#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ooz s MET 2 N 0.00 1.13 -0.10 -0.52 0.23 -0.13 -1.59 119.30 118.32 2ooz s MET 2 Ca 0.00 -0.28 0.03 0.00 -1.03 0.00 0.00 55.69 54.42 2ooz s MET 2 Cb 0.00 -1.02 0.00 0.00 -1.53 0.00 0.00 34.83 32.28 2ooz s MET 2 CO 0.00 0.03 -0.22 0.12 -2.03 0.00 0.00 175.02 172.93 2ooz s PHE 3 N 0.53 2.40 -0.04 3.16 5.36 -0.12 -1.06 117.98 128.21 2ooz s PHE 3 Ca -0.09 -1.03 0.06 0.00 -0.96 0.00 0.00 56.93 54.91 2ooz s PHE 3 Cb -0.12 -1.63 -0.01 0.00 -0.34 0.00 0.00 43.02 40.92 2ooz s PHE 3 CO 0.01 -0.44 -0.22 0.42 -1.46 0.00 0.00 175.22 173.54 2ooz s ILE 4 N 0.50 1.78 -0.12 3.12 -1.09 -0.65 -0.97 121.20 123.77 2ooz s ILE 4 Ca -0.16 -0.93 -0.00 0.00 -2.23 0.00 0.00 60.65 57.33 2ooz s ILE 4 Cb -0.17 -1.51 0.02 0.00 -1.58 0.00 0.00 42.46 39.23 2ooz s ILE 4 CO 0.06 0.50 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.48 2ooz s VAL 5 N -0.21 1.22 -0.15 2.92 1.01 0.37 -1.97 120.40 123.58 2ooz s VAL 5 Ca 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 61.98 61.54 2ooz s VAL 5 Cb -0.12 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 2ooz s VAL 5 CO 0.02 0.40 -0.08 0.20 0.00 0.00 0.00 175.10 175.64 2ooz s ASN 6 N 1.58 4.40 0.03 3.32 0.01 -0.44 0.30 114.94 124.14 2ooz s ASN 6 Ca 0.04 -0.25 -0.15 0.00 -0.71 0.00 0.00 52.86 51.80 2ooz s ASN 6 Cb -0.13 -1.70 0.02 0.00 0.41 0.00 0.00 41.25 39.85 2ooz s ASN 6 CO -0.08 0.14 0.32 0.28 -1.51 0.00 0.00 177.10 176.25 2ooz s THR 7 N 0.50 0.07 -1.82 1.60 -1.32 -0.13 -0.87 115.64 113.69 2ooz s THR 7 Ca -0.06 -0.61 0.29 0.00 -1.21 0.00 0.00 61.69 60.11 2ooz s THR 7 Cb -0.15 -0.86 0.53 0.00 -1.51 0.00 0.00 72.50 70.51 2ooz s THR 7 CO 0.03 -0.33 1.90 -0.46 -2.21 0.00 0.00 174.62 173.55 2ooz n ASN 8 N 0.74 0.54 -4.75 8.08 6.94 -1.24 -1.36 115.26 124.22 2ooz n ASN 8 Ca -0.19 -0.77 -0.41 0.00 -0.02 0.00 0.00 54.58 53.19 2ooz n ASN 8 Cb 0.59 -0.05 -0.02 0.00 -2.36 0.00 0.00 39.78 37.94 2ooz n ASN 8 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2ooz s VAL 9 N -2.34 2.47 0.64 3.53 1.01 -1.26 -4.16 120.40 120.29 2ooz s VAL 9 Ca 0.33 0.41 -0.18 0.00 0.00 0.00 0.00 61.98 62.53 2ooz s VAL 9 Cb 0.20 -3.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.31 2ooz s VAL 9 CO 0.44 0.07 1.31 -2.84 0.00 0.00 0.00 175.10 174.08 2ooz s PRO 10 N -0.76 2.58 0.17 2.72 0.02 -1.26 -0.95 135.00 137.52 2ooz s PRO 10 Ca 0.58 2.10 -0.14 0.00 0.02 0.00 0.00 61.00 63.56 2ooz s PRO 10 Cb -0.43 -1.87 0.11 0.00 0.02 0.00 0.00 34.50 32.33 2ooz s PRO 10 CO 0.48 -1.59 1.78 -0.09 -0.33 0.00 0.00 177.00 177.25 2ooz h ARG 11 N 0.60 0.44 0.00 5.54 9.65 -1.92 -1.14 114.38 127.55 2ooz h ARG 11 Ca -0.51 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.34 2ooz h ARG 11 Cb 1.34 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.82 2ooz h ARG 11 CO 0.53 0.29 0.04 0.00 2.80 0.00 0.00 179.97 183.64 2ooz h ALA 12 N 1.26 1.04 -0.00 2.80 0.00 -2.03 0.35 119.26 122.68 2ooz h ALA 12 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2ooz h ALA 12 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ooz h ALA 12 CO -0.15 -0.04 -0.12 0.43 0.00 0.00 0.00 179.25 179.37 2ooz n SER 13 N -3.01 0.48 -4.54 0.00 7.64 -0.43 -4.71 113.62 109.04 2ooz n SER 13 Ca -0.03 -0.55 -0.43 0.00 1.01 0.00 0.00 58.87 58.87 2ooz n SER 13 Cb 0.11 -0.07 -0.06 0.00 -1.01 0.00 0.00 64.21 63.18 2ooz n SER 13 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2ooz s VAL 14 N -2.50 4.73 0.38 0.44 1.01 0.11 -4.72 120.40 119.85 2ooz s VAL 14 Ca 0.28 0.43 -0.28 0.00 0.00 0.00 0.00 61.98 62.41 2ooz s VAL 14 Cb 0.20 -4.25 -0.11 0.00 0.00 0.00 0.00 36.38 32.22 2ooz s VAL 14 CO 0.48 -0.60 1.47 -2.16 0.00 0.00 0.00 175.10 174.29 2ooz s PRO 15 N 3.08 4.11 0.41 2.72 0.04 -1.26 -4.94 135.00 139.16 2ooz s PRO 15 Ca 0.28 2.55 -0.26 