#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d2b s THR 2 N 0.00 3.87 0.14 0.00 -4.23 -1.26 -3.02 115.64 111.14 1d2b s THR 2 Ca 0.00 -1.38 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 1d2b s THR 2 Cb 0.00 -4.91 0.01 0.00 1.34 0.00 0.00 72.50 68.94 1d2b s THR 2 CO 0.00 -1.61 0.09 0.00 -0.54 0.00 0.00 174.62 172.56 1d2b s VAL 4 N -0.83 5.22 -0.46 0.00 0.11 -1.26 -4.24 120.40 118.93 1d2b s VAL 4 Ca 0.06 0.21 -0.42 0.00 -2.93 0.00 0.00 61.98 58.91 1d2b s VAL 4 Cb -0.01 -3.60 -0.17 0.00 -1.53 0.00 0.00 36.38 31.07 1d2b s VAL 4 CO 0.04 0.28 2.13 -2.65 -3.33 0.00 0.00 175.10 171.58 1d2b n PRO 5 N 0.86 0.25 -2.96 1.54 -0.02 -1.26 -4.80 135.00 128.61 1d2b n PRO 5 Ca -0.09 0.07 -0.31 0.00 -2.02 0.00 0.00 63.50 61.15 1d2b n PRO 5 Cb 0.52 -1.71 -0.05 0.00 -0.02 0.00 0.00 33.50 32.24 1d2b n PRO 5 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1d2b s PRO 6 N 5.94 3.90 -0.02 0.52 0.05 -1.26 -4.95 135.00 139.18 1d2b s PRO 6 Ca 1.17 0.61 -0.19 0.00 0.05 0.00 0.00 61.00 62.64 1d2b s PRO 6 Cb -1.36 -2.39 -0.09 0.00 0.05 0.00 0.00 34.50 30.71 1d2b s PRO 6 CO 0.63 0.04 0.52 -2.39 0.05 0.00 0.00 177.00 175.84 1d2b n HIS 7 N -0.87 0.34 0.30 0.56 -0.00 -1.26 -4.46 115.22 109.83 1d2b n HIS 7 Ca 0.03 0.50 0.17 0.00 -0.00 0.00 0.00 57.72 58.42 1d2b n HIS 7 Cb 0.54 -0.98 0.76 0.00 -0.00 0.00 0.00 29.99 30.31 1d2b n HIS 7 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1d2b h PRO 8 N 1.46 0.00 0.04 -1.40 0.13 -1.94 0.33 132.00 130.63 1d2b h PRO 8 Ca -0.23 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1d2b h PRO 8 Cb 0.66 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.79 1d2b h PRO 8 CO 0.31 0.00 -0.03 0.37 -0.23 0.00 0.00 178.00 178.42 1d2b h GLN 9 N 0.00 -0.07 -0.10 0.86 -0.00 -1.78 1.09 115.11 115.11 1d2b h GLN 9 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 58.65 58.70 1d2b h GLN 9 Cb 0.38 0.02 -0.05 0.00 0.00 0.00 0.00 27.48 27.82 1d2b h GLN 9 CO 0.00 -0.05 -0.25 1.15 0.00 0.00 0.00 178.83 179.68 1d2b h THR 10 N -0.08 0.41 -0.62 2.39 2.02 -1.67 -1.75 112.91 113.62 1d2b h THR 10 Ca -0.01 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1d2b h THR 10 Cb 0.06 0.41 -0.06 0.00 -1.74 0.00 0.00 68.15 66.83 1d2b h THR 10 CO 0.00 0.00 0.32 0.00 0.37 0.00 0.00 175.52 176.21 1d2b h ALA 11 N 0.57 0.82 0.68 6.16 0.00 -0.22 0.54 119.26 127.81 1d2b h ALA 11 Ca 0.09 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1d2b h ALA 11 Cb 0.47 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.18 1d2b h ALA 11 CO -0.29 -0.03 -0.33 0.35 0.00 0.00 0.00 179.25 178.96 1d2b h PHE 12 N 0.59 -0.84 -0.13 0.00 3.57 0.16 -2.27 116.94 118.02 1d2b h PHE 12 Ca 0.28 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.70 1d2b h PHE 12 Cb 0.21 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.23 1d2b h PHE 12 CO -0.10 -0.49 -0.16 0.00 -2.23 0.00 0.00 178.31 175.33 1d2b h ASN 14 N -0.05 1.08 -4.02 0.00 2.35 -0.03 -3.42 115.58 111.48 1d2b h ASN 14 Ca 0.02 -0.02 -0.48 0.00 -0.55 0.00 0.00 56.30 55.27 1d2b h ASN 14 Cb 0.70 -0.26 0.03 0.00 0.05 0.00 0.00 38.32 38.84 1d2b h ASN 14 CO 0.04 0.76 0.41 -0.55 -1.65 0.00 0.00 177.43 176.44 1d2b s SER 15 N -6.03 6.47 0.00 5.81 0.15 -0.85 -4.94 113.70 114.32 1d2b s SER 15 Ca -0.13 2.01 0.23 0.00 0.70 0.00 0.00 55.95 58.77 1d2b s SER 15 Cb 0.18 -2.57 0.48 0.00 -1.71 0.00 0.00 66.02 62.40 1d2b s SER 15 CO 0.81 -0.69 1.44 0.47 1.20 0.00 0.00 173.24 176.47 1d2b n ASP 16 N -0.58 3.62 -3.46 5.45 9.92 -1.24 -4.79 116.55 125.46 1d2b n ASP 16 Ca 0.07 -2.00 -0.04 0.00 -0.53 0.00 0.00 54.79 52.29 1d2b n ASP 16 Cb 0.51 -0.31 -0.06 0.00 -0.64 0.00 0.00 41.12 40.62 1d2b n ASP 16 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1d2b s LEU 17 N -1.38 -0.92 -0.09 0.64 1.43 0.61 -4.44 118.68 114.53 1d2b s LEU 17 Ca 0.42 0.90 -0.02 0.00 -1.03 0.00 0.00 54.13 54.40 1d2b s LEU 17 Cb 0.24 1.69 0.03 0.00 0.03 0.00 0.00 46.19 48.17 1d2b s LEU 17 CO 0.32 -0.25 0.01 -0.69 0.23 0.00 0.00 176.35 175.97 1d2b s VAL 18 N 2.71 0.38 0.00 -1.59 1.01 0.06 0.21 120.40 123.18 1d2b s VAL 18 Ca 0.06 