#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dqc s ILE 2 N 0.00 4.46 -0.19 0.53 1.01 -1.26 -5.01 121.20 120.74 2dqc s ILE 2 Ca 0.00 1.76 -0.09 0.00 0.00 0.00 0.00 60.65 62.32 2dqc s ILE 2 Cb 0.00 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.29 2dqc s ILE 2 CO 0.00 0.01 0.12 -0.69 0.00 0.00 0.00 174.94 174.38 2dqc s VAL 3 N 2.07 5.33 -0.18 2.92 1.01 -1.26 -4.77 120.40 125.52 2dqc s VAL 3 Ca 0.53 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.63 2dqc s VAL 3 Cb -0.22 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 2dqc s VAL 3 CO 0.21 0.45 -0.03 -0.76 0.00 0.00 0.00 175.10 174.97 2dqc s LEU 4 N 0.29 3.13 -0.21 3.92 1.43 -1.26 -0.92 118.68 125.05 2dqc s LEU 4 Ca 0.08 -0.23 -0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2dqc s LEU 4 Cb -0.11 -1.77 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 2dqc s LEU 4 CO -0.01 0.09 -0.06 -0.89 0.23 0.00 0.00 176.35 175.71 2dqc s THR 5 N 0.84 3.27 0.01 5.49 2.01 0.28 -3.89 115.64 123.66 2dqc s THR 5 Ca -0.01 -0.53 0.00 0.00 0.31 0.00 0.00 61.69 61.47 2dqc s THR 5 Cb -0.14 -2.48 -0.04 0.00 0.01 0.00 0.00 72.50 69.85 2dqc s THR 5 CO 0.02 0.44 0.08 -1.10 -0.69 0.00 0.00 174.62 173.37 2dqc s GLN 6 N 1.41 3.04 -0.07 4.92 -0.21 -1.26 -0.87 119.66 126.62 2dqc s GLN 6 Ca 0.05 -0.52 -0.21 0.00 0.02 0.00 0.00 55.36 54.69 2dqc s GLN 6 Cb -0.14 -2.84 0.05 0.00 1.00 0.00 0.00 33.01 31.08 2dqc s GLN 6 CO -0.04 0.63 0.49 -1.54 -2.12 0.00 0.00 175.29 172.71 2dqc s SER 7 N -1.87 -0.44 0.90 5.90 1.04 -0.75 -4.45 113.70 114.02 2dqc s SER 7 Ca 0.24 0.52 -0.13 0.00 0.48 0.00 0.00 55.95 57.07 2dqc s SER 7 Cb -0.12 0.55 0.13 0.00 0.10 0.00 0.00 66.02 66.69 2dqc s SER 7 CO 0.16 -0.45 1.17 -2.16 0.98 0.00 0.00 173.24 172.94 2dqc s PRO 8 N -0.94 1.23 0.27 4.02 0.04 -1.26 -1.26 135.00 137.10 2dqc s PRO 8 Ca -0.10 0.14 0.05 0.00 0.04 0.00 0.00 61.00 61.13 2dqc s PRO 8 Cb -0.03 -1.86 0.36 0.00 0.04 0.00 0.00 34.50 33.01 2dqc s PRO 8 CO 0.06 -2.11 1.64 0.00 0.04 0.00 0.00 177.00 176.63 2dqc h ALA 9 N -1.43 1.00 -3.48 8.56 0.00 -1.84 -3.42 119.26 118.66 2dqc h ALA 9 Ca -0.48 -0.46 -0.21 0.00 0.00 0.00 0.00 54.91 53.76 2dqc h ALA 9 Cb 1.32 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 18.76 2dqc h ALA 9 CO 0.59 0.64 -0.71 0.99 0.00 0.00 0.00 179.25 180.77 2dqc s THR 10 N -4.04 0.03 -0.06 0.00 2.01 -1.26 -0.70 115.64 111.63 2dqc s THR 10 Ca -0.05 -0.29 -0.03 0.00 0.31 0.00 0.00 61.69 61.64 2dqc s THR 10 Cb 0.13 -0.10 0.04 0.00 0.01 0.00 0.00 72.50 72.58 2dqc s THR 10 CO 0.79 -0.16 0.11 -0.22 -0.69 0.00 0.00 174.62 174.45 2dqc s LEU 11 N -0.46 0.19 -0.15 4.42 0.20 0.71 -4.91 118.68 118.68 2dqc s LEU 11 Ca -0.05 0.22 -0.08 0.00 0.69 0.00 0.00 54.13 54.91 2dqc s LEU 11 Cb -0.03 0.12 -0.04 0.00 -0.43 0.00 0.00 46.19 45.80 2dqc s LEU 11 CO -0.00 -0.23 0.12 -0.44 -0.29 0.00 0.00 176.35 175.51 2dqc s SER 12 N 2.02 6.20 -0.00 3.68 0.01 -1.26 -1.54 113.70 122.80 2dqc s SER 12 Ca 0.01 0.34 -0.12 0.00 1.31 0.00 0.00 55.95 57.49 2dqc s SER 12 Cb -0.12 -2.03 0.02 0.00 0.21 0.00 0.00 66.02 64.09 2dqc s SER 12 CO -0.05 0.31 0.25 0.54 0.41 0.00 0.00 173.24 174.71 2dqc s VAL 13 N -0.44 0.07 -0.09 3.43 0.11 -0.18 -4.69 120.40 118.62 2dqc s VAL 13 Ca 0.12 -0.57 -0.18 0.00 -2.93 0.00 0.00 61.98 58.41 2dqc s VAL 13 Cb -0.12 -0.59 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 2dqc s VAL 13 CO 0.02 -0.31 0.50 -0.89 -3.33 0.00 0.00 175.10 171.08 2dqc s THR 14 N -1.46 5.13 0.19 5.04 2.01 -1.26 -2.62 115.64 122.67 2dqc s THR 14 Ca -0.13 1.01 -0.32 0.00 0.31 0.00 0.00 61.69 62.56 2dqc s THR 14 Cb -0.06 -3.83 -0.16 0.00 0.01 0.00 0.00 72.50 68.46 2dqc s THR 14 CO 0.03 0.36 1.04 -2.65 -0.69 0.00 0.00 174.62 172.71 2dqc n PRO 15 N 3.38 0.98 0.00 4.92 -0.02 -1.26 -1.53 135.00 141.47 2dqc n PRO 15 Ca -0.07 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2dqc n PRO 15 Cb 0.52 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 2dqc n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dqc n GLY 16 N 1.82 2.52 3.90 -1.23 0.00 0.38 -4.94 105.19 107.64 2dqc n GLY 16 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 2dqc n GLY 16 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dqc s ASN 17 N -0.28 6.36 0.10 1.61 0.01 -0.58 -4.39 114.94 117.77 2dqc s ASN 17 Ca 0.00 0.89 0.02 0.00 -0.71 0.00 0.00 52.86 53.05 2dqc s ASN 17 Cb 0.00 -2.22 -0.04 0.00 0.41 0.00 0.00 41.25 39.40 2dqc s ASN 17 CO 0.00 -0.44 0.23 -0.44 -1.51 0.00 0.00 177.10 174.94 2dqc s SER 18 N -3.70 6.24 0.11 -1.22 0.01 -1.26 -0.64 113.70 113.24 2dqc s SER 18 Ca 0.47 0.19 -0.01 0.00 1.31 0.00 0.00 55.95 57.91 2dqc s SER 18 Cb -0.10 -1.87 -0.04 0.00 0.21 0.00 0.00 66.02 64.21 2dqc s SER 18 CO 0.38 0.12 0.03 0.68 0.41 0.00 0.00 173.24 174.86 2dqc s VAL 19 N -1.61 0.17 -0.02 3.43 -7.23 -0.91 -4.95 120.40 109.28 2dqc s VAL 19 Ca 0.34 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 2dqc s VAL 19 Cb -0.12 -1.92 0.02 0.00 0.56 0.00 0.00 36.38 34.92 2dqc s VAL 19 CO 0.27 -0.60 -0.00 -0.44 -0.31 0.00 0.00 175.10 174.02 2dqc s SER 20 N -3.02 0.32 -0.08 4.85 0.01 -1.26 -1.40 113.70 113.12 2dqc s SER 20 Ca 0.20 -0.02 0.02 0.00 1.31 0.00 0.00 55.95 57.45 2dqc s SER 20 Cb 0.07 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.14 2dqc s SER 20 CO -0.01 -0.06 -0.11 -0.76 0.41 0.00 0.00 173.24 172.71 2dqc s LEU 21 N 0.68 2.90 -0.02 2.44 1.43 0.12 -4.86 118.68 121.38 2dqc s LEU 21 Ca -0.07 -0.16 -0.02 0.00 -1.03 0.00 0.00 54.13 52.86 2dqc s LEU 21 Cb -0.10 -1.62 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2dqc s LEU 21 CO -0.01 0.31 0.11 -0.55 0.23 0.00 0.00 176.35 176.44 2dqc s SER 22 N -0.51 5.92 -0.10 2.29 0.15 -0.39 -0.73 113.70 120.33 2dqc s SER 22 Ca 0.07 0.23 -0.04 0.00 0.70 0.00 0.00 55.95 56.92 2dqc s SER 22 Cb -0.12 -1.77 0.05 0.00 -1.71 0.00 0.00 66.02 62.48 2dqc s SER 22 CO 0.02 0.28 0.17 0.00 1.20 0.00 0.00 173.24 174.91 2dqc s ARG 24 N 2.30 2.89 -0.00 0.00 0.52 -0.05 -1.01 118.95 123.59 2dqc s ARG 24 Ca 0.03 -0.79 -0.07 0.00 -0.52 0.00 0.00 55.73 54.38 2dqc s ARG 24 Cb -0.13 -2.38 -0.05 0.00 0.52 0.00 0.00 34.95 32.92 2dqc s ARG 24 CO -0.07 0.34 0.27 0.00 0.02 0.00 0.00 175.30 175.87 2dqc s ALA 25 N -0.03 3.83 0.18 2.13 0.00 0.33 -0.55 121.76 127.66 2dqc s ALA 25 Ca -0.05 -0.55 0.35 0.00 0.00 0.00 0.00 51.96 51.71 2dqc s ALA 25 Cb -0.14 -2.09 1.64 0.00 0.00 0.00 0.00 23.12 22.53 2dqc s ALA 25 CO 0.05 0.63 2.05 0.66 0.00 0.00 0.00 175.76 179.15 2dqc h SER 26 N 4.11 0.00 -5.14 0.00 4.64 -1.36 -3.44 113.55 112.35 2dqc h SER 26 Ca -0.51 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.75 2dqc h SER 26 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.17 2dqc h SER 26 CO 0.65 0.00 -0.18 0.00 -0.87 0.00 0.00 176.83 176.43 2dqc s GLN 27 N -3.76 1.10 0.29 4.77 -2.07 -1.26 -4.98 119.66 113.74 2dqc s GLN 27 Ca -0.01 -0.91 -0.30 0.00 -1.82 0.00 0.00 55.36 52.32 2dqc s GLN 27 Cb 0.10 0.43 -0.11 0.00 -1.09 0.00 0.00 33.01 32.34 2dqc s GLN 27 CO 0.46 -0.42 1.57 0.45 -1.32 0.00 0.00 175.29 176.04 2dqc s SER 28 N -2.87 