#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qql n VAL 2 N 0.00 0.73 -3.99 3.84 0.31 -1.26 -3.83 118.33 114.13 2qql n VAL 2 Ca 0.00 -0.18 -0.09 0.00 -0.01 0.00 0.00 64.34 64.06 2qql n VAL 2 Cb 0.00 -2.36 -0.11 0.00 -0.91 0.00 0.00 33.84 30.47 2qql n VAL 2 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2qql s GLN 3 N 4.71 0.41 -0.04 5.55 -0.21 0.20 -5.00 119.66 125.28 2qql s GLN 3 Ca 0.90 -0.72 0.03 0.00 0.02 0.00 0.00 55.36 55.60 2qql s GLN 3 Cb -0.42 0.15 0.00 0.00 1.00 0.00 0.00 33.01 33.74 2qql s GLN 3 CO 0.41 -0.08 -0.12 -0.51 -2.12 0.00 0.00 175.29 172.88 2qql s LEU 4 N -1.78 1.79 -0.21 2.90 1.43 -1.26 -1.41 118.68 120.14 2qql s LEU 4 Ca -0.11 -0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 52.73 2qql s LEU 4 Cb -0.06 -0.70 0.06 0.00 0.03 0.00 0.00 46.19 45.52 2qql s LEU 4 CO -0.03 0.08 0.03 0.68 0.23 0.00 0.00 176.35 177.34 2qql s VAL 5 N 0.23 0.73 0.63 -1.59 -7.23 -1.12 -3.98 120.40 108.07 2qql s VAL 5 Ca -0.05 -0.76 -0.14 0.00 -1.81 0.00 0.00 61.98 59.23 2qql s VAL 5 Cb -0.10 -1.23 -0.02 0.00 0.56 0.00 0.00 36.38 35.59 2qql s VAL 5 CO 0.01 -0.24 1.05 -1.61 -0.31 0.00 0.00 175.10 174.01 2qql s GLU 6 N 1.75 3.21 0.31 4.82 8.01 -1.25 -2.11 118.70 133.43 2qql s GLU 6 Ca -0.01 1.07 -0.05 0.00 0.01 0.00 0.00 54.97 55.99 2qql s GLU 6 Cb -0.17 -2.02 0.02 0.00 -4.31 0.00 0.00 34.13 27.64 2qql s GLU 6 CO -0.09 -0.89 0.50 -1.13 0.01 0.00 0.00 175.26 173.65 2qql n SER 7 N -2.49 -1.41 -0.11 -0.19 3.41 -0.30 -4.89 113.62 107.65 2qql n SER 7 Ca 0.08 -2.49 -0.01 0.00 -0.26 0.00 0.00 58.87 56.18 2qql n SER 7 Cb 0.53 2.50 -0.01 0.00 -0.26 0.00 0.00 64.21 66.97 2qql n SER 7 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qql n GLY 8 N -0.47 0.48 3.93 5.00 0.00 -1.26 -2.64 105.19 110.23 2qql n GLY 8 Ca -0.02 -0.21 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 2qql n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qql s GLY 9 N -2.24 1.47 0.00 -0.02 0.00 -1.26 -4.39 107.32 100.87 2qql s GLY 9 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 43.99 2qql s GLY 9 CO 0.00 -0.59 0.00 0.61 0.00 0.00 0.00 173.10 173.12 2qql n GLY 10 N -2.12 -0.91 3.77 0.20 0.00 -0.73 -4.86 105.19 100.54 2qql n GLY 10 Ca -0.01 -1.04 -0.39 0.00 0.00 0.00 0.00 46.02 44.59 2qql n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qql s LEU 11 N 0.00 4.17 -0.22 0.99 0.20 -1.25 -1.19 118.68 121.38 2qql s LEU 11 Ca 0.00 2.51 -0.22 0.00 0.69 0.00 0.00 54.13 57.12 2qql s LEU 11 Cb 0.00 -3.99 0.06 0.00 -0.43 0.00 0.00 46.19 41.82 2qql s LEU 11 CO 0.00 -0.83 0.61 0.54 -0.29 0.00 0.00 176.35 176.38 2qql s VAL 12 N -1.34 0.00 0.35 1.68 0.11 -0.32 -4.92 120.40 115.96 2qql s VAL 12 Ca 0.58 -0.01 -0.29 0.00 -2.93 0.00 0.00 61.98 59.34 2qql s VAL 12 Cb -0.35 -0.86 -0.11 0.00 -1.53 0.00 0.00 36.38 33.54 2qql s VAL 12 CO 0.44 -0.01 1.48 -1.10 -3.33 0.00 0.00 175.10 172.58 2qql s GLN 13 N 0.20 4.15 0.42 1.54 -1.52 -1.26 -2.26 119.66 120.93 2qql s GLN 13 Ca -0.01 2.51 -0.25 0.00 -1.95 0.00 0.00 55.36 55.66 2qql s GLN 13 Cb -0.04 -3.00 -0.10 0.00 -0.22 0.00 0.00 33.01 29.65 2qql s GLN 13 CO 0.01 -0.49 1.10 -2.30 -0.25 0.00 0.00 175.29 173.36 2qql n PRO 14 N 0.89 1.54 0.00 2.91 -0.02 -1.26 -0.78 135.00 138.27 2qql n PRO 14 Ca 0.02 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2qql n PRO 14 Cb 0.39 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2qql n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qql n GLY 15 N 1.06 2.88 3.47 -1.23 0.00 -0.50 -4.92 105.19 105.95 2qql n GLY 15 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2qql n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qql n GLY 16 N -1.40 -2.72 3.38 -0.02 0.00 0.04 -3.64 105.19 100.82 2qql n GLY 16 Ca 0.00 -1.50 -0.23 0.00 0.00 0.00 0.00 46.02 44.29 2qql n GLY 16 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qql s SER 17 N -4.47 2.98 -0.04 1.61 0.15 -1.26 -2.34 113.70 110.33 2qql s SER 17 Ca 0.70 -0.92 -0.29 0.00 0.70 0.00 0.00 55.95 56.14 2qql s SER 17 Cb -0.07 -0.20 0.09 0.00 -1.71 0.00 0.00 66.02 64.14 2qql s SER 17 CO 0.54 -0.01 0.79 -0.22 1.20 0.00 0.00 173.24 175.54 2qql s LEU 18 N -2.92 -0.52 -0.28 3.45 2.96 -0.48 -4.99 118.68 115.91 2qql s LEU 18 Ca 0.20 0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 54.50 2qql s LEU 18 Cb -0.05 2.28 0.09 0.00 0.50 0.00 0.00 46.19 49.01 2qql s LEU 18 CO 0.09 -0.59 0.09 -0.60 -1.32 0.00 0.00 176.35 174.01 2qql s ARG 19 N -1.87 0.63 0.47 1.98 3.52 -1.26 -0.65 118.95 121.76 2qql s ARG 19 Ca -0.04 -0.85 -0.20 0.00 -0.13 0.00 0.00 55.73 54.51 2qql s ARG 19 Cb -0.00 -1.88 -0.09 0.00 -1.56 0.00 0.00 34.95 31.41 2qql s ARG 19 CO 0.01 -0.92 0.99 -0.51 -0.81 0.00 0.00 175.30 174.07 2qql s LEU 20 N 1.74 3.84 -0.11 -0.88 1.43 -0.85 -4.66 118.68 119.20 2qql s LEU 20 Ca 0.07 1.77 0.01 0.00 -1.03 0.00 0.00 54.13 54.96 2qql s LEU 20 Cb -0.17 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.52 2qql s LEU 20 CO -0.24 -0.59 -0.14 -0.44 0.23 0.00 0.00 176.35 175.18 2qql s SER 21 N -2.24 2.40 -0.25 2.29 0.01 -1.08 -1.62 113.70 113.21 2qql s SER 21 Ca 0.64 -0.42 -0.07 0.00 1.31 0.00 0.00 55.95 57.41 2qql s SER 21 Cb -0.12 -1.06 -0.03 0.00 0.21 0.00 0.00 66.02 65.02 2qql s SER 21 CO 0.19 -0.00 0.06 0.00 0.41 0.00 0.00 173.24 173.90 2qql s ALA 23 N 1.60 2.68 -0.01 0.00 0.00 -0.90 -0.70 121.76 124.45 2qql s ALA 23 Ca 0.06 -2.01 -0.27 0.00 0.00 0.00 0.00 51.96 49.74 2qql s ALA 23 Cb -0.15 -1.73 -0.04 0.00 0.00 0.00 0.00 23.12 21.20 2qql s ALA 23 CO 0.03 -1.36 0.84 0.00 0.00 0.00 0.00 175.76 175.27 2qql s ALA 24 N 1.05 3.27 0.03 0.00 0.00 -0.85 -2.78 121.76 122.48 2qql s ALA 24 Ca -0.03 0.35 0.08 0.00 0.00 0.00 0.00 51.96 52.36 2qql s ALA 24 Cb -0.20 -3.13 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 2qql s ALA 24 CO -0.06 -0.12 -0.22 -1.12 0.00 0.00 0.00 175.76 174.24 2qql s SER 25 N 0.68 2.63 0.00 0.00 0.01 -0.50 -4.79 113.70 111.73 2qql s SER 25 Ca 0.44 -0.52 0.00 0.00 1.31 0.00 0.00 55.95 57.18 2qql s SER 25 Cb -0.20 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 65.80 2qql s SER 25 CO 0.24 0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.69 2qql n GLY 26 N 1.94 2.40 3.41 3.44 0.00 -1.25 -0.62 105.19 114.51 2qql n GLY 26 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 2qql n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qql s PHE 27 N -2.59 -0.42 -0.12 1.61 -0.71 -1.26 -4.64 117.98 109.85 2qql s PHE 27 Ca 0.00 0.17 -0.22 0.00 -1.04 0.00 0.00 56.93 55.83 2qql s PHE 27 Cb 0.00 0.47 -0.03 0.00 -1.21 0.00 0.00 43.02 42.25 2qql s PHE 27 CO 0.00 -0.82 0.67 0.95 -1.34 0.00 0.00 175.22 174.68 2qql s THR 28 N -3.77 5.04 0.16 -4.49 -4.23 -1.26 -4.95 115.64 102.14 2qql s THR 28 Ca 0.02 1.34 -0.04 0.00 -1.18 0.00 0.00 61.69 61.83 2qql s THR 28 Cb -0.00 -4.00 -0.10 0.00 1.34 0.00 0.00 72.50 69.74 2qql s THR 28 CO -0.12 0.20 1.43 0.16 -0.54 0.00 0.00 174.62 175.75 2qql h ILE 29 N 4.91 1.34 -3.07 2.99 3.07 -1.93 -3.42 117.51 121.39 2qql h ILE 29 Ca -0.37 -1.99 -0.58 0.00 1.55 0.00 0.00 64.86 63.47 2qql h ILE 29 Cb 1.17 1.97 0.17 0.00 -0.27 0.00 0.00 36.82 39.86 2qql h ILE 29 CO 0.77 0.61 -0.33 -1.54 -1.05 0.00 0.00 178.15 176.61 2qql n SER 30 N -3.90 -0.84 -1.21 2.16 3.41 -1.26 -0.82 113.62 111.16 2qql n SER 30 Ca -0.05 0.73 -0.15 0.00 -0.26 0.00 0.00 58.87 59.14 2qql n SER 30 Cb 