#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qli h VAL 7 N 0.00 1.56 -3.31 6.31 -1.51 -1.99 -3.38 116.25 113.93 2qli h VAL 7 Ca 0.00 -2.78 -0.63 0.00 -1.23 0.00 0.00 66.70 62.06 2qli h VAL 7 Cb 0.00 2.52 -0.14 0.00 -2.13 0.00 0.00 31.29 31.55 2qli h VAL 7 CO 0.00 0.80 0.39 -0.63 -1.23 0.00 0.00 177.57 176.90 2qli s ILE 8 N -3.13 4.57 0.78 7.19 1.01 -1.26 -5.02 121.20 125.33 2qli s ILE 8 Ca -0.01 0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.65 2qli s ILE 8 Cb 0.11 -4.43 0.06 0.00 0.01 0.00 0.00 42.46 38.21 2qli s ILE 8 CO 0.81 -0.95 1.15 -0.54 0.00 0.00 0.00 174.94 175.41 2qli s LYS 9 N 3.47 2.18 0.49 2.79 -0.14 -1.26 -4.97 119.74 122.31 2qli s LYS 9 Ca 0.26 0.16 0.27 0.00 -1.36 0.00 0.00 55.97 55.30 2qli s LYS 9 Cb -0.14 -1.99 1.25 0.00 -1.68 0.00 0.00 37.83 35.27 2qli s LYS 9 CO 0.18 -1.44 1.97 0.93 -0.76 0.00 0.00 175.35 176.23 2qli h GLU 10 N -0.93 0.00 -5.30 1.68 5.08 -1.95 -3.39 114.58 109.77 2qli h GLU 10 Ca -0.46 0.00 -0.68 0.00 -1.00 0.00 0.00 59.36 57.22 2qli h GLU 10 Cb 1.31 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 30.23 2qli h GLU 10 CO 0.65 0.15 -0.88 0.12 -1.00 0.00 0.00 179.01 178.06 2qli s PHE 11 N -3.91 2.59 -0.01 4.33 5.36 -1.26 -3.99 117.98 121.09 2qli s PHE 11 Ca -0.01 -1.13 0.00 0.00 -0.96 0.00 0.00 56.93 54.83 2qli s PHE 11 Cb 0.11 -1.74 0.01 0.00 -0.34 0.00 0.00 43.02 41.07 2qli s PHE 11 CO 0.60 -0.47 -0.00 -1.64 -1.46 0.00 0.00 175.22 172.24 2qli s MET 12 N 0.47 0.11 0.35 10.12 -1.94 -0.54 -5.00 119.30 122.87 2qli s MET 12 Ca -0.16 0.03 0.02 0.00 -1.71 0.00 0.00 55.69 53.87 2qli s MET 12 Cb -0.17 -0.21 -0.03 0.00 2.01 0.00 0.00 34.83 36.44 2qli s MET 12 CO 0.06 -0.04 0.53 1.03 -0.01 0.00 0.00 175.02 176.59 2qli s ARG 13 N 0.40 3.38 0.05 2.03 0.52 -1.26 -0.77 118.95 123.30 2qli s ARG 13 Ca -0.04 -0.48 -0.02 0.00 -0.52 0.00 0.00 55.73 54.68 2qli s ARG 13 Cb -0.06 -2.69 -0.03 0.00 0.52 0.00 0.00 34.95 32.69 2qli s ARG 13 CO -0.01 0.12 -0.01 -0.59 0.02 0.00 0.00 175.30 174.83 2qli s PHE 14 N -2.29 0.43 0.01 -0.53 -0.12 -0.45 -1.17 117.98 113.86 2qli s PHE 14 Ca 0.41 -0.91 0.07 0.00 -0.05 0.00 0.00 56.93 56.45 2qli s PHE 14 Cb -0.10 -0.32 -0.02 0.00 -0.63 0.00 0.00 43.02 41.95 2qli s PHE 14 CO 0.35 -0.35 -0.22 0.15 -0.05 0.00 0.00 175.22 175.09 2qli s LYS 15 N -3.39 1.68 0.01 1.99 3.01 -0.20 -0.87 119.74 121.98 2qli s LYS 15 Ca 0.02 -0.89 -0.06 0.00 -1.01 0.00 0.00 55.97 54.04 2qli s LYS 15 Cb 0.04 -1.71 -0.00 0.00 -1.01 0.00 0.00 37.83 35.15 2qli s LYS 15 CO -0.08 0.46 0.10 -1.14 0.51 0.00 0.00 175.35 175.20 2qli s GLN 16 N -0.82 0.48 -0.01 1.68 0.74 -0.06 -0.59 119.66 121.08 2qli s GLN 16 Ca 0.09 -0.51 0.01 0.00 0.05 0.00 0.00 55.36 55.00 2qli s GLN 16 Cb -0.09 0.19 0.00 0.00 1.10 0.00 0.00 33.01 34.22 2qli s GLN 16 CO 0.00 -0.11 -0.04 -1.58 -0.55 0.00 0.00 175.29 173.01 2qli s HIS 17 N -1.66 0.43 -0.02 1.67 5.65 -0.06 -1.19 115.29 120.11 2qli s HIS 17 Ca -0.13 -0.08 0.04 0.00 0.25 0.00 0.00 55.06 55.14 2qli s HIS 17 Cb -0.07 -0.30 -0.01 0.00 -1.18 0.00 0.00 32.58 31.02 2qli s HIS 17 CO -0.00 -0.03 -0.14 1.41 -0.65 0.00 0.00 174.74 175.33 2qli s MET 18 N 0.06 1.31 0.06 2.88 0.00 0.82 -0.95 119.30 123.48 2qli s MET 18 Ca -0.00 -0.51 0.01 0.00 0.00 0.00 0.00 55.69 55.19 2qli s MET 18 Cb -0.04 -1.22 -0.03 0.00 0.00 0.00 0.00 34.83 33.54 2qli s MET 18 CO -0.00 0.26 -0.06 -1.83 0.00 0.00 0.00 175.02 173.39 2qli s GLU 19 N -0.14 0.60 0.00 4.11 -1.05 -0.32 -0.89 118.70 121.01 2qli s GLU 19 Ca 0.02 -0.98 0.00 0.00 -0.15 0.00 0.00 54.97 53.86 2qli s GLU 19 Cb -0.08 -0.13 0.00 0.00 -0.44 0.00 0.00 34.13 33.48 2qli s GLU 19 CO 0.00 -0.01 0.00 0.41 0.95 0.00 0.00 175.26 176.61 2qli n GLY 20 N 0.83 -0.52 3.32 -3.83 0.00 -0.81 -1.10 105.19 103.09 2qli n GLY 20 Ca -0.18 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 44.79 2qli n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qli s SER 21 N -4.00 -0.36 -0.08 1.61 1.04 -0.31 -1.25 113.70 110.36 2qli s SER 21 Ca 0.00 0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.84 2qli s SER 21 Cb 0.00 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.64 2qli s SER 21 CO 0.00 -0.42 -0.06 -0.69 0.98 0.00 0.00 173.24 173.05 2qli s VAL 22 N -0.95 0.77 -1.50 5.02 1.01 -0.89 -0.48 120.40 123.37 2qli s VAL 22 Ca -0.10 -0.18 -0.08 0.00 0.00 0.00 0.00 61.98 61.62 2qli s VAL 22 Cb -0.04 -0.80 0.06 0.00 0.00 0.00 0.00 36.38 35.60 2qli s VAL 22 CO 0.05 0.31 0.68 0.59 0.00 0.00 0.00 175.10 176.72 2qli n ASN 23 N 4.58 -2.20 0.00 3.32 4.13 -0.62 -1.22 115.26 123.25 2qli n ASN 23 Ca -0.16 -0.93 0.00 0.00 1.68 0.00 0.00 54.58 55.17 2qli n ASN 23 Cb 0.50 -3.31 0.00 0.00 -1.54 0.00 0.00 39.78 35.43 2qli n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qli n GLY 24 N -1.71 0.84 3.51 7.41 0.00 -1.26 -4.99 105.19 108.99 2qli n GLY 24 Ca -0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.46 2qli n GLY 24 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qli s HIS 25 N -3.50 3.09 0.46 1.61 5.04 -0.36 -5.06 115.29 116.58 2qli s HIS 25 Ca 0.00 -0.14 -0.20 0.00 -1.54 0.00 0.00 55.06 53.18 2qli s HIS 25 Cb 0.00 -3.25 -0.10 0.00 0.04 0.00 0.00 32.58 29.27 2qli s HIS 25 CO 0.00 -0.84 0.98 -1.21 -2.34 0.00 0.00 174.74 171.33 2qli s GLU 26 N 2.67 4.04 0.24 2.88 0.41 -1.26 -2.10 118.70 125.58 2qli s GLU 26 Ca 0.20 1.16 -0.21 0.00 -0.41 0.00 0.00 54.97 55.72 2qli s GLU 26 Cb -0.15 -2.15 0.03 0.00 -1.78 0.00 0.00 34.13 30.09 2qli s GLU 26 CO 0.18 -0.20 0.66 -0.59 -0.49 0.00 0.00 175.26 174.82 2qli s PHE 27 N -2.20 -0.25 -0.03 1.61 -0.12 -0.38 -4.51 117.98 112.10 2qli s PHE 27 Ca 0.63 -0.13 -0.04 0.00 -0.05 0.00 0.00 56.93 57.34 2qli s PHE 27 Cb -0.11 0.62 0.01 0.00 -0.63 0.00 0.00 43.02 42.90 2qli s PHE 27 CO 0.18 -1.09 0.10 -1.21 -0.05 0.00 0.00 175.22 173.15 2qli s GLU 28 N -3.87 0.19 -0.03 1.99 2.02 -0.51 -1.93 118.70 116.56 2qli s GLU 28 Ca 0.09 0.01 0.03 0.00 0.02 0.00 0.00 54.97 55.12 2qli s GLU 28 Cb -0.04 0.08 -0.00 0.00 0.10 0.00 0.00 34.13 34.27 2qli s GLU 28 CO 0.01 -0.03 -0.12 0.42 0.02 0.00 0.00 175.26 175.55 2qli s ILE 29 N -0.26 1.04 0.14 -1.63 1.01 -0.07 -0.43 121.20 121.01 2qli s ILE 29 Ca -0.03 -0.51 0.09 0.00 0.00 0.00 0.00 60.65 60.20 2qli s ILE 29 Cb -0.02 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.50 2qli s ILE 29 CO 0.00 0.31 -0.18 -1.61 0.00 0.00 0.00 174.94 173.46 2qli s GLU 30 N 0.05 1.77 0.05 2.79 2.02 0.19 -0.12 118.70 125.45 2qli s GLU 30 Ca -0.02 -1.26 -0.08 0.00 0.02 0.00 0.00 54.97 53.62 2qli s GLU 30 Cb -0.09 -2.07 -0.00 0.00 0.10 0.00 0.00 34.13 32.07 2qli s GLU 30 CO 0.01 0.46 0.17 0.20 0.02 0.00 0.00 175.26 176.11 2qli s GLY 31 N -2.36 0.09 0.01 -1.39 0.00 -0.33 -0.49 107.32 102.85 2qli s GLY 31 Ca 0.20 -0.45 0.03 0.00 0.00 0.00 0.00 44.72 44.50 2qli s GLY 31 CO 0.11 -0.61 -0.09 -1.83 0.00 0.00 0.00 173.10 170.68 2qli s GLU 32 N -2.94 0.65 0.29 2.90 4.04 -0.31 -0.88 118.70 122.45 2qli s GLU 32 Ca -0.02 -0.44 0.02 0.00 0.04 0.00 0.00 54.97 54.57 2qli s GLU 32 Cb 0.01 -0.59 -0.02 0.00 0.02 0.00 0.00 34.13 33.54 2qli s GLU 32 CO -0.06 0.15 0.30 0.20 -1.84 0.00 0.00 175.26 174.01 2qli s GLY 33 N -0.59 1.80 -0.07 -3.83 0.00 -0.05 -0.91 107.32 103.67 2qli s GLY 33 Ca 0.00 -1.78 -0.26 0.00 0.00 0.00 0.00 44.72 42.68 2qli s GLY 33 CO 0.00 -1.30 0.60 -1.83 0.00 0.00 0.00 173.10 170.57 2qli s GLU 34 N -3.58 0.93 