0.00 0.04 0.00 0.00 61.00 63.60 2ooz s PRO 15 Cb -0.13 -2.97 -0.10 0.00 0.04 0.00 0.00 34.50 31.34 2ooz s PRO 15 CO 0.20 -0.52 1.36 -0.25 0.04 0.00 0.00 177.00 177.83 2ooz n ASP 16 N 0.46 3.04 0.00 6.66 10.43 -1.26 -1.46 116.55 134.42 2ooz n ASP 16 Ca 0.01 1.15 0.00 0.00 2.57 0.00 0.00 54.79 58.52 2ooz n ASP 16 Cb 0.39 -1.55 0.00 0.00 1.84 0.00 0.00 41.12 41.80 2ooz n ASP 16 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2ooz n GLY 17 N 0.67 0.84 0.25 0.44 0.00 -1.26 -4.92 105.19 101.21 2ooz n GLY 17 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 2ooz n GLY 17 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2ooz h PHE 18 N 0.00 0.81 -0.74 1.61 3.57 -1.62 0.37 116.94 120.94 2ooz h PHE 18 Ca 0.00 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 2ooz h PHE 18 Cb 0.00 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.45 2ooz h PHE 18 CO 0.00 0.60 0.44 -0.07 -2.23 0.00 0.00 178.31 177.05 2ooz h LEU 19 N 0.78 0.91 -0.60 0.59 3.38 -1.91 -0.34 115.31 118.11 2ooz h LEU 19 Ca 0.20 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 2ooz h LEU 19 Cb 0.07 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 2ooz h LEU 19 CO -0.03 0.72 0.25 0.28 0.09 0.00 0.00 178.44 179.74 2ooz h SER 20 N 1.02 0.82 -0.54 -0.43 0.02 -1.83 -0.95 113.55 111.66 2ooz h SER 20 Ca 0.27 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 60.99 2ooz h SER 20 Cb -0.01 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.29 2ooz h SER 20 CO -0.05 0.76 0.10 -0.08 -1.14 0.00 0.00 176.83 176.42 2ooz h GLU 21 N 0.83 0.89 -0.48 3.45 4.81 -0.55 -1.65 114.58 121.87 2ooz h GLU 21 Ca 0.20 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2ooz h GLU 21 Cb 0.19 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2ooz h GLU 21 CO -0.02 0.85 0.28 -0.07 -0.73 0.00 0.00 179.01 179.33 2ooz h LEU 22 N 0.78 0.58 -0.18 1.64 3.38 -0.83 -0.60 115.31 120.09 2ooz h LEU 22 Ca 0.17 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 58.10 2ooz h LEU 22 Cb 0.38 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2ooz h LEU 22 CO 0.01 0.48 0.01 0.74 0.09 0.00 0.00 178.44 179.77 2ooz h THR 23 N 0.64 0.89 -0.37 0.22 2.02 -0.91 -0.46 112.91 114.93 2ooz h THR 23 Ca 0.17 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.28 2ooz h THR 23 Cb 0.01 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2ooz h THR 23 CO -0.03 0.01 0.06 1.56 0.37 0.00 0.00 175.52 177.49 2ooz h GLN 24 N 0.08 0.62 -0.74 6.66 4.20 -1.14 -1.30 115.11 123.48 2ooz h GLN 24 Ca 0.08 -0.17 -0.05 0.00 0.06 0.00 0.00 58.65 58.57 2ooz h GLN 24 Cb 0.09 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 2ooz h GLN 24 CO -0.13 0.68 0.26 1.96 -0.67 0.00 0.00 178.83 180.94 2ooz h GLN 25 N 0.46 1.13 -0.11 1.46 1.08 -0.95 -2.22 115.11 115.96 2ooz h GLN 25 Ca 0.11 -0.22 -0.17 0.00 -1.45 0.00 0.00 58.65 56.92 2ooz h GLN 25 Cb 0.36 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.61 2ooz h GLN 25 CO 0.01 0.94 -0.66 -0.07 -0.95 0.00 0.00 178.83 178.09 2ooz h LEU 26 N 1.09 0.50 -0.50 1.46 3.38 -1.01 -0.86 115.31 119.37 2ooz h LEU 26 Ca 0.24 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2ooz h LEU 26 Cb 0.26 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2ooz h LEU 26 CO -0.01 1.02 0.32 0.00 0.09 0.00 0.00 178.44 179.86 2ooz h ALA 27 N 0.98 0.64 -0.14 1.53 0.00 -0.97 -0.12 119.26 121.17 2ooz h ALA 27 Ca -0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2ooz h ALA 27 Cb 1.22 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2ooz h ALA 27 CO 0.12 0.05 -0.06 1.96 0.00 0.00 0.00 179.25 181.32 2ooz h GLN 28 N 0.65 0.28 -0.89 0.00 4.20 -1.31 0.19 115.11 118.23 2ooz h GLN 28 Ca 0.19 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 2ooz h GLN 28 Cb -0.04 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.68 