0.68 -1.20 -0.06 0.00 -0.26 0.00 0.00 64.21 63.37 2qql n SER 30 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qql n GLY 31 N 1.71 1.34 3.46 5.00 0.00 -1.26 -4.91 105.19 110.52 2qql n GLY 31 Ca 0.12 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 2qql n GLY 31 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qql s TYR 32 N -2.58 1.77 -0.21 1.61 1.51 -0.00 -4.84 117.35 114.60 2qql s TYR 32 Ca 0.00 -1.29 -0.07 0.00 -1.01 0.00 0.00 57.07 54.70 2qql s TYR 32 Cb 0.00 -1.09 -0.03 0.00 -0.11 0.00 0.00 41.96 40.73 2qql s TYR 32 CO 0.00 -0.34 0.06 0.20 -1.11 0.00 0.00 175.55 174.36 2qql s GLY 33 N -3.54 1.82 -0.31 0.71 0.00 0.37 -4.12 107.32 102.25 2qql s GLY 33 Ca 0.28 -0.94 -0.07 0.00 0.00 0.00 0.00 44.72 43.99 2qql s GLY 33 CO 0.16 0.28 0.09 -0.42 0.00 0.00 0.00 173.10 173.21 2qql s ILE 34 N 0.98 3.94 0.09 0.90 -1.09 -0.03 0.37 121.20 126.36 2qql s ILE 34 Ca 0.04 -0.83 0.03 0.00 -2.23 0.00 0.00 60.65 57.66 2qql s ILE 34 Cb -0.14 -3.10 -0.04 0.00 -1.58 0.00 0.00 42.46 37.60 2qql s ILE 34 CO 0.03 -0.01 0.10 -1.00 -1.23 0.00 0.00 174.94 172.83 2qql s HIS 35 N 1.47 3.23 -0.17 3.97 3.76 -0.12 -1.34 115.29 126.09 2qql s HIS 35 Ca 0.01 0.09 -0.03 0.00 -0.15 0.00 0.00 55.06 54.98 2qql s HIS 35 Cb -0.18 -1.62 -0.02 0.00 1.11 0.00 0.00 32.58 31.87 2qql s HIS 35 CO 0.03 0.53 -0.06 -1.58 -0.85 0.00 0.00 174.74 172.81 2qql s TRP 36 N -1.45 2.96 -0.08 1.40 0.52 -0.05 -0.84 118.94 121.41 2qql s TRP 36 Ca 0.30 -0.53 0.03 0.00 0.02 0.00 0.00 56.10 55.92 2qql s TRP 36 Cb -0.12 -1.98 0.00 0.00 -1.15 0.00 0.00 33.47 30.23 2qql s TRP 36 CO 0.23 -0.21 -0.18 0.08 0.02 0.00 0.00 176.95 176.89 2qql s VAL 37 N 0.67 1.59 0.22 4.03 1.01 -0.14 -1.38 120.40 126.41 2qql s VAL 37 Ca -0.03 -0.76 0.09 0.00 0.00 0.00 0.00 61.98 61.29 2qql s VAL 37 Cb -0.15 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2qql s VAL 37 CO 0.02 0.46 -0.07 0.00 0.00 0.00 0.00 175.10 175.51 2qql s ARG 38 N 0.40 2.13 -0.23 2.72 1.70 0.84 -0.60 118.95 125.92 2qql s ARG 38 Ca -0.14 -1.37 -0.04 0.00 -0.47 0.00 0.00 55.73 53.71 2qql s ARG 38 Cb -0.16 -2.13 0.08 0.00 -0.57 0.00 0.00 34.95 32.17 2qql s ARG 38 CO 0.06 0.40 0.09 -1.14 -1.08 0.00 0.00 175.30 173.62 2qql s GLN 39 N -3.23 0.29 0.26 3.89 0.74 -0.17 0.73 119.66 122.18 2qql s GLN 39 Ca 0.28 -0.39 -0.29 0.00 0.05 0.00 0.00 55.36 55.00 2qql s GLN 39 Cb -0.07 -1.70 -0.09 0.00 1.10 0.00 0.00 33.01 32.24 2qql s GLN 39 CO 0.17 -0.80 1.23 0.00 -0.55 0.00 0.00 175.29 175.34 2qql s ALA 40 N 2.01 3.47 -0.33 1.58 0.00 -1.26 -1.97 121.76 125.27 2qql s ALA 40 Ca 0.04 1.08 -0.30 0.00 0.00 0.00 0.00 51.96 52.78 2qql s ALA 40 Cb -0.16 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.40 2qql s ALA 40 CO -0.19 -0.44 1.22 -2.30 0.00 0.00 0.00 175.76 174.05 2qql n PRO 41 N 1.64 0.00 -1.62 0.00 -0.02 -1.26 0.92 135.00 134.66 2qql n PRO 41 Ca 0.02 0.00 -0.18 0.00 -2.02 0.00 0.00 63.50 61.32 2qql n PRO 41 Cb 0.43 -0.98 -0.07 0.00 -0.02 0.00 0.00 33.50 32.87 2qql n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qql n GLY 42 N 3.79 1.47 3.79 -1.23 0.00 -1.26 -4.99 105.19 106.76 2qql n GLY 42 Ca 0.28 -0.17 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2qql n GLY 42 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qql s LYS 43 N -3.67 2.24 0.99 1.61 1.02 0.26 -5.15 119.74 117.04 2qql s LYS 43 Ca 0.00 -2.46 -0.16 0.00 0.02 0.00 0.00 55.97 53.38 2qql s LYS 43 Cb 0.00 -1.51 0.20 0.00 -0.52 0.00 0.00 37.83 36.00 2qql s LYS 43 CO 0.00 -0.42 1.25 0.20 -0.92 0.00 0.00 175.35 175.46 2qql s GLY 44 N -3.91 1.70 -0.09 -3.33 0.00 -1.26 -4.52 107.32 95.91 2qql s GLY 44 Ca 0.00 -1.02 -0.26 0.00 0.00 0.00 0.00 44.72 43.44 2qql s GLY 44 CO 0.00 -0.28 0.81 1.08 0.00 0.00 0.00 173.10 174.71 2qql s LEU 45 N -6.09 4.28 -0.19 0.66 1.43 -1.26 -4.23 118.68 113.27 2qql s LEU 45 Ca 0.71 1.29 -0.04 0.00 -1.03 0.00 0.00 54.13 55.06 2qql s LEU 45 Cb -0.07 -3.25 -0.02 0.00 0.03 0.00 0.00 46.19 42.88 2qql s LEU 45 CO 0.53 -0.25 -0.03 -0.70 0.23 0.00 0.00 176.35 176.13 2qql s GLU 46 N 1.34 3.54 0.16 1.70 2.12 0.22 -4.96 118.70 122.82 2qql s GLU 46 Ca 0.41 -0.56 -0.30 0.00 0.36 0.00 0.00 54.97 54.88 2qql s GLU 46 Cb -0.18 -2.98 -0.07 0.00 0.26 0.00 0.00 34.13 31.15 2qql s GLU 46 CO 0.18 0.02 1.09 -0.46 -0.54 0.00 0.00 175.26 175.56 2qql s TRP 47 N 0.94 3.60 -0.01 5.30 -0.00 -1.26 -0.11 118.94 127.39 2qql s TRP 47 Ca 0.00 1.60 0.00 0.00 -0.00 0.00 0.00 56.10 57.70 2qql s TRP 47 Cb -0.15 -3.26 -0.01 0.00 -0.00 0.00 0.00 33.47 30.05 2qql s TRP 47 CO 0.01 -0.57 -0.01 0.28 -0.00 0.00 0.00 176.95 176.66 2qql n VAL 48 N 2.56 0.08 -3.67 5.86 0.31 -0.48 -4.63 118.33 118.37 2qql n VAL 48 Ca 0.03 -0.03 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 2qql n VAL 48 Cb 0.47 -0.57 -0.01 0.00 -0.91 0.00 0.00 33.84 32.81 2qql n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qql s ALA 49 N -2.03 -1.97 0.23 3.52 0.00 -1.12 -1.45 121.76 118.93 2qql s ALA 49 Ca -0.02 0.54 -0.18 0.00 0.00 0.00 0.00 51.96 52.31 2qql s ALA 49 Cb 0.00 0.44 0.02 0.00 0.00 0.00 0.00 23.12 23.59 2qql s ALA 49 CO 0.03 -1.00 0.57 1.52 0.00 0.00 0.00 175.76 176.88 2qql s TYR 50 N -2.80 -0.07 -0.02 0.00 -0.85 -1.05 -0.87 117.35 111.69 2qql s TYR 50 Ca 0.13 -0.30 -0.10 0.00 -0.52 0.00 0.00 57.07 56.27 2qql s TYR 50 Cb 0.02 0.44 0.01 0.00 0.38 0.00 0.00 41.96 42.81 2qql s TYR 50 CO -0.02 -1.01 0.21 -1.50 -1.52 0.00 0.00 175.55 171.71 2qql s ILE 51 N -3.91 0.06 -0.45 -3.49 2.07 -0.45 -3.06 121.20 111.98 2qql s ILE 51 Ca 0.12 -0.49 0.02 0.00 -1.41 0.00 0.00 60.65 58.89 2qql s ILE 51 Cb -0.02 -0.47 0.13 0.00 0.13 0.00 0.00 42.46 42.23 2qql s ILE 51 CO 0.01 -0.27 0.24 -0.31 -1.91 0.00 0.00 174.94 172.70 2qql s TYR 52 N -1.08 2.20 0.35 3.50 1.51 -0.49 -0.85 117.35 122.49 2qql s TYR 52 Ca -0.12 -2.55 0.03 0.00 -1.01 0.00 0.00 57.07 53.43 2qql s TYR 52 Cb -0.06 -2.06 0.63 0.00 -0.11 0.00 0.00 41.96 40.36 2qql s TYR 52 CO 0.02 -0.78 1.97 -1.35 -1.11 0.00 0.00 175.55 174.30 2qql h PRO 52 N 6.74 0.74 0.00 -1.71 0.11 -1.85 -0.48 132.00 135.56 2qql h PRO 52 Ca -0.03 -0.08 0.03 0.00 0.11 0.00 0.00 66.00 66.04 2qql h PRO 52 Cb 0.92 -0.15 -0.05 0.00 0.11 0.00 0.00 31.00 31.83 2qql h PRO 52 CO 0.52 0.55 -0.34 -0.44 -0.21 0.00 0.00 178.00 178.09 2qql h ASP 53 N 0.75 -1.01 -0.17 -2.05 3.32 -1.90 -3.13 116.42 112.23 2qql h ASP 53 Ca 0.19 0.13 -0.12 0.00 0.02 0.00 0.00 57.03 57.25 2qql h ASP 53 Cb 0.03 0.40 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2qql h ASP 53 CO -0.03 -0.40 -0.38 0.77 -1.72 0.00 0.00 179.24 177.48 2qql h SER 54 N -0.49 0.62 0.00 6.45 4.64 -1.92 -3.48 113.55 119.37 2qql h SER 54 Ca 0.06 -0.56 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2qql h SER 54 Cb 0.58 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2qql h SER 54 CO -0.27 1.07 0.00 0.61 -0.87 0.00 0.00 176.83 177.37 2qql n GLY 55 N 0.45 0.79 3.65 -0.77 0.00 -0.22 -5.06 105.19 104.05 2qql n GLY 55 Ca -0.06 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.43 2qql n GLY 55 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2qql n TYR 56 N -1.61 1.89 -4.24 1.61 9.36 -1.24 -4.74 117.16 118.19 2qql n TYR 56 Ca 0.00 0.48 -0.14 0.00 3.32 0.00 0.00 57.90 61.57 2qql n TYR 56 Cb 0.00 -2.44 -0.10 0.00 -0.63 0.00 0.00 39.34 36.17 2qql n TYR 56 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 2qql s