6.41 -0.06 12.60 0.15 -1.26 -4.69 113.70 123.97 2dqc s SER 28 Ca 0.08 2.91 0.09 0.00 0.70 0.00 0.00 55.95 59.74 2dqc s SER 28 Cb 0.02 -2.63 0.14 0.00 -1.71 0.00 0.00 66.02 61.84 2dqc s SER 28 CO -0.07 -0.89 1.05 2.30 1.20 0.00 0.00 173.24 176.83 2dqc n ILE 29 N 2.22 1.01 0.00 6.45 -5.35 -0.06 -4.99 119.36 118.63 2dqc n ILE 29 Ca 0.08 -1.20 0.00 0.00 -0.27 0.00 0.00 62.75 61.36 2dqc n ILE 29 Cb 0.38 0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 2dqc n ILE 29 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dqc n GLY 30 N -0.75 3.29 0.13 3.28 0.00 -1.25 -1.24 105.19 108.64 2dqc n GLY 30 Ca 0.08 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.34 2dqc n GLY 30 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2dqc n ASN 31 N 9.96 2.29 -3.06 1.61 6.94 -1.26 -0.70 115.26 131.04 2dqc n ASN 31 Ca 0.00 -2.38 -0.34 0.00 -0.02 0.00 0.00 54.58 51.85 2dqc n ASN 31 Cb 0.00 -0.18 -0.05 0.00 -2.36 0.00 0.00 39.78 37.20 2dqc n ASN 31 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 2dqc n ASN 32 N -0.68 7.68 -3.95 0.53 3.02 -0.37 -2.41 115.26 119.07 2dqc n ASN 32 Ca 0.07 -2.84 -0.24 0.00 -0.03 0.00 0.00 54.58 51.53 2dqc n ASN 32 Cb 0.42 -1.42 -0.17 0.00 -0.61 0.00 0.00 39.78 37.99 2dqc n ASN 32 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2dqc s LEU 33 N -0.98 1.40 0.18 3.41 1.98 -1.26 -1.88 118.68 121.53 2dqc s LEU 33 Ca 0.62 -0.25 0.11 0.00 -2.89 0.00 0.00 54.13 51.72 2dqc s LEU 33 Cb 0.23 -0.73 -0.04 0.00 0.66 0.00 0.00 46.19 46.30 2dqc s LEU 33 CO -0.09 -0.04 -0.22 -1.00 -1.89 0.00 0.00 176.35 173.12 2dqc s HIS 34 N 1.07 2.36 -0.09 5.38 3.76 0.74 0.43 115.29 128.94 2dqc s HIS 34 Ca -0.08 -0.34 0.03 0.00 -0.15 0.00 0.00 55.06 54.52 2dqc s HIS 34 Cb -0.14 -1.18 -0.01 0.00 1.11 0.00 0.00 32.58 32.35 2dqc s HIS 34 CO -0.01 0.48 -0.18 -1.58 -0.85 0.00 0.00 174.74 172.60 2dqc s TRP 35 N -1.59 2.66 0.12 1.40 0.52 -0.35 -0.47 118.94 121.23 2dqc s TRP 35 Ca 0.20 -0.63 0.10 0.00 0.02 0.00 0.00 56.10 55.80 2dqc s TRP 35 Cb -0.08 -1.72 -0.04 0.00 -1.15 0.00 0.00 33.47 30.48 2dqc s TRP 35 CO 0.10 -0.16 -0.25 0.71 0.02 0.00 0.00 176.95 177.37 2dqc s TYR 36 N -0.00 2.12 -0.04 -1.98 1.51 0.97 -0.52 117.35 119.41 2dqc s TYR 36 Ca -0.06 -0.39 0.05 0.00 -1.01 0.00 0.00 57.07 55.66 2dqc s TYR 36 Cb -0.15 -1.16 -0.02 0.00 -0.11 0.00 0.00 41.96 40.52 2dqc s TYR 36 CO 0.05 0.29 -0.18 -1.14 -1.11 0.00 0.00 175.55 173.45 2dqc s GLN 37 N -1.99 2.37 -0.08 -0.62 0.74 -0.04 -0.74 119.66 119.30 2dqc s GLN 37 Ca 0.11 -0.77 -0.03 0.00 0.05 0.00 0.00 55.36 54.72 2dqc s GLN 37 Cb -0.10 -2.27 0.04 0.00 1.10 0.00 0.00 33.01 31.79 2dqc s GLN 37 CO 0.05 0.60 0.16 -1.14 -0.55 0.00 0.00 175.29 174.42 2dqc s GLN 38 N -0.70 0.07 0.20 1.67 0.74 0.43 0.07 119.66 122.13 2dqc s GLN 38 Ca 0.11 0.49 0.05 0.00 0.05 0.00 0.00 55.36 56.07 2dqc s GLN 38 Cb -0.10 -0.22 -0.04 0.00 1.10 0.00 0.00 33.01 33.75 2dqc s GLN 38 CO 0.00 -0.25 0.21 0.15 -0.55 0.00 0.00 175.29 174.86 2dqc s LYS 39 N 1.82 3.07 0.13 1.67 1.02 -1.26 -0.92 119.74 125.27 2dqc s LYS 39 Ca -0.02 -0.88 -0.35 0.00 0.02 0.00 0.00 55.97 54.74 2dqc s LYS 39 Cb -0.12 -2.70 -0.16 0.00 -0.52 0.00 0.00 37.83 34.33 2dqc s LYS 39 CO -0.06 0.45 1.28 0.45 -0.92 0.00 0.00 175.35 176.56 2dqc n SER 40 N -0.83 1.62 -3.71 2.83 2.88 -1.26 -1.60 113.62 113.55 2dqc n SER 40 Ca -0.08 1.13 -0.24 0.00 -1.33 0.00 0.00 58.87 58.34 2dqc n SER 40 Cb 0.56 -1.22 0.05 0.00 -0.75 0.00 0.00 64.21 62.85 2dqc n SER 40 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2dqc