0.06 2.90 -1.05 -0.23 -1.34 118.70 116.38 2qli s GLU 34 Ca 0.37 0.27 -0.19 0.00 -0.15 0.00 0.00 54.97 55.27 2qli s GLU 34 Cb 0.03 0.44 0.07 0.00 -0.44 0.00 0.00 34.13 34.22 2qli s GLU 34 CO 0.21 -0.26 0.89 0.41 0.95 0.00 0.00 175.26 177.46 2qli n GLY 35 N 1.28 0.53 2.93 -3.83 0.00 0.05 -0.32 105.19 105.83 2qli n GLY 35 Ca -0.19 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.49 2qli n GLY 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qli s ARG 36 N -2.02 1.92 0.38 1.61 0.52 0.40 -1.46 118.95 120.28 2qli s ARG 36 Ca 0.20 -2.57 0.11 0.00 -0.52 0.00 0.00 55.73 52.95 2qli s ARG 36 Cb -0.01 -3.23 0.90 0.00 0.52 0.00 0.00 34.95 33.13 2qli s ARG 36 CO 0.02 -1.12 1.88 -1.35 0.02 0.00 0.00 175.30 174.76 2qli h PRO 37 N 6.51 0.58 0.00 3.54 0.11 -1.80 -0.42 132.00 140.53 2qli h PRO 37 Ca -0.07 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2qli h PRO 37 Cb 0.89 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2qli h PRO 37 CO 0.67 0.39 -0.16 1.88 -0.21 0.00 0.00 178.00 180.56 2qli h TYR 38 N 0.60 0.00 -0.00 0.65 -1.99 -1.85 -3.09 116.97 111.28 2qli h TYR 38 Ca 0.43 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.16 2qli h TYR 38 Cb 0.77 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.50 2qli h TYR 38 CO -0.00 0.00 -0.76 0.39 -0.00 0.00 0.00 178.16 177.79 2qli n GLU 39 N -2.54 0.33 -1.74 4.88 -0.58 -0.24 -4.50 120.64 116.25 2qli n GLU 39 Ca 0.04 -0.26 -0.07 0.00 -0.42 0.00 0.00 57.16 56.46 2qli n GLU 39 Cb 0.47 -1.49 -0.01 0.00 -0.57 0.00 0.00 31.44 29.83 2qli n GLU 39 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qli n GLY 40 N 1.47 0.43 3.26 0.62 0.00 -0.73 -4.55 105.19 105.70 2qli n GLY 40 Ca 0.06 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.19 2qli n GLY 40 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qli s THR 41 N -2.31 1.62 -0.09 2.61 -4.23 -1.16 -0.68 115.64 111.40 2qli s THR 41 Ca 0.00 -1.47 -0.30 0.00 -1.18 0.00 0.00 61.69 58.74 2qli s THR 41 Cb 0.00 -1.47 0.09 0.00 1.34 0.00 0.00 72.50 72.46 2qli s THR 41 CO 0.00 -0.05 0.81 0.00 -0.54 0.00 0.00 174.62 174.83 2qli s GLN 42 N -1.80 0.88 0.16 3.99 -2.07 -0.82 -0.46 119.66 119.54 2qli s GLN 42 Ca 0.05 0.18 0.07 0.00 -1.82 0.00 0.00 55.36 53.85 2qli s GLN 42 Cb -0.10 0.41 -0.04 0.00 -1.09 0.00 0.00 33.01 32.19 2qli s GLN 42 CO 0.04 -0.28 -0.15 0.95 -1.32 0.00 0.00 175.29 174.53 2qli s THR 43 N -1.26 1.59 0.00 3.63 -4.23 0.56 -1.24 115.64 114.69 2qli s THR 43 Ca -0.07 -1.95 -0.12 0.00 -1.18 0.00 0.00 61.69 58.38 2qli s THR 43 Cb -0.00 -1.80 0.01 0.00 1.34 0.00 0.00 72.50 72.05 2qli s THR 43 CO 0.06 -0.46 0.25 0.00 -0.54 0.00 0.00 174.62 173.92 2qli s ALA 44 N -2.43 -0.60 -0.23 3.99 0.00 0.01 -1.07 121.76 121.43 2qli s ALA 44 Ca 0.15 0.11 -0.05 0.00 0.00 0.00 0.00 51.96 52.17 2qli s ALA 44 Cb -0.03 0.13 -0.01 0.00 0.00 0.00 0.00 23.12 23.20 2qli s ALA 44 CO 0.05 -0.27 -0.01 1.03 0.00 0.00 0.00 175.76 176.56 2qli s ARG 45 N -1.56 3.45 -0.03 0.00 3.00 -0.09 -1.13 118.95 122.60 2qli s ARG 45 Ca -0.12 -0.58 0.04 0.00 0.00 0.00 0.00 55.73 55.07 2qli s ARG 45 Cb -0.05 -3.09 -0.03 0.00 0.00 0.00 0.00 34.95 31.78 2qli s ARG 45 CO 0.02 -0.19 -0.15 -0.51 0.00 0.00 0.00 175.30 174.47 2qli s LEU 46 N 1.51 2.70 0.01 2.53 2.01 0.46 -1.16 118.68 126.74 2qli s LEU 46 Ca 0.06 -0.25 0.02 0.00 0.01 0.00 0.00 54.13 53.97 2qli s LEU 46 Cb -0.14 -1.55 -0.01 0.00 0.01 0.00 0.00 46.19 44.49 2qli s LEU 46 CO -0.01 0.32 -0.06 -1.59 1.01 0.00 0.00 176.35 176.02 2qli s LYS 47 N -0.89 0.43 -0.22 1.70 -2.85 0.36 -1.12 119.74 117.15 2qli s LYS 47 Ca 0.12 -0.36 -0.29 0.00 -1.00 0.00 0.00 55.97 54.44 2qli s LYS 47 Cb -0.11 -0.34 -0.01 0.00 -2.06 0.00 0.00 37.83 35.31 2qli s LYS 47 CO 0.02 0.09 1.27 0.08 0.10 0.00 0.00 175.35 176.90 2qli s VAL 48 N -0.52 4.24 -0.24 1.79 1.01 -0.25 -0.64 120.40 125.79 2qli s VAL 48 Ca -0.02 1.46 0.21 0.00 0.00 0.00 0.00 61.98 63.63 2qli s VAL 48 Cb -0.04 -4.07 -0.31 0.00 0.00 0.00 0.00 36.38 31.96 2qli s VAL 48 CO -0.00 -0.27 0.56 0.35 0.00 0.00 0.00 175.10 175.74 2qli n THR 49 N 5.70 0.00 -3.82 3.92 -2.24 0.43 -4.82 114.28 113.46 2qli n THR 49 Ca 0.14 -0.38 -0.12 0.00 -2.27 0.00 0.00 64.05 61.42 2qli n THR 49 Cb 0.46 0.23 -0.12 0.00 -2.10 0.00 0.00 70.33 68.80 2qli n THR 49 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2qli s LYS 50 N -3.37 0.25 0.00 -0.78 2.20 -0.81 -4.93 119.74 112.31 2qli s LYS 50 Ca -0.04 0.16 0.00 0.00 -0.36 0.00 0.00 55.97 55.73 2qli s LYS 50 Cb 0.14 0.12 0.00 0.00 -1.51 0.00 0.00 37.83 36.58 2qli s LYS 50 CO 0.88 -0.04 0.00 0.41 -0.36 0.00 0.00 175.35 176.24 2qli n GLY 51 N 2.76 0.82 3.86 5.54 0.00 -1.26 -1.43 105.19 115.49 2qli n GLY 51 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 2qli n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qli s GLY 52 N -1.75 1.88 0.48 -0.02 0.00 -1.26 -4.12 107.32 102.52 2qli s GLY 52 Ca 0.00 -0.02 -0.21 0.00 0.00 0.00 0.00 44.72 44.49 2qli s GLY 52 CO 0.00 0.23 1.07 2.56 0.00 0.00 0.00 173.10 176.96 2qli s PRO 53 N -4.40 3.78 0.24 2.90 0.04 -1.26 -5.11 135.00 131.19 2qli s PRO 53 Ca 0.55 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.79 2qli s PRO 53 Cb -0.10 -2.20 -0.09 0.00 0.04 0.00 0.00 34.50 32.15 2qli s PRO 53 CO 0.39 -0.47 1.25 -0.51 0.04 0.00 0.00 177.00 177.70 2qli s LEU 54 N -3.33 4.45 -0.14 -3.56 1.43 -1.26 -4.91 118.68 111.36 2qli s LEU 54 Ca 0.66 2.42 0.06 0.00 -1.03 0.00 0.00 54.13 56.25 2qli s LEU 54 Cb -0.20 -3.62 0.41 0.00 0.03 0.00 0.00 46.19 42.80 2qli s LEU 54 CO 0.24 -0.43 1.18 -0.81 0.23 0.00 0.00 176.35 176.76 2qli n PRO 55 N 1.88 2.80 -4.11 1.29 -0.04 -1.26 -4.89 135.00 130.67 2qli n PRO 55 Ca 0.03 -1.59 -0.10 0.00 -0.04 0.00 0.00 63.50 61.80 2qli n PRO 55 Cb 0.43 -1.85 -0.09 0.00 -0.04 0.00 0.00 33.50 31.95 2qli n PRO 55 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2qli s PHE 56 N -1.86 0.76 0.13 0.54 -0.12 -1.26 -4.76 117.98 111.41 2qli s PHE 56 Ca 0.28 -1.14 -0.32 0.00 -0.05 0.00 0.00 56.93 55.69 2qli s PHE 56 Cb 0.22 -0.40 -0.12 0.00 -0.63 0.00 0.00 43.02 42.09 2qli s PHE 56 CO 0.08 -0.55 1.75 0.00 -0.05 0.00 0.00 175.22 176.45 2qli n ALA 57 N -0.10 1.99 0.06 1.99 0.00 -0.49 -4.88 120.51 119.08 2qli n ALA 57 Ca -0.06 0.37 0.12 0.00 0.00 0.00 0.00 53.44 53.86 2qli n ALA 57 Cb 0.63 -2.50 0.59 0.00 0.00 0.00 0.00 19.45 18.17 2qli n ALA 57 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 2qli h TRP 58 N 7.51 0.19 -0.01 0.00 2.91 -1.95 -2.61 115.95 121.99 2qli h TRP 58 Ca -0.45 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.58 2qli h TRP 58 Cb 1.23 -0.06 -0.00 0.00 -0.51 0.00 0.00 29.16 29.82 2qli h TRP 58 CO 0.72 0.10 0.02 -0.44 -1.03 0.00 0.00 178.44 177.81 2qli h ASP 59 N 0.19 0.00 1.11 2.65 3.32 -1.97 0.20 116.42 121.92 2qli h ASP 59 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2qli h ASP 59 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2qli h ASP 59 CO -0.03 0.00 0.00 2.30 -1.72 0.00 0.00 179.24 179.79 2qli n ILE 60 N -3.64 0.53 -0.04 0.35 -5.35 -0.98 -3.45 119.36 106.78 2qli n ILE 60 Ca -0.03 -0.06 -0.04 0.00 -0.27 0.00 0.00 62.75 62.35 2qli n ILE 60 Cb 0.10 -0.72 -0.14 0.00 -1.74 0.00 0.00 39.64 37.15 2qli n ILE 60 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2qli n LEU 61 N -1.98 0.43 -0.11 7.28 4.77 0.67 -4.60 117.00 123.46 2qli n LEU 61 Ca 0.05 0.19 0.01 0.00 -0.03 0.00 0.00 56.01 56.24 2qli n LEU 61 Cb 0.34 0.25 0.30 0.00 -2.33 0.00 0.00 43.42 41.98 2qli n LEU 61 CO 0.26 0.32 1.13 0.77 -1.33 0.00 0.00 177.39 178.54 2qli h SER 62 N 0.00 0.68 0.26 -1.43 4.64 -1.47 -1.12 113.55 115.11 2qli h SER 62 Ca -0.32 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2qli h SER 62 Cb 1.87 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.79 2qli h SER 62 CO 0.04 0.55 0.00 -2.65 -0.87 0.00 0.00 176.83 173.90 2qli n PRO 63 N -4.40 0.42 -0.01 4.77 -0.02 -1.26 -2.12 135.00 132.38 2qli n PRO 63 Ca 0.05 0.06 0.13 0.00 -2.02 0.00 0.00 63.50 61.72 2qli n PRO 63 Cb 0.10 -1.50 0.34 0.00 -0.02 0.00 0.00 33.50 32.42 2qli n PRO 63 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2qli n GLN 64 N -1.19 1.96 -0.42 -0.52 1.13 -0.42 -4.82 117.38 113.09 2qli n GLN 64 Ca 0.12 -1.40 0.04 0.00 -1.94 0.00 0.00 57.00 53.82 2qli n GLN 64 Cb 0.13 -1.47 0.21 0.00 0.11 0.00 0.00 30.24 29.22 2qli n GLN 64 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 2qli n ILE 65 N 0.69 1.28 0.00 5.09 5.41 -0.90 -4.97 119.36 125.96 2qli n ILE 65 Ca 0.17 -0.69 0.00 0.00 1.00 0.00 0.00 62.75 63.22 2qli n ILE 65 Cb 0.46 -0.27 0.00 0.00 -0.71 0.00 0.00 39.64 39.12 2qli n ILE 65 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2qli n SER 69 N 0.38 0.00 0.00 4.38 2.88 -1.26 -5.11 113.62 114.89 2qli n SER 69 Ca 0.14 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.84 2qli n SER 69 Cb 0.67 0.00 0.86 0.00 -0.75 0.00 0.00 64.21 65.00 2qli n SER 69 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2qli n LYS 70 N 0.00 0.75 0.25 -1.46 4.76 -1.26 -1.90 118.16 119.30 2qli n LYS 70 Ca 0.00 0.00 0.17 0.00 -2.87 0.00 0.00 58.31 55.61 2qli n LYS 70 Cb 0.00 -1.50 0.81 0.00 -1.84 0.00 0.00 35.03 32.50 2qli n LYS 70 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qli h ALA 71 N 3.74 1.00 -1.25 7.82 0.00 -1.97 -3.32 119.26 125.28 2qli h ALA 71 Ca 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 54.91 54.11 2qli h ALA 71 Cb 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 17.79 17.64 2qli h ALA 71 CO 0.00 0.00 1.00 0.66 0.00 0.00 0.00 179.25 180.91 2qli n TYR 72 N -2.79 2.82 -4.20 0.00 4.02 -0.80 -4.73 117.16 111.48 2qli n TYR 72 Ca -0.01 -2.57 -0.29 0.00 -0.01 0.00 0.00 57.90 55.02 2qli n TYR 72 Cb 0.17 -1.18 -0.17 0.00 -0.02 0.00 0.00 39.34 38.14 2qli n TYR 72 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2qli s VAL 73 N -4.40 1.49 0.10 -0.72 1.01 -1.22 -4.16 120.40 112.51 2qli s VAL 73 Ca 0.40 -0.61 -0.31 0.00 0.00 0.00 0.00 61.98 61.46 2qli s VAL 73 Cb 0.21 -1.39 -0.08 0.00 0.00 0.00 0.00 36.38 35.12 2qli s VAL 73 CO -0.15 0.44 1.50 -0.75 0.00 0.00 0.00 175.10 176.14 2qli s LYS 74 N 1.28 4.26 0.00 2.72 2.20 -0.55 -4.68 119.74 124.97 2qli s LYS 74 Ca -0.00 2.20 0.06 0.00 -0.36 0.00 0.00 55.97 57.87 2qli s LYS 74 Cb -0.14 -3.34 -0.02 0.00 -1.51 0.00 0.00 37.83 32.82 2qli s LYS 74 CO -0.06 -0.57 -0.19 -1.01 -0.36 0.00 0.00 175.35 173.15 2qli s HIS 75 N 1.64 1.71 0.79 4.03 3.76 -1.26 -0.17 115.29 125.78 2qli s HIS 75 Ca 0.68 -0.34 -0.11 0.00 -0.15 0.00 0.00 55.06 55.14 2qli s HIS 75 Cb -0.39 -1.08 0.06 0.00 1.11 0.00 0.00 32.58 32.29 2qli s HIS 75 CO 0.30 0.00 1.09 -1.25 -0.85 0.00 0.00 174.74 174.03 2qli s PRO 76 N -0.66 2.15 0.54 8.40 0.04 -1.26 -4.91 135.00 139.31 2qli s PRO 76 Ca 0.07 0.87 0.27 0.00 0.04 0.00 0.00 61.00 62.26 2qli s PRO 76 Cb -0.08 -1.91 1.53 0.00 0.04 0.00 0.00 34.50 34.09 2qli s PRO 76 CO -0.00 -1.63 2.12 0.00 0.04 0.00 0.00 177.00 177.53 2qli h ALA 77 N -1.11 1.37 -0.27 8.56 0.00 -2.00 -2.20 119.26 123.62 2qli h ALA 77 Ca -0.46 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2qli h ALA 77 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2qli h ALA 77 CO 0.56 0.11 0.00 -0.40 0.00 0.00 0.00 179.25 179.52 2qli n ASP 78 N -3.73 2.00 -4.09 0.00 5.75 -1.26 -4.67 116.55 110.54 2qli n ASP 78 Ca -0.02 -1.83 -0.32 0.00 -0.01 0.00 0.00 54.79 52.60 2qli n ASP 78 Cb 0.19 -0.17 -0.16 0.00 -1.03 0.00 0.00 41.12 39.96 2qli n ASP 78 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2qli s ILE 79 N -1.65 2.10 0.20 2.12 1.01 -0.83 -5.01 121.20 119.13 2qli s ILE 79 Ca 0.31 -1.28 -0.33 0.00 0.00 0.00 0.00 60.65 59.36 2qli s ILE 79 Cb 0.17 -2.06 -0.13 0.00 0.01 0.00 0.00 42.46 40.45 2qli s ILE 79 CO 0.24 0.26 1.61 -2.65 0.00 0.00 0.00 174.94 174.40 2qli n PRO 80 N 4.53 2.40 -2.69 2.79 -0.02 -1.26 -4.67 135.00 136.08 2qli n PRO 80 Ca -0.17 0.86 -0.43 0.00 -2.02 0.00 0.00 63.50 61.74 2qli n PRO 80 Cb 0.46 -2.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 2qli n PRO 80 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2qli n ASP 81 N 3.36 5.47 -0.29 2.55 -0.08 -1.26 -4.47 116.55 121.82 2qli n ASP 81 Ca 0.15 -3.15 0.11 0.00 -1.51 0.00 0.00 54.79 50.39 2qli n ASP 81 Cb 0.32 -1.44 0.27 0.00 2.34 0.00 0.00 41.12 42.61 2qli n ASP 81 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 2qli h TYR 82 N 6.01 0.41 -0.02 -0.67 3.20 -1.89 -0.08 116.97 123.94 2qli h TYR 82 Ca 0.32 0.05 -0.20 0.00 3.14 0.00 0.00 58.73 62.03 2qli h TYR 82 Cb 0.69 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.91 2qli h TYR 82 CO 1.13 -0.14 -0.86 -0.07 -1.64 0.00 0.00 178.16 176.58 2qli h LEU 83 N 0.27 0.40 -0.87 2.82 3.38 -1.90 -2.01 115.31 117.40 2qli h LEU 83 Ca 0.52 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 2qli h LEU 83 Cb 1.00 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 2qli h LEU 83 CO -0.59 1.09 -0.09 0.11 0.09 0.00 0.00 178.44 179.05 2qli h LYS 84 N 0.19 0.74 0.00 1.13 1.57 -1.55 -3.03 116.57 115.61 2qli h LYS 84 Ca -0.05 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.46 2qli h LYS 84 Cb 1.47 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.71 2qli h LYS 84 CO 0.14 0.81 -0.17 -0.07 -0.57 0.00 0.00 179.45 179.59 2qli h LEU 85 N 0.67 0.00 -1.75 2.94 3.38 -0.68 -2.56 115.31 117.31 2qli h LEU 85 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2qli h LEU 85 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2qli h LEU 85 CO 0.03 0.17 0.00 0.77 0.09 0.00 0.00 178.44 179.50 2qli h SER 86 N 0.00 0.00 -4.09 -0.43 4.64 -1.24 -3.45 113.55 108.97 2qli h SER 86 Ca -0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 2qli h SER 86 Cb 0.33 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.45 2qli h SER 86 CO 0.02 0.00 0.32 -0.36 -0.87 0.00 0.00 176.83 175.94 2qli s PHE 87 N -3.74 3.51 -0.06 4.77 0.40 -0.97 -0.64 117.98 121.26 2qli s PHE 87 Ca -0.00 1.28 0.31 0.00 -0.60 0.00 0.00 56.93 57.92 2qli s PHE 87 Cb 0.10 -2.66 1.11 0.00 0.51 0.00 0.00 43.02 42.07 2qli s PHE 87 CO 0.48 -0.40 1.88 -1.00 0.70 0.00 0.00 175.22 176.89 2qli h PRO 88 N 0.58 0.00 0.04 0.24 0.13 -1.89 -3.46 132.00 127.65 2qli h PRO 88 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2qli h PRO 88 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2qli h PRO 88 CO 0.62 0.00 -0.02 0.93 -0.23 0.00 0.00 178.00 179.30 2qli h GLU 89 N 0.00 -0.06 0.00 0.86 3.07 -1.86 -1.78 114.58 114.81 2qli h GLU 89 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2qli h GLU 89 Cb 0.63 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 2qli h GLU 89 CO 0.00 -0.02 0.00 0.41 -1.40 0.00 0.00 179.01 178.00 2qli n GLY 90 N -1.07 -0.35 3.64 -3.84 0.00 0.19 -4.40 105.19 99.37 2qli n GLY 90 Ca -0.07 -2.00 -0.09 