THR 57 N 2.05 0.81 0.14 2.97 -4.23 -1.26 -1.39 115.64 114.72 2qql s THR 57 Ca 0.90 -1.99 -0.25 0.00 -1.18 0.00 0.00 61.69 59.16 2qql s THR 57 Cb -0.93 -2.03 0.07 0.00 1.34 0.00 0.00 72.50 70.94 2qql s THR 57 CO 0.53 -0.57 0.92 -0.62 -0.54 0.00 0.00 174.62 174.34 2qql s ASP 58 N -3.17 -0.22 -0.04 3.99 -1.08 -1.17 -5.00 116.67 109.98 2qql s ASP 58 Ca 0.21 -0.35 -0.12 0.00 -0.52 0.00 0.00 52.55 51.77 2qql s ASP 58 Cb 0.05 0.50 0.02 0.00 -1.46 0.00 0.00 42.92 42.03 2qql s ASP 58 CO 0.03 -0.90 0.27 -0.31 0.52 0.00 0.00 175.17 174.78 2qql s TYR 59 N -3.33 -0.17 0.34 -5.34 1.51 -1.26 -2.54 117.35 106.56 2qql s TYR 59 Ca 0.11 0.32 -0.27 0.00 -1.01 0.00 0.00 57.07 56.21 2qql s TYR 59 Cb -0.02 0.07 -0.09 0.00 -0.11 0.00 0.00 41.96 41.81 2qql s TYR 59 CO 0.01 -0.31 1.16 0.00 -1.11 0.00 0.00 175.55 175.29 2qql s ALA 60 N -0.95 3.32 0.42 3.71 0.00 -0.53 -4.76 121.76 122.96 2qql s ALA 60 Ca -0.10 0.97 0.16 0.00 0.00 0.00 0.00 51.96 52.98 2qql s ALA 60 Cb -0.05 -3.37 1.04 0.00 0.00 0.00 0.00 23.12 20.75 2qql s ALA 60 CO 0.03 -0.37 1.90 -0.44 0.00 0.00 0.00 175.76 176.88 2qql h ASP 61 N 3.24 0.41 0.00 0.00 5.19 -1.94 0.14 116.42 123.47 2qql h ASP 61 Ca -0.48 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 55.96 2qql h ASP 61 Cb 1.22 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.68 2qql h ASP 61 CO 0.65 0.20 0.09 0.77 -3.12 0.00 0.00 179.24 177.83 2qql h SER 62 N 0.43 0.00 0.00 6.45 4.64 -1.95 -3.10 113.55 120.01 2qql h SER 62 Ca 0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.72 2qql h SER 62 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 2qql h SER 62 CO -0.14 0.00 -0.30 1.33 -0.87 0.00 0.00 176.83 176.86 2qql n VAL 63 N -2.26 0.00 -1.55 0.95 0.24 0.34 -5.05 118.33 110.99 2qql n VAL 63 Ca -0.01 -0.07 -0.52 0.00 -2.04 0.00 0.00 64.34 61.69 2qql n VAL 63 Cb 0.13 0.47 -0.06 0.00 -1.47 0.00 0.00 33.84 32.91 2qql n VAL 63 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2qql n LYS 64 N -0.59 0.80 0.00 7.34 4.81 -0.26 -1.18 118.16 129.08 2qql n LYS 64 Ca 0.00 0.29 0.00 0.00 -0.87 0.00 0.00 58.31 57.73 2qql n LYS 64 Cb 0.00 -1.79 0.00 0.00 0.02 0.00 0.00 35.03 33.26 2qql n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2qql n GLY 65 N 2.06 2.83 0.01 3.14 0.00 -1.26 -4.78 105.19 107.19 2qql n GLY 65 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.19 2qql n GLY 65 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qql n ARG 66 N -2.00 2.04 -4.26 1.61 1.74 -0.32 -5.03 116.66 110.43 2qql n ARG 66 Ca 0.00 -0.01 -0.31 0.00 -0.77 0.00 0.00 57.85 56.76 2qql n ARG 66 Cb 0.00 -1.05 -0.09 0.00 -1.02 0.00 0.00 32.46 30.30 2qql n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2qql s PHE 67 N -2.09 2.90 -0.32 -1.55 0.40 -0.96 -0.83 117.98 115.52 2qql s PHE 67 Ca -0.01 -0.05 -0.02 0.00 -0.60 0.00 0.00 56.93 56.25 2qql s PHE 67 Cb 0.01 -1.54 0.12 0.00 0.51 0.00 0.00 43.02 42.12 2qql s PHE 67 CO 0.08 0.43 0.17 0.99 0.70 0.00 0.00 175.22 177.59 2qql s THR 68 N -1.18 0.07 0.39 0.64 2.01 0.08 -4.88 115.64 112.77 2qql s THR 68 Ca 0.22 -1.21 -0.26 0.00 0.31 0.00 0.00 61.69 60.75 2qql s THR 68 Cb -0.11 -1.07 -0.09 0.00 0.01 0.00 0.00 72.50 71.24 2qql s THR 68 CO 0.13 -0.84 1.22 -0.51 -0.69 0.00 0.00 174.62 173.93 2qql s ILE 69 N 1.62 2.94 0.35 1.82 2.07 -1.26 -2.56 121.20 126.19 2qql s ILE 69 Ca 0.13 0.83 -0.17 0.00 -1.41 0.00 0.00 60.65 60.03 2qql s ILE 69 Cb -0.19 -3.48 0.06 0.00 0.13 0.00 0.00 42.46 38.97 2qql s ILE 69 CO -0.20 0.11 0.83 -0.94 -1.91 0.00 0.00 174.94 172.82 2qql s SER 70 N -0.94 -0.02 -0.22 4.50 1.04 -0.93 -4.99 113.70 112.14 2qql s SER 70 Ca 0.56 -1.03 -0.14 0.00 0.48 0.00 0.00 55.95 55.82 2qql s SER 70 Cb -0.34 0.79 0.07 0.00 0.10 0.00 0.00 66.02 66.63 2qql s SER 70 CO 0.43 -1.55 0.55 0.00 0.98 0.00 0.00 173.24 173.65 2qql s ALA 71 N -2.41 -1.44 -0.40 5.32 0.00 -1.26 -0.35 121.76 121.21 2qql s ALA 71 Ca 0.16 1.89 -0.06 0.00 0.00 0.00 0.00 51.96 53.95 2qql s ALA 71 Cb -0.05 -1.12 0.08 0.00 0.00 0.00 0.00 23.12 22.04 2qql s ALA 71 CO 0.10 -0.31 0.20 0.34 0.00 0.00 0.00 175.76 176.10 2qql s ASP 72 N 1.25 5.42 0.34 0.00 -1.08 0.10 -4.97 116.67 117.72 2qql s ASP 72 Ca -0.08 -1.62 0.18 0.00 -0.52 0.00 0.00 52.55 50.52 2qql s ASP 72 Cb -0.06 -1.90 0.19 0.00 -1.46 0.00 0.00 42.92 39.69 2qql s ASP 72 CO -0.13 -0.50 1.51 0.71 0.52 0.00 0.00 175.17 177.29 2qql h THR 73 N 6.22 0.57 0.00 1.71 1.35 -1.95 -0.02 112.91 120.79 2qql h THR 73 Ca -0.20 -1.78 -0.01 0.00 -0.55 0.00 0.00 66.41 63.87 2qql h THR 73 Cb 1.07 2.26 -0.00 0.00 -1.73 0.00 0.00 68.15 69.75 2qql h THR 73 CO 0.71 0.32 -0.04 0.77 -0.25 0.00 0.00 175.52 177.03 2qql h SER 74 N 0.00 0.00 -0.32 5.36 4.64 -1.95 -2.14 113.55 119.14 2qql h SER 74 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2qql h SER 74 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2qql h SER 74 CO 0.04 0.04 0.00 0.29 -0.87 0.00 0.00 176.83 176.33 2qql n LYS 75 N -3.75 2.34 -3.78 4.77 5.02 -0.86 -4.99 118.16 116.91 2qql n LYS 75 Ca -0.03 -1.94 -0.29 0.00 -2.02 0.00 0.00 58.31 54.03 2qql n LYS 75 Cb 0.13 -1.31 -0.01 0.00 -0.02 0.00 0.00 35.03 33.83 2qql n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2qql n ASN 76 N 0.74 -3.80 -4.17 4.39 5.15 -0.12 -4.84 115.26 112.61 2qql n ASN 76 Ca 0.12 -0.68 -0.19 0.00 -0.60 0.00 0.00 54.58 53.23 2qql n ASN 76 Cb 0.43 -3.11 -0.12 0.00 -0.53 0.00 0.00 39.78 36.45 2qql n ASN 76 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2qql s THR 77 N -3.12 1.13 0.08 -0.44 2.01 -0.62 -2.02 115.64 112.67 2qql s THR 77 Ca 0.58 -1.24 0.07 0.00 0.31 0.00 0.00 61.69 61.40 2qql s THR 77 Cb -0.31 -1.07 -0.04 0.00 0.01 0.00 0.00 72.50 71.09 2qql s THR 77 CO 0.71 -0.17 -0.13 0.00 -0.69 0.00 0.00 174.62 174.35 2qql s ALA 78 N -1.17 2.85 0.26 7.40 0.00 0.13 -0.72 121.76 130.51 2qql s ALA 78 Ca -0.01 -1.23 0.09 0.00 0.00 0.00 0.00 51.96 50.82 2qql s ALA 78 Cb -0.09 -0.85 -0.05 0.00 0.00 0.00 0.00 23.12 22.12 2qql s ALA 78 CO 0.02 0.62 -0.14 0.71 0.00 0.00 0.00 175.76 176.96 2qql s TYR 79 N -1.12 2.06 -0.30 0.00 2.02 0.52 0.09 117.35 120.61 2qql s TYR 79 Ca 0.19 -0.49 -0.03 0.00 -0.37 0.00 0.00 57.07 56.37 2qql s TYR 79 Cb -0.11 -1.00 0.11 0.00 -0.40 0.00 0.00 41.96 40.56 2qql s TYR 79 CO 0.11 0.51 0.14 -1.17 -1.57 0.00 0.00 175.55 173.57 2qql s LEU 80 N -3.45 0.75 -0.49 -1.29 2.96 -0.64 -2.20 118.68 114.32 2qql s LEU 80 Ca 0.28 -1.46 -0.25 0.00 -0.22 0.00 0.00 54.13 52.48 2qql s LEU 80 Cb -0.01 -0.40 0.03 0.00 0.50 0.00 0.00 46.19 46.31 2qql s LEU 80 CO 0.12 -0.42 0.93 -1.58 -1.32 0.00 0.00 176.35 174.08 2qql s GLN 81 N 1.90 3.45 -0.18 1.98 2.00 -1.06 -2.00 119.66 125.76 2qql s GLN 81 Ca 0.10 0.00 -0.12 0.00 -2.00 0.00 0.00 55.36 53.35 2qql s GLN 81 Cb -0.17 -3.97 -0.05 0.00 0.80 0.00 0.00 33.01 29.62 2qql s GLN 81 CO -0.30 -1.32 0.21 -1.64 -0.50 0.00 0.00 175.29 171.74 2qql s MET 82 N 3.82 4.22 0.28 1.67 -1.94 0.18 -0.74 119.30 126.80 2qql s MET 82 Ca 0.35 -0.06 0.07 0.00 -1.71 0.00 0.00 55.69 54.34 2qql s MET 82 Cb -0.11 -3.42 -0.06 0.00 2.01 0.00 0.00 34.83 33.25 2qql s MET 82 CO 0.24 0.27 -0.07 -0.80 -0.01 0.00 0.00 175.02 174.64 2qql s ASN 82 N 0.42 2.92 -1.33 3.03 0.01 -0.01 -1.38 114.94 118.60 2qql s ASN 82 Ca 0.12 -1.17 -0.00 0.00 -0.71 0.00 0.00 52.86 51.10 2qql s ASN 82 Cb -0.12 -0.20 -0.00 0.00 0.41 0.00 0.00 41.25 41.34 2qql