#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qqp n ALA 41 N 0.00 0.00 -2.68 1.69 0.00 -1.24 -4.91 120.51 113.37 2qqp n ALA 41 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 2qqp n ALA 41 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2qqp n ALA 41 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2qqp s THR 42 N -2.00 4.17 0.17 0.00 2.01 -1.26 -3.51 115.64 115.22 2qqp s THR 42 Ca 0.00 -0.57 0.10 0.00 0.31 0.00 0.00 61.69 61.53 2qqp s THR 42 Cb 0.00 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.62 2qqp s THR 42 CO 0.00 0.40 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.50 2qqp s ILE 43 N -1.07 2.63 -0.21 1.82 1.01 0.22 -4.92 121.20 120.68 2qqp s ILE 43 Ca 0.19 -1.81 -0.04 0.00 0.00 0.00 0.00 60.65 59.00 2qqp s ILE 43 Cb -0.11 -2.25 0.10 0.00 0.01 0.00 0.00 42.46 40.21 2qqp s ILE 43 CO 0.10 -0.04 0.27 -0.22 0.00 0.00 0.00 174.94 175.04 2qqp s LEU 44 N -2.52 -0.26 0.34 2.97 2.96 -1.26 0.32 118.68 121.23 2qqp s LEU 44 Ca 0.20 -0.06 -0.19 0.00 -0.22 0.00 0.00 54.13 53.86 2qqp s LEU 44 Cb -0.09 0.60 -0.10 0.00 0.50 0.00 0.00 46.19 47.11 2qqp s LEU 44 CO 0.11 -0.32 0.83 -0.54 -1.32 0.00 0.00 176.35 175.11 2qqp s LYS 45 N 2.39 4.20 0.40 1.98 1.02 -1.26 -5.07 119.74 123.40 2qqp s LYS 45 Ca 0.08 0.94 -0.18 0.00 0.02 0.00 0.00 55.97 56.84 2qqp s LYS 45 Cb -0.15 -2.49 -0.10 0.00 -0.52 0.00 0.00 37.83 34.57 2qqp s LYS 45 CO -0.13 0.16 0.86 -1.25 -0.92 0.00 0.00 175.35 174.08 2qqp s PRO 46 N -2.73 4.09 0.24 -1.68 0.04 -1.26 -4.91 135.00 128.80 2qqp s PRO 46 Ca 0.54 0.90 0.01 0.00 0.04 0.00 0.00 61.00 62.49 2qqp s PRO 46 Cb -0.12 -2.28 0.29 0.00 0.04 0.00 0.00 34.50 32.43 2qqp s PRO 46 CO 0.18 0.01 1.62 1.96 0.04 0.00 0.00 177.00 180.81 2qqp h GLN 47 N 1.88 0.47 -4.99 4.56 1.08 -1.97 -3.40 115.11 112.72 2qqp h GLN 47 Ca -0.48 -0.23 -0.63 0.00 -1.45 0.00 0.00 58.65 55.85 2qqp h GLN 47 Cb 1.18 0.00 -0.16 0.00 -0.05 0.00 0.00 27.48 28.45 2qqp h GLN 47 CO 0.63 0.79 -0.48 -0.51 -0.95 0.00 0.00 178.83 178.31 2qqp s LEU 48 N -8.44 4.05 0.22 1.46 2.01 -1.26 -4.84 118.68 111.89 2qqp s LEU 48 Ca -0.07 0.07 -0.30 0.00 0.01 0.00 0.00 54.13 53.84 2qqp s LEU 48 Cb 0.13 -2.15 -0.09 0.00 0.01 0.00 0.00 46.19 44.09 2qqp s LEU 48 CO 0.81 -0.03 1.13 -0.76 1.01 0.00 0.00 176.35 178.51 2qqp s LEU 49 N 1.57 4.50 -0.31 1.79 1.43 -1.26 -4.76 118.68 121.64 2qqp s LEU 49 Ca 0.08 2.21 -0.09 0.00 -1.03 0.00 0.00 54.13 55.30 2qqp s LEU 49 Cb -0.15 -3.61 -0.07 0.00 0.03 0.00 0.00 46.19 42.38 2qqp s LEU 49 CO 0.09 -0.24 0.83 -0.81 0.23 0.00 0.00 176.35 176.45 2qqp n PRO 50 N 1.91 0.00 0.00 1.29 -0.04 -1.26 0.21 135.00 137.11 2qqp n PRO 50 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 2qqp n PRO 50 Cb 0.45 -0.45 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2qqp n PRO 50 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qqp n GLY 51 N 2.00 2.30 3.64 0.55 0.00 -1.26 -5.06 105.19 107.37 2qqp n GLY 51 Ca 0.21 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.72 2qqp n GLY 51 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2qqp n GLU 52 N -0.41 1.61 -3.64 1.61 2.13 0.56 -4.92 120.64 117.57 2qqp n GLU 52 Ca 0.00 0.58 -0.33 0.00 0.66 0.00 0.00 57.16 58.07 2qqp n GLU 52 Cb 0.00 -2.30 -0.08 0.00 0.27 0.00 0.00 31.44 29.34 2qqp n GLU 52 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2qqp n SER 53 N 3.66 3.96 -4.83 4.31 2.88 -1.26 -4.73 113.62 117.60 2qqp n SER 53 Ca 0.19 -3.22 -0.32 0.00 -1.33 0.00 0.00 58.87 54.19 2qqp n SER 53 Cb 0.23 -0.93 0.01 0.00 -0.75 0.00 0.00 64.21 62.77 2qqp n SER 53 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2qqp s VAL 54 N -1.67 4.21 0.67 2.46 1.01 -1.26 -5.08 120.40 120.74 2qqp s VAL 54 Ca 0.29 0.93 -0.11 0.00 0.00 0.00 0.00 61.98 63.08 2qqp s VAL 54 Cb -0.02 -3.56 0.16 0.00 0.00 0.00 0.00 36.38 32.95 2qqp s VAL 54 CO -0.11 -0.74 0.82 0.00 0.00 0.00 0.00 175.10 175.08 2qqp n ALA 55 N -2.24 -1.28 1.00 5.51 0.00 -1.26 -4.93 120.51 117.30 2qqp n ALA 55 Ca 0.07 -1.10 0.08 0.00 0.00 0.00 0.00 53.44 52.49 2qqp n ALA 55 Cb 0.53 -0.06 0.48 0.00 0.00 0.00 0.00 19.45 20.41 2qqp n ALA 55 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2qqp n PRO 56 N -3.02 0.47 0.00 0.00 -0.04 -1.26 -3.50 135.00 127.65 2qqp n PRO 56 Ca 0.11 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 2qqp n PRO 56 Cb 0.37 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 2qqp n PRO 56 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2qqp n SER 57 N -1.06 0.00 -0.28 3.54 2.88 -1.26 -5.11 113.62 112.32 2qqp n SER 57 Ca 0.12 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.66 2qqp n SER 57 Cb 0.07 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 2qqp n SER 57 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qqp n GLY 58 N 0.00 -0.06 7.00 0.46 0.00 -1.23 -4.97 105.19 106.39 2qqp n GLY 58 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.77 2qqp n GLY 58 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqp n GLY 59 N 3.95 0.99 3.83 -0.02 0.00 -1.26 -4.86 105.19 107.83 2qqp n GLY 59 Ca 0.00 -0.74 -0.27 0.00 0.00 0.00 0.00 46.02 45.01 2qqp n GLY 59 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qqp s ARG 60 N 0.00 2.26 0.00 1.61 1.70 -1.26 -5.05 118.95 118.20 2qqp s ARG 60 Ca 0.00 -2.00 0.10 0.00 -0.47 0.00 0.00 55.73 53.36 2qqp s ARG 60 Cb 0.00 -1.99 0.05 0.00 -0.57 0.00 0.00 34.95 32.44 2qqp s ARG 60 CO 0.00 -0.40 0.77 0.41 -1.08 0.00 0.00 175.30 174.99 2qqp n GLY 61 N -1.52 -0.32 3.92 3.88 0.00 -1.26 -5.01 105.19 104.88 2qqp n GLY 61 Ca -0.04 -0.30 -0.20 0.00 0.00 0.00 0.00 46.02 45.49 2qqp n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qqp s THR 62 N -1.03 2.82 -0.40 2.61 -4.23 -1.26 -5.09 115.64 109.06 2qqp s THR 62 Ca 0.11 -1.23 0.10 0.00 -1.18 0.00 0.00 61.69 59.49 2qqp s THR 62 Cb 0.09 -3.01 0.34 0.00 1.34 0.00 0.00 72.50 71.26 2qqp s THR 62 CO 0.17 -0.01 0.92 0.80 -0.54 0.00 