0.00 0.00 0.00 0.00 46.02 43.86 2qli n GLY 90 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qli s PHE 91 N 0.00 0.07 0.13 1.61 -0.12 -0.80 -0.81 117.98 118.06 2qli s PHE 91 Ca 0.00 -0.46 0.08 0.00 -0.05 0.00 0.00 56.93 56.51 2qli s PHE 91 Cb 0.00 0.39 -0.04 0.00 -0.63 0.00 0.00 43.02 42.74 2qli s PHE 91 CO 0.00 -1.04 -0.20 0.15 -0.05 0.00 0.00 175.22 174.08 2qli s LYS 92 N -3.95 1.21 0.08 1.99 1.02 -0.58 -0.30 119.74 119.21 2qli s LYS 92 Ca 0.15 -1.29 0.01 0.00 0.02 0.00 0.00 55.97 54.87 2qli s LYS 92 Cb -0.02 -1.39 -0.04 0.00 -0.52 0.00 0.00 37.83 35.86 2qli s LYS 92 CO 0.05 0.30 -0.06 1.67 -0.92 0.00 0.00 175.35 176.39 2qli s TRP 93 N -1.57 0.78 -0.06 3.18 1.48 -0.47 -0.63 118.94 121.66 2qli s TRP 93 Ca 0.11 -0.86 -0.04 0.00 -1.06 0.00 0.00 56.10 54.25 2qli s TRP 93 Cb -0.08 -0.47 0.02 0.00 -1.16 0.00 0.00 33.47 31.78 2qli s TRP 93 CO 0.05 -0.18 0.14 -2.00 -4.06 0.00 0.00 176.95 170.91 2qli s GLU 94 N -3.41 0.13 0.02 3.25 2.12 -0.31 -1.20 118.70 119.31 2qli s GLU 94 Ca 0.07 0.26 0.01 0.00 0.36 0.00 0.00 54.97 55.66 2qli s GLU 94 Cb 0.03 -0.02 -0.02 0.00 0.26 0.00 0.00 34.13 34.38 2qli s GLU 94 CO -0.05 -0.08 -0.04 0.50 -0.54 0.00 0.00 175.26 175.06 2qli s ARG 95 N 0.50 0.32 -0.03 4.30 3.52 -0.57 -0.63 118.95 126.37 2qli s ARG 95 Ca -0.04 -0.48 0.05 0.00 -0.13 0.00 0.00 55.73 55.13 2qli s ARG 95 Cb -0.05 -0.07 -0.01 0.00 -1.56 0.00 0.00 34.95 33.26 2qli s ARG 95 CO -0.02 0.00 -0.18 0.54 -0.81 0.00 0.00 175.30 174.83 2qli s VAL 96 N -1.01 1.47 -0.20 7.11 0.11 -0.23 -1.44 120.40 126.21 2qli s VAL 96 Ca -0.09 -0.77 -0.02 0.00 -2.93 0.00 0.00 61.98 58.16 2qli s VAL 96 Cb -0.07 -1.24 -0.00 0.00 -1.53 0.00 0.00 36.38 33.54 2qli s VAL 96 CO -0.00 0.42 -0.10 -0.04 -3.33 0.00 0.00 175.10 172.05 2qli s MET 97 N -0.25 3.27 -0.39 1.54 -1.94 0.39 -1.46 119.30 120.46 2qli s MET 97 Ca 0.03 -0.69 -0.09 0.00 -1.71 0.00 0.00 55.69 53.23 2qli s MET 97 Cb -0.09 -2.85 0.06 0.00 2.01 0.00 0.00 34.83 33.96 2qli s MET 97 CO 0.01 -0.16 0.21 -0.80 -0.01 0.00 0.00 175.02 174.26 2qli s ASN 98 N 1.32 5.57 0.35 3.03 0.01 0.27 -1.42 114.94 124.08 2qli s ASN 98 Ca 0.04 -1.32 -0.20 0.00 -0.71 0.00 0.00 52.86 50.67 2qli s ASN 98 Cb -0.14 -1.96 -0.10 0.00 0.41 0.00 0.00 41.25 39.46 2qli s ASN 98 CO -0.05 -0.45 0.85 -0.36 -1.51 0.00 0.00 177.10 175.58 2qli s PHE 99 N 1.44 3.44 0.65 2.20 0.40 0.70 -0.66 117.98 126.15 2qli s PHE 99 Ca 0.02 1.49 0.40 0.00 -0.60 0.00 0.00 56.93 58.23 2qli s PHE 99 Cb -0.21 -2.74 2.19 0.00 0.51 0.00 0.00 43.02 42.78 2qli s PHE 99 CO 0.03 0.06 2.27 1.05 0.70 0.00 0.00 175.22 179.34 2qli h GLU 100 N 2.42 0.00 -0.51 0.44 4.11 -1.35 -0.94 114.58 118.75 2qli h GLU 100 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2qli h GLU 100 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2qli h GLU 100 CO 0.64 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.32 2qli n ASP 101 N -3.19 4.76 0.00 3.06 3.85 -1.26 -4.92 116.55 118.86 2qli n ASP 101 Ca -0.03 -2.71 0.00 0.00 -0.71 0.00 0.00 54.79 51.34 2qli n ASP 101 Cb 0.14 -0.58 0.00 0.00 -1.35 0.00 0.00 41.12 39.33 2qli n ASP 101 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2qli n GLY 102 N 0.52 1.68 3.76 6.12 0.00 -0.36 -4.68 105.19 112.24 2qli n GLY 102 Ca 0.24 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 2qli n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qli s GLY 103 N -2.34 2.77 -0.01 -0.02 0.00 -1.16 -4.74 107.32 101.81 2qli s GLY 103 Ca 0.00 1.02 0.02 0.00 0.00 0.00 0.00 44.72 45.76 2qli s GLY 103 CO 0.00 1.45 -0.06 0.54 0.00 0.00 0.00 173.10 175.03 2qli s VAL 104 N -1.55 0.46 -0.09 1.40 0.11 -0.78 -0.21 120.40 119.74 2qli s VAL 104 Ca 0.71 -0.24 0.03 0.00 -2.93 0.00 0.00 61.98 59.55 2qli s VAL 104 Cb -0.31 -0.40 0.01 0.00 -1.53 0.00 0.00 36.38 34.16 2qli s VAL 104 CO 0.35 0.14 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.40 2qli s VAL 105 N -0.07 1.50 0.09 2.04 1.01 -0.50 -1.79 120.40 122.67 2qli s VAL 105 Ca 0.01 -0.68 0.08 0.00 0.00 0.00 0.00 61.98 61.40 2qli s VAL 105 Cb -0.03 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 2qli s VAL 105 CO -0.00 0.44 -0.16 0.42 0.00 0.00 0.00 175.10 175.79 2qli s THR 106 N 0.65 2.94 0.01 3.92 -4.23 0.03 -0.46 115.64 118.50 2qli s THR 106 Ca -0.14 -1.35 0.01 0.00 -1.18 0.00 0.00 61.69 59.04 2qli s THR 106 Cb -0.16 -2.32 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 2qli s THR 106 CO 0.04 0.18 -0.04 -0.69 -0.54 0.00 0.00 174.62 173.57 2qli s VAL 107 N -1.09 0.28 0.01 2.29 1.01 -0.52 -1.09 120.40 121.29 2qli s VAL 107 Ca 0.18 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.85 2qli s VAL 107 Cb -0.11 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 2qli s VAL 107 CO 0.09 -0.06 -0.16 0.42 0.00 0.00 0.00 175.10 175.39 2qli s THR 108 N -0.42 1.30 -0.05 3.92 -4.23 -0.32 -1.51 115.64 114.33 2qli s THR 108 Ca -0.02 -0.87 -0.07 0.00 -1.18 0.00 0.00 61.69 59.55 2qli s THR 108 Cb -0.03 -1.12 0.01 0.00 1.34 0.00 0.00 72.50 72.70 2qli s THR 108 CO -0.00 0.23 0.18 -1.58 -0.54 0.00 0.00 174.62 172.91 2qli s GLN 109 N -0.74 0.28 -0.12 3.99 -0.44 -0.34 -0.99 119.66 121.30 2qli s GLN 109 Ca 0.05 0.10 0.00 0.00 -2.50 0.00 0.00 55.36 53.01 2qli s GLN 109 Cb -0.07 0.13 -0.01 0.00 -1.64 0.00 0.00 33.01 31.42 2qli s GLN 109 CO 0.00 -0.05 -0.14 0.34 0.50 0.00 0.00 175.29 175.94 2qli s ASP 110 N -0.27 3.93 -0.06 6.67 2.15 -0.13 -1.37 116.67 127.59 2qli s ASP 110 Ca -0.04 -0.34 0.05 0.00 0.43 0.00 0.00 52.55 52.65 2qli s ASP 110 Cb -0.03 -1.57 -0.01 0.00 -0.30 0.00 0.00 42.92 41.01 2qli s ASP 110 CO 0.01 0.17 -0.22 -0.44 -0.17 0.00 0.00 175.17 174.51 2qli s SER 111 N 0.32 2.80 0.30 -0.34 0.01 0.59 -1.49 113.70 115.89 2qli s SER 111 Ca -0.11 -0.48 -0.06 0.00 1.31 0.00 0.00 55.95 56.62 2qli s SER 111 Cb -0.16 -0.92 -0.00 0.00 0.21 0.00 0.00 66.02 65.15 2qli s SER 111 CO 0.06 0.19 0.45 -0.94 0.41 0.00 0.00 173.24 173.41 2qli s SER 112 N 0.05 0.52 -0.12 2.44 1.04 -0.57 -1.91 113.70 115.14 2qli s SER 112 Ca -0.08 -1.31 -0.00 0.00 0.48 0.00 0.00 55.95 55.04 2qli s SER 112 Cb -0.14 0.62 0.02 0.00 0.10 0.00 0.00 66.02 66.62 2qli s SER 112 CO 0.05 -1.22 -0.09 -0.22 0.98 0.00 0.00 173.24 172.74 2qli s LEU 113 N -3.16 1.30 -0.04 2.42 2.96 -0.67 -0.56 118.68 120.93 2qli s LEU 113 Ca 0.29 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 2qli s LEU 113 Cb 0.00 -0.91 0.02 0.00 0.50 0.00 0.00 46.19 45.80 2qli s LEU 113 CO 0.16 -0.10 -0.05 -1.10 -1.32 0.00 0.00 176.35 173.94 2qli s GLN 114 N 1.62 0.79 -1.47 1.98 -0.21 -0.50 -4.83 119.66 117.04 2qli s GLN 114 Ca 0.04 -0.14 -0.10 0.00 0.02 0.00 0.00 55.36 55.18 2qli s GLN 114 Cb -0.13 -0.78 0.06 0.00 1.00 0.00 0.00 33.01 33.16 2qli s GLN 114 CO -0.08 -0.03 0.90 -0.25 -2.12 0.00 0.00 175.29 173.71 2qli n ASP 115 N 3.79 -3.79 -0.12 5.90 8.00 -1.26 -2.06 116.55 127.01 2qli n ASP 115 Ca -0.23 -0.79 -0.02 0.00 0.71 0.00 0.00 54.79 54.46 2qli n ASP 115 Cb 0.52 -3.92 -0.01 0.00 -0.02 0.00 0.00 41.12 37.70 2qli n ASP 115 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2qli n GLY 116 N -1.68 0.46 3.08 0.44 0.00 -1.26 -4.99 105.19 101.24 2qli n GLY 116 Ca -0.05 -0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 2qli n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qli s GLU 117 N -1.09 0.82 0.41 1.61 2.02 -0.88 -4.64 118.70 116.96 2qli s GLU 117 Ca 0.00 -0.57 -0.25 0.00 0.02 0.00 0.00 54.97 54.17 2qli s GLU 117 Cb 0.00 -0.79 -0.08 0.00 0.10 0.00 0.00 34.13 33.36 2qli s GLU 117 CO 0.00 0.20 1.17 -0.06 0.02 0.00 0.00 175.26 176.59 2qli s PHE 118 N -0.62 3.03 -0.15 1.61 0.40 -0.32 -1.41 117.98 120.52 2qli s PHE 118 Ca 0.01 1.55 0.01 0.00 -0.60 0.00 0.00 56.93 57.90 2qli s PHE 118 Cb -0.06 -3.39 0.02 0.00 0.51 0.00 0.00 43.02 40.09 2qli s PHE 118 CO 0.00 -1.36 -0.17 0.42 0.70 0.00 0.00 175.22 174.81 2qli s ILE 119 N -1.44 1.77 -0.08 0.64 -1.09 0.28 -1.03 121.20 120.25 2qli s ILE 119 Ca 0.58 -0.78 0.04 0.00 -2.23 0.00 0.00 60.65 58.27 2qli s ILE 119 Cb -0.30 -1.62 -0.01 0.00 -1.58 0.00 0.00 42.46 38.95 2qli s ILE 119 CO 0.38 0.49 -0.22 -0.31 -1.23 0.00 0.00 174.94 174.05 2qli s TYR 120 N 1.20 2.55 -0.16 3.97 2.02 0.24 -1.51 117.35 125.67 2qli s TYR 120 Ca 0.00 -0.76 -0.00 0.00 -0.37 0.00 0.00 57.07 55.94 2qli s TYR 120 Cb -0.14 -1.67 0.04 0.00 -0.40 0.00 0.00 41.96 39.79 2qli s TYR 120 CO -0.08 -0.24 -0.06 0.15 -1.57 0.00 0.00 175.55 173.76 2qli s LYS 121 N 0.01 1.47 -0.01 -0.62 3.01 -0.56 -0.88 119.74 122.17 2qli s LYS 121 Ca -0.08 -0.48 0.08 0.00 -1.01 0.00 0.00 55.97 54.48 2qli s LYS 121 Cb -0.15 -1.94 -0.02 0.00 -1.01 0.00 0.00 37.83 34.70 2qli s LYS 121 CO 0.05 -0.40 -0.25 0.08 0.51 0.00 0.00 175.35 175.34 2qli s VAL 122 N 1.64 2.16 -0.15 3.17 1.01 -0.13 -0.96 120.40 127.14 2qli s VAL 122 Ca 0.01 -1.12 0.00 0.00 0.00 0.00 0.00 61.98 60.88 2qli s VAL 122 Cb -0.15 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.49 2qli s VAL 122 CO -0.08 0.55 -0.13 -0.54 0.00 0.00 0.00 175.10 174.90 2qli s LYS 123 N -0.73 2.19 -0.08 2.72 1.02 -0.16 -1.17 119.74 123.52 2qli s LYS 123 Ca 0.10 -0.57 0.05 0.00 0.02 0.00 0.00 55.97 55.58 2qli s LYS 123 Cb -0.10 -2.10 -0.00 0.00 -0.52 0.00 0.00 37.83 35.11 2qli s LYS 123 CO -0.00 -0.27 -0.24 0.08 -0.92 0.00 0.00 175.35 174.00 2qli s VAL 124 N 1.50 2.06 -0.18 3.17 1.01 -0.26 -1.17 120.40 126.52 2qli s VAL 124 Ca 0.04 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.97 2qli s VAL 124 Cb -0.13 -1.76 0.05 0.00 0.00 0.00 0.00 36.38 34.54 2qli s VAL 124 CO -0.10 0.56 -0.02 -0.13 0.00 0.00 0.00 175.10 175.41 2qli s ARG 125 N 0.14 1.17 0.10 2.72 1.81 -0.25 -1.16 118.95 123.48 2qli s ARG 125 Ca -0.13 -0.52 0.09 0.00 -1.72 0.00 0.00 55.73 53.45 2qli s ARG 125 Cb -0.16 -2.06 -0.04 0.00 -0.45 0.00 0.00 34.95 32.24 2qli s ARG 125 CO 0.07 -0.51 -0.20 0.20 -0.68 0.00 0.00 175.30 174.18 2qli s GLY 126 N 1.68 1.64 0.19 -3.53 0.00 0.36 -0.79 107.32 106.88 2qli s GLY 126 Ca -0.01 -1.33 -0.19 0.00 0.00 0.00 0.00 44.72 43.19 2qli s GLY 126 CO -0.07 -1.29 0.55 -0.51 0.00 0.00 0.00 173.10 171.79 2qli s THR 127 N -1.07 0.02 -1.22 0.90 -4.23 -0.74 -1.59 115.64 107.71 2qli s THR 127 Ca 0.16 -0.61 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 2qli s THR 127 Cb -0.10 -1.46 0.00 0.00 1.34 0.00 0.00 72.50 72.28 2qli s THR 127 CO 0.08 -0.09 0.00 -3.20 -0.54 0.00 0.00 174.62 170.87 2qli n ASN 128 N -0.36 -4.27 -4.69 3.99 5.15 -1.26 -1.86 115.26 111.96 2qli n ASN 128 Ca -0.11 0.17 -0.42 0.00 -0.60 0.00 0.00 54.58 53.61 2qli n ASN 128 Cb 0.63 -3.13 -0.03 0.00 -0.53 0.00 0.00 39.78 36.72 2qli n ASN 128 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2qli s PHE 129 N -2.53 3.52 0.37 1.20 0.40 -1.26 -3.00 117.98 116.67 2qli s PHE 129 Ca 0.00 1.60 -0.27 0.00 -0.60 0.00 0.00 56.93 57.66 2qli s PHE 129 Cb 0.00 -3.19 -0.11 0.00 0.51 0.00 0.00 43.02 40.23 2qli s PHE 129 CO 0.00 -0.22 1.21 -2.30 0.70 0.00 0.00 175.22 174.60 2qli n PRO 130 N 5.00 1.86 0.21 0.24 -0.02 -1.26 -4.89 135.00 136.14 2qli n PRO 130 Ca 0.09 0.66 0.07 0.00 -2.02 0.00 0.00 63.50 62.29 2qli n PRO 130 Cb 0.49 -2.24 0.46 0.00 -0.02 0.00 0.00 33.50 32.19 2qli n PRO 130 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2qli h SER 131 N 2.18 0.00 -0.16 2.55 4.64 -1.98 -2.00 113.55 118.79 2qli h SER 131 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2qli h SER 131 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2qli h SER 131 CO 0.61 0.29 0.00 0.47 -0.87 0.00 0.00 176.83 177.33 2qli n ASP 132 N -3.78 1.95 -4.93 4.97 9.92 -1.26 -4.38 116.55 119.03 2qli n ASP 132 Ca -0.01 -1.72 -0.25 0.00 -0.53 0.00 0.00 54.79 52.27 2qli n ASP 132 Cb 0.39 -0.10 0.06 0.00 -0.64 0.00 0.00 41.12 40.83 2qli n ASP 132 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2qli s GLY 133 N -1.66 1.69 0.41 0.44 0.00 -0.75 -4.84 107.32 102.61 2qli s GLY 133 Ca 0.34 -0.94 0.10 0.00 0.00 0.00 0.00 44.72 44.22 2qli s GLY 133 CO 0.29 -0.57 2.00 -0.56 0.00 0.00 0.00 173.10 174.25 2qli h PRO 134 N -0.45 0.30 -0.05 2.90 0.13 -1.93 -0.54 132.00 132.36 2qli h PRO 134 Ca -0.44 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 2qli h PRO 134 Cb 1.30 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2qli h PRO 134 CO 0.59 0.32 -0.22 0.28 -0.23 0.00 0.00 178.00 178.74 2qli h VAL 135 N 0.30 1.45 0.00 1.56 2.07 -1.94 -0.97 116.25 118.72 2qli h VAL 135 Ca 0.07 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.95 2qli h VAL 135 Cb 0.18 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.31 2qli h VAL 135 CO 0.00 0.46 0.00 0.24 0.02 0.00 0.00 177.57 178.29 2qli h MET 136 N -0.29 0.00 -0.42 1.57 2.86 -1.68 -1.26 114.93 115.71 2qli h MET 136 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2qli h MET 136 Cb 0.86 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.52 2qli h MET 136 CO 0.05 0.00 0.00 1.04 1.06 0.00 0.00 176.91 179.06 2qli n GLN 137 N -2.72 2.49 -3.15 1.72 1.13 -0.24 -4.69 117.38 111.93 2qli n GLN 137 Ca 0.03 -2.29 -0.14 0.00 -1.94 0.00 0.00 57.00 52.65 2qli n GLN 137 Cb 0.37 -1.50 0.07 0.00 0.11 0.00 0.00 30.24 29.29 2qli n GLN 137 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2qli n LYS 138 N 1.44 -3.72 -0.08 -1.09 5.02 -1.00 -4.95 118.16 113.79 2qli n LYS 138 Ca 0.19 0.76 0.07 0.00 -2.02 0.00 0.00 58.31 57.32 2qli n LYS 138 Cb 0.59 -5.41 0.11 0.00 -0.02 0.00 0.00 35.03 30.30 2qli n LYS 138 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2qli n LYS 139 N -3.36 1.89 -2.61 1.97 5.02 -0.40 -5.00 118.16 115.66 2qli n LYS 139 Ca -0.15 -2.30 -0.23 0.00 -2.02 0.00 0.00 58.31 53.62 2qli n LYS 139 Cb 0.63 -1.38 0.04 0.00 -0.02 0.00 0.00 35.03 34.29 2qli n LYS 139 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2qli s THR 140 N -2.33 2.93 -0.29 -0.18 -4.23 -1.25 -2.10 115.64 108.19 2qli s THR 140 Ca 0.24 -0.51 0.20 0.00 -1.18 0.00 0.00 61.69 60.44 2qli s THR 140 Cb 0.21 -3.13 0.48 0.00 1.34 0.00 0.00 72.50 71.39 2qli s THR 140 CO 0.03 -0.10 1.22 0.23 -0.54 0.00 0.00 174.62 175.45 2qli n MET 141 N -2.42 1.58 0.00 3.99 2.81 0.56 -4.72 117.12 118.92 2qli n MET 141 Ca 0.06 -2.86 0.00 0.00 -1.81 0.00 0.00 57.70 53.09 2qli n MET 141 Cb 0.59 -1.02 0.00 0.00 -0.71 0.00 0.00 33.22 32.08 2qli n MET 141 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qli n GLY 142 N -0.80 -0.25 3.76 3.03 0.00 -1.26 -4.63 105.19 105.04 2qli n GLY 142 Ca 0.01 -1.72 -0.37 0.00 0.00 0.00 0.00 46.02 43.93 2qli n GLY 142 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qli s TRP 143 N -2.37 3.57 0.80 1.61 0.52 -1.26 -1.17 118.94 120.63 2qli s TRP 143 Ca 0.00 0.83 -0.12 0.00 0.02 0.00 0.00 56.10 56.83 2qli s TRP 143 Cb 0.00 -2.40 0.08 0.00 -1.15 0.00 0.00 33.47 30.00 2qli s TRP 143 CO 0.00 0.35 1.15 -1.21 0.02 0.00 