s ASN 82 CO 0.01 -0.30 0.62 -1.20 -1.51 0.00 0.00 177.10 174.72 2qql n SER 82 N -0.60 -0.91 -4.67 -1.22 7.64 -1.17 -4.76 113.62 107.93 2qql n SER 82 Ca -0.05 -0.87 -0.42 0.00 1.01 0.00 0.00 58.87 58.53 2qql n SER 82 Cb 0.63 -3.78 -0.03 0.00 -1.01 0.00 0.00 64.21 60.02 2qql n SER 82 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2qql s LEU 82 N -6.75 4.29 0.59 -3.43 1.43 -0.99 -4.66 118.68 109.16 2qql s LEU 82 Ca 0.00 2.10 -0.05 0.00 -1.03 0.00 0.00 54.13 55.15 2qql s LEU 82 Cb -0.00 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.70 2qql s LEU 82 CO 0.83 -0.84 0.89 -0.13 0.23 0.00 0.00 176.35 177.32 2qql s ARG 83 N 3.51 2.79 0.16 1.70 0.52 -1.26 -1.41 118.95 124.97 2qql s ARG 83 Ca 0.67 -0.15 -0.15 0.00 -0.52 0.00 0.00 55.73 55.58 2qql s ARG 83 Cb -0.31 -2.30 0.04 0.00 0.52 0.00 0.00 34.95 32.90 2qql s ARG 83 CO 0.26 -0.74 1.82 0.00 0.02 0.00 0.00 175.30 176.65 2qql h ALA 84 N -0.16 0.56 0.00 2.13 0.00 -1.96 -2.88 119.26 116.95 2qql h ALA 84 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2qql h ALA 84 Cb 1.27 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2qql h ALA 84 CO 0.60 -0.01 0.00 -0.85 0.00 0.00 0.00 179.25 178.98 2qql n GLU 85 N -4.80 0.58 0.00 0.00 0.00 -1.26 -0.62 120.64 114.54 2qql n GLU 85 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.32 2qql n GLU 85 Cb 0.03 -1.46 0.67 0.00 0.00 0.00 0.00 31.44 30.68 2qql n GLU 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2qql n ASP 86 N -0.96 0.02 -4.69 -1.84 8.00 -1.09 -4.87 116.55 111.13 2qql n ASP 86 Ca 0.13 0.22 -0.42 0.00 0.71 0.00 0.00 54.79 55.43 2qql n ASP 86 Cb 0.06 -0.40 -0.03 0.00 -0.02 0.00 0.00 41.12 40.73 2qql n ASP 86 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2qql s THR 87 N -2.83 2.64 0.00 -3.53 2.01 0.21 -4.89 115.64 109.26 2qql s THR 87 Ca 0.20 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.28 2qql s THR 87 Cb 0.19 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.65 2qql s THR 87 CO 0.51 -0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.43 2qql n ALA 88 N 5.95 0.00 -2.40 7.40 0.00 -0.30 -4.41 120.51 126.74 2qql n ALA 88 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.23 2qql n ALA 88 Cb 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 2qql n ALA 88 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2qql s VAL 89 N -2.00 4.83 -0.30 0.00 1.01 -0.83 -0.70 120.40 122.41 2qql s VAL 89 Ca 0.00 1.28 -0.01 0.00 0.00 0.00 0.00 61.98 63.26 2qql s VAL 89 Cb 0.00 -3.94 0.05 0.00 0.00 0.00 0.00 36.38 32.49 2qql s VAL 89 CO 0.00 0.45 -0.02 -0.31 0.00 0.00 0.00 175.10 175.23 2qql s TYR 90 N -0.46 3.29 0.18 5.22 1.51 0.13 -0.99 117.35 126.23 2qql s TYR 90 Ca 0.31 -2.02 -0.11 0.00 -1.01 0.00 0.00 57.07 54.24 2qql s TYR 90 Cb -0.19 -2.12 -0.07 0.00 -0.11 0.00 0.00 41.96 39.47 2qql s TYR 90 CO 0.18 -0.83 0.53 0.71 -1.11 0.00 0.00 175.55 175.03 2qql s TYR 91 N 1.21 3.51 -0.06 2.71 1.51 0.23 -2.07 117.35 124.39 2qql s TYR 91 Ca -0.05 0.92 0.05 0.00 -1.01 0.00 0.00 57.07 56.98 2qql s TYR 91 Cb -0.20 -2.28 -0.02 0.00 -0.11 0.00 0.00 41.96 39.36 2qql s TYR 91 CO -0.02 0.36 -0.21 0.00 -1.11 0.00 0.00 175.55 174.57 2qql s ALA 93 N -0.31 0.70 0.14 0.00 0.00 -0.02 -0.03 121.76 122.23 2qql s ALA 93 Ca 0.01 -0.63 -0.18 0.00 0.00 0.00 0.00 51.96 51.17 2qql s ALA 93 Cb -0.13 -0.06 -0.07 0.00 0.00 0.00 0.00 23.12 22.86 2qql s ALA 93 CO 0.02 0.08 0.61 0.50 0.00 0.00 0.00 175.76 176.97 2qql s ARG 94 N -1.05 4.15 -0.12 0.00 3.52 0.83 -0.95 118.95 125.34 2qql s ARG 94 Ca -0.03 0.70 0.02 0.00 -0.13 0.00 0.00 55.73 56.28 2qql s ARG 94 Cb -0.07 -3.05 0.02 0.00 -1.56 0.00 0.00 34.95 30.28 2qql s ARG 94 CO 0.00 0.53 -0.16 -2.00 -0.81 0.00 0.00 175.30 172.86 2qql s GLU 95 N -1.60 2.38 -0.59 5.12 2.12 0.16 -0.76 118.70 125.53 2qql s GLU 95 Ca 0.35 -0.62 -0.09 0.00 0.36 0.00 0.00 54.97 54.98 2qql s GLU 95 Cb -0.17 -2.03 0.15 0.00 0.26 0.00 0.00 34.13 32.33 2qql s GLU 95 CO 0.20 -0.09 0.47 0.34 -0.54 0.00 0.00 175.26 175.64 2qql s ASP 96 N 1.06 5.84 -0.19 -1.70 2.15 -1.26 -0.48 116.67 122.10 2qql s ASP 96 Ca -0.04 -2.31 0.06 0.00 0.43 0.00 0.00 52.55 50.68 2qql s ASP 96 Cb -0.15 -2.02 -0.16 0.00 -0.30 0.00 0.00 42.92 40.29 2qql s ASP 96 CO -0.04 -0.59 -0.10 2.22 -0.17 0.00 0.00 175.17 176.49 2qql n PHE 97 N 4.36 0.00 -1.61 -5.34 1.16 -1.26 -4.65 117.46 110.13 2qql n PHE 97 Ca 0.01 0.00 -0.57 0.00 -1.87 0.00 0.00 57.45 55.02 2qql n PHE 97 Cb 0.41 -0.79 -0.08 0.00 -1.61 0.00 0.00 39.48 37.42 2qql n PHE 97 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 2qql n ARG 98 N -2.92 0.98 -2.35 3.97 1.74 -1.26 -4.81 116.66 112.01 2qql n ARG 98 Ca -0.33 0.34 -0.06 0.00 -0.77 0.00 0.00 57.85 57.03 2qql n ARG 98 Cb 0.93 -2.11 0.03 0.00 -1.02 0.00 0.00 32.46 30.29 2qql n ARG 98 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2qql n ASN 99 N 6.61 -2.64 0.00 0.55 5.03 -1.26 -5.16 115.26 118.38 2qql n ASN 99 Ca 0.33 -0.23 0.00 0.00 0.87 0.00 0.00 54.58 55.55 2qql n ASN 99 Cb 0.13 -2.13 0.00 0.00 -1.02 0.00 0.00 39.78 36.75 2qql n ASN 99 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2qql n ARG 100 N -2.10 0.00 -0.06 3.52 1.74 -1.26 -5.17 116.66 113.32 2qql n ARG 100 Ca -0.07 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.04 2qql n ARG 100 Cb 0.55 -2.64 0.07 0.00 -1.02 0.00 0.00 32.46 29.42 2qql n ARG 100 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2qql n LEU 100 N 0.00 2.17 -4.60 0.55 7.99 -1.26 -4.95 117.00 116.90 2qql n LEU 100 Ca 0.00 -1.63 -0.48 0.00 -0.01 0.00 0.00 56.01 53.89 2qql n LEU 100 Cb 0.00 -0.08 -0.04 0.00 -0.11 0.00 0.00 43.42 43.19 2qql n LEU 100 CO 0.00 0.52 0.79 0.79 -1.51 0.00 0.00 177.39 177.97 2qql n TRP 100 N 0.19 1.48 -1.91 -1.77 7.02 -1.26 -1.42 117.44 119.77 2qql n TRP 100 Ca 0.06 0.63 -0.13 0.00 -1.02 0.00 0.00 57.50 57.03 2qql n TRP 100 Cb 0.28 -2.32 -0.03 0.00 -2.42 0.00 0.00 31.31 26.82 2qql n TRP 100 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2qql n TYR 100 N 1.62 -0.89 -4.02 -5.99 4.02 -1.26 -4.96 117.16 105.68 2qql n TYR 100 Ca 0.14 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.68 2qql n TYR 100 Cb 0.26 -2.69 -0.08 0.00 -0.02 0.00 0.00 39.34 36.81 2qql n TYR 100 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2qql s VAL 100 N -2.37 5.02 -0.50 -0.72 1.01 -0.51 -5.07 120.40 117.26 2qql s VAL 100 Ca 0.00 0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 2qql s VAL 100 Cb 0.00 -3.20 0.13 0.00 0.00 0.00 0.00 36.38 33.31 2qql s VAL 100 CO 0.00 0.56 0.37 -0.04 0.00 0.00 0.00 175.10 175.99 2qql s MET 100 N -0.53 2.51 0.06 2.72 -1.94 -1.26 -4.12 119.30 116.74 2qql s MET 100 Ca 0.11 -1.89 0.16 0.00 -1.71 0.00 0.00 55.69 52.35 2qql s MET 100 Cb -0.12 -3.90 -0.14 0.00 2.01 0.00 0.00 34.83 32.68 2qql s MET 100 CO 0.02 -1.19 0.85 0.38 -0.01 0.00 0.00 175.02 175.08 2qql h ASP 101 N 8.23 0.00 -3.74 3.03 3.04 -1.32 -3.46 116.42 122.21 2qql h ASP 101 Ca -0.16 0.00 -0.46 0.00 -3.24 0.00 0.00 57.03 53.17 2qql h ASP 101 Cb 1.06 0.00 -0.32 0.00 -1.04 0.00 0.00 39.33 39.03 2qql h ASP 101 CO 0.82 0.66 -0.80 -0.31 -2.04 0.00 0.00 179.24 177.58 2qql s TYR 102 N -2.86 1.12 -0.07 4.15 1.51 -1.25 -4.98 117.35 114.97 2qql s TYR 102 Ca -0.03 -0.32 0.05 0.00 -1.01 0.00 0.00 57.07 55.77 2qql s TYR 102 Cb 0.08 -0.81 -0.01 0.00 -0.11 0.00 0.00 41.96 41.12 2qql s TYR 102 