0.00 174.62 175.96 2qqp n MET 63 N -1.64 1.01 0.00 3.99 1.56 -1.26 -4.96 117.12 115.82 2qqp n MET 63 Ca 0.05 -2.75 0.00 0.00 -0.27 0.00 0.00 57.70 54.73 2qqp n MET 63 Cb 0.61 -1.36 0.00 0.00 2.15 0.00 0.00 33.22 34.62 2qqp n MET 63 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 2qqp n ASP 64 N 0.27 0.00 -4.61 6.12 9.92 -1.26 -4.46 116.55 122.52 2qqp n ASP 64 Ca 0.16 0.00 -0.50 0.00 -0.53 0.00 0.00 54.79 53.91 2qqp n ASP 64 Cb 0.69 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 41.11 2qqp n ASP 64 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 2qqp n PRO 65 N 0.01 1.42 -0.56 -0.24 -0.02 -1.26 -4.78 135.00 129.57 2qqp n PRO 65 Ca 0.00 0.51 -0.19 0.00 -2.02 0.00 0.00 63.50 61.81 2qqp n PRO 65 Cb 0.00 -2.19 0.01 0.00 -0.02 0.00 0.00 33.50 31.30 2qqp n PRO 65 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2qqp n PRO 66 N 2.84 0.00 -3.49 0.52 -0.04 -1.26 -4.92 135.00 128.65 2qqp n PRO 66 Ca 0.18 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.22 2qqp n PRO 66 Cb 0.22 -0.50 -0.09 0.00 -0.04 0.00 0.00 33.50 33.09 2qqp n PRO 66 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2qqp s VAL 67 N -0.99 4.76 -0.78 0.52 1.01 0.15 -4.90 120.40 120.17 2qqp s VAL 67 Ca 0.24 -1.22 -0.02 0.00 0.00 0.00 0.00 61.98 60.97 2qqp s VAL 67 Cb -0.17 -3.87 0.29 0.00 0.00 0.00 0.00 36.38 32.63 2qqp s VAL 67 CO 0.37 -0.55 2.17 1.41 0.00 0.00 0.00 175.10 178.50 2qqp n HIS 68 N 5.07 2.71 -2.19 5.22 8.25 -1.26 0.70 115.22 133.72 2qqp n HIS 68 Ca -0.11 -2.25 -0.42 0.00 -0.26 0.00 0.00 57.72 54.68 2qqp n HIS 68 Cb 0.43 -1.23 -0.03 0.00 1.12 0.00 0.00 29.99 30.28 2qqp n HIS 68 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 2qqp s GLU 69 N -3.62 4.36 0.67 -0.41 -1.05 -1.23 -3.55 118.70 113.87 2qqp s GLU 69 Ca 0.53 2.08 -0.11 0.00 -0.15 0.00 0.00 54.97 57.32 2qqp s GLU 69 Cb 0.42 -3.21 -0.01 0.00 -0.44 0.00 0.00 34.13 30.90 2qqp s GLU 69 CO -0.38 -0.32 1.05 0.42 0.95 0.00 0.00 175.26 176.98 2qqp s ILE 70 N 0.43 4.19 0.21 1.83 1.01 0.45 -3.60 121.20 125.71 2qqp s ILE 70 Ca 0.59 0.71 0.09 0.00 0.00 0.00 0.00 60.65 62.05 2qqp s ILE 70 Cb -0.37 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 2qqp s ILE 70 CO 0.36 -0.93 -0.08 0.00 0.00 0.00 0.00 174.94 174.29 2qqp s ALA 72 N -1.90 0.31 0.52 0.00 0.00 0.24 -4.67 121.76 116.26 2qqp s ALA 72 Ca 0.27 -1.21 0.21 0.00 0.00 0.00 0.00 51.96 51.22 2qqp s ALA 72 Cb -0.08 1.16 1.40 0.00 0.00 0.00 0.00 23.12 25.60 2qqp s ALA 72 CO 0.16 -0.78 2.14 0.37 0.00 0.00 0.00 175.76 177.65 2qqp h GLN 73 N 2.30 0.00 0.00 0.00 4.15 -2.07 -3.33 115.11 116.16 2qqp h GLN 73 Ca -0.29 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.13 2qqp h GLN 73 Cb 1.25 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.94 2qqp h GLN 73 CO 0.40 0.05 -0.54 -1.13 -1.93 0.00 0.00 178.83 175.68 2qqp n SER 74 N -4.21 2.69 -4.10 -0.69 3.41 -1.26 -5.11 113.62 104.35 2qqp n SER 74 Ca -0.03 -0.07 -0.10 0.00 -0.26 0.00 0.00 58.87 58.41 2qqp n SER 74 Cb 0.13 0.68 -0.09 0.00 -0.26 0.00 0.00 64.21 64.67 2qqp n SER 74 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2qqp s ILE 75 N -1.22 0.09 -0.39 -1.33 -4.36 -1.25 -5.11 121.20 107.63 2qqp s ILE 75 Ca 0.00 -1.76 0.10 0.00 -0.26 0.00 0.00 60.65 58.73 2qqp s ILE 75 Cb 0.00 -2.00 0.32 0.00 1.25 0.00 0.00 42.46 42.03 2qqp s ILE 75 CO 0.00 -0.40 0.73 -0.90 0.24 0.00 0.00 174.94 174.62 2qqp n ASP 76 N -0.14 0.18 -4.76 4.36 5.68 -1.26 -0.59 116.55 120.03 2qqp n ASP 76 Ca -0.06 -3.03 -0.38 0.00 -0.50 0.00 0.00 54.79 50.83 2qqp n ASP 76 Cb 0.64 -0.24 0.03 0.00 -1.14 0.00 0.00 41.12 40.40 2qqp n ASP 76 CO 0.00 0.00 0.00 -2.84 -1.33 0.00 0.00 177.20 173.03 2qqp s PRO 77 N -1.73 3.31 0.26 0.11 0.02 -1.21 -4.36 135.00 131.40 2qqp s PRO 77 Ca 0.37 2.06 -0.23 0.00 0.02 0.00 0.00 61.00 63.22 2qqp s PRO 77 Cb 0.30 -2.28 -0.09 0.00 0.02 0.00 0.00 34.50 32.45 2qqp s PRO 77 CO -0.09 -1.00 0.82 -1.54 -0.33 0.00 0.00 177.00 174.86 2qqp s SER 78 N -1.13 7.20 0.53 2.53 1.04 -1.26 -0.41 113.70 122.21 2qqp s SER 78 Ca 0.70 1.62 0.45 0.00 0.48 0.00 0.00 55.95 59.20 2qqp s SER 78 Cb -0.36 -2.49 1.67 0.00 0.10 0.00 0.00 66.02 64.94 2qqp s SER 78 CO 0.43 0.00 1.60 -0.33 0.98 0.00 0.00 173.24 175.91 2qqp h GLU 79 N 3.38 0.01 -0.06 4.02 5.08 -1.90 1.92 114.58 127.02 2qqp h GLU 79 Ca -0.47 -0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.81 2qqp h GLU 79 Cb 1.19 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2qqp h GLU 79 CO 0.65 0.01 -0.26 0.78 -1.00 0.00 0.00 179.01 179.19 2qqp h GLY 80 N 0.01 0.31 0.54 -3.84 0.00 -1.84 1.05 103.07 99.29 2qqp h GLY 80 Ca 0.90 -0.43 0.02 0.00 0.00 0.00 0.00 47.33 47.82 2qqp h GLY 80 CO -0.10 0.38 -0.25 0.00 0.00 0.00 0.00 176.54 176.57 2qqp h ALA 81 N 0.42 -0.40 0.79 3.60 0.00 0.25 0.28 119.26 124.20 2qqp h ALA 81 Ca -0.01 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2qqp h ALA 81 Cb 0.90 0.41 0.01 0.00 0.00 0.00 0.00 17.79 19.11 2qqp h ALA 81 CO 0.05 -0.77 -0.40 0.28 0.00 0.00 0.00 179.25 178.41 2qqp h VAL 82 N -0.43 0.00 -0.76 0.00 2.07 -0.30 -0.69 116.25 116.13 2qqp h VAL 82 Ca 0.04 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.70 2qqp h VAL 82 Cb 0.47 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.10 2qqp h VAL 82 CO -0.16 0.00 -0.25 1.23 0.02 0.00 0.00 177.57 178.41 2qqp h GLY 83 N -1.09 0.35 -0.01 2.17 0.00 0.13 0.29 103.07 104.91 2qqp h GLY 83 Ca -0.11 0.33 0.08 0.00 0.00 0.00 0.00 47.33 47.63 2qqp h GLY 83 CO 0.16 -0.27 -0.26 -0.25 0.00 0.00 0.00 176.54 175.92 2qqp h TRP 84 N -0.04 -0.70 -0.60 5.60 7.01 -0.22 0.35 115.95 127.35 2qqp h TRP 84 Ca 0.34 0.05 0.07 0.00 2.11 0.00 0.00 58.89 61.46 2qqp h TRP 84 Cb 0.57 0.36 -0.10 0.00 -2.10 0.00 0.00 29.16 27.89 2qqp h TRP 84 CO -0.65 -0.33 -0.54 0.35 -2.79 0.00 0.00 178.44 174.48 2qqp h PHE 85 N -0.22 -1.65 -0.25 2.65 3.57 0.11 1.46 116.94 122.61 2qqp h PHE 85 Ca 0.17 