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1d2b s VAL 18 Cb -0.14 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.66 1d2b s VAL 18 CO -0.17 0.20 0.00 2.30 0.00 0.00 0.00 175.10 177.44 1d2b n ILE 19 N 5.14 0.00 -4.12 2.22 -0.00 -0.41 0.18 119.36 122.36 1d2b n ILE 19 Ca -0.07 0.00 -0.21 0.00 -0.00 0.00 0.00 62.75 62.47 1d2b n ILE 19 Cb 0.50 0.00 -0.17 0.00 -0.00 0.00 0.00 39.64 39.97 1d2b n ILE 19 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1d2b s ARG 20 N -1.53 0.90 0.23 6.28 1.04 0.28 -0.44 118.95 125.70 1d2b s ARG 20 Ca 0.00 -0.11 -0.15 0.00 -1.04 0.00 0.00 55.73 54.44 1d2b s ARG 20 Cb 0.00 -0.94 0.01 0.00 -2.04 0.00 0.00 34.95 31.98 1d2b s ARG 20 CO 0.00 -0.11 0.50 0.00 -0.04 0.00 0.00 175.30 175.64 1d2b s ALA 21 N 1.09 -0.52 -0.00 7.88 0.00 0.41 -1.85 121.76 128.77 1d2b s ALA 21 Ca -0.08 -0.64 0.02 0.00 0.00 0.00 0.00 51.96 51.27 1d2b s ALA 21 Cb -0.14 0.96 -0.03 0.00 0.00 0.00 0.00 23.12 23.91 1d2b s ALA 21 CO -0.01 -0.84 -0.04 0.15 0.00 0.00 0.00 175.76 175.02 1d2b s LYS 22 N -3.96 2.65 -0.29 0.00 1.02 -0.56 0.25 119.74 118.84 1d2b s LYS 22 Ca 0.17 -0.67 -0.17 0.00 0.02 0.00 0.00 55.97 55.32 1d2b s LYS 22 Cb -0.01 -2.57 -0.02 0.00 -0.52 0.00 0.00 37.83 34.71 1d2b s LYS 22 CO 0.05 0.61 0.46 -0.06 -0.92 0.00 0.00 175.35 175.49 1d2b s PHE 23 N -1.02 3.23 -0.31 3.18 0.40 -1.26 0.35 117.98 122.56 1d2b s PHE 23 Ca 0.18 0.42 0.16 0.00 -0.60 0.00 0.00 56.93 57.08 1d2b s PHE 23 Cb -0.11 -2.72 0.47 0.00 0.51 0.00 0.00 43.02 41.17 1d2b s PHE 23 CO 0.08 -0.33 1.09 1.33 0.70 0.00 0.00 175.22 178.08 1d2b n VAL 24 N 5.22 1.61 -3.63 -0.44 0.24 -0.77 -4.37 118.33 116.18 1d2b n VAL 24 Ca -0.06 -3.50 -0.06 0.00 -2.04 0.00 0.00 64.34 58.69 1d2b n VAL 24 Cb 0.50 0.29 -0.02 0.00 -1.47 0.00 0.00 33.84 33.14 1d2b n VAL 24 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1d2b s GLY 25 N -3.55 -0.34 0.36 7.63 0.00 -0.81 -4.61 107.32 105.99 1d2b s GLY 25 Ca 0.35 0.55 0.07 0.00 0.00 0.00 0.00 44.72 45.69 1d2b s GLY 25 CO -0.02 0.16 0.43 -0.51 0.00 0.00 0.00 173.10 173.15 1d2b s THR 26 N -3.18 3.53 -0.49 0.90 -4.23 -1.26 -4.18 115.64 106.74 1d2b s THR 26 Ca 0.09 -1.15 -0.29 0.00 -1.18 0.00 0.00 61.69 59.17 1d2b s THR 26 Cb -0.01 -3.22 0.02 0.00 1.34 0.00 0.00 72.50 70.63 1d2b s THR 26 CO -0.03 -0.11 1.30 -2.16 -0.54 0.00 0.00 174.62 173.08 1d2b s PRO 27 N -4.15 3.54 0.77 3.99 0.04 -1.26 -4.22 135.00 133.71 1d2b s PRO 27 Ca 0.46 0.61 -0.11 0.00 0.04 0.00 0.00 61.00 62.00 1d2b s PRO 27 Cb -0.08 -4.01 0.05 0.00 0.04 0.00 0.00 34.50 30.50 1d2b s PRO 27 CO 0.30 -1.62 1.09 -1.83 0.04 0.00 0.00 177.00 174.98 1d2b s GLU 28 N 4.94 2.30 -0.34 4.56 -1.05 -1.22 -4.97 118.70 122.91 1d2b s GLU 28 Ca 0.53 0.71 0.02 0.00 -0.15 0.00 0.00 54.97 56.08 1d2b s GLU 28 Cb -0.10 -1.94 0.15 0.00 -0.44 0.00 0.00 34.13 31.80 1d2b s GLU 28 CO 0.30 -1.49 0.35 0.08 0.95 0.00 0.00 175.26 175.46 1d2b s VAL 29 N -3.13 -0.36 0.50 1.83 1.01 -1.26 -4.25 120.40 114.74 1d2b s VAL 29 Ca 0.60 -0.83 -0.19 0.00 0.00 0.00 0.00 61.98 61.56 1d2b s VAL 29 Cb -0.14 -0.78 -0.08 0.00 0.00 0.00 0.00 36.38 35.38 1d2b s VAL 29 CO 0.54 -0.54 1.03 0.21 0.00 0.00 0.00 175.10 176.34 1d2b s ASN 30 N 1.74 6.32 0.00 3.32 2.47 -1.26 -4.91 114.94 122.62 1d2b s ASN 30 Ca 0.14 1.85 0.29 0.00 0.42 0.00 0.00 52.86 55.56 1d2b s ASN 30 Cb -0.15 -2.55 1.25 0.00 -1.45 0.00 0.00 41.25 38.35 1d2b s ASN 30 CO -0.13 -0.79 1.90 0.00 -3.72 0.00 0.00 177.10 174.36 1d2b n GLN 31 N -1.19 0.25 -2.59 0.43 1.13 -1.26 -3.91 117.38 110.23 1d2b n GLN 31 Ca 0.09 -0.04 -0.00 0.00 -1.94 0.00 0.00 57.00 55.11 1d2b n GLN 31 Cb 0.53 -1.50 0.06 0.00 0.11 0.00 0.00 30.24 29.44 1d2b n GLN 31 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1d2b n THR 32 N -1.34 0.81 -0.11 5.09 -1.04 -1.26 -4.84 114.28 111.59 1d2b n THR 32 Ca 0.10 -2.19 -0.23 0.00 -2.04 0.00 0.00 64.05 59.70 1d2b n THR 32 Cb 0.30 1.18 -0.08 0.00 -1.82 0.00 0.00 70.33 69.91 1d2b n THR 32 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 1d2b n THR 33 N -0.66 1.15 0.00 12.58 5.66 -1.25 -4.97 114.28 126.78 1d2b n THR 33 Ca 0.00 -0.29 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 