2ooz h GLN 28 CO -0.06 0.60 0.50 0.00 -0.67 0.00 0.00 178.83 179.20 2ooz h ALA 29 N 0.67 1.14 0.00 3.87 0.00 -0.95 -2.97 119.26 121.02 2ooz h ALA 29 Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2ooz h ALA 29 Cb 0.51 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2ooz h ALA 29 CO 0.02 0.64 -0.86 0.25 0.00 0.00 0.00 179.25 179.30 2ooz n THR 30 N -4.35 0.38 -1.04 0.00 -2.24 -0.08 -4.95 114.28 102.00 2ooz n THR 30 Ca 0.09 -0.35 -0.01 0.00 -2.27 0.00 0.00 64.05 61.51 2ooz n THR 30 Cb 0.09 -0.10 -0.01 0.00 -2.10 0.00 0.00 70.33 68.21 2ooz n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ooz n GLY 31 N 1.30 0.51 3.91 3.38 0.00 0.02 -5.00 105.19 109.31 2ooz n GLY 31 Ca 0.02 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.37 2ooz n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ooz s LYS 32 N -1.13 3.48 0.40 1.61 -0.14 -0.98 -5.01 119.74 117.97 2ooz s LYS 32 Ca 0.00 -0.34 -0.27 0.00 -1.36 0.00 0.00 55.97 54.00 2ooz s LYS 32 Cb 0.00 -3.01 -0.10 0.00 -1.68 0.00 0.00 37.83 33.04 2ooz s LYS 32 CO 0.00 0.59 1.48 -2.30 -0.76 0.00 0.00 175.35 174.35 2ooz n PRO 33 N 0.34 2.57 0.28 -1.68 -0.02 -1.26 -4.55 135.00 130.68 2ooz n PRO 33 Ca -0.05 0.90 0.18 0.00 -2.02 0.00 0.00 63.50 62.51 2ooz n PRO 33 Cb 0.51 -2.66 0.96 0.00 -0.02 0.00 0.00 33.50 32.29 2ooz n PRO 33 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2ooz h PRO 34 N 2.77 0.00 0.00 0.52 0.13 -1.90 -1.72 132.00 131.80 2ooz h PRO 34 Ca -0.51 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2ooz h PRO 34 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 2ooz h PRO 34 CO 0.63 0.00 -0.01 1.96 -0.23 0.00 0.00 178.00 180.35 2ooz h GLN 35 N 0.00 0.00 -0.00 0.86 7.50 -1.98 -1.81 115.11 119.68 2ooz h GLN 35 Ca 0.03 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.18 2ooz h GLN 35 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.73 2ooz h GLN 35 CO -0.00 0.01 -0.68 0.66 -1.50 0.00 0.00 178.83 177.32 2ooz n TYR 36 N -3.45 0.00 -2.81 2.96 4.01 -0.65 -4.93 117.16 112.29 2ooz n TYR 36 Ca -0.03 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.30 2ooz n TYR 36 Cb 0.10 -0.09 -0.03 0.00 -0.31 0.00 0.00 39.34 39.00 2ooz n TYR 36 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2ooz s ILE 37 N -2.85 4.91 -0.06 -0.72 -1.09 -0.68 -3.35 121.20 117.36 2ooz s ILE 37 Ca 0.13 1.86 0.06 0.00 -2.23 0.00 0.00 60.65 60.46 2ooz s ILE 37 Cb 0.17 -4.23 -0.01 0.00 -1.58 0.00 0.00 42.46 36.81 2ooz s ILE 37 CO 0.73 0.16 -0.23 0.00 -1.23 0.00 0.00 174.94 174.37 2ooz s ALA 38 N 1.16 2.27 0.02 9.38 0.00 -0.62 -5.00 121.76 128.97 2ooz s ALA 38 Ca 0.47 -1.04 0.05 0.00 0.00 0.00 0.00 51.96 51.44 2ooz s ALA 38 Cb -0.19 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 22.17 2ooz s ALA 38 CO 0.23 0.44 -0.14 0.08 0.00 0.00 0.00 175.76 176.36 2ooz s VAL 39 N -0.25 1.11 -0.10 0.00 1.01 -1.26 -0.95 120.40 119.96 2ooz s VAL 39 Ca -0.00 -0.88 -0.04 0.00 0.00 0.00 0.00 61.98 61.06 2ooz s VAL 39 Cb -0.13 -0.98 0.05 0.00 0.00 0.00 0.00 36.38 35.32 2ooz s VAL 39 CO 0.03 0.10 0.21 -2.28 0.00 0.00 0.00 175.10 173.15 2ooz s HIS 40 N -0.69 -0.28 -0.13 5.22 5.04 -0.14 -4.97 115.29 119.33 2ooz s HIS 40 Ca 0.03 0.75 0.02 0.00 -1.54 0.00 0.00 55.06 54.32 2ooz s HIS 40 Cb -0.07 -0.13 -0.00 0.00 0.04 0.00 0.00 32.58 32.42 2ooz s HIS 40 CO 0.01 -0.29 -0.18 0.08 -2.34 0.00 0.00 174.74 172.01 2ooz s VAL 41 N 2.13 2.47 -0.35 0.89 1.01 -1.26 -0.48 120.40 124.80 2ooz s VAL 41 Ca -0.00 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.15 2ooz s VAL 41 Cb -0.12 -2.01 0.10 0.00 0.00 0.00 0.00 36.38 34.36 2ooz s VAL 41 CO -0.07 0.54 0.09 -0.69 0.00 0.00 0.00 175.10 174.96 2ooz s VAL 42 N 0.58 1.88 0.72 2.92 1.01 0.15 -4.96 120.40 122.70 2ooz s VAL 42 Ca -0.11 -2.18 -0.00 0.00 