0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.77 2qqp h PHE 85 Cb 0.49 0.80 -0.01 0.00 2.79 0.00 0.00 35.95 40.01 2qqp h PHE 85 CO -0.46 -0.45 0.15 1.88 -2.23 0.00 0.00 178.31 177.21 2qqp h TYR 86 N -0.26 0.29 -0.25 0.41 -1.99 -0.68 0.35 116.97 114.84 2qqp h TYR 86 Ca 0.12 0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.90 2qqp h TYR 86 Cb 0.55 -0.09 -0.03 0.00 2.00 0.00 0.00 36.73 39.15 2qqp h TYR 86 CO -0.80 0.18 0.04 0.87 -0.00 0.00 0.00 178.16 178.44 2qqp h LYS 87 N 0.31 0.12 -0.28 4.88 1.79 0.12 1.84 116.57 125.36 2qqp h LYS 87 Ca 0.09 -0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.56 2qqp h LYS 87 Cb -0.02 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 2qqp h LYS 87 CO -0.04 0.08 0.18 -0.92 -1.08 0.00 0.00 179.45 177.68 2qqp h TYR 88 N 0.13 0.33 0.00 -1.35 3.20 0.22 0.47 116.97 119.98 2qqp h TYR 88 Ca 0.11 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 2qqp h TYR 88 Cb 0.12 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.28 2qqp h TYR 88 CO -0.16 0.21 -0.13 1.98 -1.64 0.00 0.00 178.16 178.41 2qqp h MET 89 N 0.35 0.00 -1.91 1.82 4.05 0.57 -3.42 114.93 116.40 2qqp h MET 89 Ca 0.10 0.00 -0.54 0.00 -0.28 0.00 0.00 59.70 58.98 2qqp h MET 89 Cb -0.01 0.00 -0.41 0.00 -0.80 0.00 0.00 31.60 30.37 2qqp h MET 89 CO -0.02 0.02 -0.84 -3.47 0.23 0.00 0.00 176.91 172.83 2qqp n ASP 90 N -4.74 3.47 0.00 1.39 2.03 0.61 -4.91 116.55 114.41 2qqp n ASP 90 Ca -0.02 -3.45 0.00 0.00 0.52 0.00 0.00 54.79 51.84 2qqp n ASP 90 Cb 0.07 -0.54 0.00 0.00 -0.72 0.00 0.00 41.12 39.93 2qqp n ASP 90 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2qqp n PRO 91 N -0.18 0.00 -0.27 -0.67 -0.04 0.17 0.26 135.00 134.27 2qqp n PRO 91 Ca 0.29 0.23 0.07 0.00 -0.04 0.00 0.00 63.50 64.06 2qqp n PRO 91 Cb 0.56 -0.50 0.19 0.00 -0.04 0.00 0.00 33.50 33.71 2qqp n PRO 91 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qqp h ALA 92 N -1.13 0.91 0.49 0.55 0.00 -1.90 -2.96 119.26 115.22 2qqp h ALA 92 Ca 0.00 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2qqp h ALA 92 Cb 0.00 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2qqp h ALA 92 CO 0.00 -0.43 -0.24 0.78 0.00 0.00 0.00 179.25 179.37 2qqp h GLY 93 N 0.13 -0.69 -1.37 0.00 0.00 -1.12 -3.17 103.07 96.85 2qqp h GLY 93 Ca 0.45 0.26 0.40 0.00 0.00 0.00 0.00 47.33 48.43 2qqp h GLY 93 CO -0.66 -0.25 1.28 0.00 0.00 0.00 0.00 176.54 176.91 2qqp n ALA 94 N -2.48 1.32 0.04 3.60 0.00 0.14 0.30 120.51 123.42 2qqp n ALA 94 Ca -0.08 0.45 -0.03 0.00 0.00 0.00 0.00 53.44 53.78 2qqp n ALA 94 Cb 0.26 -0.79 -0.01 0.00 0.00 0.00 0.00 19.45 18.91 2qqp n ALA 94 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qqp h VAL 95 N 0.00 0.00 0.00 0.00 2.07 -1.53 0.40 116.25 117.19 2qqp h VAL 95 Ca 0.65 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 67.48 2qqp h VAL 95 Cb 3.21 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 2qqp h VAL 95 CO -0.01 0.00 0.00 -1.84 0.02 0.00 0.00 177.57 175.74 2qqp n GLU 96 N -4.40 0.11 0.08 1.57 0.28 0.27 -0.73 120.64 117.83 2qqp n GLU 96 Ca -0.02 0.17 0.12 0.00 -0.16 0.00 0.00 57.16 57.27 2qqp n GLU 96 Cb 0.07 -1.50 0.25 0.00 1.43 0.00 0.00 31.44 31.69 2qqp n GLU 96 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2qqp h SER 97 N 0.00 0.00 0.00 -1.84 0.87 0.46 -3.47 113.55 109.57 2qqp h SER 97 Ca 0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2qqp h SER 97 Cb 0.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.20 2qqp h SER 97 CO 0.00 0.06 0.00 0.61 -0.53 0.00 0.00 176.83 176.97 2qqp n GLY 98 N 1.31 2.57 0.00 5.77 0.00 0.09 -4.85 105.19 110.09 2qqp n GLY 98 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.19 2qqp n GLY 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qqp n LYS 99 N -2.00 0.28 -2.34 1.61 5.02 0.32 -4.82 118.16 116.22 2qqp n LYS 99 Ca 0.00 0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 56.00 2qqp n LYS 99 Cb 0.00 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 2qqp n LYS 99 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qqp s ALA 100 N -2.69 2.98 0.00 7.82 0.00 0.11 -4.38 121.76 125.61 2qqp s ALA 100 Ca 0.22 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2qqp s ALA 100 Cb 0.18 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 20.15 2qqp s ALA 100 CO 0.43 -0.35 0.00 1.47 0.00 0.00 0.00 175.76 177.30 2qqp n LEU 101 N -1.62 0.00 0.00 0.00 -0.00 -1.26 -4.91 117.00 109.21 2qqp n LEU 101 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.08 2qqp n LEU 101 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 2qqp n LEU 101 CO 0.46 0.00 0.00 0.61 -0.00 0.00 0.00 177.39 178.46 2qqp n GLY 102 N -0.43 0.15 2.53 1.47 0.00 -1.25 -2.99 105.19 104.66 2qqp n GLY 102 Ca 0.00 -0.75 -0.07 0.00 0.00 0.00 0.00 46.02 45.20 2qqp n GLY 102 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qqp n GLU 103 N -0.60 0.81 0.30 1.61 -0.58 -1.26 -4.56 120.64 116.37 2qqp n GLU 103 Ca 0.00 -0.59 0.20 0.00 -0.42 0.00 0.00 57.16 56.35 2qqp n GLU 103 Cb 0.00 -1.89 1.07 0.00 -0.57 0.00 0.00 31.44 30.05 2qqp n GLU 103 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2qqp h PHE 104 N 5.93 0.00 -0.16 -0.32 -5.15 -1.66 0.19 116.94 115.77 2qqp h PHE 104 Ca 0.14 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.91 2qqp h PHE 104 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.47 2qqp h PHE 104 CO 1.55 0.00 0.00 -1.13 -2.00 0.00 0.00 178.31 176.73 2qqp n SER 105 N -2.90 1.02 -4.46 -0.68 3.41 -1.26 -4.22 113.62 104.53 2qqp n SER 105 Ca -0.03 -1.82 -0.31 0.00 -0.26 0.00 0.00 58.87 56.45 2qqp n SER 105 Cb 0.09 -0.10 -0.13 0.00 -0.26 0.00 0.00 64.21 63.81 2qqp n SER 105 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2qqp s LYS 106 N -1.79 2.25 -0.11 4.33 1.02 0.66 -4.18 119.74 121.91 2qqp s LYS 106 Ca 0.21 -0.87 -0.21 0.00 0.02 0.00 0.00 55.97 55.12 2qqp s LYS 106 Cb 0.11 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 35.12 2qqp