1d2b n THR 33 Cb 0.85 -1.79 0.00 0.00 -1.55 0.00 0.00 70.33 67.85 1d2b n THR 33 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1d2b n LEU 34 N -3.94 0.00 -4.02 1.09 4.77 -1.26 -4.88 117.00 108.75 1d2b n LEU 34 Ca -0.41 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.48 1d2b n LEU 34 Cb 0.79 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.80 1d2b n LEU 34 CO 0.02 0.00 -0.19 -0.72 -1.33 0.00 0.00 177.39 175.17 1d2b s TYR 35 N -2.30 0.51 0.25 -1.77 1.13 -1.26 1.08 117.35 115.00 1d2b s TYR 35 Ca 0.00 -0.94 0.04 0.00 -1.41 0.00 0.00 57.07 54.77 1d2b s TYR 35 Cb 0.00 -0.26 -0.05 0.00 -1.10 0.00 0.00 41.96 40.55 1d2b s TYR 35 CO 0.00 -0.55 -0.02 -0.65 -2.51 0.00 0.00 175.55 171.83 1d2b s GLN 36 N -3.96 1.43 -0.15 -3.49 -1.52 0.69 -4.41 119.66 108.24 1d2b s GLN 36 Ca 0.15 -1.73 -0.01 0.00 -1.95 0.00 0.00 55.36 51.82 1d2b s GLN 36 Cb 0.06 -0.81 0.04 0.00 -0.22 0.00 0.00 33.01 32.08 1d2b s GLN 36 CO -0.04 -0.06 -0.03 1.03 -0.25 0.00 0.00 175.29 175.94 1d2b s ARG 37 N -3.82 1.20 0.16 2.91 0.52 -1.26 -1.47 118.95 117.20 1d2b s ARG 37 Ca 0.29 -0.39 -0.11 0.00 -0.52 0.00 0.00 55.73 55.01 1d2b s ARG 37 Cb 0.05 -1.83 -0.07 0.00 0.52 0.00 0.00 34.95 33.62 1d2b s ARG 37 CO 0.10 -0.43 0.50 0.71 0.02 0.00 0.00 175.30 176.20 1d2b s TYR 38 N 1.72 3.52 -0.04 -0.53 2.02 -0.78 -3.45 117.35 119.81 1d2b s TYR 38 Ca 0.01 0.88 -0.04 0.00 -0.37 0.00 0.00 57.07 57.56 1d2b s TYR 38 Cb -0.15 -2.24 -0.04 0.00 -0.40 0.00 0.00 41.96 39.13 1d2b s TYR 38 CO -0.07 0.39 0.15 -1.21 -1.57 0.00 0.00 175.55 173.23 1d2b s GLU 39 N -2.35 3.37 0.32 -0.62 2.02 -1.26 -1.38 118.70 118.80 1d2b s GLU 39 Ca 0.41 -0.29 0.03 0.00 0.02 0.00 0.00 54.97 55.13 1d2b s GLU 39 Cb -0.13 -3.08 -0.04 0.00 0.10 0.00 0.00 34.13 30.98 1d2b s GLU 39 CO 0.20 0.70 0.14 0.96 0.02 0.00 0.00 175.26 177.29 1d2b s ILE 40 N -1.21 0.46 -0.77 -1.63 -4.36 -1.07 -1.84 121.20 110.78 1d2b s ILE 40 Ca 0.23 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.63 1d2b s ILE 40 Cb -0.12 -2.52 0.19 0.00 1.25 0.00 0.00 42.46 41.25 1d2b s ILE 40 CO 0.13 0.00 0.60 -0.75 0.24 0.00 0.00 174.94 175.16 1d2b s LYS 41 N -3.83 2.79 -0.34 0.37 2.47 1.08 -4.60 119.74 117.69 1d2b s LYS 41 Ca 0.34 -3.24 -0.28 0.00 -1.56 0.00 0.00 55.97 51.23 1d2b s LYS 41 Cb 0.05 -3.67 -0.07 0.00 -1.46 0.00 0.00 37.83 32.69 1d2b s LYS 41 CO 0.17 -1.26 2.31 -0.12 0.16 0.00 0.00 175.35 176.60 1d2b n MET 42 N 2.26 1.52 0.16 4.03 0.00 -1.26 -1.50 117.12 122.33 1d2b n MET 42 Ca 0.19 0.31 -0.07 0.00 -0.00 0.00 0.00 57.70 58.13 1d2b n MET 42 Cb 0.36 -3.23 -0.03 0.00 0.00 0.00 0.00 33.22 30.31 1d2b n MET 42 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 175.97 177.76 1d2b h THR 43 N 7.38 0.00 -2.53 1.12 1.35 -1.74 -3.48 112.91 114.99 1d2b h THR 43 Ca -0.33 -0.58 -0.09 0.00 -0.55 0.00 0.00 66.41 64.86 1d2b h THR 43 Cb 1.26 0.00 -0.20 0.00 -1.73 0.00 0.00 68.15 67.48 1d2b h THR 43 CO 1.05 0.00 -0.05 -0.54 -0.25 0.00 0.00 175.52 175.72 1d2b s LYS 44 N -3.08 0.85 -0.01 4.72 -0.14 -0.77 -5.04 119.74 116.27 1d2b s LYS 44 Ca -0.07 0.04 -0.11 0.00 -1.36 0.00 0.00 55.97 54.48 1d2b s LYS 44 Cb 0.01 0.39 -0.05 0.00 -1.68 0.00 0.00 37.83 36.50 1d2b s LYS 44 CO 0.20 -0.25 0.32 0.00 -0.76 0.00 0.00 175.35 174.86 1d2b s MET 45 N -1.22 3.72 -0.06 1.68 0.23 -1.26 -0.56 119.30 121.82 1d2b s MET 45 Ca -0.12 0.16 0.09 0.00 -1.03 0.00 0.00 55.69 54.79 1d2b s MET 45 Cb -0.03 -3.15 0.14 0.00 -1.53 0.00 0.00 34.83 30.26 1d2b s MET 45 CO 0.07 0.68 1.03 0.66 -2.03 0.00 0.00 175.02 175.43 1d2b n TYR 46 N 1.56 0.00 0.00 3.16 4.02 0.45 -4.89 117.16 121.46 1d2b n TYR 46 Ca -0.14 -0.64 0.00 0.00 -0.01 0.00 0.00 57.90 57.11 1d2b n TYR 46 Cb 0.53 -0.09 0.00 0.00 -0.02 0.00 0.00 39.34 39.76 1d2b n TYR 46 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1d2b n LYS 47 N -0.85 0.00 0.00 -0.72 4.81 0.47 -4.74 118.16 117.13 1d2b n LYS 47 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 1d2b n LYS 47 Cb 0.50 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.55 1d2b n LYS 47 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1d2b n GLY 