CO 0.81 -0.14 -0.23 -1.58 -1.11 0.00 0.00 175.55 173.30 2qql s TRP 103 N 0.30 2.29 1.31 2.71 0.52 -1.26 -0.12 118.94 124.70 2qql s TRP 103 Ca -0.06 -0.76 -0.20 0.00 0.02 0.00 0.00 56.10 55.11 2qql s TRP 103 Cb -0.11 -1.52 0.33 0.00 -1.15 0.00 0.00 33.47 31.02 2qql s TRP 103 CO 0.01 -0.27 0.99 0.20 0.02 0.00 0.00 176.95 177.91 2qql s GLY 104 N 0.05 1.48 0.02 0.98 0.00 0.95 -4.77 107.32 106.04 2qql s GLY 104 Ca -0.08 -0.69 0.27 0.00 0.00 0.00 0.00 44.72 44.22 2qql s GLY 104 CO 0.05 0.22 1.88 0.61 0.00 0.00 0.00 173.10 175.86 2qql n GLN 105 N -5.27 0.03 0.00 2.90 -0.00 -1.26 -4.75 117.38 109.03 2qql n GLN 105 Ca 0.10 0.04 0.00 0.00 -0.00 0.00 0.00 57.00 57.15 2qql n GLN 105 Cb 0.59 -1.53 0.00 0.00 -0.00 0.00 0.00 30.24 29.29 2qql n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2qql n GLY 106 N 1.35 -0.66 3.19 2.61 0.00 -1.26 -5.00 105.19 105.41 2qql n GLY 106 Ca 0.07 -1.34 -0.24 0.00 0.00 0.00 0.00 46.02 44.50 2qql n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qql s THR 107 N -1.46 1.43 -0.36 2.61 -1.32 -0.88 -4.88 115.64 110.78 2qql s THR 107 Ca 0.00 -0.96 -0.20 0.00 -1.21 0.00 0.00 61.69 59.32 2qql s THR 107 Cb 0.00 -1.23 0.00 0.00 -1.51 0.00 0.00 72.50 69.77 2qql s THR 107 CO 0.00 0.25 0.60 -0.22 -2.21 0.00 0.00 174.62 173.03 2qql s LEU 108 N -0.83 4.31 -0.30 9.08 0.20 -1.26 0.22 118.68 130.10 2qql s LEU 108 Ca 0.06 0.05 -0.12 0.00 0.69 0.00 0.00 54.13 54.81 2qql s LEU 108 Cb -0.08 -2.72 -0.04 0.00 -0.43 0.00 0.00 46.19 42.93 2qql s LEU 108 CO 0.01 -0.58 0.22 -0.69 -0.29 0.00 0.00 176.35 175.02 2qql s VAL 109 N 2.62 5.29 -0.13 1.68 1.01 0.12 -1.78 120.40 129.21 2qql s VAL 109 Ca 0.22 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.28 2qql s VAL 109 Cb -0.15 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 2qql s VAL 109 CO 0.15 0.16 -0.16 -0.89 0.00 0.00 0.00 175.10 174.35 2qql s THR 110 N 1.77 2.74 -0.49 3.92 2.01 -0.34 -1.15 115.64 124.10 2qql s THR 110 Ca 0.07 -0.77 -0.01 0.00 0.31 0.00 0.00 61.69 61.30 2qql s THR 110 Cb -0.16 -2.13 0.13 0.00 0.01 0.00 0.00 72.50 70.34 2qql s THR 110 CO 0.11 0.53 0.27 -0.69 -0.69 0.00 0.00 174.62 174.14 2qql s VAL 111 N 0.45 3.15 -0.04 3.82 1.01 -1.26 -1.17 120.40 126.35 2qql s VAL 111 Ca -0.12 -2.62 -0.06 0.00 0.00 0.00 0.00 61.98 59.19 2qql s VAL 111 Cb -0.16 -3.14 0.01 0.00 0.00 0.00 0.00 36.38 33.09 2qql s VAL 111 CO 0.05 -0.76 0.15 -0.55 0.00 0.00 0.00 175.10 174.00 2qql s SER 112 N 0.95 -0.10 0.54 3.32 0.15 -0.96 -4.64 113.70 112.95 2qql s SER 112 Ca 0.13 0.15 0.32 0.00 0.70 0.00 0.00 55.95 57.25 2qql s SER 112 Cb -0.22 0.29 1.31 0.00 -1.71 0.00 0.00 66.02 65.69 2qql s SER 112 CO -0.04 -0.16 1.97 0.28 1.20 0.00 0.00 173.24 176.49 2qql h SER 113 N 5.36 0.00 -3.57 5.45 0.02 -1.96 -3.39 113.55 115.47 2qql h SER 113 Ca -0.27 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.11 2qql h SER 113 Cb 1.20 0.00 0.14 0.00 0.14 0.00 0.00 62.40 63.88 2qql h SER 113 CO 0.41 0.03 0.35 0.00 -1.14 0.00 0.00 176.83 176.48 2qql n ALA 114 N -2.11 0.82 -2.12 3.77 0.00 -1.26 -5.01 120.51 114.60 2qql n ALA 114 Ca 0.00 0.15 -0.21 0.00 0.00 0.00 0.00 53.44 53.39 2qql n ALA 114 Cb 0.32 -2.21 0.02 0.00 0.00 0.00 0.00 19.45 17.59 2qql n ALA 114 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2qql s SER 115 N -0.87 5.54 0.62 0.00 0.01 -1.26 -4.99 113.70 112.75 2qql s SER 115 Ca 0.68 -0.01 -0.17 0.00 1.31 0.00 0.00 55.95 57.76 2qql s SER 115 Cb -0.47 -1.05 -0.02 0.00 0.21 0.00 0.00 66.02 64.69 2qql s SER 115 CO 0.52 -0.91 1.17 -0.89 0.41 0.00 0.00 173.24 173.54 2qql s THR 116 N -2.60 2.84 -0.29 1.44 2.01 -1.26 -4.66 115.64 113.11 2qql s THR 116 Ca 0.54 0.47 -0.06 0.00 0.31 0.00 0.00 61.69 62.94 2qql s THR 116 Cb -0.10 -3.10 0.15 0.00 0.01 0.00 0.00 72.50 69.46 2qql s THR 116 CO 0.37 -0.16 0.61 -0.75 -0.69 0.00 0.00 174.62 174.00 2qql s LYS 117 N -3.60 0.56 0.57 4.92 2.36 0.69 -4.95 119.74 120.28 2qql s LYS 117 Ca 0.73 1.25 -0.17 0.00 -2.55 0.00 0.00 55.97 55.23 2qql s LYS 117 Cb -0.26 0.70 -0.04 0.00 -1.05 0.00 0.00 37.83 37.17 2qql s LYS 117 CO 0.36 -0.37 1.08 0.20 1.55 0.00 0.00 175.35 178.17 2qql s GLY 118 N 2.86 2.32 0.53 5.54 0.00 -1.26 -2.18 107.32 115.13 2qql s GLY 118 Ca 0.04 0.56 -0.07 0.00 0.00 0.00 0.00 44.72 45.25 2qql s GLY 118 CO -0.19 0.89 0.86 2.56 0.00 0.00 0.00 173.10 177.22 2qql s PRO 119 N -3.73 3.50 -0.17 2.90 0.04 -1.26 -4.65 135.00 131.63 2qql s PRO 119 Ca 0.67 0.33 -0.07 0.00 0.04 0.00 0.00 61.00 61.97 2qql s PRO 119 Cb -0.19 -2.28 -0.04 0.00 0.04 0.00 0.00 34.50 32.03 2qql s PRO 119 CO 0.32 -0.35 0.07 -1.12 0.04 0.00 0.00 177.00 175.96 2qql s SER 120 N -4.15 5.74 -0.35 6.66 0.01 0.96 -4.95 113.70 117.63 2qql s SER 120 Ca 0.50 0.14 -0.08 0.00 1.31 0.00 0.00 55.95 57.82 2qql s SER 120 Cb -0.10 -1.96 0.03 0.00 0.21 0.00 0.00 66.02 64.20 2qql s SER 120 CO 0.47 0.21 0.13 -0.69 0.41 0.00 0.00 173.24 173.78 2qql s VAL 121 N 0.16 4.03 -0.07 3.43 1.01 -1.26 -0.15 120.40 127.55 2qql s VAL 121 Ca 0.05 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.02 2qql s VAL 121 Cb -0.12 -3.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 2qql s VAL 121 CO 0.00 -0.18 -0.05 -0.36 0.00 0.00 0.00 175.10 174.51 2qql s PHE 122 N 1.45 2.98 0.42 5.22 0.08 -0.30 -4.96 117.98 122.88 2qql s PHE 122 Ca -0.00 0.05 -0.19 0.00 0.12 0.00 0.00 56.93 56.91 2qql s PHE 122 Cb -0.19 -1.73 -0.10 0.00 -0.57 0.00 0.00 43.02 40.43 2qql s PHE 122 CO 0.04 0.35 0.91 -1.25 -0.10 0.00 0.00 175.22 175.17 2qql s PRO 123 N -0.81 4.14 -0.42 0.24 0.04 -1.26 0.44 135.00 137.37 2qql s PRO 123 Ca 0.12 1.00 -0.06 0.00 0.04 0.00 0.00 61.00 62.10 2qql s PRO 123 Cb -0.11 -2.22 0.10 0.00 0.04 0.00 0.00 34.50 32.31 2qql s PRO 123 CO 0.02 -0.03 0.25 -0.51 0.04 0.00 0.00 177.00 176.76 2qql s LEU 124 N -3.28 5.26 -0.00 -3.56 1.43 -0.62 -4.81 118.68 113.10 2qql s LEU 124 Ca 0.60 -1.80 -0.21 0.00 -1.03 0.00 0.00 54.13 51.69 2qql s LEU 124 Cb -0.09 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.16 2qql s LEU 124 CO 0.17 -0.57 0.61 0.00 0.23 0.00 0.00 176.35 176.79 2qql s ALA 125 N 1.29 3.48 0.77 4.21 0.00 -1.26 -2.93 121.76 127.31 2qql s ALA 125 Ca 0.05 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.06 2qql s ALA 125 Cb -0.24 -2.76 0.00 0.00 0.00 0.00 0.00 23.12 20.12 2qql s ALA 125 CO -0.01 0.16 0.00 -2.30 0.00 0.00 0.00 175.76 173.60 2qql n PRO 126 N 2.74 0.60 -1.99 0.00 -0.02 -1.26 -4.99 135.00 130.08 2qql n PRO 126 Ca -0.07 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.12 2qql n PRO 126 Cb 0.51 0.00 0.18 0.00 -0.02 0.00 0.00 33.50 34.17 2qql n PRO 126 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2qql s SER 127 N -2.07 3.17 -0.40 2.55 0.01 -1.26 -4.89 113.70 110.81 2qql s SER 127 Ca 0.00 0.20 0.10 0.00 1.31 0.00 0.00 55.95 57.56 2qql s SER 127 Cb 0.00 -0.25 0.35 0.00 0.21 0.00 0.00 66.02 66.33 2qql s SER 127 CO 0.00 -2.69 0.87 -1.20 0.41 0.00 0.00 173.24 170.63 2qql n SER 128 N -3.71 -0.17 0.00 2.44 7.64 -1.26 -4.91 113.62 113.65 2qql n SER 128 Ca 0.15 -3.19 0.00 0.00 1.01 0.00 0.00 58.87 56.84 2qql n SER 128 Cb 0.59 0.20 0.00 0.00 -1.01 0.00 0.00 64.21 63.99 2qql n SER 128 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qql n GLY 134 N 0.27 0.40 2.74 0.23 0.00 -1.26 -5.27 105.19 102.30 2qql n GLY 134 Ca 0.18 0.43 -0.25 0.00 0.00 0.00 0.00 46.02 46.38 2qql