3.03 3.84 -1.26 -4.07 114.94 123.08 2oow s ASN 102 Ca 0.39 1.84 0.16 0.00 0.21 0.00 0.00 52.86 55.47 2oow s ASN 102 Cb -0.20 -2.57 1.06 0.00 -0.55 0.00 0.00 41.25 38.99 2oow s ASN 102 CO 0.23 0.18 1.89 0.00 -2.79 0.00 0.00 177.10 176.62 2oow h ALA 103 N 4.21 2.15 0.00 1.71 0.00 -1.95 0.75 119.26 126.14 2oow h ALA 103 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2oow h ALA 103 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2oow h ALA 103 CO 0.67 -0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.54 2oow h ALA 104 N 1.63 1.00 -0.57 0.00 0.00 -1.92 -2.72 119.26 116.67 2oow h ALA 104 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2oow h ALA 104 Cb 0.98 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2oow h ALA 104 CO -0.14 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.20 2oow n ASN 105 N -2.91 5.38 -3.92 0.00 3.02 0.26 -4.83 115.26 112.26 2oow n ASN 105 Ca 0.00 -2.81 -0.29 0.00 -0.03 0.00 0.00 54.58 51.45 2oow n ASN 105 Cb 0.25 -0.65 -0.16 0.00 -0.61 0.00 0.00 39.78 38.61 2oow n ASN 105 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2oow s VAL 106 N -2.53 1.31 0.22 2.41 1.01 -1.08 -4.89 120.40 116.85 2oow s VAL 106 Ca 0.53 -0.86 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 2oow s VAL 106 Cb 0.39 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 35.19 2oow s VAL 106 CO 0.18 0.07 0.61 -0.83 0.00 0.00 0.00 175.10 175.13 2oow s GLY 107 N 1.53 2.39 -0.29 4.51 0.00 -1.26 -2.11 107.32 112.09 2oow s GLY 107 Ca -0.01 -0.11 -0.24 0.00 0.00 0.00 0.00 44.72 44.36 2oow s GLY 107 CO -0.08 0.11 1.16 0.86 0.00 0.00 0.00 173.10 175.15 2oow s TRP 108 N -1.71 -0.34 -1.32 1.90 -0.00 0.30 -4.95 118.94 112.82 2oow s TRP 108 Ca 0.45 0.81 -0.04 0.00 -0.00 0.00 0.00 56.10 57.32 2oow s TRP 108 Cb -0.13 0.38 -0.00 0.00 -0.00 0.00 0.00 33.47 33.72 2oow s TRP 108 CO 0.20 -0.17 0.57 -1.71 -0.00 0.00 0.00 176.95 175.84 2oow n ASN 109 N 2.22 -1.55 0.00 5.86 4.05 -1.26 -1.80 115.26 122.78 2oow n ASN 109 Ca -0.13 -0.96 0.00 0.00 0.45 0.00 0.00 54.58 53.95 2oow n ASN 109 Cb 0.56 -3.41 0.00 0.00 1.23 0.00 0.00 39.78 38.17 2oow n ASN 109 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2oow n ASN 110 N -2.95 -3.71 0.00 1.20 5.03 -1.26 -4.90 115.26 108.67 2oow n ASN 110 Ca -0.26 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.19 2oow n ASN 110 Cb 0.67 -2.15 0.00 0.00 -1.02 0.00 0.00 39.78 37.27 2oow n ASN 110 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2oow n SER 111 N -0.47 0.00 -4.32 6.41 2.88 -0.75 -5.19 113.62 112.18 2oow n SER 111 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 2oow n SER 111 Cb 0.24 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.62 2oow n SER 111 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2oow s THR 112 N -0.82 0.74 -2.34 2.46 -4.23 -1.26 -0.54 115.64 109.66 2oow s THR 112 Ca 0.00 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 58.80 2oow s THR 112 Cb 0.00 -2.23 0.60 0.00 1.34 0.00 0.00 72.50 72.21 2oow s THR 112 CO 0.00 0.00 1.83 0.49 -0.54 0.00 0.00 174.62 176.40 2oow n PHE 113 N -1.07 0.00 0.07 3.99 3.01 -0.90 -4.81 117.46 117.75 2oow n PHE 113 Ca -0.11 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.35 2oow n PHE 113 Cb 0.66 -0.01 0.03 0.00 -0.01 0.00 0.00 39.48 40.14 2oow n PHE 113 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77