0.00 0.00 0.00 61.98 59.69 2ooz s VAL 42 Cb -0.16 -2.38 0.14 0.00 0.00 0.00 0.00 36.38 33.98 2ooz s VAL 42 CO 0.03 -0.65 0.99 -0.81 0.00 0.00 0.00 175.10 174.67 2ooz n PRO 43 N 4.29 -0.12 -2.22 2.72 -0.04 -1.26 -0.95 135.00 137.41 2ooz n PRO 43 Ca 0.03 -2.68 -0.21 0.00 -0.04 0.00 0.00 63.50 60.60 2ooz n PRO 43 Cb 0.41 -0.67 -0.03 0.00 -0.04 0.00 0.00 33.50 33.17 2ooz n PRO 43 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2ooz n ASP 44 N -2.92 -5.78 -4.81 3.54 9.92 -0.13 -4.85 116.55 111.52 2ooz n ASP 44 Ca 0.16 0.11 -0.35 0.00 -0.53 0.00 0.00 54.79 54.18 2ooz n ASP 44 Cb 0.58 -4.88 -0.07 0.00 -0.64 0.00 0.00 41.12 36.12 2ooz n ASP 44 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2ooz s GLN 45 N -4.76 4.32 -0.67 -1.24 -1.52 -0.46 -4.93 119.66 110.40 2ooz s GLN 45 Ca 0.00 1.10 -0.23 0.00 -1.95 0.00 0.00 55.36 54.27 2ooz s GLN 45 Cb 0.00 -2.50 0.07 0.00 -0.22 0.00 0.00 33.01 30.35 2ooz s GLN 45 CO 0.00 0.15 1.00 -1.17 -0.25 0.00 0.00 175.29 175.02 2ooz s LEU 46 N -2.64 4.25 0.19 2.90 2.96 -1.26 -4.06 118.68 121.03 2ooz s LEU 46 Ca 0.55 -0.92 -0.11 0.00 -0.22 0.00 0.00 54.13 53.42 2ooz s LEU 46 Cb -0.13 -2.44 -0.00 0.00 0.50 0.00 0.00 46.19 44.11 2ooz s LEU 46 CO 0.18 -1.48 0.37 0.00 -1.32 0.00 0.00 176.35 174.10 2ooz s MET 47 N 4.25 1.30 0.00 1.98 0.23 -1.26 -5.08 119.30 120.72 2ooz s MET 47 Ca 0.24 -1.15 -0.08 0.00 -1.03 0.00 0.00 55.69 53.66 2ooz s MET 47 Cb -0.16 0.42 0.00 0.00 -1.53 0.00 0.00 34.83 33.57 2ooz s MET 47 CO 0.11 -0.51 0.16 0.00 -2.03 0.00 0.00 175.02 172.75 2ooz s ALA 48 N -3.97 -0.37 -0.12 3.16 0.00 -1.26 -4.67 121.76 114.53 2ooz s ALA 48 Ca 0.18 -0.11 -0.00 0.00 0.00 0.00 0.00 51.96 52.02 2ooz s ALA 48 Cb 0.02 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.28 2ooz s ALA 48 CO 0.02 -0.23 -0.10 0.12 0.00 0.00 0.00 175.76 175.58 2ooz s PHE 49 N -1.50 1.66 -1.77 0.00 5.36 -0.16 -4.69 117.98 116.87 2ooz s PHE 49 Ca -0.14 -0.85 0.00 0.00 -0.96 0.00 0.00 56.93 54.98 2ooz s PHE 49 Cb -0.07 -1.32 0.00 0.00 -0.34 0.00 0.00 43.02 41.30 2ooz s PHE 49 CO 0.01 -0.54 0.00 0.41 -1.46 0.00 0.00 175.22 173.65 2ooz n GLY 50 N 4.82 1.35 1.43 13.12 0.00 -1.26 -1.42 105.19 123.23 2ooz n GLY 50 Ca -0.14 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2ooz n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ooz n GLY 51 N -0.89 1.95 3.86 -0.02 0.00 -1.26 -5.04 105.19 103.79 2ooz n GLY 51 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 2ooz n GLY 51 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ooz s SER 52 N -2.24 6.72 -0.14 1.61 0.15 -0.51 -4.99 113.70 114.31 2ooz s SER 52 Ca 0.00 0.90 0.15 0.00 0.70 0.00 0.00 55.95 57.70 2ooz s SER 52 Cb 0.00 -2.22 0.68 0.00 -1.71 0.00 0.00 66.02 62.77 2ooz s SER 52 CO 0.00 0.19 1.57 -1.54 1.20 0.00 0.00 173.24 174.66 2ooz n SER 53 N 1.07 4.65 -4.71 5.45 3.41 -1.26 -0.99 113.62 121.24 2ooz n SER 53 Ca -0.09 -2.54 -0.31 0.00 -0.26 0.00 0.00 58.87 55.68 2ooz n SER 53 Cb 0.52 -0.59 0.13 0.00 -0.26 0.00 0.00 64.21 64.02 2ooz n SER 53 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2ooz s GLU 54 N -2.06 1.48 0.15 4.33 0.41 -1.26 -4.87 118.70 116.88 2ooz s GLU 54 Ca 0.47 1.20 -0.34 0.00 -0.41 0.00 0.00 54.97 55.89 2ooz s GLU 54 Cb 0.32 -1.81 -0.16 0.00 -1.78 0.00 0.00 34.13 30.71 2ooz s GLU 54 CO 0.20 -2.20 1.26 -2.30 -0.49 0.00 0.00 175.26 171.73 2ooz n PRO 55 N -3.90 1.29 -3.95 0.39 -0.02 -1.26 -4.82 135.00 122.73 2ooz n PRO 55 Ca 0.09 0.46 -0.11 0.00 -2.02 0.00 0.00 63.50 61.93 2ooz n PRO 55 Cb 0.53 -2.04 -0.02 0.00 -0.02 0.00 0.00 33.50 31.96 2ooz n PRO 55 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ooz s ALA 57 N -3.14 -1.25 -0.20 0.00 0.00 -0.53 -3.60 121.76 113.03 2ooz s ALA 57 Ca 0.22 1.32 0.02 0.00 0.00 0.00 0.00 51.96 53.52 2ooz s ALA 57 Cb -0.03 -0.69 0.03 0.00 0.00 0.00 0.00 23.12 22.44 2ooz s ALA 57 CO 0.13 -0.25 -0.16 -0.51 0.00 0.00 0.00 175.76 174.97 2ooz s LEU 58 N 0.02 2.50 0.40 0.00 1.43 -0.05 -1.66 118.68 121.33 2ooz s LEU 58 Ca -0.02 -0.88 0.05 0.00 -1.03 0.00 0.00 54.13 52.24 2ooz s LEU 58 Cb -0.03 -1.46 -0.06 0.00 0.03 0.00 0.00 46.19 44.67 2ooz s LEU 58 CO 0.02 -0.07 0.04 0.00 0.23 0.00 0.00 176.35 176.56 2ooz s SER 60 N -3.64 -0.43 -0.14 0.00 1.04 -0.83 -1.10 113.70 108.60 2ooz s SER 60 Ca 0.30 0.71 -0.01 0.00 0.48 0.00 0.00 55.95 57.43 2ooz s SER 60 Cb 0.07 0.75 0.03 0.00 0.10 0.00 0.00 66.02 66.98 2ooz s SER 60 CO 0.14 -0.27 -0.06 -0.22 0.98 0.00 0.00 173.24 173.82 2ooz s LEU 61 N -0.27 1.37 -0.10 2.42 2.96 0.22 -1.64 118.68 123.65 2ooz s LEU 61 Ca -0.04 -0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2ooz s LEU 61 Cb -0.03 -0.85 -0.03 0.00 0.50 0.00 0.00 46.19 45.77 2ooz s LEU 61 CO 0.02 -0.16 -0.01 -1.00 -1.32 0.00 0.00 176.35 173.89 2ooz s HIS 62 N 1.69 3.13 -0.03 5.38 3.76 -0.22 -1.22 115.29 127.78 2ooz s HIS 62 Ca 0.03 0.13 -0.22 0.00 -0.15 0.00 0.00 55.06 54.84 2ooz s HIS 62 Cb -0.14 -1.81 0.04 0.00 1.11 0.00 0.00 32.58 31.78 2ooz s HIS 62 CO -0.08 0.39 0.47 0.45 -0.85 0.00 0.00 174.74 175.13 2ooz s SER 63 N -0.70 -0.39 -0.59 1.40 0.15 -0.57 -0.96 113.70 112.03 2ooz s SER 63 Ca 0.11 0.35 -0.20 0.00 0.70 0.00 0.00 55.95 56.92 2ooz s SER 63 Cb -0.12 0.41 0.09 0.00 -1.71 0.00 0.00 66.02 64.70 2ooz s SER 63 CO 0.02 -0.52 0.75 -0.63 1.20 0.00 0.00 173.24 174.06 2ooz s ILE 64 N -1.30 4.72 0.00 6.45 1.01 -1.26 -0.25 121.20 130.58 2ooz s ILE 64 Ca -0.12 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.74 2ooz s ILE 64 Cb -0.03 -4.50 0.00 0.00 0.01 0.00 0.00 42.46 37.94 2ooz s ILE 64 CO 0.07 -1.15 0.00 0.61 0.00 0.00 0.00 174.94 174.47 2ooz n GLY 65 N 5.27 -2.37 2.38 6.18 0.00 -1.26 -4.95 105.19 110.45 2ooz n GLY 65 Ca -0.08 -1.57 -0.19 0.00 0.00 0.00 0.00 46.02 44.19 2ooz n GLY 65 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ooz n LYS 66 N -0.73 -1.47 -4.42 1.61 4.76 -1.26 -4.91 118.16 111.74 2ooz n LYS 66 Ca 0.00 0.94 -0.26 0.00 -2.87 0.00 0.00 58.31 56.12 2ooz n LYS 66 Cb 0.00 -5.45 -0.17 0.00 -1.84 0.00 0.00 35.03 27.57 2ooz n LYS 66 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2ooz s ILE 67 N -2.90 1.18 -0.03 -0.18 -1.09 -1.26 -4.87 121.20 112.05 2ooz s ILE 67 Ca 0.00 -0.47 -0.30 0.00 -2.23 0.00 0.00 60.65 57.65 2ooz s ILE 67 Cb 0.00 -1.10 0.11 0.00 -1.58 0.00 0.00 42.46 39.89 2ooz s ILE 67 CO 0.00 0.37 1.31 -0.83 -1.23 0.00 0.00 174.94 174.56 2ooz s GLY 68 N 0.94 -0.30 0.07 6.18 0.00 -1.26 -4.99 107.32 107.96 2ooz s GLY 68 Ca -0.09 0.43 -0.20 0.00 0.00 0.00 0.00 44.72 44.86 2ooz s GLY 68 CO 0.00 2.62 1.33 -1.33 0.00 0.00 0.00 173.10 175.72 2ooz h GLY 69 N 2.00 -1.36 0.93 0.20 0.00 -1.99 0.27 103.07 103.11 2ooz h GLY 69 Ca -0.27 0.74 -0.03 0.00 0.00 0.00 0.00 47.33 47.77 2ooz h GLY 69 CO 0.30 -0.37 0.12 0.00 0.00 0.00 0.00 176.54 176.59 2ooz h ALA 70 N -0.62 0.47 -0.66 3.60 0.00 -1.99 -2.32 119.26 117.74 2ooz h ALA 70 Ca 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2ooz h ALA 70 Cb 0.37 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2ooz h ALA 70 CO -0.32 0.10 0.38 1.96 0.00 0.00 0.00 179.25 181.37 2ooz h GLN 71 N 0.43 0.92 -0.39 0.00 4.20 -1.90 -1.26 115.11 117.11 2ooz h GLN 71 Ca 0.12 -0.10 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 2ooz h GLN 71 Cb 0.23 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 2ooz h GLN 71 CO -0.01 0.68 -0.05 -0.91 -0.67 0.00 0.00 178.83 177.87 2ooz h ASN 72 N 0.91 0.62 -0.69 1.46 2.35 -0.39 0.31 115.58 120.14 2ooz h ASN 72 Ca 0.24 -0.15 -0.06 0.00 -0.55 0.00 0.00 56.30 55.77 2ooz h ASN 72 Cb 0.01 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 2ooz h ASN 72 CO -0.04 