n HIS 41 N 2.15 -2.30 -3.74 0.66 8.25 -1.26 -4.99 115.22 113.99 2dqc n HIS 41 Ca 0.17 0.92 -0.13 0.00 -0.26 0.00 0.00 57.72 58.41 2dqc n HIS 41 Cb 0.22 -4.50 -0.08 0.00 1.12 0.00 0.00 29.99 26.75 2dqc n HIS 41 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 2dqc s GLU 42 N -6.18 0.72 0.58 -0.41 2.12 -0.63 -5.16 118.70 109.74 2dqc s GLU 42 Ca 0.35 -0.21 -0.15 0.00 0.36 0.00 0.00 54.97 55.33 2dqc s GLU 42 Cb -0.17 0.32 -0.05 0.00 0.26 0.00 0.00 34.13 34.49 2dqc s GLU 42 CO 0.79 -0.21 1.02 -1.54 -0.54 0.00 0.00 175.26 174.79 2dqc s SER 43 N -1.45 6.14 0.74 -1.70 1.04 -1.26 -4.47 113.70 112.74 2dqc s SER 43 Ca -0.12 1.62 -0.15 0.00 0.48 0.00 0.00 55.95 57.79 2dqc s SER 43 Cb -0.04 -2.51 0.05 0.00 0.10 0.00 0.00 66.02 63.62 2dqc s SER 43 CO 0.03 -0.93 1.20 -2.84 0.98 0.00 0.00 173.24 171.69 2dqc s PRO 44 N -4.39 2.07 -0.09 4.02 0.02 -1.26 -4.65 135.00 130.72 2dqc s PRO 44 Ca 0.60 1.75 0.01 0.00 0.02 0.00 0.00 61.00 63.37 2dqc s PRO 44 Cb -0.12 -1.83 0.02 0.00 0.02 0.00 0.00 34.50 32.59 2dqc s PRO 44 CO 0.40 -1.88 -0.09 0.50 -0.33 0.00 0.00 177.00 175.60 2dqc s ARG 45 N -3.96 1.52 0.00 5.54 3.52 0.11 -4.93 118.95 120.76 2dqc s ARG 45 Ca 0.74 -0.30 -0.30 0.00 -0.13 0.00 0.00 55.73 55.74 2dqc s ARG 45 Cb -0.29 -1.45 -0.06 0.00 -1.56 0.00 0.00 34.95 31.60 2dqc s ARG 45 CO 0.46 -0.14 1.44 -1.17 -0.81 0.00 0.00 175.30 175.08 2dqc s LEU 46 N 1.24 4.32 -0.21 -0.88 2.96 -1.26 -0.86 118.68 124.00 2dqc s LEU 46 Ca -0.04 2.15 -0.04 0.00 -0.22 0.00 0.00 54.13 55.99 2dqc s LEU 46 Cb -0.14 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 42.88 2dqc s LEU 46 CO -0.03 -0.75 -0.22 0.18 -1.32 0.00 0.00 176.35 174.21 2dqc n LEU 47 N 5.47 2.36 -3.87 -0.68 4.77 0.32 -4.95 117.00 120.42 2dqc n LEU 47 Ca 0.14 0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 56.04 2dqc n LEU 47 Cb 0.43 -0.67 -0.14 0.00 -2.33 0.00 0.00 43.42 40.71 2dqc n LEU 47 CO 0.59 0.67 -0.36 -0.63 -1.33 0.00 0.00 177.39 176.33 2dqc s ILE 48 N -2.40 0.04 0.16 -0.08 -1.09 -1.18 -4.10 121.20 112.56 2dqc s ILE 48 Ca -0.28 0.00 0.11 0.00 -2.23 0.00 0.00 60.65 58.25 2dqc s ILE 48 Cb 0.09 -0.05 -0.04 0.00 -1.58 0.00 0.00 42.46 40.87 2dqc s ILE 48 CO 0.43 0.02 -0.25 -1.59 -1.23 0.00 0.00 174.94 172.32 2dqc s LYS 49 N 0.11 1.45 -1.35 2.79 -2.85 -0.80 -1.21 119.74 117.88 2dqc s LYS 49 Ca -0.01 -1.43 -0.04 0.00 -1.00 0.00 0.00 55.97 53.49 2dqc s LYS 49 Cb -0.02 -1.84 -0.00 0.00 -2.06 0.00 0.00 37.83 33.91 2dqc s LYS 49 CO -0.00 0.42 0.51 0.66 0.10 0.00 0.00 175.35 177.03 2dqc n TYR 50 N 0.58 -1.71 0.00 1.78 4.01 -1.19 -1.03 117.16 119.60 2dqc n TYR 50 Ca -0.15 0.69 0.00 0.00 -0.16 0.00 0.00 57.90 58.28 2dqc n TYR 50 Cb 0.55 -3.74 0.00 0.00 -0.31 0.00 0.00 39.34 35.83 2dqc n TYR 50 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dqc n ALA 51 N -4.36 0.00 -1.04 -0.72 0.00 0.17 -3.92 120.51 110.64 2dqc n ALA 51 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2dqc n ALA 51 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 2dqc n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2dqc n SER 52 N 1.38 0.00 -4.71 0.00 3.41 -1.21 -2.68 113.62 109.81 2dqc n SER 52 Ca 0.00 -1.00 -0.42 0.00 -0.26 0.00 0.00 58.87 57.19 2dqc n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2dqc n SER 52 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2dqc s GLN 53 N 0.00 4.47 0.64 4.33 -0.21 -0.20 -4.62 119.66 124.07 2dqc s GLN 53 Ca 0.00 1.64 -0.15 0.00 0.02 0.00 0.00 55.36 56.87 2dqc s GLN 53 Cb 0.00 -3.40 -0.01 