n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qql s THR 135 N 0.00 0.39 0.20 2.61 -4.23 -1.26 -3.24 115.64 110.11 2qql s THR 135 Ca 0.00 -0.14 0.05 0.00 -1.18 0.00 0.00 61.69 60.42 2qql s THR 135 Cb 0.00 -0.71 -0.04 0.00 1.34 0.00 0.00 72.50 73.09 2qql s THR 135 CO 0.00 0.05 0.20 0.00 -0.54 0.00 0.00 174.62 174.33 2qql s ALA 136 N 1.95 3.68 0.34 3.99 0.00 -1.18 -4.92 121.76 125.61 2qql s ALA 136 Ca 0.03 -1.26 0.07 0.00 0.00 0.00 0.00 51.96 50.80 2qql s ALA 136 Cb -0.14 -1.45 -0.07 0.00 0.00 0.00 0.00 23.12 21.46 2qql s ALA 136 CO -0.06 0.39 -0.03 0.00 0.00 0.00 0.00 175.76 176.06 2qql s ALA 137 N -1.90 2.73 0.14 0.00 0.00 -1.26 -2.34 121.76 119.12 2qql s ALA 137 Ca 0.32 -2.09 -0.25 0.00 0.00 0.00 0.00 51.96 49.95 2qql s ALA 137 Cb -0.09 0.20 0.07 0.00 0.00 0.00 0.00 23.12 23.29 2qql s ALA 137 CO 0.25 -0.08 0.76 -0.48 0.00 0.00 0.00 175.76 176.21 2qql s LEU 138 N -3.57 -0.39 0.00 0.00 0.05 -0.44 -4.38 118.68 109.95 2qql s LEU 138 Ca 0.33 -0.18 0.00 0.00 0.05 0.00 0.00 54.13 54.33 2qql s LEU 138 Cb 0.06 2.40 0.00 0.00 -2.05 0.00 0.00 46.19 46.60 2qql s LEU 138 CO 0.15 -0.93 0.00 0.61 -0.55 0.00 0.00 176.35 175.63 2qql n GLY 139 N -0.37 1.96 2.89 -3.48 0.00 -1.15 0.17 105.19 105.21 2qql n GLY 139 Ca -0.11 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.94 2qql n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qql s LEU 141 N 0.35 5.01 -0.55 0.00 2.96 0.17 -0.55 118.68 126.06 2qql s LEU 141 Ca -0.03 -1.32 -0.24 0.00 -0.22 0.00 0.00 54.13 52.32 2qql s LEU 141 Cb -0.06 -2.00 0.04 0.00 0.50 0.00 0.00 46.19 44.67 2qql s LEU 141 CO -0.01 -0.49 0.91 -0.69 -1.32 0.00 0.00 176.35 174.75 2qql s VAL 142 N 1.48 4.44 0.07 1.68 1.01 0.27 -1.15 120.40 128.20 2qql s VAL 142 Ca 0.02 0.17 0.10 0.00 0.00 0.00 0.00 61.98 62.27 2qql s VAL 142 Cb -0.22 -4.52 -0.03 0.00 0.00 0.00 0.00 36.38 31.61 2qql s VAL 142 CO 0.04 -1.10 -0.27 -0.75 0.00 0.00 0.00 175.10 173.03 2qql s LYS 143 N 3.81 1.67 -0.66 2.72 2.20 0.79 -1.49 119.74 128.78 2qql s LYS 143 Ca 0.28 -1.19 -0.01 0.00 -0.36 0.00 0.00 55.97 54.70 2qql s LYS 143 Cb -0.13 -1.95 -0.01 0.00 -1.51 0.00 0.00 37.83 34.22 2qql s LYS 143 CO 0.18 0.49 0.61 -0.25 -0.36 0.00 0.00 175.35 176.02 2qql n ASP 144 N 1.50 -6.67 -4.21 1.43 8.00 -1.09 -0.03 116.55 115.48 2qql n ASP 144 Ca -0.17 -0.15 -0.12 0.00 0.71 0.00 0.00 54.79 55.06 2qql n ASP 144 Cb 0.52 -4.57 -0.10 0.00 -0.02 0.00 0.00 41.12 36.96 2qql n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2qql s TYR 145 N -3.05 1.10 -0.28 1.24 1.13 -1.08 -4.14 117.35 112.27 2qql s TYR 145 Ca 0.06 -1.00 -0.26 0.00 -1.41 0.00 0.00 57.07 54.47 2qql s TYR 145 Cb -0.01 -0.62 0.15 0.00 -1.10 0.00 0.00 41.96 40.37 2qql s TYR 145 CO 0.62 -0.21 1.17 0.12 -2.51 0.00 0.00 175.55 174.75 2qql s PHE 146 N -3.67 -0.31 0.87 -3.49 2.19 -0.93 -0.88 117.98 111.77 2qql s PHE 146 Ca 0.20 0.74 -0.11 0.00 0.33 0.00 0.00 56.93 58.09 2qql s PHE 146 Cb 0.06 0.41 0.17 0.00 -1.31 0.00 0.00 43.02 42.35 2qql s PHE 146 CO 0.01 -0.17 1.21 -1.25 1.83 0.00 0.00 175.22 176.85 2qql s PRO 147 N -0.02 1.09 0.79 10.12 0.04 -1.26 -0.23 135.00 145.53 2qql s PRO 147 Ca 0.04 -0.55 -0.13 0.00 0.04 0.00 0.00 61.00 60.40 2qql s PRO 147 Cb -0.04 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.57 2qql s PRO 147 CO -0.09 -2.04 1.16 -1.21 0.04 0.00 0.00 177.00 174.86 2qql s GLU 148 N -5.64 1.86 0.23 4.56 0.41 -1.26 -4.72 118.70 114.14 2qql s GLU 148 Ca 0.70 1.56 0.08 0.00 -0.41 0.00 0.00 54.97 56.90 2qql s GLU 148 Cb -0.05 -1.82 -0.04 0.00 -1.78 0.00 0.00 34.13 30.44 2qql s GLU 148 CO 0.50 -2.00 0.08 -1.25 -0.49 0.00 0.00 175.26 172.09 2qql s PRO 149 N -4.32 2.59 0.11 0.39 0.04 -1.26 -4.99 135.00 127.56 2qql s PRO 149 Ca 0.69 -1.17 0.02 0.00 0.04 0.00 0.00 61.00 60.58 2qql s PRO 149 Cb -0.24 -2.39 -0.04 0.00 0.04 0.00 0.00 34.50 31.87 2qql s PRO 149 CO 0.51 0.41 0.22 0.54 0.04 0.00 0.00 177.00 178.71 2qql s VAL 150 N -2.07 5.16 -0.09 -0.36 0.11 -1.26 -4.56 120.40 117.33 2qql s VAL 150 Ca 0.31 -0.64 0.02 0.00 -2.93 0.00 0.00 61.98 58.74 2qql s VAL 150 Cb -0.08 -3.58 0.01 0.00 -1.53 0.00 0.00 36.38 31.20 2qql s VAL 150 CO 0.22 0.02 -0.13 0.42 -3.33 0.00 0.00 175.10 172.29 2qql s THR 151 N -1.62 1.28 0.00 5.04 -4.23 -0.52 -5.00 115.64 110.60 2qql s THR 151 Ca 0.34 -0.53 0.03 0.00 -1.18 0.00 0.00 61.69 60.35 2qql s THR 151 Cb -0.12 -1.18 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 2qql s THR 151 CO 0.27 0.39 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.98 2qql s VAL 152 N 0.87 3.58 0.09 2.29 1.01 -1.26 -1.18 120.40 125.80 2qql s VAL 152 Ca -0.10 -0.80 -0.09 0.00 0.00 0.00 0.00 61.98 60.99 2qql s VAL 152 Cb -0.15 -2.55 -0.00 0.00 0.00 0.00 0.00 36.38 33.68 2qql s VAL 152 CO 0.01 0.40 0.19 -0.94 0.00 0.00 0.00 175.10 174.76 2qql s SER 153 N -1.40 0.12 -0.14 3.32 1.04 -0.41 -4.95 113.70 111.27 2qql s SER 153 Ca 0.17 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.94 2qql s SER 153 Cb -0.11 0.34 -0.01 0.00 0.10 0.00 0.00 66.02 66.34 2qql s SER 153 CO 0.07 -0.73 -0.14 0.26 0.98 0.00 0.00 173.24 173.67 2qql s TRP 154 N -3.86 2.79 -1.42 5.02 0.52 -1.26 0.23 118.94 120.95 2qql s TRP 154 Ca 0.05 -0.85 -0.06 0.00 0.02 0.00 0.00 56.10 55.26 2qql s TRP 154 Cb 0.05 -1.86 0.03 0.00 -1.15 0.00 0.00 33.47 30.54 2qql s TRP 154 CO -0.11 -0.35 0.53 0.09 0.02 0.00 0.00 176.95 177.13 2qql n ASN 155 N 3.80 -5.01 -3.42 2.95 3.02 -0.03 -2.18 115.26 114.40 2qql n ASN 155 Ca -0.19 -0.31 -0.24 0.00 -0.03 0.00 0.00 54.58 53.81 2qql n ASN 155 Cb 0.52 -4.08 0.06 0.00 -0.61 0.00 0.00 39.78 35.67 2qql n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2qql n SER 156 N -2.40 -6.19 0.00 6.41 7.64 -1.26 -2.85 113.62 114.98 2qql n SER 156 Ca -0.07 -0.47 0.00 0.00 1.01 0.00 0.00 58.87 59.34 2qql n SER 156 Cb 0.59 -4.92 0.00 0.00 -1.01 0.00 0.00 64.21 58.87 2qql n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2qql n GLY 157 N -1.82 2.98 0.36 0.23 0.00 -0.93 -4.93 105.19 101.08 2qql n GLY 157 Ca -0.03 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.22 2qql n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qql h ALA 158 N 0.00 2.03 -3.18 4.61 0.00 -1.56 -3.34 119.26 117.82 2qql h ALA 158 Ca 0.00 0.15 -0.70 0.00 0.00 0.00 0.00 54.91 54.36 2qql h ALA 158 Cb 0.00 0.10 -0.32 0.00 0.00 0.00 0.00 17.79 17.57 2qql h ALA 158 CO 0.00 -0.58 -0.59 -1.17 0.00 0.00 0.00 179.25 176.91 2qql s LEU 159 N -10.19 4.71 -0.06 0.00 2.96 -1.05 -4.92 118.68 110.13 2qql s LEU 159 Ca -0.10 -1.58 -0.08 0.00 -0.22 0.00 0.00 54.13 52.16 2qql s LEU 159 Cb 0.29 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 45.11 2qql s LEU 159 CO 0.80 -0.43 -0.16 0.35 -1.32 0.00 0.00 176.35 175.58 2qql n THR 160 N 4.70 1.12 -1.68 3.68 -2.24 -1.26 -4.25 114.28 114.36 2qql n THR 160 Ca -0.08 0.12 -0.51 0.00 -2.27 0.00 0.00 64.05 61.31 2qql n THR 160 Cb 0.43 -1.84 -0.05 0.00 -2.10 0.00 0.00 70.33 66.76 2qql n THR 160 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2qql n SER 161 N -3.81 2.88 0.00 3.42 2.88 -1.26 -1.91 113.62 115.82 2qql n SER 161 Ca -0.13 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.45 2qql n SER 161 Cb 0.40 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 2qql n SER 161 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qql n GLY 162 N 3.92 0.79 3.84 0.46 0.00 -1.26 -4.94 105.19 