48 N 0.00 -0.59 0.39 3.14 0.00 -1.26 -0.76 105.19 106.10 1d2b n GLY 48 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1d2b n GLY 48 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1d2b h PHE 49 N 0.00 -1.23 -0.72 1.61 0.04 -1.93 2.69 116.94 117.40 1d2b h PHE 49 Ca 0.00 0.10 0.21 0.00 2.80 0.00 0.00 57.97 61.08 1d2b h PHE 49 Cb 0.00 0.65 -0.03 0.00 2.20 0.00 0.00 35.95 38.78 1d2b h PHE 49 CO 0.00 -0.40 0.58 -0.56 -0.60 0.00 0.00 178.31 177.33 1d2b h GLN 50 N -0.10 0.00 0.00 1.51 3.07 -1.98 0.74 115.11 118.35 1d2b h GLN 50 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.99 1d2b h GLN 50 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.11 1d2b h GLN 50 CO -0.84 0.00 -1.19 0.00 0.09 0.00 0.00 178.83 176.89 1d2b n ALA 51 N -2.57 3.71 -1.56 0.06 0.00 0.74 -4.66 120.51 116.22 1d2b n ALA 51 Ca 0.14 -0.49 -0.42 0.00 0.00 0.00 0.00 53.44 52.68 1d2b n ALA 51 Cb 0.85 -0.87 -0.03 0.00 0.00 0.00 0.00 19.45 19.40 1d2b n ALA 51 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1d2b n LEU 52 N -1.86 5.20 -0.30 0.00 4.32 0.71 -4.70 117.00 120.37 1d2b n LEU 52 Ca 0.02 -3.50 0.03 0.00 -0.02 0.00 0.00 56.01 52.54 1d2b n LEU 52 Cb 0.43 -1.43 0.17 0.00 -1.62 0.00 0.00 43.42 40.97 1d2b n LEU 52 CO 0.42 0.16 1.15 1.23 -1.22 0.00 0.00 177.39 179.13 1d2b h GLY 53 N 12.46 1.31 0.00 -0.72 0.00 -1.83 -3.42 103.07 110.87 1d2b h GLY 53 Ca 0.47 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1d2b h GLY 53 CO 1.84 0.13 0.00 1.34 0.00 0.00 0.00 176.54 179.85 1d2b n ASP 54 N -4.74 0.00 0.00 0.19 -0.08 -1.26 -5.06 116.55 105.60 1d2b n ASP 54 Ca 0.14 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.42 1d2b n ASP 54 Cb 0.29 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.75 1d2b n ASP 54 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1d2b n ALA 55 N -1.97 0.50 -3.07 -1.67 0.00 -1.26 -5.01 120.51 108.03 1d2b n ALA 55 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1d2b n ALA 55 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1d2b n ALA 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1d2b n ALA 56 N -0.69 5.00 1.02 0.00 0.00 -1.26 -4.65 120.51 119.93 1d2b n ALA 56 Ca 0.00 -4.80 0.11 0.00 0.00 0.00 0.00 53.44 48.74 1d2b n ALA 56 Cb 0.00 -2.10 0.02 0.00 0.00 0.00 0.00 19.45 17.38 1d2b n ALA 56 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1d2b n ASP 57 N 1.22 1.12 -4.24 0.00 5.75 -1.26 -4.83 116.55 114.31 1d2b n ASP 57 Ca 0.27 -0.95 -0.33 0.00 -0.01 0.00 0.00 54.79 53.77 1d2b n ASP 57 Cb 0.34 0.66 -0.16 0.00 -1.03 0.00 0.00 41.12 40.94 1d2b n ASP 57 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1d2b s ILE 58 N -2.85 2.43 0.00 2.12 1.09 -1.26 -4.78 121.20 117.96 1d2b s ILE 58 Ca 0.12 -0.86 0.00 0.00 -1.10 0.00 0.00 60.65 58.82 1d2b s ILE 58 Cb 0.17 -2.00 0.00 0.00 -1.06 0.00 0.00 42.46 39.57 1d2b s ILE 58 CO 0.74 0.53 0.00 0.54 -0.10 0.00 0.00 174.94 176.65 1d2b n ARG 59 N 3.95 1.28 -3.73 2.79 1.74 -1.26 -4.74 116.66 116.68 1d2b n ARG 59 Ca -0.19 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 56.77 1d2b n ARG 59 Cb 0.52 -0.26 -0.07 0.00 -1.02 0.00 0.00 32.46 31.63 1d2b n ARG 59 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1d2b s PHE 60 N -0.59 -0.15 -0.18 -1.55 0.40 -1.26 -2.60 117.98 112.06 1d2b s PHE 60 Ca 0.00 0.05 -0.02 0.00 -0.60 0.00 0.00 56.93 56.36 1d2b s PHE 60 Cb 0.00 0.12 -0.01 0.00 0.51 0.00 0.00 43.02 43.65 1d2b s PHE 60 CO 0.00 -0.51 -0.11 0.14 0.70 0.00 0.00 175.22 175.44 1d2b s VAL 61 N -2.47 3.00 -0.44 -0.44 -7.23 -0.48 -4.15 120.40 108.20 1d2b s VAL 61 Ca -0.05 -0.64 -0.13 0.00 -1.81 0.00 0.00 61.98 59.34 1d2b s VAL 61 Cb -0.01 -2.31 0.07 0.00 0.56 0.00 0.00 36.38 34.69 1d2b s VAL 61 CO -0.03 0.48 0.33 -0.31 -0.31 0.00 0.00 175.10 175.26 1d2b s TYR 62 N 1.01 3.27 -0.04 2.82 1.51 0.13 -1.87 117.35 124.19 1d2b s TYR 62 Ca -0.01 -1.11 0.01 0.00 -1.01 0.00 0.00 57.07 54.96 1d2b s TYR 62 Cb -0.15 -2.99 -0.03 0.00 -0.11 0.00 0.00 41.96 38.68 1d2b s TYR 62 CO -0.02 -0.79 -0.05 -0.08 -1.11 0.00 0.00 175.55 173.51 1d2b s THR 63 N 1.56 3.83 0.39 -0.71 -1.32 -0.54 -3.04 