s LYS 106 CO 0.16 0.57 0.59 0.08 -0.92 0.00 0.00 175.35 175.83 2qqp s VAL 107 N -0.85 5.11 0.00 3.17 1.01 -1.26 -4.81 120.40 122.77 2qqp s VAL 107 Ca 0.13 1.19 -0.05 0.00 0.00 0.00 0.00 61.98 63.25 2qqp s VAL 107 Cb -0.11 -3.93 -0.24 0.00 0.00 0.00 0.00 36.38 32.10 2qqp s VAL 107 CO 0.03 0.26 3.36 -0.81 0.00 0.00 0.00 175.10 177.95 2qqp n PRO 108 N 3.92 1.83 -2.03 2.72 -0.04 -1.26 -4.02 135.00 136.12 2qqp n PRO 108 Ca -0.04 -0.90 -0.23 0.00 -0.04 0.00 0.00 63.50 62.28 2qqp n PRO 108 Cb 0.51 -1.94 0.02 0.00 -0.04 0.00 0.00 33.50 32.05 2qqp n PRO 108 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2qqp n ASP 109 N 2.51 4.84 -2.16 3.54 5.75 -1.24 0.89 116.55 130.69 2qqp n ASP 109 Ca 0.39 -3.71 0.00 0.00 -0.01 0.00 0.00 54.79 51.46 2qqp n ASP 109 Cb 0.84 -0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 2qqp n ASP 109 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qqp n GLY 110 N -0.71 0.00 0.11 6.12 0.00 -0.79 -4.49 105.19 105.44 2qqp n GLY 110 Ca 0.43 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.25 2qqp n GLY 110 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2qqp n LEU 111 N -0.71 1.91 -4.73 0.99 7.94 -1.26 -4.64 117.00 116.50 2qqp n LEU 111 Ca 0.00 0.40 -0.41 0.00 -1.11 0.00 0.00 56.01 54.89 2qqp n LEU 111 Cb 0.00 -0.85 -0.05 0.00 0.53 0.00 0.00 43.42 43.05 2qqp n LEU 111 CO 0.00 0.20 0.65 -0.76 -1.11 0.00 0.00 177.39 176.36 2qqp s LEU 112 N -7.78 4.51 0.29 -1.96 1.43 -1.26 -4.92 118.68 108.98 2qqp s LEU 112 Ca -0.31 1.77 0.13 0.00 -1.03 0.00 0.00 54.13 54.70 2qqp s LEU 112 Cb 0.09 -3.56 0.35 0.00 0.03 0.00 0.00 46.19 43.10 2qqp s LEU 112 CO 0.47 -0.04 1.59 0.03 0.23 0.00 0.00 176.35 178.63 2qqp h ARG 113 N 5.46 0.00 -2.39 1.70 3.08 -1.92 -3.11 114.38 117.21 2qqp h ARG 113 Ca -0.43 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.54 2qqp h ARG 113 Cb 1.21 0.00 -0.22 0.00 0.08 0.00 0.00 29.97 31.04 2qqp h ARG 113 CO 0.71 0.58 -0.04 1.52 -1.07 0.00 0.00 179.97 181.67 2qqp s TYR 114 N -3.40 -0.57 -0.17 3.04 -0.85 -1.26 -3.56 117.35 110.58 2qqp s TYR 114 Ca 0.00 1.28 -0.29 0.00 -0.52 0.00 0.00 57.07 57.55 2qqp s TYR 114 Cb 0.11 0.23 0.10 0.00 0.38 0.00 0.00 41.96 42.79 2qqp s TYR 114 CO 0.74 -0.37 0.89 -1.54 -1.52 0.00 0.00 175.55 173.76 2qqp s SER 115 N -0.19 -0.51 0.35 -0.18 1.04 0.12 -4.69 113.70 109.64 2qqp s SER 115 Ca -0.04 0.71 0.06 0.00 0.48 0.00 0.00 55.95 57.16 2qqp s SER 115 Cb -0.03 0.63 -0.01 0.00 0.10 0.00 0.00 66.02 66.71 2qqp s SER 115 CO 0.03 -0.36 0.50 0.54 0.98 0.00 0.00 173.24 174.93 2qqp s VAL 116 N -0.66 3.94 -0.04 5.02 0.11 -0.10 -2.12 120.40 126.55 2qqp s VAL 116 Ca -0.03 -0.95 -0.31 0.00 -2.93 0.00 0.00 61.98 57.76 2qqp s VAL 116 Cb -0.02 -3.37 0.12 0.00 -1.53 0.00 0.00 36.38 31.58 2qqp s VAL 116 CO 0.02 -0.15 1.23 1.51 -3.33 0.00 0.00 175.10 174.38 2qqp s ASP 117 N -4.20 -0.09 0.00 3.54 -4.77 -1.26 -1.48 116.67 108.40 2qqp s ASP 117 Ca 0.46 -0.12 0.00 0.00 -3.30 0.00 0.00 52.55 49.59 2qqp s ASP 117 Cb -0.10 0.19 0.00 0.00 -1.09 0.00 0.00 42.92 41.92 2qqp s ASP 117 CO 0.32 -0.34 0.00 0.00 0.70 0.00 0.00 175.17 175.85 2qqp n ALA 118 N -0.39 0.00 -2.94 2.11 0.00 -0.52 -5.00 120.51 113.78 2qqp n ALA 118 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.26 2qqp n ALA 118 Cb 0.62 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.94 2qqp n ALA 118 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2qqp s GLU 119 N -0.44 0.12 -0.17 0.00 2.12 -1.25 -1.72 118.70 117.36 2qqp s GLU 119 Ca 0.00 -0.06 -0.01 0.00 0.36 0.00 0.00 54.97 55.26 2qqp s GLU 119 Cb 0.00 0.05 -0.00 0.00 0.26 0.00 0.00 34.13 34.44 2qqp s GLU 119 CO 0.00 -0.02 -0.13 -0.65 -0.54 0.00 0.00 175.26 173.92 2qqp s GLN 120 N -0.28 3.25 -0.44 4.30 -0.21 0.18 -4.92 119.66 121.53 2qqp s GLN 120 Ca -0.03 -0.72 0.04 0.00 0.02 0.00 0.00 55.36 54.67 2qqp s GLN 120 Cb -0.02 -2.72 0.51 0.00 1.00 0.00 0.00 33.01 31.78 2qqp s GLN 120 CO -0.00 -0.05 1.68 0.54 -2.12 0.00 0.00 175.29 175.34 2qqp n ARG 121 N 4.26 2.55 -1.54 2.91 1.74 -1.26 -0.75 116.66 124.57 2qqp n ARG 121 Ca -0.19 -3.40 -0.50 0.00 -0.77 0.00 0.00 57.85 52.99 2qqp n ARG 121 Cb 0.51 -2.13 -0.05 0.00 -1.02 0.00 0.00 32.46 29.78 2qqp n ARG 121 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2qqp n PRO 122 N -0.98 0.84 -4.05 5.56 -0.04 -1.24 -4.39 135.00 130.69 2qqp n PRO 122 Ca 0.50 0.30 -0.33 0.00 -0.04 0.00 0.00 63.50 63.93 2qqp n PRO 122 Cb 1.02 -1.74 -0.15 0.00 -0.04 0.00 0.00 33.50 32.59 2qqp n PRO 122 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2qqp s ILE 123 N -0.26 2.33 0.11 0.52 1.01 -1.26 -2.37 121.20 121.28 2qqp s ILE 123 Ca 0.75 -1.27 0.06 0.00 0.00 0.00 0.00 60.65 60.18 2qqp s ILE 123 Cb -0.93 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 2qqp s ILE 123 CO 0.53 0.19 -0.01 -0.69 0.00 0.00 0.00 174.94 174.97 2qqp s VAL 124 N 1.22 3.88 -0.52 2.92 1.01 -0.94 -4.91 120.40 123.06 2qqp s VAL 124 Ca -0.02 -1.11 -0.03 0.00 0.00 0.00 0.00 61.98 60.81 2qqp s VAL 124 Cb -0.17 -2.87 0.14 0.00 0.00 0.00 0.00 36.38 33.48 2qqp s VAL 124 CO -0.07 0.07 0.33 -0.89 0.00 0.00 0.00 175.10 174.54 2qqp s THR 125 N -1.38 3.56 0.20 3.92 2.01 -1.26 0.13 115.64 122.82 2qqp s THR 125 Ca 0.26 -2.48 -0.28 0.00 0.31 0.00 0.00 61.69 59.49 2qqp s THR 125 Cb -0.11 -3.38 -0.08 0.00 0.01 0.00 0.00 72.50 68.94 2qqp s THR 125 CO 0.18 -0.79 0.89 -0.63 -0.69 0.00 0.00 174.62 173.58 2qqp s ILE 126 N 0.57 4.22 -0.02 1.82 1.09 0.32 -4.85 121.20 124.35 2qqp s ILE 126 Ca 0.12 1.96 -0.26 0.00 -1.10 0.00 0.00 60.65 61.37 2qqp s ILE 126 Cb -0.22 -4.27 0.06 0.00 -1.06 0.00 0.00 42.46 36.98 2qqp s ILE 126 CO -0.04 0.48 0.58 -1.83 -0.10 0.00 0.00 174.94 174.04 2qqp s GLU 127 N -1.01 0.99 0.13 2.79 -1.05 -1.26 0.13 118.70 119.41 2qqp s GLU 127 Ca 0.40 0.07 -0.32 0.00 -0.15 0.00 0.00 54.97 54.97 2qqp s GLU 127 Cb -0.25 0.46 -0.18 0.00 -0.44 0.00 0.00 34.13 33.72 2qqp s GLU 127 CO 0.30 -0.32 0.76 