108.01 2qql n GLY 162 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 2qql n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qql s VAL 163 N -2.43 4.50 -0.28 1.61 1.01 -0.80 -3.23 120.40 120.77 2qql s VAL 163 Ca 0.00 1.29 -0.03 0.00 0.00 0.00 0.00 61.98 63.24 2qql s VAL 163 Cb 0.00 -3.69 0.11 0.00 0.00 0.00 0.00 36.38 32.80 2qql s VAL 163 CO 0.00 -0.58 0.18 -1.00 0.00 0.00 0.00 175.10 173.70 2qql s HIS 164 N -2.50 0.04 -0.23 5.22 3.76 0.37 -4.95 115.29 117.00 2qql s HIS 164 Ca 0.60 -0.59 -0.20 0.00 -0.15 0.00 0.00 55.06 54.72 2qql s HIS 164 Cb -0.10 -0.73 -0.03 0.00 1.11 0.00 0.00 32.58 32.84 2qql s HIS 164 CO 0.26 -0.84 0.58 0.99 -0.85 0.00 0.00 174.74 174.89 2qql s THR 165 N 2.19 5.04 0.34 1.30 2.01 -1.26 -1.02 115.64 124.25 2qql s THR 165 Ca 0.09 1.06 -0.18 0.00 0.31 0.00 0.00 61.69 62.96 2qql s THR 165 Cb -0.15 -3.89 -0.10 0.00 0.01 0.00 0.00 72.50 68.37 2qql s THR 165 CO -0.34 0.09 0.82 -0.36 -0.69 0.00 0.00 174.62 174.15 2qql s PHE 166 N 2.11 3.41 0.10 4.92 0.40 -0.36 -5.00 117.98 123.57 2qql s PHE 166 Ca 0.25 1.41 -0.33 0.00 -0.60 0.00 0.00 56.93 57.66 2qql s PHE 166 Cb -0.16 -2.68 -0.13 0.00 0.51 0.00 0.00 43.02 40.57 2qql s PHE 166 CO 0.09 0.07 1.70 -2.30 0.70 0.00 0.00 175.22 175.48 2qql n PRO 167 N -0.24 2.31 -1.65 0.24 -0.02 -1.26 -4.54 135.00 129.85 2qql n PRO 167 Ca 0.04 0.84 -0.46 0.00 -2.02 0.00 0.00 63.50 61.89 2qql n PRO 167 Cb 0.53 -2.65 -0.04 0.00 -0.02 0.00 0.00 33.50 31.32 2qql n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qql n ALA 168 N 4.53 0.65 -2.89 3.55 0.00 -1.26 -4.84 120.51 120.25 2qql n ALA 168 Ca 0.18 0.44 -0.32 0.00 0.00 0.00 0.00 53.44 53.74 2qql n ALA 168 Cb 0.31 -2.23 -0.05 0.00 0.00 0.00 0.00 19.45 17.48 2qql n ALA 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2qql s VAL 169 N 0.21 5.31 -0.39 0.00 -7.23 -1.07 -4.93 120.40 112.30 2qql s VAL 169 Ca 0.73 -0.29 -0.23 0.00 -1.81 0.00 0.00 61.98 60.38 2qql s VAL 169 Cb -0.72 -3.52 0.01 0.00 0.56 0.00 0.00 36.38 32.72 2qql s VAL 169 CO 0.47 0.25 0.78 -0.22 -0.31 0.00 0.00 175.10 176.07 2qql s LEU 170 N -2.14 4.17 0.72 1.32 0.20 -1.26 -2.55 118.68 119.14 2qql s LEU 170 Ca 0.30 0.19 -0.11 0.00 0.69 0.00 0.00 54.13 55.20 2qql s LEU 170 Cb -0.13 -3.00 0.02 0.00 -0.43 0.00 0.00 46.19 42.66 2qql s LEU 170 CO 0.22 -0.79 1.07 -1.10 -0.29 0.00 0.00 176.35 175.45 2qql s GLN 171 N 3.16 2.72 0.55 1.98 -0.21 -0.91 -4.93 119.66 122.02 2qql s GLN 171 Ca 0.31 0.95 0.24 0.00 0.02 0.00 0.00 55.36 56.87 2qql s GLN 171 Cb -0.13 -1.97 1.45 0.00 1.00 0.00 0.00 33.01 33.36 2qql s GLN 171 CO 0.19 -1.25 2.07 0.66 -2.12 0.00 0.00 175.29 174.83 2qql h SER 172 N -0.83 0.00 0.60 5.90 4.64 -1.97 -0.96 113.55 120.94 2qql h SER 172 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2qql h SER 172 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2qql h SER 172 CO 0.56 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.29 2qql h SER 173 N 0.00 0.00 0.00 4.97 4.64 -2.02 -3.46 113.55 117.67 2qql h SER 173 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2qql h SER 173 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2qql h SER 173 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2qql n GLY 174 N -0.29 0.89 3.87 -0.77 0.00 -0.36 -5.07 105.19 103.46 2qql n GLY 174 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2qql n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qql s LEU 175 N 0.00 4.18 0.60 0.99 1.43 -1.26 -4.83 118.68 119.79 2qql s LEU 175 Ca 0.00 0.20 -0.08 0.00 -1.03 0.00 0.00 54.13 53.22 2qql s LEU 175 Cb 0.00 -2.75 -0.01 0.00 0.03 0.00 0.00 46.19 43.46 2qql s LEU 175 CO 0.00 0.19 0.94 -0.31 0.23 0.00 0.00 176.35 177.40 2qql s TYR 176 N -1.43 3.41 -0.26 0.29 2.02 -0.06 -2.14 117.35 119.17 2qql s TYR 176 Ca 0.32 0.89 -0.25 0.00 -0.37 0.00 0.00 57.07 57.67 2qql s TYR 176 Cb -0.13 -2.72 0.07 0.00 -0.40 0.00 0.00 41.96 38.79 2qql s TYR 176 CO 0.24 -0.76 0.70 -1.54 -1.57 0.00 0.00 175.55 172.63 2qql s SER 177 N -4.25 -0.73 0.29 2.29 1.04 -1.06 -2.64 113.70 108.65 2qql s SER 177 Ca 0.54 1.40 0.03 0.00 0.48 0.00 0.00 55.95 58.40 2qql s SER 177 Cb -0.11 1.42 -0.04 0.00 0.10 0.00 0.00 66.02 67.39 2qql s SER 177 CO 0.48 -0.25 0.15 -1.48 0.98 0.00 0.00 173.24 173.12 2qql s LEU 178 N 0.34 1.65 0.02 2.42 0.05 -0.56 -2.58 118.68 120.02 2qql s LEU 178 Ca -0.00 -1.53 0.02 0.00 0.05 0.00 0.00 54.13 52.68 2qql s LEU 178 Cb -0.05 0.17 -0.01 0.00 -2.05 0.00 0.00 46.19 44.25 2qql s LEU 178 CO 0.01 -0.86 -0.08 -0.44 -0.55 0.00 0.00 176.35 174.43 2qql s SER 179 N -3.36 0.93 -0.13 1.48 0.01 -1.26 -0.57 113.70 110.80 2qql s SER 179 Ca 0.36 -0.30 0.01 0.00 1.31 0.00 0.00 55.95 57.33 2qql s SER 179 Cb 0.05 -0.05 -0.01 0.00 0.21 0.00 0.00 66.02 66.22 2qql s SER 179 CO 0.17 -0.01 -0.15 -0.55 0.41 0.00 0.00 173.24 173.10 2qql s SER 180 N -0.74 3.78 0.19 2.44 0.15 0.29 -1.22 113.70 118.58 2qql s SER 180 Ca -0.01 -0.40 0.09 0.00 0.70 0.00 0.00 55.95 56.33 2qql s SER 180 Cb -0.06 -1.57 -0.04 0.00 -1.71 0.00 0.00 66.02 62.64 2qql s SER 180 CO 0.00 0.15 -0.18 0.68 1.20 0.00 0.00 173.24 175.09 2qql s VAL 181 N 0.46 1.91 -0.02 4.45 -7.23 -0.18 -0.03 120.40 119.75 2qql s VAL 181 Ca -0.11 -2.04 -0.01 0.00 -1.81 0.00 0.00 61.98 58.01 2qql s VAL 181 Cb -0.16 -1.95 0.01 0.00 0.56 0.00 0.00 36.38 34.84 2qql s VAL 181 CO 0.05 -0.37 0.04 0.54 -0.31 0.00 0.00 175.10 175.06 2qql s VAL 182 N -2.26 -0.01 -0.09 1.32 0.11 0.13 0.14 120.40 119.73 2qql s VAL 182 Ca 0.19 0.04 -0.05 0.00 -2.93 0.00 0.00 61.98 59.23 2qql s VAL 182 Cb -0.05 -0.08 -0.04 0.00 -1.53 0.00 0.00 36.38 34.69 2qql s VAL 182 CO 0.08 0.02 0.14 0.42 -3.33 0.00 0.00 175.10 172.42 2qql s THR 183 N 0.23 5.36 0.05 5.04 -4.23 -1.20 -1.32 115.64 119.57 2qql s THR 183 Ca -0.02 0.06 -0.20 0.00 -1.18 0.00 0.00 61.69 60.35 2qql s THR 183 Cb -0.03 -3.38 0.04 0.00 1.34 0.00 0.00 72.50 70.48 2qql s THR 183 CO -0.01 0.54 0.47 0.68 -0.54 0.00 0.00 174.62 175.76 2qql s VAL 184 N -1.09 0.04 0.13 2.29 -7.23 -0.99 -4.87 120.40 108.68 2qql s VAL 184 Ca 0.18 -0.34 -0.35 0.00 -1.81 0.00 0.00 61.98 59.66 2qql s VAL 184 Cb -0.12 -0.97 -0.15 0.00 0.56 0.00 0.00 36.38 35.70 2qql s VAL 184 CO 0.08 -0.19 1.50 -2.65 -0.31 0.00 0.00 175.10 173.53 2qql n PRO 185 N 0.43 1.81 0.00 4.82 -0.02 -1.26 -3.13 135.00 137.65 2qql n PRO 185 Ca -0.18 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 61.95 2qql n PRO 185 Cb 0.60 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2qql n PRO 185 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2qql n SER 186 N 3.15 0.11 -0.12 2.55 3.41 -1.20 -1.11 113.62 120.41 2qql n SER 186 Ca 0.18 -1.65 -0.18 0.00 -0.26 0.00 0.00 58.87 56.96 2qql n SER 186 Cb 0.25 -0.05 -0.11 0.00 -0.26 0.00 0.00 64.21 64.04 2qql n SER 186 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2qql n SER 187 N -0.42 2.10 0.03 4.04 3.41 -1.26 -4.41 113.62 117.10 2qql n SER 187 Ca 0.00 -0.07 0.13 0.00 -0.26 0.00 0.00 58.87 58.66 2qql n SER 187 Cb 0.03 -0.42 0.52 0.00 -0.26 0.00 0.00 64.21 64.07 2qql n SER 187 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2qql n SER 188 N -3.32 0.18 -4.75 4.04 3.41 -0.96 -4.71 113.62 107.51 2qql n SER 188 Ca -0.43 0.52 -0.39 0.00 -0.26 0.00 0.00 58.87 58.31 2qql n SER 188 Cb 0.94 -0.57 0.03 0.00 -0.26 0.00 0.00 64.21 64.36 2qql n SER 188 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2qql