0.00 176.95 177.26 2qli s GLU 144 N 0.00 1.85 0.52 4.98 0.41 0.10 -4.71 118.70 121.86 2qli s GLU 144 Ca 0.22 1.51 -0.22 0.00 -0.41 0.00 0.00 54.97 56.07 2qli s GLU 144 Cb -0.15 -1.82 -0.07 0.00 -1.78 0.00 0.00 34.13 30.31 2qli s GLU 144 CO 0.09 -2.00 1.20 0.00 -0.49 0.00 0.00 175.26 174.07 2qli n ALA 145 N -3.40 1.02 -2.52 5.21 0.00 -1.26 -4.65 120.51 114.91 2qli n ALA 145 Ca 0.12 0.14 -0.25 0.00 0.00 0.00 0.00 53.44 53.45 2qli n ALA 145 Cb 0.52 -2.24 -0.10 0.00 0.00 0.00 0.00 19.45 17.62 2qli n ALA 145 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qli s SER 146 N -0.88 3.78 -0.24 0.00 0.01 0.99 -4.90 113.70 112.47 2qli s SER 146 Ca 0.69 -1.06 -0.02 0.00 1.31 0.00 0.00 55.95 56.87 2qli s SER 146 Cb -0.45 -0.38 0.07 0.00 0.21 0.00 0.00 66.02 65.47 2qli s SER 146 CO 0.52 -0.09 0.05 -0.55 0.41 0.00 0.00 173.24 173.58 2qli s SER 147 N -3.58 3.35 -0.18 2.44 0.15 -1.26 -0.46 113.70 114.15 2qli s SER 147 Ca 0.32 -1.12 -0.22 0.00 0.70 0.00 0.00 55.95 55.63 2qli s SER 147 Cb -0.02 -0.69 -0.03 0.00 -1.71 0.00 0.00 66.02 63.57 2qli s SER 147 CO 0.16 -0.34 0.66 -0.70 1.20 0.00 0.00 173.24 174.23 2qli s GLU 148 N 1.78 4.26 -0.36 5.44 2.12 0.11 -4.76 118.70 127.29 2qli s GLU 148 Ca 0.03 0.70 -0.27 0.00 0.36 0.00 0.00 54.97 55.79 2qli s GLU 148 Cb -0.17 -3.56 0.02 0.00 0.26 0.00 0.00 34.13 30.68 2qli s GLU 148 CO -0.15 -0.20 0.99 0.50 -0.54 0.00 0.00 175.26 175.86 2qli s ARG 149 N 1.77 3.91 -0.02 4.30 3.52 -0.22 -0.54 118.95 131.67 2qli s ARG 149 Ca 0.31 0.74 -0.03 0.00 -0.13 0.00 0.00 55.73 56.63 2qli s ARG 149 Cb -0.16 -3.79 -0.04 0.00 -1.56 0.00 0.00 34.95 29.40 2qli s ARG 149 CO 0.11 -0.97 0.16 -1.64 -0.81 0.00 0.00 175.30 172.16 2qli s MET 150 N 3.62 3.38 -0.22 5.12 -1.94 0.54 -1.03 119.30 128.77 2qli s MET 150 Ca 0.41 -0.32 -0.28 0.00 -1.71 0.00 0.00 55.69 53.79 2qli s MET 150 Cb -0.12 -3.07 0.13 0.00 2.01 0.00 0.00 34.83 33.78 2qli s MET 150 CO 0.19 0.68 1.06 1.52 -0.01 0.00 0.00 175.02 178.46 2qli s TYR 151 N -1.27 -0.37 0.31 -0.03 -0.85 -0.30 -2.08 117.35 112.76 2qli s TYR 151 Ca 0.25 0.75 -0.27 0.00 -0.52 0.00 0.00 57.07 57.28 2qli s TYR 151 Cb -0.12 0.42 -0.09 0.00 0.38 0.00 0.00 41.96 42.54 2qli s TYR 151 CO 0.16 -0.27 0.98 -1.25 -1.52 0.00 0.00 175.55 173.66 2qli s PRO 152 N -0.57 4.58 -0.25 -3.49 0.04 -1.26 -1.20 135.00 132.85 2qli s PRO 152 Ca 0.01 1.46 -0.18 0.00 0.04 0.00 0.00 61.00 62.33 2qli s PRO 152 Cb -0.02 -2.92 0.07 0.00 0.04 0.00 0.00 34.50 31.67 2qli s PRO 152 CO -0.03 0.25 0.65 -2.00 0.04 0.00 0.00 177.00 175.91 2qli s GLU 153 N -1.85 0.70 -1.84 4.56 2.12 -0.19 -4.92 118.70 117.28 2qli s GLU 153 Ca 0.49 1.05 0.00 0.00 0.36 0.00 0.00 54.97 56.87 2qli s GLU 153 Cb -0.23 0.22 0.00 0.00 0.26 0.00 0.00 34.13 34.38 2qli s GLU 153 CO 0.29 -0.13 0.00 -0.25 -0.54 0.00 0.00 175.26 174.63 2qli n ASP 154 N 3.67 -5.45 0.00 -1.70 10.43 -1.26 -1.27 116.55 120.96 2qli n ASP 154 Ca -0.18 0.20 0.00 0.00 2.57 0.00 0.00 54.79 57.38 2qli n ASP 154 Cb 0.57 -4.66 0.00 0.00 1.84 0.00 0.00 41.12 38.87 2qli n ASP 154 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2qli n GLY 155 N -0.74 0.65 3.32 0.44 0.00 -1.26 -5.02 105.19 102.59 2qli n GLY 155 Ca -0.22 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.62 2qli n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qli s ALA 156 N -2.15 1.90 -0.19 4.61 0.00 -0.40 -4.94 121.76 120.59 2qli s ALA 156 Ca 0.00 -1.77 -0.09 0.00 0.00 0.00 0.00 51.96 50.10 2qli s ALA 156 Cb 0.00 1.17 -0.05 0.00 0.00 0.00 0.00 23.12 24.25 2qli s ALA 156 CO 0.00 -0.52 0.10 -1.17 0.00 0.00 0.00 175.76 174.18 2qli s LEU 157 N -3.36 4.08 0.16 0.00 2.96 -0.51 -1.02 118.68 120.99 2qli s LEU 157 Ca 0.36 0.20 0.09 0.00 -0.22 0.00 0.00 54.13 54.56 2qli s LEU 157 Cb 0.05 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 2qli s LEU 157 CO 0.17 0.20 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.70 2qli s LYS 158 N 0.23 1.84 -0.01 1.98 1.02 -0.34 0.77 119.74 125.23 2qli s LYS 158 Ca 0.07 -1.30 -0.00 0.00 0.02 0.00 0.00 55.97 54.76 2qli s LYS 158 Cb -0.12 -2.07 0.02 0.00 -0.52 0.00 0.00 37.83 35.14 2qli s LYS 158 CO -0.01 0.44 0.03 0.20 -0.92 0.00 0.00 175.35 175.09 2qli s GLY 159 N -2.56 0.04 -0.01 -3.33 0.00 -0.22 -1.15 107.32 100.09 2qli s GLY 159 Ca 0.22 0.19 0.02 0.00 0.00 0.00 0.00 44.72 45.14 2qli s GLY 159 CO 0.12 0.36 -0.07 1.85 0.00 0.00 0.00 173.10 175.36 2qli s GLU 160 N 0.52 0.64 -0.12 2.90 2.12 -0.20 -0.72 118.70 123.84 2qli s GLU 160 Ca -0.04 -0.26 -0.30 0.00 0.36 0.00 0.00 54.97 54.73 2qli s GLU 160 Cb -0.06 -0.62 0.11 0.00 0.26 0.00 0.00 34.13 33.82 2qli s GLU 160 CO -0.02 0.14 0.91 0.00 -0.54 0.00 0.00 175.26 175.76 2qli s MET 161 N -0.08 0.72 -0.30 4.30 0.23 -0.57 -1.06 119.30 122.55 2qli s MET 161 Ca 0.01 0.14 -0.17 0.00 -1.03 0.00 0.00 55.69 54.65 2qli s MET 161 Cb -0.04 0.34 -0.02 0.00 -1.53 0.00 0.00 34.83 33.58 2qli s MET 161 CO -0.00 -0.23 0.46 0.21 -2.03 0.00 0.00 175.02 173.43 2qli s LYS 162 N -1.27 3.86 0.03 3.16 2.20 -1.26 -0.68 119.74 125.78 2qli s LYS 162 Ca -0.04 0.02 -0.04 0.00 -0.36 0.00 0.00 55.97 55.56 2qli s LYS 162 Cb -0.00 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.55 2qli s LYS 162 CO 0.03 -0.45 0.24 -1.64 -0.36 0.00 0.00 175.35 173.17 2qli s MET 163 N 2.26 3.50 -0.19 4.03 -1.94 -0.42 -4.83 119.30 121.71 2qli s MET 163 Ca 0.18 -0.24 -0.01 0.00 -1.71 0.00 0.00 55.69 53.91 2qli s MET 163 Cb -0.16 -3.05 0.05 0.00 2.01 0.00 0.00 34.83 33.68 2qli s MET 163 CO 0.11 0.63 -0.03 1.03 -0.01 0.00 0.00 175.02 176.75 2qli s ARG 164 N -2.07 1.30 -0.14 2.03 0.52 -1.26 -1.20 118.95 118.13 2qli s ARG 164 Ca 0.30 -0.59 -0.22 0.00 -0.52 0.00 0.00 55.73 54.70 2qli s ARG 164 Cb -0.13 -2.14 -0.03 0.00 0.52 0.00 0.00 34.95 33.17 2qli s ARG 164 CO 0.20 -0.51 0.65 -0.51 0.02 0.00 0.00 175.30 175.15 2qli s LEU 165 N 1.63 4.22 0.35 2.53 1.43 -0.42 -0.72 118.68 127.71 2qli s LEU 165 Ca -0.01 0.98 -0.28 0.00 -1.03 0.00 0.00 54.13 53.79 2qli s LEU 165 Cb -0.16 -2.96 -0.10 0.00 0.03 0.00 0.00 46.19 43.00 2qli s LEU 165 CO -0.07 -0.19 1.25 -0.13 0.23 0.00 0.00 176.35 177.44 2qli s ARG 166 N 1.36 4.28 0.05 1.70 0.52 -0.32 0.22 118.95 126.76 2qli s ARG 166 Ca 0.32 2.09 0.02 0.00 -0.52 0.00 0.00 55.73 57.63 2qli s ARG 166 Cb -0.16 -2.97 -0.04 0.00 0.52 0.00 0.00 34.95 32.30 2qli s ARG 166 CO 0.13 -0.20 0.08 -0.51 0.02 0.00 0.00 175.30 174.82 2qli s LEU 167 N -1.96 3.85 0.14 2.53 1.02 -0.81 -0.32 118.68 123.12 2qli s LEU 167 Ca 0.51 0.06 -0.26 0.00 0.02 0.00 0.00 54.13 54.46 2qli s LEU 167 Cb -0.37 -2.42 -0.01 0.00 0.02 0.00 0.00 46.19 43.41 2qli s LEU 167 CO 0.48 0.21 1.60 0.11 0.02 0.00 0.00 176.35 178.77 2qli h LYS 168 N 3.61 -0.37 0.00 1.70 1.79 -1.71 -1.32 116.57 120.27 2qli h LYS 168 Ca -0.48 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 2qli h LYS 168 Cb 1.17 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.90 2qli h LYS 168 CO 0.65 -0.25 0.00 0.38 -1.08 0.00 0.00 179.45 179.15 2qli h ASP 169 N -0.39 0.00 0.00 0.86 2.03 -1.96 -3.46 116.42 113.50 2qli h ASP 169 Ca 0.11 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.41 2qli h ASP 169 Cb 0.56 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.06 2qli h ASP 169 CO -0.41 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.41 2qli n GLY 170 N -0.83 1.24 0.00 7.15 0.00 -0.50 -5.12 105.19 107.13 2qli n GLY 