115.64 115.81 1d2b s THR 63 Ca 0.04 -0.56 -0.27 0.00 -1.21 0.00 0.00 61.69 59.69 1d2b s THR 63 Cb -0.23 -2.62 -0.09 0.00 -1.51 0.00 0.00 72.50 68.05 1d2b s THR 63 CO 0.05 0.50 1.33 -2.84 -2.21 0.00 0.00 174.62 171.45 1d2b s PRO 64 N -1.12 4.06 -0.55 7.08 0.02 -1.26 0.25 135.00 143.48 1d2b s PRO 64 Ca 0.15 2.22 -0.01 0.00 0.02 0.00 0.00 61.00 63.38 1d2b s PRO 64 Cb -0.11 -2.85 0.38 0.00 0.02 0.00 0.00 34.50 31.94 1d2b s PRO 64 CO 0.05 -0.44 2.02 0.00 -0.33 0.00 0.00 177.00 178.30 1d2b n ALA 65 N 0.30 5.92 -1.96 -1.55 0.00 7.76 -4.23 120.51 126.76 1d2b n ALA 65 Ca 0.03 -2.87 -0.23 0.00 0.00 0.00 0.00 53.44 50.36 1d2b n ALA 65 Cb 0.43 -1.64 0.05 0.00 0.00 0.00 0.00 19.45 18.29 1d2b n ALA 65 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1d2b s MET 66 N -3.17 2.34 0.40 0.00 -1.94 -1.21 -4.71 119.30 111.01 1d2b s MET 66 Ca 0.54 -0.57 0.22 0.00 -1.71 0.00 0.00 55.69 54.17 1d2b s MET 66 Cb 0.42 -2.34 0.27 0.00 2.01 0.00 0.00 34.83 35.20 1d2b s MET 66 CO -0.00 -0.98 1.53 1.49 -0.01 0.00 0.00 175.02 177.05 1d2b h GLU 67 N -0.25 0.00 -0.12 2.03 4.81 -1.97 -3.34 114.58 115.74 1d2b h GLU 67 Ca -0.43 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 58.63 1d2b h GLU 67 Cb 1.30 0.00 -0.29 0.00 0.63 0.00 0.00 28.75 30.39 1d2b h GLU 67 CO 0.55 0.06 -0.89 0.45 -0.73 0.00 0.00 179.01 178.45 1d2b n SER 68 N -3.07 1.58 -4.98 1.04 2.88 -1.26 -5.09 113.62 104.72 1d2b n SER 68 Ca 0.03 -2.65 -0.20 0.00 -1.33 0.00 0.00 58.87 54.73 1d2b n SER 68 Cb 0.56 -0.39 -0.00 0.00 -0.75 0.00 0.00 64.21 63.62 1d2b n SER 68 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1d2b s VAL 69 N -1.79 4.15 -0.99 2.46 0.11 -1.25 -4.69 120.40 118.40 1d2b s VAL 69 Ca 0.35 -0.89 -0.03 0.00 -2.93 0.00 0.00 61.98 58.48 1d2b s VAL 69 Cb 0.38 -3.46 0.20 0.00 -1.53 0.00 0.00 36.38 31.97 1d2b s VAL 69 CO -0.11 -0.21 2.25 0.00 -3.33 0.00 0.00 175.10 173.70 1d2b n GLY 71 N 0.69 -1.52 2.80 0.00 0.00 -1.26 -2.27 105.19 103.62 1d2b n GLY 71 Ca 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.54 1d2b n GLY 71 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1d2b s TYR 72 N 0.00 -1.02 -0.87 1.61 5.04 -1.26 -2.70 117.35 118.14 1d2b s TYR 72 Ca 0.00 -0.20 -0.25 0.00 -2.44 0.00 0.00 57.07 54.18 1d2b s TYR 72 Cb 0.00 0.20 -0.05 0.00 0.35 0.00 0.00 41.96 42.45 1d2b s TYR 72 CO 0.00 -0.77 1.99 -0.06 -1.34 0.00 0.00 175.55 175.37 1d2b s PHE 73 N 1.21 1.73 -0.38 4.97 0.08 -1.26 -4.91 117.98 119.42 1d2b s PHE 73 Ca 0.24 0.77 -0.16 0.00 0.12 0.00 0.00 56.93 57.90 1d2b s PHE 73 Cb 0.04 -3.99 0.00 0.00 -0.57 0.00 0.00 43.02 38.51 1d2b s PHE 73 CO -0.09 -1.76 0.37 -1.58 -0.10 0.00 0.00 175.22 172.06 1d2b s HIS 74 N 10.49 3.20 -0.65 0.36 5.65 -1.26 -5.02 115.29 128.05 1d2b s HIS 74 Ca 0.72 -0.23 0.01 0.00 0.25 0.00 0.00 55.06 55.82 1d2b s HIS 74 Cb -0.08 -2.73 0.16 0.00 -1.18 0.00 0.00 32.58 28.76 1d2b s HIS 74 CO 0.01 -0.54 0.44 1.03 -0.65 0.00 0.00 174.74 175.04 1d2b s ARG 75 N 2.00 2.46 0.03 2.88 1.81 -1.26 -5.07 118.95 121.80 1d2b s ARG 75 Ca 0.11 -2.87 0.03 0.00 -1.72 0.00 0.00 55.73 51.28 1d2b s ARG 75 Cb -0.17 -3.56 -0.02 0.00 -0.45 0.00 0.00 34.95 30.75 1d2b s ARG 75 CO 0.12 -1.19 -0.10 -1.12 -0.68 0.00 0.00 175.30 172.32 1d2b s SER 76 N -0.26 1.22 -0.18 0.23 0.01 -1.26 -5.05 113.70 108.40 1d2b s SER 76 Ca 0.20 -0.40 -0.17 0.00 1.31 0.00 0.00 55.95 56.90 1d2b s SER 76 Cb -0.17 -0.06 -0.06 0.00 0.21 0.00 0.00 66.02 65.94 1d2b s SER 76 CO -0.07 -0.02 -0.34 1.57 0.41 0.00 0.00 173.24 174.79 1d2b n HIS 77 N 2.03 0.00 -2.23 2.43 -0.00 -1.26 -4.93 115.22 111.26 1d2b n HIS 77 Ca -0.18 0.00 -0.43 0.00 0.46 0.00 0.00 57.72 57.57 1d2b n HIS 77 Cb 0.55 -0.53 -0.02 0.00 -0.12 0.00 0.00 29.99 29.87 1d2b n HIS 77 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1d2b s ASN 78 N -6.07 6.67 0.00 0.26 2.47 -1.26 -4.87 114.94 112.14 1d2b s ASN 78 Ca -0.29 1.74 0.30 0.00 0.42 0.00 0.00 52.86 55.02 1d2b s ASN 78 Cb 0.05 -2.54 1.39 0.00 -1.45 0.00 0.00 41.25 38.70 1d2b s ASN 78 CO 0.42 -0.99 1.99 0.54 -3.72 0.00 0.00 177.10 175.34 1d2b n ARG 79 N 7.15 0.24 -0.09 0.43 3.00 -1.26 -2.64 116.66 123.49 