s LEU 189 N -3.35 3.92 -0.66 1.04 1.98 -0.27 -3.42 118.68 117.93 2qql s LEU 189 Ca 0.12 2.81 0.00 0.00 -2.89 0.00 0.00 54.13 54.17 2qql s LEU 189 Cb 0.16 -4.18 0.00 0.00 0.66 0.00 0.00 46.19 42.83 2qql s LEU 189 CO 0.49 -1.47 0.00 0.61 -1.89 0.00 0.00 176.35 174.09 2qql n GLY 190 N 0.68 0.70 0.55 7.98 0.00 -1.26 -4.71 105.19 109.14 2qql n GLY 190 Ca 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2qql n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qql n THR 191 N -2.36 0.00 -3.80 2.61 -2.24 -1.22 -5.10 114.28 102.17 2qql n THR 191 Ca -0.06 -0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.54 2qql n THR 191 Cb 0.43 0.44 -0.14 0.00 -2.10 0.00 0.00 70.33 68.97 2qql n THR 191 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2qql s GLN 192 N 0.00 0.08 -0.12 -0.78 2.00 -1.22 -5.08 119.66 114.54 2qql s GLN 192 Ca 0.02 0.23 -0.29 0.00 -2.00 0.00 0.00 55.36 53.31 2qql s GLN 192 Cb 0.02 -0.07 -0.04 0.00 0.80 0.00 0.00 33.01 33.72 2qql s GLN 192 CO -0.01 -0.09 1.59 0.99 -0.50 0.00 0.00 175.29 177.27 2qql s THR 193 N 0.60 3.72 -0.38 -0.34 2.01 -1.26 -4.97 115.64 115.01 2qql s THR 193 Ca -0.05 0.85 0.04 0.00 0.31 0.00 0.00 61.69 62.84 2qql s THR 193 Cb -0.06 -3.61 0.11 0.00 0.01 0.00 0.00 72.50 68.95 2qql s THR 193 CO -0.03 -0.14 0.10 -0.31 -0.69 0.00 0.00 174.62 173.55 2qql s TYR 194 N 4.37 3.59 -0.13 4.92 2.02 -1.26 -4.98 117.35 125.88 2qql s TYR 194 Ca 0.70 -3.02 0.00 0.00 -0.37 0.00 0.00 57.07 54.39 2qql s TYR 194 Cb -0.29 -2.88 -0.01 0.00 -0.40 0.00 0.00 41.96 38.38 2qql s TYR 194 CO 0.27 -0.90 -0.14 0.96 -1.57 0.00 0.00 175.55 174.17 2qql s ILE 195 N 0.65 2.91 0.10 2.71 -4.36 -1.26 -0.59 121.20 121.35 2qql s ILE 195 Ca 0.12 -0.71 -0.06 0.00 -0.26 0.00 0.00 60.65 59.74 2qql s ILE 195 Cb -0.21 -2.21 -0.05 0.00 1.25 0.00 0.00 42.46 41.24 2qql s ILE 195 CO -0.07 0.53 0.36 0.00 0.24 0.00 0.00 174.94 176.00 2qql s ASN 197 N -2.13 4.83 -0.01 0.00 -0.87 0.62 -1.22 114.94 116.16 2qql s ASN 197 Ca 0.37 -2.13 -0.18 0.00 -1.57 0.00 0.00 52.86 49.35 2qql s ASN 197 Cb -0.13 -1.65 -0.05 0.00 -0.02 0.00 0.00 41.25 39.39 2qql s ASN 197 CO 0.21 -0.40 0.51 -0.69 -2.57 0.00 0.00 177.10 174.17 2qql s VAL 198 N 0.94 4.97 -0.01 1.60 1.01 -1.16 -1.29 120.40 126.45 2qql s VAL 198 Ca 0.10 1.07 0.01 0.00 0.00 0.00 0.00 61.98 63.16 2qql s VAL 198 Cb -0.20 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.35 2qql s VAL 198 CO -0.07 0.47 -0.02 0.21 0.00 0.00 0.00 175.10 175.68 2qql s ASN 199 N -0.41 0.44 -0.31 3.32 3.84 -0.33 -2.99 114.94 118.50 2qql s ASN 199 Ca 0.27 -0.05 -0.02 0.00 0.21 0.00 0.00 52.86 53.27 2qql s ASN 199 Cb -0.17 -0.13 0.11 0.00 -0.55 0.00 0.00 41.25 40.50 2qql s ASN 199 CO 0.15 -0.01 0.14 -2.28 -2.79 0.00 0.00 177.10 172.31 2qql s HIS 200 N 0.37 0.84 0.14 0.43 5.65 -0.41 -1.43 115.29 120.87 2qql s HIS 200 Ca -0.04 -1.32 -0.20 0.00 0.25 0.00 0.00 55.06 53.76 2qql s HIS 200 Cb -0.07 -1.17 0.01 0.00 -1.18 0.00 0.00 32.58 30.17 2qql s HIS 200 CO -0.01 -0.84 1.68 1.57 -0.65 0.00 0.00 174.74 176.50 2qql h LYS 201 N 7.99 -0.06 -0.27 2.88 2.10 -1.84 -2.04 116.57 125.33 2qql h LYS 201 Ca -0.13 0.00 0.08 0.00 -2.00 0.00 0.00 60.65 58.61 2qql h LYS 201 Cb 1.00 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 32.33 2qql h LYS 201 CO 0.42 -0.04 0.37 -1.35 -2.00 0.00 0.00 179.45 176.85 2qql h PRO 202 N -0.06 0.00 -0.01 0.07 0.11 -1.92 0.22 132.00 130.41 2qql h PRO 202 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 2qql h PRO 202 Cb 0.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.35 2qql h PRO 202 CO -0.27 0.00 -0.14 -1.13 -0.21 0.00 0.00 178.00 176.25 2qql n SER 203 N -3.55 1.57 -3.79 -2.05 3.41 -1.14 -4.90 113.62 103.18 2qql n SER 203 Ca 0.04 -1.29 -0.27 0.00 -0.26 0.00 0.00 58.87 57.09 2qql n SER 203 Cb 0.50 0.29 0.04 0.00 -0.26 0.00 0.00 64.21 64.78 2qql n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2qql n ASN 204 N 0.13 -4.56 -4.49 4.04 5.03 0.76 -4.92 115.26 111.25 2qql n ASN 204 Ca 0.06 -0.72 -0.35 0.00 0.87 0.00 0.00 54.58 54.44 2qql n ASN 204 Cb 0.26 -4.23 -0.12 0.00 -1.02 0.00 0.00 39.78 34.67 2qql n ASN 204 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2qql s THR 205 N -3.36 4.12 -0.15 3.41 2.01 -1.00 -5.01 115.64 115.65 2qql s THR 205 Ca 0.53 -0.26 0.01 0.00 0.31 0.00 0.00 61.69 62.28 2qql s THR 205 Cb -0.25 -2.86 0.02 0.00 0.01 0.00 0.00 72.50 69.42 2qql s THR 205 CO 0.80 0.44 -0.17 -0.75 -0.69 0.00 0.00 174.62 174.24 2qql s LYS 206 N 0.84 2.59 -0.11 4.92 2.20 -1.26 -1.29 119.74 127.63 2qql s LYS 206 Ca 0.01 -0.68 -0.01 0.00 -0.36 0.00 0.00 55.97 54.94 2qql s LYS 206 Cb -0.14 -2.24 0.03 0.00 -1.51 0.00 0.00 37.83 33.97 2qql s LYS 206 CO 0.02 -0.15 -0.06 0.08 -0.36 0.00 0.00 175.35 174.88 2qql s VAL 207 N 1.21 0.92 -0.46 4.02 1.01 -1.16 -5.06 120.40 120.88 2qql s VAL 207 Ca 0.00 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.57 2qql s VAL 207 Cb -0.14 -0.97 0.05 0.00 0.00 0.00 0.00 36.38 35.32 2qql s VAL 207 CO -0.08 0.34 0.50 -1.81 0.00 0.00 0.00 175.10 174.05 2qql s ASP 208 N 1.75 6.20 -0.15 3.32 1.01 -1.26 -2.98 116.67 124.56 2qql s ASP 208 Ca 0.05 -0.89 -0.10 0.00 0.71 0.00 0.00 52.55 52.31 2qql s ASP 208 Cb -0.13 -2.24 -0.05 0.00 1.01 0.00 0.00 42.92 41.52 2qql s ASP 208 CO -0.08 -0.71 0.19 -0.75 0.21 0.00 0.00 175.17 174.03 2qql s LYS 209 N 2.22 3.93 -0.32 8.23 2.47 -0.36 -4.91 119.74 131.01 2qql s LYS 209 Ca 0.12 -0.07 -0.14 0.00 -1.56 0.00 0.00 55.97 54.31 2qql s LYS 209 Cb -0.19 -3.33 -0.02 0.00 -1.46 0.00 0.00 37.83 32.83 2qql s LYS 209 CO 0.12 0.48 0.34 0.21 0.16 0.00 0.00 175.35 176.65 2qql s LYS 210 N -0.19 3.70 -0.20 4.03 2.20 -1.26 -0.49 119.74 127.52 2qql s LYS 210 Ca 0.13 -0.32 -0.15 0.00 -0.36 0.00 0.00 55.97 55.28 2qql s LYS 210 Cb -0.12 -3.76 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 2qql s LYS 210 CO 0.02 -0.43 0.35 0.08 -0.36 0.00 0.00 175.35 175.02 2qql s VAL 211 N 1.98 5.23 0.15 4.02 1.01 0.24 -4.98 120.40 128.05 2qql s VAL 211 Ca 0.12 0.61 0.06 0.00 0.00 0.00 0.00 61.98 62.76 2qql s VAL 211 Cb -0.16 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 2qql s VAL 211 CO 0.11 0.28 -0.12 -1.61 0.00 0.00 0.00 175.10 173.76 2qql s GLU 212 N 1.20 1.10 -0.70 2.72 2.02 -1.26 -4.47 118.70 119.31 2qql s GLU 212 Ca 0.17 -1.41 -0.20 0.00 0.02 0.00 0.00 54.97 53.55 2qql s GLU 212 Cb -0.14 -0.81 0.10 0.00 0.10 0.00 0.00 34.13 33.38 2qql s GLU 212 CO 0.07 0.13 0.90 -1.25 0.02 0.00 0.00 175.26 175.13 2qql s PRO 213 N -3.37 3.22 0.16 0.39 0.04 -1.26 -4.57 135.00 129.61 2qql s PRO 213 Ca 0.15 -1.29 0.05 0.00 0.04 0.00 0.00 61.00 59.95 2qql s PRO 213 Cb -0.01 -4.40 -0.04 0.00 0.04 0.00 0.00 34.50 30.09 2qql s PRO 213 CO 0.03 -1.68 0.11 0.15 0.04 0.00 0.00 177.00 175.64 2qql s LYS 214 N 3.07 2.82 -0.11 4.56 -0.14 -1.26 -5.01 119.74 123.68 2qql s LYS 214 Ca 0.20 -0.90 -0.30 0.00 -1.36 0.00 0.00 55.97 53.62 2qql s LYS 214 Cb -0.17 -2.60 0.07 0.00 -1.68 0.00 0.00 37.83 33.45 2qql s LYS 214 CO 0.03 0.48 0.70 -1.54 -0.76 0.00 0.00 175.35 174.27 2qql s SER 215 N -3.05 -0.67 0.00 2.83 1.04 -1.26 -5.05 113.70 107.54 2qql s SER 215 Ca 0.30 0.89 0.00 0.00 0.48 0.00 0.00 55.95 57.62 2qql s SER 215 Cb -0.10 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.77 2qql s SER 215 CO 0.23 -0.52 0.00 0.00 0.98 0.00 0.00 173.24 173.93