0.00 1.00 0.00 0.00 33.01 30.60 2dqc s GLN 53 CO 0.00 -0.20 1.10 -1.12 -2.12 0.00 0.00 175.29 172.95 2dqc s SER 54 N 1.07 5.28 -0.11 5.90 0.01 -1.26 -1.90 113.70 122.68 2dqc s SER 54 Ca 0.56 1.97 0.04 0.00 1.31 0.00 0.00 55.95 59.82 2dqc s SER 54 Cb -0.26 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.42 2dqc s SER 54 CO 0.28 -1.51 -0.23 -0.63 0.41 0.00 0.00 173.24 171.55 2dqc s ILE 55 N -2.34 2.07 0.23 1.44 -1.09 -1.26 -4.83 121.20 115.41 2dqc s ILE 55 Ca 0.66 -1.01 -0.32 0.00 -2.23 0.00 0.00 60.65 57.76 2dqc s ILE 55 Cb -0.20 -1.79 -0.12 0.00 -1.58 0.00 0.00 42.46 38.77 2dqc s ILE 55 CO 0.40 0.56 1.67 -0.24 -1.23 0.00 0.00 174.94 176.10 2dqc n SER 56 N 3.68 3.84 0.00 3.58 2.88 -1.26 -2.25 113.62 124.08 2dqc n SER 56 Ca -0.19 1.09 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 2dqc n SER 56 Cb 0.53 -1.56 0.00 0.00 -0.75 0.00 0.00 64.21 62.43 2dqc n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dqc n GLY 57 N 3.42 0.64 3.88 0.46 0.00 -1.26 -5.06 105.19 107.27 2dqc n GLY 57 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2dqc n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dqc s ILE 58 N -2.33 5.36 0.42 -0.61 -1.09 -0.96 -5.06 121.20 116.94 2dqc s ILE 58 Ca 0.00 0.16 -0.26 0.00 -2.23 0.00 0.00 60.65 58.31 2dqc s ILE 58 Cb 0.00 -3.53 -0.10 0.00 -1.58 0.00 0.00 42.46 37.25 2dqc s ILE 58 CO 0.00 0.43 1.42 -2.65 -1.23 0.00 0.00 174.94 172.92 2dqc n PRO 59 N 1.34 2.35 0.30 2.79 -0.02 -1.26 -4.88 135.00 135.63 2dqc n PRO 59 Ca -0.14 0.83 0.18 0.00 -2.02 0.00 0.00 63.50 62.36 2dqc n PRO 59 Cb 0.53 -2.59 0.95 0.00 -0.02 0.00 0.00 33.50 32.37 2dqc n PRO 59 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2dqc h SER 60 N 2.50 0.00 0.28 2.55 0.02 -1.97 -2.69 113.55 114.24 2dqc h SER 60 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 2dqc h SER 60 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2dqc h SER 60 CO 0.62 0.03 0.00 -2.11 -1.14 0.00 0.00 176.83 174.23 2dqc n ARG 61 N -3.29 0.12 -3.32 3.45 1.85 -1.26 -4.56 116.66 109.66 2dqc n ARG 61 Ca -0.02 0.51 -0.38 0.00 -1.00 0.00 0.00 57.85 56.96 2dqc n ARG 61 Cb 0.17 -1.82 -0.06 0.00 -1.05 0.00 0.00 32.46 29.69 2dqc n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2dqc s PHE 62 N -3.34 3.49 0.01 2.89 0.08 -1.02 -0.88 117.98 119.20 2dqc s PHE 62 Ca 0.01 0.85 -0.09 0.00 0.12 0.00 0.00 56.93 57.82 2dqc s PHE 62 Cb 0.07 -2.55 0.01 0.00 -0.57 0.00 0.00 43.02 39.97 2dqc s PHE 62 CO 0.24 0.13 0.18 -1.54 -0.10 0.00 0.00 175.22 174.13 2dqc s SER 63 N 0.69 -0.00 0.14 1.36 1.04 -0.47 -5.01 113.70 111.46 2dqc s SER 63 Ca 0.25 -0.20 0.08 0.00 0.48 0.00 0.00 55.95 56.56 2dqc s SER 63 Cb -0.15 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 2dqc s SER 63 CO 0.10 -0.43 -0.17 -0.83 0.98 0.00 0.00 173.24 172.89 2dqc s GLY 64 N -1.54 1.28 0.23 7.32 0.00 -1.26 -0.20 107.32 113.15 2dqc s GLY 64 Ca -0.12 -1.39 -0.12 0.00 0.00 0.00 0.00 44.72 43.08 2dqc s GLY 64 CO 0.01 -1.44 0.44 -1.35 0.00 0.00 0.00 173.10 170.76 2dqc s SER 65 N -2.48 -0.08 0.00 1.64 1.04 -0.44 -4.20 113.70 109.18 2dqc s SER 65 Ca 0.12 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.64 2dqc s SER 65 Cb -0.06 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2dqc s SER 65 CO 0.05 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 173.79 2dqc n GLY 66 N -0.35 2.15 3.64 7.32 0.00 -1.26 -1.35 105.19 115.33 2dqc n GLY 66 Ca -0.03 -2.09 -0.05 0.00 0.00 0.00 0.00 46.02 43.86 2dqc n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dqc