1d2b n ARG 79 Ca 0.16 -0.00 0.12 0.00 -0.01 0.00 0.00 57.85 58.12 1d2b n ARG 79 Cb 0.45 -1.50 0.15 0.00 0.00 0.00 0.00 32.46 31.56 1d2b n ARG 79 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1d2b n SER 80 N -1.38 3.22 -4.69 0.55 3.41 -1.26 -4.24 113.62 109.23 1d2b n SER 80 Ca 0.11 -2.00 -0.42 0.00 -0.26 0.00 0.00 58.87 56.30 1d2b n SER 80 Cb 0.29 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.09 1d2b n SER 80 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1d2b s GLU 81 N -1.76 4.40 0.08 4.33 2.56 -1.08 -5.01 118.70 122.22 1d2b s GLU 81 Ca 0.33 1.27 -0.30 0.00 0.00 0.00 0.00 54.97 56.27 1d2b s GLU 81 Cb 0.21 -3.54 -0.05 0.00 2.00 0.00 0.00 34.13 32.76 1d2b s GLU 81 CO 0.31 -0.28 0.97 -1.21 -0.56 0.00 0.00 175.26 174.49 1d2b s GLU 82 N 1.90 4.66 0.49 4.30 2.02 -1.26 -4.23 118.70 126.56 1d2b s GLU 82 Ca 0.46 1.45 0.05 0.00 0.02 0.00 0.00 54.97 56.94 1d2b s GLU 82 Cb -0.18 -3.40 -0.01 0.00 0.10 0.00 0.00 34.13 30.64 1d2b s GLU 82 CO 0.17 0.13 0.17 -0.06 0.02 0.00 0.00 175.26 175.69 1d2b s PHE 83 N 0.30 2.05 -0.15 1.61 0.08 0.68 -3.12 117.98 119.43 1d2b s PHE 83 Ca 0.48 -0.80 0.02 0.00 0.12 0.00 0.00 56.93 56.75 1d2b s PHE 83 Cb -0.23 -1.81 0.02 0.00 -0.57 0.00 0.00 43.02 40.43 1d2b s PHE 83 CO 0.29 0.03 -0.19 -1.17 -0.10 0.00 0.00 175.22 174.09 1d2b s LEU 84 N -3.99 1.96 -0.20 -0.37 1.98 0.86 -0.45 118.68 118.48 1d2b s LEU 84 Ca 0.26 -0.56 0.00 0.00 -2.89 0.00 0.00 54.13 50.94 1d2b s LEU 84 Cb 0.02 -1.34 0.05 0.00 0.66 0.00 0.00 46.19 45.58 1d2b s LEU 84 CO 0.15 0.02 -0.06 -0.63 -1.89 0.00 0.00 176.35 173.94 1d2b s ILE 85 N 1.09 1.36 -0.33 6.68 1.01 0.42 -1.98 121.20 129.45 1d2b s ILE 85 Ca -0.02 -0.94 -0.13 0.00 0.00 0.00 0.00 60.65 59.56 1d2b s ILE 85 Cb -0.14 -1.57 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 1d2b s ILE 85 CO -0.06 0.03 0.27 0.00 0.00 0.00 0.00 174.94 175.18 1d2b s ALA 86 N 1.50 3.51 -0.28 9.38 0.00 -0.28 -1.29 121.76 134.30 1d2b s ALA 86 Ca -0.02 -1.28 -0.25 0.00 0.00 0.00 0.00 51.96 50.41 1d2b s ALA 86 Cb -0.17 -2.69 0.11 0.00 0.00 0.00 0.00 23.12 20.37 1d2b s ALA 86 CO -0.07 -0.94 0.94 0.20 0.00 0.00 0.00 175.76 175.89 1d2b s GLY 87 N 1.73 -0.26 1.00 0.00 0.00 0.55 -4.38 107.32 105.96 1d2b s GLY 87 Ca 0.08 2.51 -0.16 0.00 0.00 0.00 0.00 44.72 47.16 1d2b s GLY 87 CO 0.11 1.85 1.23 0.54 0.00 0.00 0.00 173.10 176.82 1d2b s LYS 88 N 0.33 0.35 0.07 2.90 1.02 -1.19 0.23 119.74 123.45 1d2b s LYS 88 Ca 0.02 -0.16 0.07 0.00 0.02 0.00 0.00 55.97 55.92 1d2b s LYS 88 Cb -0.05 -1.79 -0.04 0.00 -0.52 0.00 0.00 37.83 35.44 1d2b s LYS 88 CO -0.05 -2.65 -0.16 -0.51 -0.92 0.00 0.00 175.35 171.07 1d2b s LEU 89 N -6.16 2.75 -0.19 3.17 1.43 -1.26 -1.06 118.68 117.35 1d2b s LEU 89 Ca 0.70 -0.43 -0.00 0.00 -1.03 0.00 0.00 54.13 53.37 1d2b s LEU 89 Cb -0.08 -1.60 0.05 0.00 0.03 0.00 0.00 46.19 44.59 1d2b s LEU 89 CO 0.53 0.23 -0.04 -1.10 0.23 0.00 0.00 176.35 176.20 1d2b s GLN 90 N -1.73 1.40 -0.35 1.70 -1.52 0.35 -4.80 119.66 114.72 1d2b s GLN 90 Ca 0.17 -0.68 -0.04 0.00 -1.95 0.00 0.00 55.36 52.86 1d2b s GLN 90 Cb -0.11 -2.24 0.04 0.00 -0.22 0.00 0.00 33.01 30.49 1d2b s GLN 90 CO 0.08 -0.52 0.11 -0.25 -0.25 0.00 0.00 175.29 174.46 1d2b n ASP 91 N 4.82 -1.09 0.00 5.90 9.92 -1.26 0.55 116.55 135.40 1d2b n ASP 91 Ca -0.12 0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.29 1d2b n ASP 91 Cb 0.46 -1.05 0.00 0.00 -0.64 0.00 0.00 41.12 39.89 1d2b n ASP 91 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1d2b n GLY 92 N -0.58 3.23 3.76 0.44 0.00 -1.26 -5.09 105.19 105.70 1d2b n GLY 92 Ca 0.02 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.76 1d2b n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d2b s LEU 93 N 0.00 4.45 0.62 0.99 1.43 0.19 -4.92 118.68 121.45 1d2b s LEU 93 Ca 0.00 2.25 -0.14 0.00 -1.03 0.00 0.00 54.13 55.21 1d2b s LEU 93 Cb 0.00 -3.75 -0.02 0.00 0.03 0.00 0.00 46.19 42.45 1d2b s LEU 93 CO 0.00 -0.25 1.06 -0.22 0.23 0.00 0.00 176.35 177.17 1d2b s LEU 94 N -1.73 3.40 -0.01 1.79 2.96 -1.26 0.13 118.68 123.97 1d2b s LEU 94 Ca 0.48 1.78 0.01 0.00 -0.22 0.00 0.00 54.13 56.18 