0.72 0.19 0.03 -1.65 0.00 0.00 177.43 176.68 2ooz h ARG 73 N 0.60 1.10 -0.31 0.81 3.08 -0.97 -1.09 114.38 117.59 2ooz h ARG 73 Ca 0.12 -0.25 -0.06 0.00 0.07 0.00 0.00 59.98 59.86 2ooz h ARG 73 Cb 0.45 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2ooz h ARG 73 CO 0.02 0.96 -0.03 1.03 -1.07 0.00 0.00 179.97 180.88 2ooz h SER 74 N 1.03 0.56 -0.85 7.04 0.87 -0.28 -2.33 113.55 119.61 2ooz h SER 74 Ca 0.22 -0.33 -0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2ooz h SER 74 Cb 0.34 -0.15 -0.04 0.00 -0.44 0.00 0.00 62.40 62.11 2ooz h SER 74 CO -0.00 0.76 0.52 1.88 -0.53 0.00 0.00 176.83 179.45 2ooz h TYR 75 N 0.35 1.11 -0.49 2.24 0.99 -0.24 -1.97 116.97 118.96 2ooz h TYR 75 Ca 0.08 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.75 2ooz h TYR 75 Cb 0.49 -0.37 -0.02 0.00 1.00 0.00 0.00 36.73 37.84 2ooz h TYR 75 CO 0.04 0.74 0.05 0.77 -0.00 0.00 0.00 178.16 179.76 2ooz h SER 76 N 1.17 0.82 -0.24 3.88 0.02 -1.05 0.14 113.55 118.28 2ooz h SER 76 Ca 0.31 -0.28 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2ooz h SER 76 Cb -0.06 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.25 2ooz h SER 76 CO -0.06 0.89 0.13 0.50 -1.14 0.00 0.00 176.83 177.16 2ooz h LYS 77 N 0.71 0.27 0.29 3.45 3.64 -1.10 0.99 116.57 124.82 2ooz h LYS 77 Ca 0.15 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 2ooz h LYS 77 Cb 0.45 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2ooz h LYS 77 CO 0.02 0.18 -0.14 1.25 -2.27 0.00 0.00 179.45 178.48 2ooz h LEU 78 N 0.28 -0.34 -0.37 5.20 5.85 -1.07 -1.76 115.31 123.10 2ooz h LEU 78 Ca 0.10 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 2ooz h LEU 78 Cb 0.01 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2ooz h LEU 78 CO -0.05 -0.19 -0.20 -0.07 -0.34 0.00 0.00 178.44 177.59 2ooz h LEU 79 N -0.46 0.82 -1.18 2.25 3.38 -0.67 -1.58 115.31 117.87 2ooz h LEU 79 Ca -0.04 -0.41 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 2ooz h LEU 79 Cb 0.35 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2ooz h LEU 79 CO 0.07 1.05 0.30 0.00 0.09 0.00 0.00 178.44 179.94 2ooz h GLY 81 N 0.95 1.03 0.88 0.00 0.00 -1.09 0.63 103.07 105.48 2ooz h GLY 81 Ca 0.21 -0.72 -0.09 0.00 0.00 0.00 0.00 47.33 46.74 2ooz h GLY 81 CO -0.03 0.67 -0.18 1.41 0.00 0.00 0.00 176.54 178.41 2ooz h LEU 82 N 0.88 0.59 -0.80 3.11 3.38 -0.59 -1.26 115.31 120.63 2ooz h LEU 82 Ca 0.16 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 2ooz h LEU 82 Cb 0.50 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2ooz h LEU 82 CO 0.02 0.91 0.07 -0.07 0.09 0.00 0.00 178.44 179.46 2ooz h LEU 83 N 0.28 0.94 -0.41 1.67 3.38 -0.88 0.64 115.31 120.93 2ooz h LEU 83 Ca 0.05 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 2ooz h LEU 83 Cb 0.71 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2ooz h LEU 83 CO 0.05 0.95 -0.09 0.00 0.09 0.00 0.00 178.44 179.44 2ooz h ALA 84 N 1.16 0.57 0.00 1.53 0.00 -0.81 -1.10 119.26 120.60 2ooz h ALA 84 Ca 0.18 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.62 2ooz h ALA 84 Cb 0.43 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.09 2ooz h ALA 84 CO 0.01 0.43 -0.62 1.49 0.00 0.00 0.00 179.25 180.56 2ooz h GLU 85 N 0.61 0.42 0.04 0.00 4.81 -1.05 -2.48 114.58 116.91 2ooz h GLU 85 Ca 0.11 -0.45 -0.31 0.00 -0.13 0.00 0.00 59.36 58.58 2ooz h GLU 85 Cb 0.61 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 30.08 2ooz h GLU 85 CO 0.04 1.11 -1.73 0.00 -0.73 0.00 0.00 179.01 177.71 2ooz h ARG 86 N -0.09 0.08 -0.01 1.92 2.47 -0.97 -3.39 114.38 114.39 2ooz h ARG 86 Ca -0.08 -0.13 0.00 0.00 -1.26 0.00 0.00 59.98 58.51 2ooz h ARG 86 Cb 1.33 0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.70 2ooz h ARG 86 CO 0.12 0.72 -0.27 1.28 0.56 0.00 0.00 179.97 182.38 2ooz n LEU 87 N -3.19 1.05 -2.09 3.04 4.77 -0.50 -4.58 117.00 115.51 2ooz n LEU 87 Ca -0.19 -0.70 -0.15 0.00 -0.03 0.00 0.00 56.01 54.93 2ooz n LEU 87 Cb 1.05 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.16 2ooz n LEU 87 CO 0.45 0.22 -0.01 0.54 -1.33 0.00 0.00 177.39 177.26 2ooz n ARG 88 N -0.48 -3.21 -3.80 3.23 5.12 -0.73 -4.97 116.66 111.83 2ooz n ARG 88 Ca 0.04 0.62 -0.35 0.00 -1.93 0.00 0.00 57.85 56.23 2ooz n ARG 88 Cb 0.20 -4.88 -0.08 0.00 -1.16 0.00 0.00 32.46 26.54 2ooz n ARG 88 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2ooz s ILE 89 N -2.95 5.31 0.15 0.55 1.01 -0.99 -4.94 121.20 119.33 2ooz s ILE 89 Ca 0.19 0.15 -0.31 0.00 0.00 0.00 0.00 60.65 60.69 2ooz s ILE 89 Cb -0.09 -3.41 -0.09 0.00 0.01 0.00 0.00 42.46 38.89 2ooz s ILE 89 CO 0.24 0.46 1.41 -0.55 0.00 0.00 0.00 174.94 176.50 2ooz s SER 90 N 0.20 6.79 0.46 3.58 0.15 -1.26 -3.30 113.70 120.32 2ooz s SER 90 Ca 0.08 2.42 0.23 0.00 0.70 0.00 0.00 55.95 59.38 2ooz s SER 90 Cb -0.11 -2.60 1.24 0.00 -1.71 0.00 0.00 66.02 62.84 2ooz s SER 90 CO -0.01 -0.66 1.85 -0.65 1.20 0.00 0.00 173.24 174.97 2ooz h PRO 91 N 6.36 0.25 0.00 5.44 0.11 -1.97 0.13 132.00 142.32 2ooz h PRO 91 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2ooz h PRO 91 Cb 1.21 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2ooz h PRO 91 CO 0.85 0.16 0.00 -0.40 -0.21 0.00 0.00 178.00 178.40 2ooz n ASP 92 N -4.44 0.00 -1.38 -2.05 5.75 -1.26 -2.55 116.55 110.62 2ooz n ASP 92 Ca 0.20 -1.36 -0.05 0.00 -0.01 0.00 0.00 54.79 53.57 2ooz n ASP 92 Cb 0.84 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 41.04 2ooz n ASP 92 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2ooz n ARG 93 N -0.73 2.13 -4.24 0.11 1.74 0.46 -5.01 116.66 111.11 2ooz n ARG 93 Ca 0.10 -3.48 -0.20 0.00 -0.77 0.00 0.00 57.85 53.51 2ooz n ARG 93 Cb 0.05 -1.67 -0.16 0.00 -1.02 0.00 0.00 32.46 29.66 2ooz n ARG 93 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ooz s VAL 94 N -3.40 0.60 -0.06 1.55 1.01 -1.06 -1.46 120.40 117.60 2ooz s VAL 94 Ca 0.41 -0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.23 2ooz s VAL 94 Cb 0.38 -0.58 -0.01 0.00 0.00 0.00 0.00 36.38 36.17 2ooz s VAL 94 CO -0.04 0.22 -0.24 -0.31 0.00 0.00 0.00 175.10 174.73 2ooz s TYR 95 N 0.54 2.32 -0.17 5.22 4.12 -0.66 -5.00 117.35 123.72 2ooz s TYR 95 Ca -0.08 -0.70 -0.01 0.00 0.02 0.00 0.00 57.07 56.31 2ooz s TYR 95 Cb -0.11 -1.53 0.05 0.00 -1.52 0.00 0.00 41.96 38.85 2ooz s TYR 95 CO 0.00 -0.22 -0.02 0.42 0.02 0.00 0.00 175.55 175.76 2ooz s ILE 96 N -0.12 0.91 -0.16 2.71 1.01 -1.26 -0.09 121.20 124.20 2ooz s ILE 96 Ca -0.04 -0.57 -0.20 0.00 0.00 0.00 0.00 60.65 59.84 2ooz s ILE 96 Cb -0.14 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.13 2ooz s ILE 96 CO 0.04 0.04 0.56 0.20 0.00 0.00 0.00 174.94 175.77 2ooz s ASN 97 N 1.71 6.69 -0.16 3.58 0.02 -0.26 -4.92 114.94 121.60 2ooz s ASN 97 Ca 0.00 0.82 -0.07 0.00 -1.02 0.00 0.00 52.86 52.59 2ooz s ASN 97 Cb -0.16 -2.32 -0.04 0.00 0.02 0.00 0.00 41.25 38.75 2ooz s ASN 97 CO -0.07 -0.14 0.09 -0.31 0.02 0.00 0.00 177.10 176.68 2ooz s TYR 98 N 1.29 3.35 -0.12 2.20 1.51 -1.26 -0.61 117.35 123.72 2ooz s TYR 98 Ca 0.28 0.25 -0.00 0.00 -1.01 0.00 0.00 57.07 56.58 2ooz s TYR 98 Cb -0.16 -2.04 0.02 0.00 -0.11 0.00 0.00 41.96 39.68 2ooz s TYR 98 CO 0.11 0.35 -0.09 0.71 -1.11 0.00 0.00 175.55 175.52 2ooz s TYR 99 N -0.07 1.61 -0.56 2.71 1.51 -0.36 -4.97 117.35 117.21 2ooz s TYR 99 Ca 0.08 -0.82 -0.21 0.00 -1.01 0.00 0.00 57.07 55.12 2ooz s TYR 99 Cb -0.12 -1.29 0.07 0.00 -0.11 0.00 0.00 41.96 40.51 2ooz s TYR 99 CO 0.01 -0.53 0.76 0.34 -1.11 0.00 0.00 175.55 175.02 2ooz s ASP 100 N 1.61 6.23 0.17 2.29 -1.08 -1.26 -1.52 116.67 123.11 2ooz s ASP 100 Ca 0.04 -0.94 -0.14 0.00 -0.52 0.00 0.00 52.55 50.98 2ooz s ASP 100 