0.00 0.95 0.00 0.00 175.26 176.95 2qqp h PRO 129 N 1.86 0.54 -6.13 0.00 0.13 -1.96 -3.46 132.00 122.97 2qqp h PRO 129 Ca -0.37 -0.61 -0.56 0.00 -0.87 0.00 0.00 66.00 63.60 2qqp h PRO 129 Cb 1.43 0.18 -0.05 0.00 0.13 0.00 0.00 31.00 32.69 2qqp h PRO 129 CO 0.61 1.23 0.10 0.99 -0.23 0.00 0.00 178.00 180.69 2qqp s THR 130 N -3.18 4.93 -1.17 1.56 2.01 -1.26 -4.92 115.64 113.61 2qqp s THR 130 Ca -0.12 1.47 -0.06 0.00 0.31 0.00 0.00 61.69 63.29 2qqp s THR 130 Cb 0.05 -4.05 0.02 0.00 0.01 0.00 0.00 72.50 68.53 2qqp s THR 130 CO 0.87 0.31 2.70 0.52 -0.69 0.00 0.00 174.62 178.33 2qqp n VAL 131 N 3.31 4.55 -1.51 3.82 0.31 -1.26 -4.90 118.33 122.64 2qqp n VAL 131 Ca -0.02 -3.45 -0.28 0.00 -0.01 0.00 0.00 64.34 60.57 2qqp n VAL 131 Cb 0.51 -2.14 -0.16 0.00 -0.91 0.00 0.00 33.84 31.14 2qqp n VAL 131 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2qqp n SER 132 N 2.15 -0.04 -4.67 4.52 3.41 -1.26 -4.83 113.62 112.89 2qqp n SER 132 Ca 0.63 -0.44 -0.42 0.00 -0.26 0.00 0.00 58.87 58.38 2qqp n SER 132 Cb 0.34 -0.93 -0.03 0.00 -0.26 0.00 0.00 64.21 63.34 2qqp n SER 132 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2qqp s GLU 133 N 8.06 4.21 0.09 4.33 2.56 -1.26 -5.00 118.70 131.69 2qqp s GLU 133 Ca 1.24 2.11 0.09 0.00 0.00 0.00 0.00 54.97 58.41 2qqp s GLU 133 Cb -0.81 -3.80 -0.04 0.00 2.00 0.00 0.00 34.13 31.48 2qqp s GLU 133 CO 0.44 -0.75 -0.22 0.45 -0.56 0.00 0.00 175.26 174.62 2qqp s SER 134 N 2.71 3.56 -0.10 -1.70 0.15 -1.26 -5.05 113.70 112.00 2qqp s SER 134 Ca 0.69 -0.60 0.07 0.00 0.70 0.00 0.00 55.95 56.81 2qqp s SER 134 Cb -0.33 -0.41 -0.24 0.00 -1.71 0.00 0.00 66.02 63.34 2qqp s SER 134 CO 0.28 0.21 0.42 -0.67 1.20 0.00 0.00 173.24 174.68 2qqp n ASP 135 N 1.16 1.21 -4.63 5.45 -0.08 -1.26 -4.96 116.55 113.44 2qqp n ASP 135 Ca -0.17 0.25 -0.30 0.00 -1.51 0.00 0.00 54.79 53.07 2qqp n ASP 135 Cb 0.53 -0.18 0.18 0.00 2.34 0.00 0.00 41.12 43.99 2qqp n ASP 135 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2qqp s LEU 136 N -6.32 1.97 0.17 -2.67 1.43 -1.26 -4.90 118.68 107.10 2qqp s LEU 136 Ca -0.13 1.70 0.27 0.00 -1.03 0.00 0.00 54.13 54.94 2qqp s LEU 136 Cb 0.07 -3.95 0.90 0.00 0.03 0.00 0.00 46.19 43.25 2qqp s LEU 136 CO 0.79 -3.28 1.81 -0.81 0.23 0.00 0.00 176.35 175.09 2qqp n PRO 137 N -4.32 0.21 -3.58 1.29 -0.04 -1.26 -4.38 135.00 122.91 2qqp n PRO 137 Ca 0.07 0.17 -0.29 0.00 -0.04 0.00 0.00 63.50 63.41 2qqp n PRO 137 Cb 0.54 -1.74 -0.12 0.00 -0.04 0.00 0.00 33.50 32.14 2qqp n PRO 137 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2qqp s LEU 138 N -4.21 1.91 -1.24 1.53 1.43 -1.26 -5.02 118.68 111.83 2qqp s LEU 138 Ca 0.11 -2.52 -0.16 0.00 -1.03 0.00 0.00 54.13 50.53 2qqp s LEU 138 Cb 0.14 -0.73 -0.03 0.00 0.03 0.00 0.00 46.19 45.60 2qqp s LEU 138 CO 0.58 -0.27 2.16 -0.67 0.23 0.00 0.00 176.35 178.39 2qqp n ASP 139 N 3.63 3.68 -1.36 2.29 -0.08 -1.26 -4.81 116.55 118.64 2qqp n ASP 139 Ca 0.13 -2.77 0.00 0.00 -1.51 0.00 0.00 54.79 50.64 2qqp n ASP 139 Cb 0.37 -1.47 0.00 0.00 2.34 0.00 0.00 41.12 42.36 2qqp n ASP 139 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2qqp n GLY 140 N 4.20 0.05 3.78 0.27 0.00 -1.26 -4.75 105.19 107.49 2qqp n GLY 140 Ca 0.52 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.21 2qqp n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qqp s LYS 141 N 0.70 3.26 0.10 1.61 1.02 -1.26 -5.03 119.74 120.14 2qqp s LYS 141 Ca 0.00 1.40 0.03 0.00 0.02 0.00 0.00 55.97 57.43 2qqp s LYS 141 Cb 0.00 -2.01 -0.04 0.00 -0.52 0.00 0.00 37.83 35.26 2qqp s LYS 141 CO 0.00 -0.88 -0.10 -0.51 -0.92 0.00 0.00 175.35 172.94 2qqp s LEU 142 N -4.23 2.42 0.05 3.17 1.43 -1.26 -3.22 118.68 117.04 2qqp s LEU 142 Ca 0.68 -0.84 -0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2qqp s LEU 142 Cb -0.20 -0.28 -0.03 0.00 0.03 0.00 0.00 46.19 45.72 2qqp s LEU 142 CO 0.32 -0.29 0.02 -1.66 0.23 0.00 0.00 176.35 174.97 2qqp s TRP 143 N -2.61 0.37 0.25 0.29 1.48 -0.88 -2.24 118.94 115.59 2qqp s TRP 143 Ca 0.07 -0.81 0.07 0.00 -1.06 0.00 0.00 56.10 54.36 2qqp s TRP 143 Cb -0.02 -0.27 -0.04 0.00 -1.16 0.00 0.00 33.47 31.99 2qqp s TRP 143 CO -0.00 -0.36 0.19 0.50 -4.06 0.00 0.00 176.95 173.21 2qqp s ARG 144 N -3.24 2.91 -0.22 3.25 3.52 -0.87 -3.24 118.95 121.06 2qqp s ARG 144 Ca 0.01 -1.06 -0.27 0.00 -0.13 0.00 0.00 55.73 54.27 2qqp s ARG 144 Cb 0.03 -2.56 0.12 0.00 -1.56 0.00 0.00 34.95 30.98 2qqp s ARG 144 CO -0.08 0.40 1.00 0.54 -0.81 0.00 0.00 175.30 176.36 2qqp s VAL 145 N -2.14 0.00 0.02 7.11 0.11 -1.04 -1.10 120.40 123.37 2qqp s VAL 145 Ca 0.33 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 59.32 2qqp s VAL 145 Cb -0.08 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.76 2qqp s VAL 145 CO 0.25 0.00 0.09 -0.44 -3.33 0.00 0.00 175.10 171.67 2qqp s SER 146 N -0.36 0.13 -0.02 3.54 0.01 0.15 0.19 113.70 117.35 2qqp s SER 146 Ca 0.01 -0.41 0.04 0.00 1.31 0.00 0.00 55.95 56.89 2qqp s SER 146 Cb -0.03 0.20 -0.01 0.00 0.21 0.00 0.00 66.02 66.39 2qqp s SER 146 CO -0.02 -0.43 -0.15 -0.36 0.41 0.00 0.00 173.24 172.69 2qqp s PHE 147 N -2.01 1.42 -0.17 2.43 0.40 0.11 -1.27 117.98 118.88 2qqp s PHE 147 Ca -0.10 -0.32 -0.03 0.00 -0.60 0.00 0.00 56.93 55.88 2qqp s PHE 147 Cb -0.05 -0.94 -0.02 0.00 0.51 0.00 0.00 43.02 42.53 2qqp s PHE 147 CO -0.02 -0.08 -0.06 0.42 0.70 0.00 0.00 175.22 176.18 2qqp s ILE 148 N -0.16 3.48 -0.20 0.64 1.09 0.53 -0.65 121.20 125.94 2qqp s ILE 148 Ca 0.02 -0.49 -0.05 0.00 -1.10 0.00 0.00 60.65 59.03 2qqp s ILE 148 Cb -0.08 -2.53 -0.03 0.00 -1.06 0.00 0.00 42.46 38.76 2qqp s ILE 148 CO 0.00 0.47 0.01 -0.55 -0.10 0.00 0.00 174.94 174.78 2qqp s SER 149 N 0.77 4.96 -0.18 3.58 0.15 0.47 0.15 113.70 123.61 2qqp s SER 149 Ca -0.02 -0.16 0.01 0.00 0.70 0.00 0.00 55.95 56.47 2qqp s SER 149 Cb -0.15 -1.85 0.02 0.00 -1.71 0.00 0.00 66.02 62.33 2qqp s SER 149 CO 0.02 0.08 -0.19 -0.36 1.20 0.00 0.00 173.24 173.99 2qqp s PHE 