1d2b s LEU 94 Cb -0.31 -4.53 0.00 0.00 0.50 0.00 0.00 46.19 41.86 1d2b s LEU 94 CO 0.39 -1.27 -0.03 -1.00 -1.32 0.00 0.00 176.35 173.11 1d2b s HIS 95 N -2.58 0.36 0.03 5.38 3.76 -0.22 -0.70 115.29 121.32 1d2b s HIS 95 Ca 0.62 -0.06 0.05 0.00 -0.15 0.00 0.00 55.06 55.52 1d2b s HIS 95 Cb -0.16 -0.27 -0.02 0.00 1.11 0.00 0.00 32.58 33.24 1d2b s HIS 95 CO 0.41 -0.03 -0.14 0.42 -0.85 0.00 0.00 174.74 174.56 1d2b s ILE 96 N 0.11 1.07 -0.01 0.60 -1.09 -1.17 -3.18 121.20 117.53 1d2b s ILE 96 Ca -0.01 -0.92 0.01 0.00 -2.23 0.00 0.00 60.65 57.51 1d2b s ILE 96 Cb -0.04 -0.96 0.00 0.00 -1.58 0.00 0.00 42.46 39.88 1d2b s ILE 96 CO -0.00 0.04 -0.04 0.42 -1.23 0.00 0.00 174.94 174.12 1d2b s THR 97 N -0.77 0.37 -1.73 2.92 -4.23 -1.10 -4.35 115.64 106.76 1d2b s THR 97 Ca 0.02 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.36 1d2b s THR 97 Cb -0.07 -0.34 0.01 0.00 1.34 0.00 0.00 72.50 73.44 1d2b s THR 97 CO 0.01 0.12 0.65 1.07 -0.54 0.00 0.00 174.62 175.93 1d2b n THR 98 N 3.17 0.54 -1.38 3.99 5.66 -0.96 0.13 114.28 125.41 1d2b n THR 98 Ca -0.15 0.13 0.01 0.00 -3.05 0.00 0.00 64.05 60.99 1d2b n THR 98 Cb 0.57 -1.13 0.20 0.00 -1.55 0.00 0.00 70.33 68.42 1d2b n THR 98 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1d2b s SER 100 N -2.64 3.58 -0.47 0.00 0.01 0.12 -4.60 113.70 109.70 1d2b s SER 100 Ca 0.42 -0.85 -0.27 0.00 1.31 0.00 0.00 55.95 56.55 1d2b s SER 100 Cb 0.38 -0.33 -0.02 0.00 0.21 0.00 0.00 66.02 66.26 1d2b s SER 100 CO -0.00 0.11 1.88 0.12 0.41 0.00 0.00 173.24 175.75 1d2b s PHE 101 N -1.81 1.68 -0.25 2.43 2.19 -1.26 -4.59 117.98 116.37 1d2b s PHE 101 Ca 0.23 0.78 -0.02 0.00 0.33 0.00 0.00 56.93 58.25 1d2b s PHE 101 Cb -0.08 -4.06 0.13 0.00 -1.31 0.00 0.00 43.02 37.70 1d2b s PHE 101 CO 0.11 -2.62 0.31 0.08 1.83 0.00 0.00 175.22 174.93 1d2b s VAL 102 N 8.35 -0.46 0.32 3.12 1.01 -1.26 -1.13 120.40 130.35 1d2b s VAL 102 Ca 0.76 -0.25 -0.15 0.00 0.00 0.00 0.00 61.98 62.34 1d2b s VAL 102 Cb -0.17 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.38 1d2b s VAL 102 CO 0.27 -0.28 0.66 0.00 0.00 0.00 0.00 175.10 175.75 1d2b s ALA 103 N 2.42 -0.57 0.01 5.51 0.00 -0.84 -5.00 121.76 123.29 1d2b s ALA 103 Ca 0.10 -0.75 -0.32 0.00 0.00 0.00 0.00 51.96 50.98 1d2b s ALA 103 Cb -0.15 0.88 -0.11 0.00 0.00 0.00 0.00 23.12 23.74 1d2b s ALA 103 CO -0.22 -0.95 1.88 -2.30 0.00 0.00 0.00 175.76 174.17 1d2b n PRO 104 N -0.48 2.49 -0.17 0.00 -0.02 -1.26 -0.10 135.00 135.46 1d2b n PRO 104 Ca -0.04 0.91 -0.04 0.00 -2.02 0.00 0.00 63.50 62.31 1d2b n PRO 104 Cb 0.60 -2.79 0.02 0.00 -0.02 0.00 0.00 33.50 31.31 1d2b n PRO 104 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 1d2b h TRP 105 N 9.26 -0.63 -0.62 6.00 2.91 -1.73 0.63 115.95 131.76 1d2b h TRP 105 Ca -0.48 0.06 0.18 0.00 1.13 0.00 0.00 58.89 59.78 1d2b h TRP 105 Cb 1.25 0.36 -0.02 0.00 -0.51 0.00 0.00 29.16 30.23 1d2b h TRP 105 CO 0.87 -0.32 0.91 -0.91 -1.03 0.00 0.00 178.44 177.95 1d2b h ASN 106 N -0.12 0.00 -0.21 2.65 2.35 -1.90 1.57 115.58 119.91 1d2b h ASN 106 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.99 1d2b h ASN 106 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1d2b h ASN 106 CO -0.60 0.00 0.00 -0.24 -1.65 0.00 0.00 177.43 174.94 1d2b n SER 107 N -3.22 2.36 -4.89 5.81 2.88 0.22 -4.94 113.62 111.84 1d2b n SER 107 Ca 0.13 -1.81 -0.29 0.00 -1.33 0.00 0.00 58.87 55.57 1d2b n SER 107 Cb 1.11 -0.13 -0.01 0.00 -0.75 0.00 0.00 64.21 64.43 1d2b n SER 107 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1d2b s LEU 108 N -1.62 3.58 0.64 2.46 1.02 0.53 -5.04 118.68 120.26 1d2b s LEU 108 Ca 0.34 1.12 -0.17 0.00 0.02 0.00 0.00 54.13 55.44 1d2b s LEU 108 Cb 0.20 -4.08 -0.01 0.00 0.02 0.00 0.00 46.19 42.32 1d2b s LEU 108 CO 0.29 -0.61 1.19 -0.44 0.02 0.00 0.00 176.35 176.80 1d2b s SER 109 N -3.87 4.91 0.42 2.29 0.01 -1.26 -4.78 113.70 111.41 1d2b s SER 109 Ca 0.51 2.30 0.16 0.00 1.31 0.00 0.00 55.95 60.23 1d2b s SER 109 Cb -0.10 -2.59 0.91 0.00 0.21 0.00 0.00 66.02 64.45 1d2b s SER 109 CO 0.43 -1.78 1.90 0.17 0.41 0.00 0.00 173.24 174.37 1d2b h LEU 110 N 0.40 0.00 0.06 2.44 -0.00 -1.97 1.44 115.31 117.68 1d2b h LEU 110 Ca -0.49 0.00 -0.29 0.00 -0.00 0.00 0.00 57.88 57.11 1d2b h LEU 110 Cb 1.29 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.92 1d2b h LEU 110 CO 0.53 0.29 -1.50 0.00 -0.00 0.00 0.00 178.44 177.76 1d2b h ALA 111 N 1.71 0.45 -0.01 0.17 0.00 -1.99 -3.04 119.26 116.56 1d2b h ALA 111 Ca -0.00 -1.19 0.00 0.00 0.00 0.00 0.00 54.91 53.71 1d2b h ALA 111 Cb 0.55 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1d2b h ALA 111 CO 0.04 1.31 -0.08 0.94 0.00 0.00 0.00 179.25 181.46 1d2b n GLN 112 N -3.31 1.08 0.06 0.00 7.27 -0.76 0.11 117.38 121.84 1d2b n GLN 112 Ca -0.14 -0.48 -0.22 0.00 0.07 0.00 0.00 57.00 56.23 1d2b n GLN 112 Cb 1.02 -1.49 -0.15 0.00 2.41 0.00 0.00 30.24 32.04 1d2b n GLN 112 CO 0.00 0.00 0.00 -0.09 0.07 0.00 0.00 177.06 177.04 1d2b h ARG 113 N 1.16 0.36 0.01 3.69 9.65 0.20 -2.27 114.38 127.18 1d2b h ARG 113 Ca 0.00 -0.61 -0.00 0.00 -1.10 0.00 0.00 59.98 58.27 1d2b h ARG 113 Cb 0.37 0.23 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 1d2b h ARG 113 CO 0.00 1.29 -0.01 0.07 2.80 0.00 0.00 179.97 184.13 1d2b h ARG 114 N -0.10 -0.02 -0.48 0.20 -0.00 -1.37 -3.30 114.38 109.31 1d2b h ARG 114 Ca -0.28 0.00 0.10 0.00 -0.00 0.00 0.00 59.98 59.80 1d2b h ARG 114 Cb 1.92 0.00 -0.09 0.00 -0.00 0.00 0.00 29.97 31.81 1d2b h ARG 114 CO 0.15 0.64 -0.10 0.78 -0.00 0.00 0.00 179.97 181.44 1d2b h GLY 115 N -0.97 0.37 1.83 0.08 0.00 0.66 0.92 103.07 105.95 1d2b h GLY 115 Ca -0.00 0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1d2b h GLY 115 CO 0.00 -0.18 0.06 0.69 0.00 0.00 0.00 176.54 177.12 1d2b n PHE 116 N -5.33 0.48 0.17 5.60 3.72 -0.85 0.50 117.46 121.74 1d2b n PHE 116 Ca 0.04 0.25 0.11 0.00 -0.05 0.00 0.00 57.45 57.80 1d2b n PHE 116 Cb 0.26 -0.86 -0.07 0.00 -0.94 0.00 0.00 39.48 37.87 1d2b n PHE 116 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 1d2b n THR 117 N -1.99 0.26 0.00 4.37 5.66 0.30 -4.70 114.28 118.18 1d2b n THR 117 Ca -0.01 -0.46 0.00 0.00 -3.05 0.00 0.00 64.05 60.53 1d2b n THR 117 Cb 0.08 -0.06 0.00 0.00 -1.55 0.00 0.00 70.33 68.80 1d2b n THR 117 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 175.07 174.31 1d2b n LYS 118 N -2.34 0.04 0.01 1.09 2.85 0.44 -4.98 118.16 115.27 1d2b n LYS 118 Ca -0.01 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 57.13 1d2b n LYS 118 Cb 0.53 -0.51 0.01 0.00 -0.65 0.00 0.00 35.03 34.41 1d2b n LYS 118 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1d2b h THR 119 N 0.00 1.33 -0.42 0.58 1.35 1.14 -3.36 112.91 113.52 1d2b h THR 119 Ca 0.00 -1.96 -0.13 0.00 -0.55 0.00 0.00 66.41 63.77 1d2b h THR 119 Cb 0.02 1.94 -0.08 0.00 -1.73 0.00 0.00 68.15 68.30 1d2b h THR 119 CO 0.00 0.61 0.16 -1.22 -0.25 0.00 0.00 175.52 174.82 1d2b n TYR 120 N -3.91 1.41 -0.09 4.73 4.02 -1.14 -0.93 117.16 121.25 1d2b n TYR 120 Ca -0.05 -0.78 -0.12 0.00 -0.01 0.00 0.00 57.90 56.94 1d2b n TYR 120 Cb 0.68 -0.47 -0.15 0.00 -0.02 0.00 0.00 39.34 39.38 1d2b n TYR 120 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 176.86 173.48 1d2b n THR 121 N 0.01 1.45 0.00 -0.72 5.66 -1.26 -3.90 114.28 115.52 1d2b n THR 121 Ca 0.23 -0.79 0.00 0.00 -3.05 0.00 0.00 64.05 60.45 1d2b n THR 121 Cb 0.95 -0.77 0.00 0.00 -1.55 0.00 0.00 70.33 68.96 1d2b n THR 121 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1d2b n VAL 122 N -2.91 0.00 -1.52 1.08 0.31 -1.25 -4.78 118.33 109.25 1d2b n VAL 122 Ca -0.34 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.06 1d2b n VAL 122 Cb 1.11 -0.20 0.19 0.00 -0.91 0.00 0.00 33.84 34.03 1d2b n VAL 122 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1d2b n GLY 123 N 2.26 4.98 2.98 2.92 0.00 -0.10 -4.94 105.19 113.29 1d2b n GLY 123 Ca 0.00 -1.26 -0.08 0.00 0.00 0.00 0.00 46.02 44.68 1d2b n GLY 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d2b n GLU 125 N 4.86 2.58 0.00 0.00 0.28 -1.26 -4.06 120.64 123.04 1d2b n GLU 125 Ca 0.08 -4.20 0.08 0.00 -0.16 0.00 0.00 57.16 52.96 1d2b n GLU 125 Cb 0.09 -1.97 0.07 0.00 1.43 0.00 0.00 31.44 31.06 1d2b n GLU 125 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36