Cb -0.13 -2.34 -0.07 0.00 -1.46 0.00 0.00 42.92 38.92 2ooz s ASP 100 CO -0.08 -1.11 0.58 -0.04 0.52 0.00 0.00 175.17 175.04 2ooz s MET 101 N 3.15 3.99 0.14 4.34 -1.94 0.66 -4.91 119.30 124.73 2ooz s MET 101 Ca 0.18 0.52 -0.25 0.00 -1.71 0.00 0.00 55.69 54.42 2ooz s MET 101 Cb -0.19 -2.87 -0.07 0.00 2.01 0.00 0.00 34.83 33.71 2ooz s MET 101 CO 0.12 0.44 0.78 -0.80 -0.01 0.00 0.00 175.02 175.55 2ooz s ASN 102 N -1.80 7.36 0.42 3.03 0.01 -1.26 -4.12 114.94 118.57 2ooz s ASN 102 Ca 0.40 1.61 0.18 0.00 -0.71 0.00 0.00 52.86 54.34 2ooz s ASN 102 Cb -0.15 -2.50 1.09 0.00 0.41 0.00 0.00 41.25 40.11 2ooz s ASN 102 CO 0.19 0.16 1.85 0.00 -1.51 0.00 0.00 177.10 177.79 2ooz h ALA 103 N 4.67 2.22 0.00 0.60 0.00 -1.94 0.12 119.26 124.92 2ooz h ALA 103 Ca -0.46 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2ooz h ALA 103 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2ooz h ALA 103 CO 0.67 -0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.41 2ooz h ALA 104 N 1.61 1.00 -0.52 0.00 0.00 -1.92 -2.74 119.26 116.69 2ooz h ALA 104 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 2ooz h ALA 104 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2ooz h ALA 104 CO -0.18 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.16 2ooz n ASN 105 N -2.66 5.11 -3.94 0.00 3.02 0.40 -4.82 115.26 112.36 2ooz n ASN 105 Ca 0.01 -2.84 -0.30 0.00 -0.03 0.00 0.00 54.58 51.42 2ooz n ASN 105 Cb 0.26 -0.63 -0.16 0.00 -0.61 0.00 0.00 39.78 38.64 2ooz n ASN 105 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2ooz s VAL 106 N -2.57 1.47 0.24 2.41 1.01 -1.06 -4.89 120.40 117.02 2ooz s VAL 106 Ca 0.51 -1.09 -0.16 0.00 0.00 0.00 0.00 61.98 61.23 2ooz s VAL 106 Cb 0.38 -1.70 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 2ooz s VAL 106 CO 0.16 -0.02 0.67 -0.83 0.00 0.00 0.00 175.10 175.08 2ooz s GLY 107 N 1.44 2.46 -0.28 4.51 0.00 -1.26 -1.98 107.32 112.21 2ooz s GLY 107 Ca -0.04 0.02 -0.25 0.00 0.00 0.00 0.00 44.72 44.44 2ooz s GLY 107 CO -0.07 0.29 1.09 0.86 0.00 0.00 0.00 173.10 175.27 2ooz s TRP 108 N -1.68 -0.41 -1.32 1.90 -0.00 0.10 -4.94 118.94 112.59 2ooz s TRP 108 Ca 0.46 0.98 -0.09 0.00 -0.00 0.00 0.00 56.10 57.45 2ooz s TRP 108 Cb -0.14 0.39 0.00 0.00 -0.00 0.00 0.00 33.47 33.72 2ooz s TRP 108 CO 0.20 -0.21 0.53 -1.71 -0.00 0.00 0.00 176.95 175.76 2ooz n ASN 109 N 2.02 -2.00 0.00 5.86 4.05 -1.26 -1.62 115.26 122.31 2ooz n ASN 109 Ca -0.12 -1.04 0.00 0.00 0.45 0.00 0.00 54.58 53.87 2ooz n ASN 109 Cb 0.56 -3.01 0.00 0.00 1.23 0.00 0.00 39.78 38.56 2ooz n ASN 109 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2ooz n ASN 110 N -2.83 -3.19 0.00 1.20 5.03 -1.26 -4.88 115.26 109.32 2ooz n ASN 110 Ca -0.23 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.22 2ooz n ASN 110 Cb 0.65 -2.11 0.00 0.00 -1.02 0.00 0.00 39.78 37.30 2ooz n ASN 110 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 2ooz n SER 111 N -0.41 0.00 -4.25 6.41 2.88 -0.64 -5.19 113.62 112.42 2ooz n SER 111 Ca 0.00 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.30 2ooz n SER 111 Cb 0.21 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.58 2ooz n SER 111 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2ooz s THR 112 N -0.19 0.79 -2.20 2.46 -4.23 -1.26 -0.72 115.64 110.28 2ooz s THR 112 Ca 0.00 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 58.79 2ooz s THR 112 Cb 0.00 -2.49 0.70 0.00 1.34 0.00 0.00 72.50 72.06 2ooz s THR 112 CO 0.00 0.00 1.94 0.49 -0.54 0.00 0.00 174.62 176.51 2ooz n PHE 113 N -0.84 0.02 0.15 3.99 3.01 -0.84 -4.82 117.46 118.14 2ooz n PHE 113 Ca -0.05 -0.01 0.01 0.00 1.01 0.00 0.00 57.45 58.41 2ooz n PHE 113 Cb 0.66 0.00 0.07 0.00 -0.01 0.00 0.00 39.48 40.20 2ooz n PHE 113 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77