150 N 0.93 2.78 -0.69 3.44 2.99 -1.20 -1.26 117.98 124.97 2qqp s PHE 150 Ca 0.02 -1.52 -0.23 0.00 0.00 0.00 0.00 56.93 55.19 2qqp s PHE 150 Cb -0.14 -1.92 -0.19 0.00 0.00 0.00 0.00 43.02 40.77 2qqp s PHE 150 CO 0.02 -0.75 1.88 -0.35 -0.00 0.00 0.00 175.22 176.02 2qqp n PRO 151 N 4.53 1.27 -4.24 0.24 -0.04 -1.26 -4.64 135.00 130.86 2qqp n PRO 151 Ca -0.21 -1.76 -0.31 0.00 -0.04 0.00 0.00 63.50 61.19 2qqp n PRO 151 Cb 0.50 -2.92 -0.09 0.00 -0.04 0.00 0.00 33.50 30.95 2qqp n PRO 151 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qqp s ALA 152 N 5.82 3.13 0.12 0.55 0.00 -1.25 0.02 121.76 130.14 2qqp s ALA 152 Ca 0.60 -1.13 -0.29 0.00 0.00 0.00 0.00 51.96 51.14 2qqp s ALA 152 Cb 0.13 -1.10 -0.07 0.00 0.00 0.00 0.00 23.12 22.09 2qqp s ALA 152 CO 0.15 0.66 1.60 0.35 0.00 0.00 0.00 175.76 178.52 2qqp h PHE 153 N 3.77 -1.07 0.00 0.00 3.57 -1.09 -3.26 116.94 118.85 2qqp h PHE 153 Ca -0.48 0.03 -0.25 0.00 3.53 0.00 0.00 57.97 60.80 2qqp h PHE 153 Cb 1.17 0.47 -0.05 0.00 2.79 0.00 0.00 35.95 40.33 2qqp h PHE 153 CO 0.60 -0.47 -2.04 0.54 -2.23 0.00 0.00 178.31 174.71 2qqp n ARG 154 N -5.44 0.66 -3.01 1.11 1.74 -1.26 -4.77 116.66 105.68 2qqp n ARG 154 Ca -0.06 0.04 -0.39 0.00 -0.77 0.00 0.00 57.85 56.67 2qqp n ARG 154 Cb 0.36 -1.61 -0.06 0.00 -1.02 0.00 0.00 32.46 30.13 2qqp n ARG 154 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2qqp s LEU 155 N -5.44 4.57 0.00 0.55 2.96 -1.23 -0.59 118.68 119.50 2qqp s LEU 155 Ca -0.08 1.60 0.00 0.00 -0.22 0.00 0.00 54.13 55.43 2qqp s LEU 155 Cb 0.08 -3.28 0.00 0.00 0.50 0.00 0.00 46.19 43.49 2qqp s LEU 155 CO 0.84 0.20 0.00 -3.20 -1.32 0.00 0.00 176.35 172.87 2qqp n ASN 156 N 1.54 0.00 -3.85 3.68 4.05 0.27 -3.93 115.26 117.02 2qqp n ASN 156 Ca -0.06 0.10 -0.08 0.00 0.45 0.00 0.00 54.58 55.00 2qqp n ASN 156 Cb 0.49 -0.25 -0.03 0.00 1.23 0.00 0.00 39.78 41.22 2qqp n ASN 156 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 177.26 174.93 2qqp s PHE 157 N -0.50 -0.03 0.30 1.20 -0.00 -1.16 -3.21 117.98 114.59 2qqp s PHE 157 Ca 0.00 -0.41 0.10 0.00 -0.00 0.00 0.00 56.93 56.61 2qqp s PHE 157 Cb 0.00 0.58 -0.05 0.00 -0.00 0.00 0.00 43.02 43.55 2qqp s PHE 157 CO 0.00 -1.19 -0.04 0.42 -0.00 0.00 0.00 175.22 174.40 2qqp s ILE 158 N -3.86 2.82 -0.16 -4.49 1.01 0.41 -2.26 121.20 114.66 2qqp s ILE 158 Ca 0.14 -2.06 -0.22 0.00 0.00 0.00 0.00 60.65 58.50 2qqp s ILE 158 Cb -0.05 -2.69 0.06 0.00 0.01 0.00 0.00 42.46 39.79 2qqp s ILE 158 CO 0.08 -0.30 0.58 0.00 0.00 0.00 0.00 174.94 175.30 2qqp s ALA 159 N -2.46 -1.46 -0.10 9.38 0.00 -0.82 -0.34 121.76 125.95 2qqp s ALA 159 Ca 0.33 1.45 -0.07 0.00 0.00 0.00 0.00 51.96 53.66 2qqp s ALA 159 Cb -0.03 -0.64 0.04 0.00 0.00 0.00 0.00 23.12 22.49 2qqp s ALA 159 CO 0.18 -0.30 0.26 -0.48 0.00 0.00 0.00 175.76 175.42 2qqp s LEU 160 N -0.21 0.68 0.32 0.00 2.34 -0.40 -0.44 118.68 120.98 2qqp s LEU 160 Ca -0.04 0.54 0.04 0.00 0.06 0.00 0.00 54.13 54.73 2qqp s LEU 160 Cb -0.03 0.83 -0.06 0.00 -0.56 0.00 0.00 46.19 46.36 2qqp s LEU 160 CO 0.03 -0.13 0.04 0.00 -1.06 0.00 0.00 176.35 175.24 2qqp s ALA 161 N 0.73 2.40 -0.16 1.48 0.00 -0.92 -0.67 121.76 124.60 2qqp s ALA 161 Ca -0.05 -2.06 -0.00 0.00 0.00 0.00 0.00 51.96 49.85 2qqp s ALA 161 Cb -0.06 0.58 0.04 0.00 0.00 0.00 0.00 23.12 23.68 2qqp s ALA 161 CO -0.04 -0.28 -0.08 1.21 0.00 0.00 0.00 175.76 176.57 2qqp s ASN 162 N -3.49 2.82 0.27 0.00 3.04 -0.26 -2.17 114.94 115.14 2qqp s ASN 162 Ca 0.36 -0.63 -0.00 0.00 0.04 0.00 0.00 52.86 52.63 2qqp s ASN 162 Cb 0.08 -0.99 0.59 0.00 -1.54 0.00 0.00 41.25 39.39 2qqp s ASN 162 CO 0.15 -0.15 1.73 0.40 -3.04 0.00 0.00 177.10 176.19 2qqp h ILE 163 N 6.31 0.61 -3.54 -5.21 5.03 -1.09 -2.31 117.51 117.31 2qqp h ILE 163 Ca -0.27 -0.17 -0.52 0.00 -0.12 0.00 0.00 64.86 63.78 2qqp h ILE 163 Cb 1.11 0.08 -0.03 0.00 -3.03 0.00 0.00 36.82 34.96 2qqp h ILE 163 CO 0.43 0.09 0.04 0.20 -0.68 0.00 0.00 178.15 178.23 2qqp s ASN 164 N -5.31 6.88 0.00 1.72 0.01 -1.26 -4.08 114.94 112.91 2qqp s ASN 164 Ca -0.12 1.25 0.00 0.00 -0.71 0.00 0.00 52.86 53.28 2qqp s ASN 164 Cb 0.23 -2.36 0.00 0.00 0.41 0.00 0.00 41.25 39.53 2qqp s ASN 164 CO 0.77 -0.03 0.43 -3.20 -1.51 0.00 0.00 177.10 173.57 2qqp n ASN 165 N 0.36 0.28 -4.75 -1.22 5.15 -0.95 -4.06 115.26 110.07 2qqp n ASN 165 Ca -0.01 -1.15 -0.38 0.00 -0.60 0.00 0.00 54.58 52.43 2qqp n ASN 165 Cb 0.52 -0.14 0.04 0.00 -0.53 0.00 0.00 39.78 39.67 2qqp n ASN 165 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2qqp s GLU 166 N -1.51 3.10 0.86 1.20 2.02 -1.26 -4.64 118.70 118.47 2qqp s GLU 166 Ca 0.00 2.26 -0.15 0.00 0.02 0.00 0.00 54.97 57.10 2qqp s GLU 166 Cb 0.00 -2.24 0.20 0.00 0.10 0.00 0.00 34.13 32.19 2qqp s GLU 166 CO 0.00 -1.23 1.10 0.00 0.02 0.00 0.00 175.26 175.15 2qqp n ALA 167 N -1.07 -1.54 -2.56 5.21 0.00 -1.26 -4.80 120.51 114.49 2qqp n ALA 167 Ca 0.11 -1.46 -0.38 0.00 0.00 0.00 0.00 53.44 51.71 2qqp n ALA 167 Cb 0.45 -0.08 -0.06 0.00 0.00 0.00 0.00 19.45 19.76 2qqp n ALA 167 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2qqp s LEU 168 N 0.00 4.41 0.48 0.00 2.96 -1.26 -5.08 118.68 120.19 2qqp s LEU 168 Ca 0.64 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 55.48 2qqp s LEU 168 Cb -0.02 -2.64 0.01 0.00 0.50 0.00 0.00 46.19 44.04 2qqp s LEU 168 CO 0.45 0.21 0.70 -0.89 -1.32 0.00 0.00 176.35 175.50 2qqp s THR 169 N -0.48 3.59 0.00 3.68 2.01 -1.26 -4.82 115.64 118.35 2qqp s THR 169 Ca 0.24 -0.56 0.00 0.00 0.31 0.00 0.00 61.69 61.68 2qqp s THR 169 Cb -0.16 -3.33 0.00 0.00 0.01 0.00 0.00 72.50 69.02 2qqp s THR 169 CO 0.12 -0.23 0.82 -0.11 -0.69 0.00 0.00 174.62 174.54 2qqp n LEU 170 N -2.15 0.00 -0.10 4.42 7.94 -1.26 0.21 117.00 126.06 2qqp n LEU 170 Ca 0.03 0.82 0.23 0.00 -1.11 0.00 0.00 56.01 55.99 2qqp n LEU 170 Cb 0.58 -0.32 0.68 0.00 0.53 0.00 0.00 43.42 44.89 2qqp n LEU 170 CO 0.47 -0.32 1.22 1.05 -1.11 0.00 0.00 177.39 178.70 2qqp h GLU 171 N 