170 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2qli n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qli n GLY 171 N -0.23 5.79 2.92 -0.02 0.00 -1.25 -4.95 105.19 107.45 2qli n GLY 171 Ca 0.00 -1.59 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 2qli n GLY 171 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qli s HIS 172 N 0.90 0.19 -0.22 1.61 4.02 -1.26 -1.93 115.29 118.61 2qli s HIS 172 Ca 0.00 -0.11 -0.01 0.00 1.02 0.00 0.00 55.06 55.96 2qli s HIS 172 Cb 0.00 -0.13 0.02 0.00 -1.02 0.00 0.00 32.58 31.45 2qli s HIS 172 CO 0.00 -0.03 -0.11 -0.47 1.02 0.00 0.00 174.74 175.15 2qli s TYR 173 N -0.28 2.94 0.21 1.40 5.04 0.13 -4.95 117.35 121.84 2qli s TYR 173 Ca -0.02 -1.47 0.05 0.00 -2.44 0.00 0.00 57.07 53.19 2qli s TYR 173 Cb -0.02 -2.01 -0.03 0.00 0.35 0.00 0.00 41.96 40.24 2qli s TYR 173 CO -0.00 -0.72 0.27 -0.51 -1.34 0.00 0.00 175.55 173.25 2qli s ASP 174 N 1.34 6.01 0.00 4.32 1.01 -1.26 -1.30 116.67 126.79 2qli s ASP 174 Ca 0.03 -0.02 0.00 0.00 0.71 0.00 0.00 52.55 53.28 2qli s ASP 174 Cb -0.15 -1.70 -0.00 0.00 1.01 0.00 0.00 42.92 42.08 2qli s ASP 174 CO -0.07 -0.02 -0.01 0.00 0.21 0.00 0.00 175.17 175.28 2qli s ALA 175 N -1.93 0.11 -0.14 5.23 0.00 -0.34 -0.98 121.76 123.70 2qli s ALA 175 Ca 0.33 -0.08 -0.18 0.00 0.00 0.00 0.00 51.96 52.03 2qli s ALA 175 Cb -0.09 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.97 2qli s ALA 175 CO 0.27 0.02 0.48 -1.21 0.00 0.00 0.00 175.76 175.31 2qli s GLU 176 N -0.11 4.29 -0.09 0.00 0.41 0.17 -1.30 118.70 122.07 2qli s GLU 176 Ca -0.00 0.41 0.03 0.00 -0.41 0.00 0.00 54.97 55.00 2qli s GLU 176 Cb -0.01 -3.47 0.01 0.00 -1.78 0.00 0.00 34.13 28.88 2qli s GLU 176 CO -0.00 0.08 -0.17 0.08 -0.49 0.00 0.00 175.26 174.75 2qli s VAL 177 N 0.89 1.59 -0.08 2.63 1.01 0.15 -0.56 120.40 126.03 2qli s VAL 177 Ca 0.25 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.52 2qli s VAL 177 Cb -0.15 -1.41 0.02 0.00 0.00 0.00 0.00 36.38 34.83 2qli s VAL 177 CO 0.10 0.46 -0.11 -0.54 0.00 0.00 0.00 175.10 175.00 2qli s LYS 178 N 0.66 1.69 0.00 2.72 1.02 -0.54 -1.51 119.74 123.78 2qli s LYS 178 Ca -0.13 -0.39 0.03 0.00 0.02 0.00 0.00 55.97 55.50 2qli s LYS 178 Cb -0.16 -1.46 -0.01 0.00 -0.52 0.00 0.00 37.83 35.68 2qli s LYS 178 CO 0.04 -0.04 -0.10 0.99 -0.92 0.00 0.00 175.35 175.32 2qli s THR 179 N 0.88 0.76 -0.12 2.17 2.01 0.10 -1.07 115.64 120.38 2qli s THR 179 Ca -0.10 -0.50 0.01 0.00 0.31 0.00 0.00 61.69 61.41 2qli s THR 179 Cb -0.15 -0.65 -0.01 0.00 0.01 0.00 0.00 72.50 71.69 2qli s THR 179 CO 0.01 0.15 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.05 2qli s THR 180 N -0.35 2.88 -0.19 -0.82 2.01 0.20 -1.05 115.64 118.32 2qli s THR 180 Ca 0.03 -0.73 -0.02 0.00 0.31 0.00 0.00 61.69 61.28 2qli s THR 180 Cb -0.04 -2.19 -0.00 0.00 0.01 0.00 0.00 72.50 70.27 2qli s THR 180 CO -0.00 0.53 -0.11 -0.31 -0.69 0.00 0.00 174.62 174.04 2qli s TYR 181 N 0.31 2.87 -0.26 4.92 1.51 0.23 -1.16 117.35 125.77 2qli s TYR 181 Ca -0.12 -1.07 0.01 0.00 -1.01 0.00 0.00 57.07 54.89 2qli s TYR 181 Cb -0.16 -1.99 0.07 0.00 -0.11 0.00 0.00 41.96 39.76 2qli s TYR 181 CO 0.06 -0.55 -0.04 1.41 -1.11 0.00 0.00 175.55 175.33 2qli s MET 182 N 1.18 1.62 0.53 -0.62 1.75 0.20 -1.42 119.30 122.54 2qli s MET 182 Ca 0.02 -1.18 -0.22 0.00 -1.25 0.00 0.00 55.69 53.06 2qli s MET 182 Cb -0.14 -2.67 -0.05 0.00 2.84 0.00 0.00 34.83 34.80 2qli s MET 182 CO -0.04 -0.67 1.31 0.00 -0.65 0.00 0.00 175.02 174.96 2qli s ALA 183 N 1.30 2.83 -0.14 4.11 0.00 -1.26 -1.53 121.76 127.07 2qli s ALA 183 Ca -0.03 1.22 0.30 0.00 0.00 0.00 0.00 51.96 53.45 2qli s ALA 183 Cb -0.19 -3.52 1.18 0.00 0.00 0.00 0.00 23.12 20.59 2qli s ALA 183 CO -0.08 -1.21 1.87 0.87 0.00 0.00 0.00 175.76 177.22 2qli h LYS 184 N 1.54 0.00 -5.83 0.00 1.57 -1.27 -3.42 116.57 109.15 2qli h LYS 184 Ca -0.51 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 57.78 2qli h LYS 184 Cb 1.29 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.39 2qli h LYS 184 CO 0.58 0.00 -0.80 -1.59 -0.57 0.00 0.00 179.45 177.06 2qli s LYS 185 N -3.51 1.03 -1.54 3.15 -2.85 -1.26 -5.06 119.74 109.69 2qli s LYS 185 Ca 0.03 -1.11 -0.11 0.00 -1.00 0.00 0.00 55.97 53.77 2qli s LYS 185 Cb 0.09 -1.17 -0.06 0.00 -2.06 0.00 0.00 37.83 34.64 2qli s LYS 185 CO 0.50 0.26 2.73 -0.35 0.10 0.00 0.00 175.35 178.60 2qli n PRO 186 N 1.06 3.39 -0.97 1.78 -0.04 -1.26 -4.92 135.00 134.03 2qli n PRO 186 Ca -0.19 -2.26 -0.29 0.00 -0.04 0.00 0.00 63.50 60.71 2qli n PRO 186 Cb 0.54 -2.91 0.18 0.00 -0.04 0.00 0.00 33.50 31.28 2qli n PRO 186 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2qli s VAL 187 N 2.53 2.24 0.00 0.52 -7.23 -1.26 -4.89 120.40 112.31 2qli s VAL 187 Ca 0.63 0.08 -0.30 0.00 -1.81 0.00 0.00 61.98 60.58 2qli s VAL 187 Cb 0.17 -2.41 -0.07 0.00 0.56 0.00 0.00 36.38 34.62 2qli s VAL 187 CO -0.06 -0.10 1.78 -1.58 -0.31 0.00 0.00 175.10 174.83 2qli s GLN 188 N -4.79 4.17 0.41 4.82 0.74 -1.26 -4.97 119.66 118.76 2qli s GLN 188 Ca 0.66 2.39 -0.24 0.00 0.05 0.00 0.00 55.36 58.21 2qli s GLN 188 Cb -0.20 -4.00 -0.09 0.00 1.10 0.00 0.00 33.01 29.82 2qli s GLN 188 CO 0.59 -0.88 1.08 -0.51 -0.55 0.00 0.00 175.29 175.02 2qli s LEU 189 N 4.01 4.13 0.84 3.68 1.43 -1.26 -4.34 118.68 127.17 2qli s LEU 189 Ca 0.80 2.11 -0.11 0.00 -1.03 0.00 0.00 54.13 55.90 2qli s LEU 189 Cb -0.38 -4.17 0.13 0.00 0.03 0.00 0.00 46.19 41.80 2qli s LEU 189 CO 0.35 -0.57 1.17 -2.16 0.23 0.00 0.00 176.35 175.37 2qli s PRO 190 N -2.49 1.40 0.00 1.29 0.04 -1.26 -4.87 135.00 129.11 2qli s PRO 190 Ca 0.58 -0.39 0.00 0.00 0.04 0.00 0.00 61.00 61.23 2qli s PRO 190 Cb -0.24 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2qli s PRO 190 CO 0.30 -1.84 0.00 0.41 0.04 0.00 0.00 177.00 175.91 2qli n GLY 191 N -3.34 0.19 3.76 0.56 0.00 -1.26 -4.31 105.19 100.79 2qli n GLY 191 Ca 0.12 -1.80 -0.40 0.00 0.00 0.00 0.00 46.02 43.94 2qli n GLY 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qli s ALA 192 N -3.25 3.42 0.36 4.61 0.00 -1.26 -4.53 121.76 121.11 2qli s ALA 192 Ca 0.00 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 52.87 2qli s ALA 192 Cb 0.00 -3.38 0.05 0.00 0.00 0.00 0.00 23.12 19.79 2qli s ALA 192 CO 0.00 -0.35 0.70 2.48 0.00 0.00 0.00 175.76 178.58 2qli n TYR 193 N 0.97 -2.16 -4.84 0.00 0.18 -0.89 -4.68 117.16 105.75 2qli n TYR 193 Ca -0.00 -1.78 -0.30 0.00 1.88 0.00 0.00 57.90 57.69 2qli n TYR 193 Cb 0.44 0.81 -0.14 0.00 -0.38 0.00 0.00 39.34 40.07 2qli n TYR 193 CO 0.00 0.00 0.00 0.15 -2.08 0.00 0.00 176.86 174.93 2qli s LYS 194 N -2.17 1.75 -0.21 -3.48 -0.14 0.18 -0.34 119.74 115.32 2qli s LYS 194 Ca 0.16 -1.14 -0.02 0.00 -1.36 0.00 0.00 55.97 53.61 2qli s LYS 194 Cb -0.04 -1.97 0.00 0.00 -1.68 0.00 0.00 37.83 34.14 2qli s LYS 194 CO 0.12 0.50 -0.09 0.99 -0.76 0.00 0.00 175.35 176.12 2qli s THR 195 N -0.84 2.95 -0.09 2.17 2.01 0.30 -0.89 115.64 121.25 2qli s THR 195 Ca 0.12 -0.68 -0.22 0.00 0.31 0.00 0.00 61.69 61.21 2qli s THR 195 Cb -0.10 -2.34 -0.04 0.00 0.01 0.00 0.00 72.50 70.03 2qli s THR 195 CO 0.03 0.43 0.66 -1.81 -0.69 0.00 0.00 174.62 173.23 2qli s ASP 196 N 1.41 6.92 -0.02 3.53 1.01 -0.54 0.08 116.67 129.06 2qli s ASP 196 Ca 0.05 1.11 0.01 0.00 0.71 0.00 0.00 52.55 54.43 2qli s ASP 196 Cb -0.14 -2.39 0.01 0.00 1.01 0.00 0.00 42.92 41.41 2qli s ASP 196 CO -0.06 -0.11 -0.03 -0.63 