s SER 67 N 0.00 -0.23 0.36 1.61 1.04 -1.06 -4.87 113.70 110.55 2dqc s SER 67 Ca 0.00 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2dqc s SER 67 Cb 0.00 0.39 0.00 0.00 0.10 0.00 0.00 66.02 66.51 2dqc s SER 67 CO 0.00 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.14 2dqc n GLY 68 N -0.37 1.44 0.00 7.32 0.00 0.12 -3.00 105.19 110.71 2dqc n GLY 68 Ca -0.07 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2dqc n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dqc n THR 69 N 0.00 0.00 -4.03 2.61 -2.24 -1.26 -0.88 114.28 108.47 2dqc n THR 69 Ca 0.00 -0.39 -0.34 0.00 -2.27 0.00 0.00 64.05 61.06 2dqc n THR 69 Cb 0.00 0.92 -0.15 0.00 -2.10 0.00 0.00 70.33 69.00 2dqc n THR 69 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dqc s ASP 70 N -1.03 3.79 0.14 3.42 -1.08 -1.16 -0.51 116.67 120.24 2dqc s ASP 70 Ca 0.00 -0.74 0.07 0.00 -0.52 0.00 0.00 52.55 51.36 2dqc s ASP 70 Cb 0.00 -1.58 -0.04 0.00 -1.46 0.00 0.00 42.92 39.84 2dqc s ASP 70 CO 0.00 -0.06 -0.15 -0.36 0.52 0.00 0.00 175.17 175.12 2dqc s PHE 71 N 1.31 1.54 -0.03 -5.34 0.40 -0.18 -2.58 117.98 113.11 2dqc s PHE 71 Ca 0.02 -0.54 -0.03 0.00 -0.60 0.00 0.00 56.93 55.78 2dqc s PHE 71 Cb -0.15 -0.79 0.01 0.00 0.51 0.00 0.00 43.02 42.60 2dqc s PHE 71 CO -0.08 0.21 0.09 0.99 0.70 0.00 0.00 175.22 177.12 2dqc s THR 72 N -2.20 0.01 -0.17 0.64 2.01 -0.46 -1.41 115.64 114.07 2dqc s THR 72 Ca 0.12 -0.12 -0.02 0.00 0.31 0.00 0.00 61.69 61.99 2dqc s THR 72 Cb -0.05 -0.17 -0.01 0.00 0.01 0.00 0.00 72.50 72.29 2dqc s THR 72 CO 0.04 -0.06 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.59 2dqc s LEU 73 N -0.17 2.77 0.02 4.42 2.96 0.09 -1.32 118.68 127.44 2dqc s LEU 73 Ca -0.02 -0.37 0.06 0.00 -0.22 0.00 0.00 54.13 53.58 2dqc s LEU 73 Cb -0.02 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 2dqc s LEU 73 CO 0.00 0.08 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.51 2dqc s SER 74 N 0.88 3.96 -0.22 3.68 0.01 0.72 0.14 113.70 122.87 2dqc s SER 74 Ca -0.02 -0.34 0.01 0.00 1.31 0.00 0.00 55.95 56.91 2dqc s SER 74 Cb -0.15 -0.73 0.05 0.00 0.21 0.00 0.00 66.02 65.41 2dqc s SER 74 CO 0.00 0.28 -0.08 -0.63 0.41 0.00 0.00 173.24 173.22 2dqc s ILE 75 N -0.90 1.62 -0.50 1.44 1.01 -0.49 -1.37 121.20 122.02 2dqc s ILE 75 Ca 0.14 -1.13 -0.24 0.00 0.00 0.00 0.00 60.65 59.43 2dqc s ILE 75 Cb -0.11 -1.78 0.03 0.00 0.01 0.00 0.00 42.46 40.62 2dqc s ILE 75 CO 0.05 0.05 0.87 0.21 0.00 0.00 0.00 174.94 176.12 2dqc s ASN 76 N 1.38 6.39 -0.22 3.58 3.04 -0.06 -2.14 114.94 126.91 2dqc s ASN 76 Ca -0.04 -0.22 -0.06 0.00 0.04 0.00 0.00 52.86 52.59 2dqc s ASN 76 Cb -0.17 -2.41 0.01 0.00 -1.54 0.00 0.00 41.25 37.13 2dqc s ASN 76 CO -0.07 -1.07 0.28 -0.24 -3.04 0.00 0.00 177.10 172.96 2dqc n SER 77 N 7.09 -4.71 -4.71 -4.21 2.88 -1.25 -4.76 113.62 103.96 2dqc n SER 77 Ca 0.02 0.20 -0.43 0.00 -1.33 0.00 0.00 58.87 57.33 2dqc n SER 77 Cb 0.48 -3.01 -0.01 0.00 -0.75 0.00 0.00 64.21 60.92 2dqc n SER 77 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2dqc n VAL 78 N -0.58 1.47 -4.19 2.46 0.31 0.19 -4.61 118.33 113.39 2dqc n VAL 78 Ca 0.05 -0.37 -0.23 0.00 -0.01 0.00 0.00 64.34 63.78 2dqc n VAL 78 Cb 0.26 -1.66 -0.06 0.00 -0.91 0.00 0.00 33.84 31.47 2dqc n VAL 78 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2dqc s GLU 79 N -1.16 2.43 0.45 5.55 0.41 -1.26 -0.47 118.70 124.64 2dqc s GLU 79 Ca 0.61 -1.41 0.12 0.00 -0.41 0.00 0.00 54.97 53.89 2dqc s GLU 79 Cb -0.57 -2.23 1.04 0.00 -1.78 0.00 0.00 34.13 