0.00 0.06 0.84 1.96 -0.00 -1.95 0.80 114.58 116.28 2qqp h GLU 171 Ca 0.00 -0.00 -0.04 0.00 -0.00 0.00 0.00 59.36 59.32 2qqp h GLU 171 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 28.74 2qqp h GLU 171 CO 0.00 0.04 -0.46 1.15 -0.00 0.00 0.00 179.01 179.74 2qqp h THR 172 N 0.06 0.00 -0.25 -1.06 2.02 -1.72 -0.95 112.91 111.01 2qqp h THR 172 Ca 0.35 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.59 2qqp h THR 172 Cb 1.30 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.64 2qqp h THR 172 CO -0.03 0.00 -0.36 -0.09 0.37 0.00 0.00 175.52 175.41 2qqp h ARG 173 N -1.20 -0.35 -0.38 6.66 2.43 0.56 -2.20 114.38 119.89 2qqp h ARG 173 Ca -0.11 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2qqp h ARG 173 Cb 0.94 0.08 -0.08 0.00 -0.42 0.00 0.00 29.97 30.49 2qqp h ARG 173 CO 0.15 -0.24 -0.52 -0.91 -1.51 0.00 0.00 179.97 176.94 2qqp h ASN 174 N -0.37 -1.75 -0.66 -3.80 -0.26 0.61 0.78 115.58 110.14 2qqp h ASN 174 Ca 0.12 0.23 0.13 0.00 -0.56 0.00 0.00 56.30 56.22 2qqp h ASN 174 Cb 0.57 0.72 -0.13 0.00 -1.06 0.00 0.00 38.32 38.42 2qqp h ASN 174 CO -0.45 -0.38 -0.21 0.74 -1.06 0.00 0.00 177.43 176.07 2qqp h THR 175 N -0.38 0.28 -0.01 2.81 2.02 -0.81 0.20 112.91 117.02 2qqp h THR 175 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 2qqp h THR 175 Cb 0.56 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2qqp h THR 175 CO -0.56 0.00 -0.01 0.15 0.37 0.00 0.00 175.52 175.48 2qqp h PHE 176 N -0.04 -0.02 0.00 3.16 3.57 -0.36 0.16 116.94 123.41 2qqp h PHE 176 Ca 0.31 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.81 2qqp h PHE 176 Cb 0.52 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.26 2qqp h PHE 176 CO -0.57 -0.00 0.00 -0.89 -2.23 0.00 0.00 178.31 174.61 2qqp n ILE 177 N -2.85 0.00 0.10 1.41 5.41 0.31 0.36 119.36 124.10 2qqp n ILE 177 Ca -0.00 1.30 0.15 0.00 1.00 0.00 0.00 62.75 65.20 2qqp n ILE 177 Cb 0.00 -1.82 0.38 0.00 -0.71 0.00 0.00 39.64 37.49 2qqp n ILE 177 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 176.55 176.61 2qqp h GLN 178 N 0.00 0.00 0.00 0.38 -0.00 -0.55 0.81 115.11 115.76 2qqp h GLN 178 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2qqp h GLN 178 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 2qqp h GLN 178 CO 0.00 0.00 -0.00 1.15 -0.00 0.00 0.00 178.83 179.98 2qqp h THR 179 N 0.00 1.51 0.00 1.86 2.02 0.29 -1.27 112.91 117.32 2qqp h THR 179 Ca 0.21 -1.55 0.00 0.00 0.77 0.00 0.00 66.41 65.84 2qqp h THR 179 Cb 2.03 2.56 0.00 0.00 -1.74 0.00 0.00 68.15 70.99 2qqp h THR 179 CO -0.00 0.40 0.00 -0.07 0.37 0.00 0.00 175.52 176.22 2qqp h LEU 180 N -0.67 0.00 0.04 2.58 4.07 0.12 0.61 115.31 122.06 2qqp h LEU 180 Ca -0.00 0.00 -0.33 0.00 0.08 0.00 0.00 57.88 57.63 2qqp h LEU 180 Cb 0.66 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 42.36 2qqp h LEU 180 CO 0.00 0.00 -1.91 0.59 -1.08 0.00 0.00 178.44 176.04 2qqp n ASN 181 N -2.37 1.23 0.08 -0.43 3.02 -0.79 -4.10 115.26 111.89 2qqp n ASN 181 Ca -0.00 0.28 0.13 0.00 -0.03 0.00 0.00 54.58 54.95 2qqp n ASN 181 Cb 0.12 -0.22 0.31 0.00 -0.61 0.00 0.00 39.78 39.38 2qqp n ASN 181 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2qqp n ASN 182 N -3.16 0.71 -4.59 6.41 3.02 0.02 -3.30 115.26 114.37 2qqp n ASN 182 Ca -0.25 0.34 -0.53 0.00 -0.03 0.00 0.00 54.58 54.11 2qqp n ASN 182 Cb 1.06 -0.32 -0.06 0.00 -0.61 0.00 0.00 39.78 39.85 2qqp n ASN 182 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2qqp n ILE 183 N -2.13 0.02 0.00 2.41 5.41 0.19 -4.58 119.36 120.68 2qqp n ILE 183 Ca 0.05 -0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.79 2qqp n ILE 183 Cb 0.43 -0.74 0.00 0.00 -0.71 0.00 0.00 39.64 38.62 2qqp n ILE 183 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2qqp n THR 184 N 2.51 0.00 -1.15 1.39 -2.24 -1.26 0.39 114.28 113.92 2qqp n THR 184 Ca 0.19 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.66 2qqp n THR 184 Cb 0.17 -0.38 -0.05 0.00 -2.10 0.00 0.00 70.33 67.97 2qqp n THR 184 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2qqp n ASN 185 N -0.26 7.48 -0.31 3.42 3.02 -1.26 -3.84 115.26 123.51 2qqp n ASN 185 Ca 0.00 -2.50 0.30 0.00 -0.03 0.00 0.00 54.58 52.35 2qqp n ASN 185 Cb 0.00 -1.44 0.55 0.00 -0.61 0.00 0.00 39.78 38.28 2qqp n ASN 185 CO 0.00 0.00 0.00 -2.67 -2.62 0.00 0.00 177.26 171.97 2qqp n TRP 186 N 3.48 1.06 -0.32 3.10 4.27 -1.26 0.82 117.44 128.60 2qqp n TRP 186 Ca 0.67 1.07 0.18 0.00 -3.89 0.00 0.00 57.50 55.53 2qqp n TRP 186 Cb 0.33 -1.48 0.43 0.00 -1.36 0.00 0.00 31.31 29.23 2qqp n TRP 186 CO 0.00 0.00 0.00 -0.09 -2.29 0.00 0.00 177.69 175.31 2qqp h ARG 187 N 0.00 0.53 -2.83 -2.67 2.43 -1.89 -1.21 114.38 108.74 2qqp h ARG 187 Ca 0.79 -0.03 -0.54 0.00 -0.81 0.00 0.00 59.98 59.39 2qqp h ARG 187 Cb 2.13 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 31.57 2qqp h ARG 187 CO -0.70 0.35 2.84 -0.40 -1.51 0.00 0.00 179.97 180.55 2qqp n ASP 188 N -4.69 7.63 0.00 -3.80 5.75 0.24 -2.34 116.55 119.35 2qqp n ASP 188 Ca 0.24 -2.52 0.00 0.00 -0.01 0.00 0.00 54.79 52.50 2qqp n ASP 188 Cb 0.73 -1.48 0.00 0.00 -1.03 0.00 0.00 41.12 39.34 2qqp n ASP 188 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2qqp n LEU 189 N 3.40 0.00 0.28 -2.12 -0.00 -0.46 -4.91 117.00 113.20 2qqp n LEU 189 Ca 0.68 0.00 0.16 0.00 -0.00 0.00 0.00 56.01 56.85 2qqp n LEU 189 Cb 0.36 0.00 0.87 0.00 -0.00 0.00 0.00 43.42 44.65 2qqp n LEU 189 CO 0.69 0.00 1.05 1.23 -0.00 0.00 0.00 177.39 180.36 2qqp h GLY 190 N 0.00 0.00 1.20 -3.96 0.00 -1.59 -1.76 103.07 96.96 2qqp h GLY 190 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qqp h GLY 190 CO 0.00 0.00 0.11 -1.30 0.00 0.00 0.00 176.54 175.35 2qqp n THR 191 N -2.73 1.02 -0.97 4.70 -2.24 -1.26 -4.25 114.28 108.54 2qqp n THR 191 Ca -0.02 0.37 0.00 0.00 -2.27 0.00 0.00 64.05 62.13 2qqp n THR 191 Cb 0.19 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.06 2qqp n THR 191 