0.21 0.00 0.00 175.17 174.54 2qli s ILE 197 N 0.87 0.36 -0.05 0.77 1.01 0.39 -1.55 121.20 123.00 2qli s ILE 197 Ca 0.35 -0.10 -0.02 0.00 0.00 0.00 0.00 60.65 60.88 2qli s ILE 197 Cb -0.17 -0.36 0.03 0.00 0.01 0.00 0.00 42.46 41.97 2qli s ILE 197 CO 0.16 0.14 0.08 -0.75 0.00 0.00 0.00 174.94 174.58 2qli s LYS 198 N 0.44 -0.04 -0.16 2.79 2.20 -0.50 -0.01 119.74 124.46 2qli s LYS 198 Ca -0.05 0.38 -0.01 0.00 -0.36 0.00 0.00 55.97 55.93 2qli s LYS 198 Cb -0.08 -0.39 -0.01 0.00 -1.51 0.00 0.00 37.83 35.83 2qli s LYS 198 CO -0.00 -0.29 -0.11 -1.17 -0.36 0.00 0.00 175.35 173.42 2qli s LEU 199 N 1.93 2.77 -0.02 5.43 0.20 -1.26 -1.34 118.68 126.39 2qli s LEU 199 Ca 0.01 -0.34 0.05 0.00 0.69 0.00 0.00 54.13 54.54 2qli s LEU 199 Cb -0.12 -1.65 -0.01 0.00 -0.43 0.00 0.00 46.19 43.98 2qli s LEU 199 CO -0.04 0.11 -0.18 -1.81 -0.29 0.00 0.00 176.35 174.14 2qli s ASP 200 N 0.67 2.21 -0.29 3.68 1.01 0.57 -4.43 116.67 120.08 2qli s ASP 200 Ca -0.06 -0.35 -0.24 0.00 0.71 0.00 0.00 52.55 52.61 2qli s ASP 200 Cb -0.15 -0.37 0.00 0.00 1.01 0.00 0.00 42.92 43.41 2qli s ASP 200 CO 0.02 0.21 0.83 -0.63 0.21 0.00 0.00 175.17 175.81 2qli s ILE 201 N -0.29 4.77 -0.58 0.77 -1.09 -1.26 -0.71 121.20 122.81 2qli s ILE 201 Ca 0.04 1.34 0.19 0.00 -2.23 0.00 0.00 60.65 59.99 2qli s ILE 201 Cb -0.09 -4.17 -0.24 0.00 -1.58 0.00 0.00 42.46 36.38 2qli s ILE 201 CO 0.00 -0.23 0.67 0.35 -1.23 0.00 0.00 174.94 174.51 2qli n THR 202 N 5.50 0.00 -3.59 2.92 -2.24 -0.51 -4.96 114.28 111.40 2qli n THR 202 Ca 0.05 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 2qli n THR 202 Cb 0.48 0.66 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 2qli n THR 202 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2qli s SER 203 N -3.33 -0.54 0.04 3.42 0.15 -1.22 -4.98 113.70 107.25 2qli s SER 203 Ca 0.02 0.80 -0.27 0.00 0.70 0.00 0.00 55.95 57.19 2qli s SER 203 Cb 0.14 0.73 0.07 0.00 -1.71 0.00 0.00 66.02 65.25 2qli s SER 203 CO 0.79 -0.35 0.66 -1.38 1.20 0.00 0.00 173.24 174.17 2qli s HIS 204 N -0.52 -0.59 0.76 3.44 -0.00 -1.26 -0.69 115.29 116.43 2qli s HIS 204 Ca -0.03 0.73 -0.09 0.00 -0.00 0.00 0.00 55.06 55.67 2qli s HIS 204 Cb -0.02 0.48 0.17 0.00 -0.00 0.00 0.00 32.58 33.21 2qli s HIS 204 CO 0.02 -0.70 1.04 0.27 -0.00 0.00 0.00 174.74 175.36 2qli n ASN 205 N 0.30 0.45 -0.21 7.38 6.94 -0.56 -4.96 115.26 124.60 2qli n ASN 205 Ca -0.17 -1.60 -0.06 0.00 -0.02 0.00 0.00 54.58 52.72 2qli n ASN 205 Cb 0.61 -0.76 0.03 0.00 -2.36 0.00 0.00 39.78 37.30 2qli n ASN 205 CO 0.00 0.00 0.00 -0.08 -1.03 0.00 0.00 177.26 176.15 2qli h GLU 206 N 0.00 0.78 -0.63 -3.83 4.81 -2.02 -2.60 114.58 111.09 2qli h GLU 206 Ca -0.34 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2qli h GLU 206 Cb 1.02 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.23 2qli h GLU 206 CO 0.27 0.53 0.00 -0.40 -0.73 0.00 0.00 179.01 178.68 2qli n ASP 207 N -4.66 3.73 -1.36 1.04 3.85 -1.26 -4.93 116.55 112.96 2qli n ASP 207 Ca 0.04 -1.99 -0.11 0.00 -0.71 0.00 0.00 54.79 52.02 2qli n ASP 207 Cb 0.03 -0.42 0.00 0.00 -1.35 0.00 0.00 41.12 39.38 2qli n ASP 207 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 2qli n TYR 208 N 1.46 -0.68 0.95 2.11 4.02 -0.98 -4.48 117.16 119.56 2qli n TYR 208 Ca 0.22 0.10 0.13 0.00 -0.01 0.00 0.00 57.90 58.34 2qli n TYR 208 Cb 0.59 -2.59 0.37 0.00 -0.02 0.00 0.00 39.34 37.69 2qli n TYR 208 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2qli n THR 209 N -3.96 0.05 -3.82 -0.72 -2.24 -1.26 -4.72 114.28 97.62 2qli n THR 209 Ca -0.10 -0.03 -0.22 0.00 -2.27 0.00 0.00 64.05 61.43 2qli n THR 209 Cb 0.58 -0.05 -0.17 0.00 -2.10 0.00 0.00 70.33 68.59 2qli n THR 209 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2qli s ILE 210 N -3.02 0.35 -0.02 2.28 1.01 -1.26 -1.08 121.20 119.46 2qli s ILE 210 Ca 0.11 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.84 2qli s ILE 210 Cb 0.17 -0.50 0.00 0.00 0.01 0.00 0.00 42.46 42.15 2qli s ILE 210 CO 0.64 0.24 0.08 -0.69 0.00 0.00 0.00 174.94 175.22 2qli s VAL 211 N 1.81 0.04 0.08 2.92 1.01 -0.28 -1.49 120.40 124.49 2qli s VAL 211 Ca 0.02 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.75 2qli s VAL 211 Cb -0.13 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 2qli s VAL 211 CO -0.04 -0.19 -0.23 -1.61 0.00 0.00 0.00 175.10 173.03 2qli s GLU 212 N -0.58 1.35 0.05 2.72 2.02 0.14 -0.40 118.70 123.99 2qli s GLU 212 Ca -0.07 -1.14 -0.07 0.00 0.02 0.00 0.00 54.97 53.72 2qli s GLU 212 Cb -0.04 -1.61 -0.01 0.00 0.10 0.00 0.00 34.13 32.57 2qli s GLU 212 CO 0.00 0.39 0.14 1.14 0.02 0.00 0.00 175.26 176.95 2qli s GLN 213 N -1.65 0.69 -0.02 1.61 -2.07 -0.28 -1.42 119.66 116.51 2qli s GLN 213 Ca 0.09 -0.81 0.04 0.00 -1.82 0.00 0.00 55.36 52.86 2qli s GLN 213 Cb -0.10 0.27 -0.01 0.00 -1.09 0.00 0.00 33.01 32.09 2qli s GLN 213 CO 0.04 -0.19 -0.15 -0.47 -1.32 0.00 0.00 175.29 173.20 2qli s TYR 214 N -3.03 1.38 0.00 9.60 5.04 0.11 -0.81 117.35 129.64 2qli s TYR 214 Ca -0.01 -0.30 0.02 0.00 -2.44 0.00 0.00 57.07 54.34 2qli s TYR 214 Cb 0.01 -0.91 -0.01 0.00 0.35 0.00 0.00 41.96 41.41 2qli s TYR 214 CO -0.06 -0.06 -0.07 -2.00 -1.34 0.00 0.00 175.55 172.02 2qli s GLU 215 N -0.21 0.53 -0.07 4.97 2.12 -0.37 -0.32 118.70 125.35 2qli s GLU 215 Ca 0.03 -0.31 0.05 0.00 0.36 0.00 0.00 54.97 55.10 2qli s GLU 215 Cb -0.07 -0.49 -0.01 0.00 0.26 0.00 0.00 34.13 33.82 2qli s GLU 215 CO 0.00 0.13 -0.23 0.50 -0.54 0.00 0.00 175.26 175.12 2qli s ARG 216 N -0.35 2.74 -0.05 4.30 3.52 -0.45 -1.95 118.95 126.71 2qli s ARG 216 Ca 0.01 -0.87 -0.03 0.00 -0.13 0.00 0.00 55.73 54.71 2qli s ARG 216 Cb -0.04 -2.25 0.02 0.00 -1.56 0.00 0.00 34.95 31.13 2qli s ARG 216 CO -0.00 0.34 0.12 0.00 -0.81 0.00 0.00 175.30 174.94 2qli s ALA 217 N -0.04 -0.24 -0.10 6.12 0.00 0.14 -1.41 121.76 126.24 2qli s ALA 217 Ca -0.07 0.46 -0.04 0.00 0.00 0.00 0.00 51.96 52.31 2qli s ALA 217 Cb -0.15 -0.29 0.05 0.00 0.00 0.00 0.00 23.12 22.73 2qli s ALA 217 CO 0.05 -0.10 0.21 -2.00 0.00 0.00 0.00 175.76 173.92 2qli s GLU 218 N 0.57 0.15 0.22 0.00 2.12 -0.59 -1.48 118.70 119.68 2qli s GLU 218 Ca -0.04 0.52 -0.13 0.00 0.36 0.00 0.00 54.97 55.67 2qli s GLU 218 Cb -0.06 -0.14 -0.08 0.00 0.26 0.00 0.00 34.13 34.11 2qli s GLU 218 CO -0.03 -0.19 0.61 0.20 -0.54 0.00 0.00 175.26 175.31 2qli s GLY 219 N 1.47 2.39 0.14 -1.50 0.00 0.75 -1.47 107.32 109.11 2qli s GLY 219 Ca -0.07 -0.11 -0.16 0.00 0.00 0.00 0.00 44.72 44.38 2qli s GLY 219 CO -0.08 0.12 0.42 1.09 0.00 0.00 0.00 173.10 174.66 2qli s ARG 220 N -2.47 1.12 0.82 2.90 1.70 -0.07 -4.29 118.95 118.65 2qli s ARG 220 Ca 0.45 -0.72 -0.14 0.00 -0.47 0.00 0.00 55.73 54.85 2qli s ARG 220 Cb -0.13 0.48 0.06 0.00 -0.57 0.00 0.00 34.95 34.79 2qli s ARG 220 CO 0.20 -0.45 1.00 0.72 -1.08 0.00 0.00 175.30 175.69 2qli n HIS 221 N -0.25 0.61 -2.21 5.89 8.25 -1.26 -0.65 115.22 125.60 2qli n HIS 221 Ca -0.15 0.38 -0.40 0.00 -0.26 0.00 0.00 57.72 57.28 2qli n HIS 221 Cb 0.64 -2.03 0.00 0.00 1.12 0.00 0.00 29.99 29.72 2qli n HIS 221 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2qli n SER 222 N -2.62 7.80 -0.58 0.41 7.64 -1.26 -4.56 113.62 120.45 2qli n SER 222 Ca 0.12 -3.32 0.07 0.00 1.01 0.00 0.00 58.87 56.75 2qli n SER 222 Cb 0.51 -1.30 0.06 0.00 -1.01 0.00 0.00 64.21 62.47 2qli n SER 222 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44