30.58 2dqc s GLU 79 CO 0.56 0.27 2.05 1.15 -0.49 0.00 0.00 175.26 178.80 2dqc h THR 80 N 1.69 0.99 0.00 3.63 2.02 -1.99 -0.88 112.91 118.38 2dqc h THR 80 Ca -0.45 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 66.61 2dqc h THR 80 Cb 1.25 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 2dqc h THR 80 CO 0.61 0.06 0.00 -1.84 0.37 0.00 0.00 175.52 174.73 2dqc n GLU 81 N -4.48 0.07 0.02 6.66 0.28 -1.26 -2.79 120.64 119.15 2dqc n GLU 81 Ca 0.04 0.21 0.12 0.00 -0.16 0.00 0.00 57.16 57.38 2dqc n GLU 81 Cb 0.20 -1.50 0.30 0.00 1.43 0.00 0.00 31.44 31.87 2dqc n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2dqc n ASP 82 N -1.43 0.49 -4.72 -1.84 8.00 -0.33 -4.89 116.55 111.82 2dqc n ASP 82 Ca 0.05 0.04 -0.42 0.00 0.71 0.00 0.00 54.79 55.17 2dqc n ASP 82 Cb 0.15 0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 2dqc n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2dqc s PHE 83 N -3.06 3.21 -5.00 1.24 0.08 -1.12 -4.83 117.98 108.50 2dqc s PHE 83 Ca 0.10 0.90 0.00 0.00 0.12 0.00 0.00 56.93 58.05 2dqc s PHE 83 Cb 0.16 -3.73 0.00 0.00 -0.57 0.00 0.00 43.02 38.89 2dqc s PHE 83 CO 0.67 -2.56 0.00 0.41 -0.10 0.00 0.00 175.22 173.64 2dqc n GLY 84 N 3.47 -0.49 3.91 4.36 0.00 -0.52 -4.91 105.19 111.02 2dqc n GLY 84 Ca 0.12 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 2dqc n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dqc s MET 85 N -2.00 3.43 -0.08 1.61 -1.94 -0.09 -0.66 119.30 119.58 2dqc s MET 85 Ca 0.00 -0.39 0.02 0.00 -1.71 0.00 0.00 55.69 53.61 2dqc s MET 85 Cb 0.00 -3.06 0.02 0.00 2.01 0.00 0.00 34.83 33.79 2dqc s MET 85 CO 0.00 0.64 -0.11 0.71 -0.01 0.00 0.00 175.02 176.25 2dqc s TYR 86 N -1.42 1.44 0.02 -0.03 1.51 -0.37 -0.43 117.35 118.06 2dqc s TYR 86 Ca 0.31 -0.58 0.07 0.00 -1.01 0.00 0.00 57.07 55.86 2dqc s TYR 86 Cb -0.13 -1.10 -0.02 0.00 -0.11 0.00 0.00 41.96 40.60 2dqc s TYR 86 CO 0.23 -0.34 -0.20 -0.06 -1.11 0.00 0.00 175.55 174.08 2dqc s PHE 87 N 0.94 1.76 0.12 2.71 0.08 0.08 -1.11 117.98 122.56 2dqc s PHE 87 Ca -0.09 -0.36 0.04 0.00 0.12 0.00 0.00 56.93 56.64 2dqc s PHE 87 Cb -0.15 -1.08 -0.04 0.00 -0.57 0.00 0.00 43.02 41.18 2dqc s PHE 87 CO 0.00 0.04 0.13 0.00 -0.10 0.00 0.00 175.22 175.30 2dqc s GLN 89 N -2.78 0.11 -0.01 0.00 0.74 0.38 -0.72 119.66 117.38 2dqc s GLN 89 Ca 0.31 0.21 0.00 0.00 0.05 0.00 0.00 55.36 55.93 2dqc s GLN 89 Cb -0.11 -0.01 -0.04 0.00 1.10 0.00 0.00 33.01 33.95 2dqc s GLN 89 CO 0.24 -0.06 0.04 1.14 -0.55 0.00 0.00 175.29 176.10 2dqc s GLN 90 N 0.37 2.94 -0.06 1.67 1.03 -0.47 -0.18 119.66 124.96 2dqc s GLN 90 Ca -0.03 -0.53 0.09 0.00 0.04 0.00 0.00 55.36 54.93 2dqc s GLN 90 Cb -0.04 -2.78 0.13 0.00 0.03 0.00 0.00 33.01 30.36 2dqc s GLN 90 CO -0.01 0.64 1.02 -1.13 -2.54 0.00 0.00 175.29 173.27 2dqc n SER 91 N 1.35 1.63 -0.14 12.60 3.41 -0.79 -3.31 113.62 128.38 2dqc n SER 91 Ca -0.14 -2.40 -0.11 0.00 -0.26 0.00 0.00 58.87 55.95 2dqc n SER 91 Cb 0.53 -0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 64.23 2dqc n SER 91 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 2dqc h ASN 92 N 0.00 0.82 -4.78 4.04 -1.24 -1.87 -3.46 115.58 109.09 2dqc h ASN 92 Ca 0.00 -0.38 -0.27 0.00 0.71 0.00 0.00 56.30 56.37 2dqc h ASN 92 Cb 0.93 -0.22 -0.21 0.00 0.73 0.00 0.00 38.32 39.54 2dqc h ASN 92 CO 0.00 1.01 -0.73 -0.44 -1.29 0.00 0.00 177.43 175.98 2dqc s SER 93 N -6.46 0.81 -0.02 1.15 0.01 -1.26 -5.14 113.70 102.78 2dqc s SER 93 Ca -0.12 -0.55 -0.18 0.00 1.31 0.00 0.00 55.95 56.41 2dqc s SER 93 Cb 0.10 0.04 -0.05 0.00 0.21 0.00 0.00 66.02 66.32 2dqc s SER 93 CO 0.83 -0.21 0.49 0.86 0.41 0.00 0.00 173.24 175.62 2dqc s TRP 94 N -1.39 3.67 0.39 2.43 -0.11 -1.26 -3.35 118.94 119.32 2dqc s TRP 94 Ca -0.10 1.05 -0.24 0.00 1.22 0.00 0.00 56.10 58.03 2dqc s TRP 94 Cb -0.10 -2.46 -0.09 0.00 -1.50 0.00 0.00 33.47 29.32 2dqc s TRP 94 CO 0.00 0.44 1.02 -1.25 -4.62 0.00 0.00 176.95 172.54 2dqc s PRO 95 N -0.42 4.24 0.48 5.86 0.04 -1.26 -5.03 135.00 138.91 2dqc s PRO 95 Ca 0.27 1.42 -0.23 0.00 0.04 0.00 0.00 61.00 62.49 2dqc s PRO 95 Cb -0.17 -2.53 -0.07 0.00 0.04 0.00 0.00 34.50 31.78 2dqc s PRO 95 CO 0.14 -0.06 1.27 0.71 0.04 0.00 0.00 177.00 179.11 2dqc s TYR 96 N -1.73 2.63 0.06 0.56 2.02 -1.21 -4.75 117.35 114.93 2dqc s TYR 96 Ca 0.57 1.44 0.02 0.00 -0.37 0.00 0.00 57.07 58.74 2dqc s TYR 96 Cb -0.19 -3.61 -0.03 0.00 -0.40 0.00 0.00 41.96 37.72 2dqc s TYR 96 CO 0.25 -2.19 -0.08 0.95 -1.57 0.00 0.00 175.55 172.91 2dqc s THR 97 N -1.38 0.63 0.13 -0.71 -4.23 -1.21 -4.99 115.64 103.88 2dqc s THR 97 Ca 0.65 -1.38 0.07 0.00 -1.18 0.00 0.00 61.69 59.86 2dqc s THR 97 Cb -0.35 -0.99 -0.04 0.00 1.34 0.00 0.00 72.50 72.45 2dqc s THR 97 CO 0.43 -0.53 -0.07 -0.36 -0.54 0.00 0.00 174.62 173.55 2dqc s PHE 98 N -2.10 2.77 0.82 3.99 0.08 -1.26 -1.37 117.98 120.90 2dqc s PHE 98 Ca -0.02 -0.15 -0.12 0.00 0.12 0.00 0.00 56.93 56.76 2dqc s PHE 98 Cb -0.05 -1.41 0.08 0.00 -0.57 0.00 0.00 43.02 41.08 2dqc s PHE 98 CO -0.01 0.47 1.16 0.20 -0.10 0.00 0.00 175.22 176.94 2dqc s GLY 99 N -2.48 1.59 0.07 4.36 0.00 0.10 -4.56 107.32 106.41 2dqc s GLY 99 Ca 0.24 -0.59 0.17 0.00 0.00 0.00 0.00 44.72 44.54 2dqc s GLY 99 CO 0.15 -0.10 1.54 0.61 0.00 0.00 0.00 173.10 175.31 2dqc n GLY 100 N -3.05 -1.09 0.00 0.20 0.00 -1.25 -4.70 105.19 95.30 2dqc n GLY 100 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2dqc n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dqc n GLY 101 N 0.02 -0.42 3.05 -0.02 0.00 -1.26 -5.03 105.19 101.53 2dqc n GLY 101 Ca 0.03 -1.53 -0.27 0.00 0.00 0.00 0.00 46.02 44.25 2dqc n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dqc s THR 102 N -3.05 1.34 -0.22 2.61 2.01 -0.27 -4.70 115.64 113.37 2dqc s THR 102 Ca 0.00 -0.58 -0.17 0.00 0.31 0.00 0.00 61.69 61.25 2dqc s THR 102 Cb 0.00 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 2dqc s THR 102 CO 0.00 0.40 0.47 -0.75 -0.69 0.00 0.00 174.62 174.05 2dqc s LYS 103 N 0.76 4.15 -0.24 4.92 2.20 0.12 -1.24 119.74 130.41 2dqc s LYS 103 Ca -0.12 0.30 -0.07 0.00 -0.36 0.00 0.00 55.97 55.72 2dqc s LYS 103 Cb -0.16 -3.58 -0.03 0.00 -1.51 0.00 0.00 37.83 32.56 2dqc s LYS 103 CO 0.02 -0.16 0.06 -1.17 -0.36 0.00 0.00 175.35 173.74 2dqc s LEU 104 N 1.69 3.40 0.06 5.43 2.96 0.17 -0.21 118.68 132.18 2dqc s LEU 104 Ca 0.21 -0.21 -0.03 0.00 -0.22 0.00 0.00 54.13 53.88 2dqc s LEU 104 Cb -0.15 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 2dqc s LEU 104 CO 0.09 -0.03 0.03 -1.83 -1.32 0.00 0.00 176.35 173.30 2dqc s GLU 105 N 1.56 0.67 0.10 1.98 -1.05 -0.59 -1.44 118.70 119.92 2dqc s GLU 105 Ca 0.06 -1.13 -0.31 0.00 -0.15 0.00 0.00 54.97 53.44 2dqc s GLU 105 Cb -0.15 0.25 -0.08 0.00 -0.44 0.00 0.00 34.13 33.71 2dqc s GLU 105 CO 0.03 -0.15 1.46 -1.50 0.95 0.00 0.00 175.26 176.05 2dqc s ILE 106 N -3.85 3.21 0.00 1.83 2.07 -1.26 -1.01 121.20 122.20 2dqc s ILE 106 Ca 0.06 0.81 0.00 0.00 -1.41 0.00 0.00 60.65 60.11 2dqc s ILE 106 Cb 0.07 -3.52 0.00 0.00 0.13 0.00 0.00 42.46 39.14 2dqc s ILE 106 CO -0.10 0.04 0.00 0.29 -1.91 0.00 0.00 174.94 173.26