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qqp n GLY 192 N -1.21 0.93 3.62 3.38 0.00 -0.66 -5.00 105.19 106.25 2qqp n GLY 192 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2qqp n GLY 192 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqp n GLN 193 N -2.11 1.33 -2.29 1.61 10.64 -1.24 -4.69 117.38 120.63 2qqp n GLN 193 Ca 0.00 0.48 -0.33 0.00 -1.83 0.00 0.00 57.00 55.32 2qqp n GLN 193 Cb 0.00 -2.10 -0.01 0.00 -0.86 0.00 0.00 30.24 27.27 2qqp n GLN 193 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.06 173.65 2qqp s TRP 194 N -1.32 3.10 -0.12 2.61 0.23 -1.26 -4.42 118.94 117.76 2qqp s TRP 194 Ca 0.65 1.53 -0.05 0.00 -2.03 0.00 0.00 56.10 56.20 2qqp s TRP 194 Cb -0.52 -2.97 0.06 0.00 0.03 0.00 0.00 33.47 30.06 2qqp s TRP 194 CO 0.55 -0.84 0.25 0.00 0.96 0.00 0.00 176.95 177.88 2qqp s ALA 195 N -2.34 -0.54 0.24 0.98 0.00 0.22 -4.90 121.76 115.42 2qqp s ALA 195 Ca 0.64 0.94 -0.30 0.00 0.00 0.00 0.00 51.96 53.24 2qqp s ALA 195 Cb -0.15 -0.88 -0.09 0.00 0.00 0.00 0.00 23.12 22.00 2qqp s ALA 195 CO 0.30 -0.49 1.00 -1.14 0.00 0.00 0.00 175.76 175.42 2qqp s GLN 196 N 2.04 4.77 0.00 0.00 0.74 -1.26 0.23 119.66 126.18 2qqp s GLN 196 Ca -0.02 1.59 0.00 0.00 0.05 0.00 0.00 55.36 56.98 2qqp s GLN 196 Cb -0.11 -3.26 0.00 0.00 1.10 0.00 0.00 33.01 30.74 2qqp s GLN 196 CO -0.08 0.39 0.00 1.97 -0.55 0.00 0.00 175.29 177.01 2qqp n PHE 197 N 1.54 0.00 -4.67 1.67 1.16 -1.03 -4.94 117.46 111.18 2qqp n PHE 197 Ca -0.01 0.00 -0.30 0.00 -1.87 0.00 0.00 57.45 55.26 2qqp n PHE 197 Cb 0.46 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.26 2qqp n PHE 197 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2qqp s ALA 198 N -0.86 3.71 0.00 1.98 0.00 -1.08 -3.90 121.76 121.60 2qqp s ALA 198 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 51.96 51.35 2qqp s ALA 198 Cb 0.00 0.32 0.00 0.00 0.00 0.00 0.00 23.12 23.44 2qqp s ALA 198 CO 0.00 -0.14 0.52 -0.35 0.00 0.00 0.00 175.76 175.79 2qqp n PRO 199 N -1.15 0.00 -0.10 0.00 -0.04 -1.25 -3.41 135.00 129.05 2qqp n PRO 199 Ca -0.15 0.17 0.01 0.00 -0.04 0.00 0.00 63.50 63.50 2qqp n PRO 199 Cb 0.66 -1.06 0.05 0.00 -0.04 0.00 0.00 33.50 33.12 2qqp n PRO 199 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qqp n GLY 200 N 0.00 0.64 3.33 0.55 0.00 -1.26 -4.84 105.19 103.62 2qqp n GLY 200 Ca 0.00 -0.13 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 2qqp n GLY 200 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2qqp s TRP 201 N -1.55 2.39 0.35 1.61 0.52 -1.22 -0.52 118.94 120.51 2qqp s TRP 201 Ca 0.08 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 55.83 2qqp s TRP 201 Cb 0.05 -1.52 -0.04 0.00 -1.15 0.00 0.00 33.47 30.81 2qqp s TRP 201 CO 0.04 -0.01 0.14 0.71 0.02 0.00 0.00 176.95 177.84 2qqp s TYR 202 N -0.62 1.73 -0.17 -1.98 1.51 -0.92 -2.47 117.35 114.43 2qqp s TYR 202 Ca 0.10 -1.29 -0.30 0.00 -1.01 0.00 0.00 57.07 54.57 2qqp s TYR 202 Cb -0.10 -1.03 0.13 0.00 -0.11 0.00 0.00 41.96 40.85 2qqp s TYR 202 CO -0.01 -0.38 1.00 1.52 -1.11 0.00 0.00 175.55 176.57 2qqp s TYR 203 N -3.41 -0.38 0.12 2.71 -0.85 0.14 -2.18 117.35 113.50 2qqp s TYR 203 Ca 0.31 0.68 -0.03 0.00 -0.52 0.00 0.00 57.07 57.51 2qqp s TYR 203 Cb 0.04 0.44 -0.03 0.00 0.38 0.00 0.00 41.96 42.80 2qqp s TYR 203 CO 0.16 -0.34 0.10 0.45 -1.52 0.00 0.00 175.55 174.41 2qqp s SER 204 N -1.00 0.27 -0.01 -0.18 0.15 0.41 -0.61 113.70 112.74 2qqp s SER 204 Ca -0.01 -1.04 0.05 0.00 0.70 0.00 0.00 55.95 55.65 2qqp s SER 204 Cb -0.01 0.31 -0.01 0.00 -1.71 0.00 0.00 66.02 64.60 2qqp s SER 204 CO 0.01 -0.73 -0.17 0.27 1.20 0.00 0.00 173.24 173.82 2qqp s ILE 205 N -3.98 1.34 -0.13 6.45 -4.36 -1.26 -1.95 121.20 117.30 2qqp s ILE 205 Ca 0.17 -0.76 0.02 0.00 -0.26 0.00 0.00 60.65 59.82 2qqp s ILE 205 Cb 0.06 -1.12 0.01 0.00 1.25 0.00 0.00 42.46 42.66 2qqp s ILE 205 CO -0.03 0.34 -0.20 -0.31 0.24 0.00 0.00 174.94 174.99 2qqp s TYR 206 N -0.45 2.45 0.46 1.37 1.51 -0.96 -3.75 117.35 117.99 2qqp s TYR 206 Ca 0.06 -1.19 -0.05 0.00 -1.01 0.00 0.00 57.07 54.88 2qqp s TYR 206 Cb -0.07 -1.69 0.10 0.00 -0.11 0.00 0.00 41.96 40.20 2qqp s TYR 206 CO -0.00 -0.55 0.63 1.33 -1.11 0.00 0.00 175.55 175.85 2qqp n VAL 207 N 4.04 0.00 -3.75 0.71 0.24 -1.26 -0.57 118.33 117.75 2qqp n VAL 207 Ca -0.20 -0.65 -0.37 0.00 -2.04 0.00 0.00 64.34 61.08 2qqp n VAL 207 Cb 0.52 -1.48 -0.12 0.00 -1.47 0.00 0.00 33.84 31.29 2qqp n VAL 207 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2qqp s LEU 208 N 0.00 4.69 0.00 1.34 1.43 0.24 -4.32 118.68 122.06 2qqp s LEU 208 Ca 0.38 -1.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.00 2qqp s LEU 208 Cb -0.01 -1.86 0.00 0.00 0.03 0.00 0.00 46.19 44.34 2qqp s LEU 208 CO 0.26 -0.42 0.00 -2.65 0.23 0.00 0.00 176.35 173.77 2qqp n PRO 209 N 4.75 0.00 -0.09 1.29 -0.02 -1.26 -1.33 135.00 138.35 2qqp n PRO 209 Ca -0.09 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.27 2qqp n PRO 209 Cb 0.43 0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.86 2qqp n PRO 209 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2qqp n ASN 210 N -2.75 1.85 -0.25 2.55 4.13 -1.26 -2.95 115.26 116.58 2qqp n ASN 210 Ca 0.00 0.52 0.20 0.00 1.68 0.00 0.00 54.58 56.97 2qqp n ASN 210 Cb 0.00 -0.87 0.52 0.00 -1.54 0.00 0.00 39.78 37.89 2qqp n ASN 210 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 2qqp h THR 211 N -1.00 0.66 0.00 3.41 1.35 -1.78 4.02 112.91 119.58 2qqp h THR 211 Ca -0.13 -0.14 -0.13 0.00 -0.55 0.00 0.00 66.41 65.46 2qqp h THR 211 Cb 0.86 0.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.49 2qqp h THR 211 CO -0.08 0.07 -0.60 0.22 -0.25 0.00 0.00 175.52 174.88 2qqp h TYR 212 N 0.39 0.00 0.00 4.73 3.20 -1.40 -1.94 116.97 121.96 2qqp h TYR 212 Ca 0.48 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.35 2qqp h TYR 212 Cb 1.22 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.49 2qqp h TYR 212 CO -0.00 0.60 0.00 0.00 -1.64 0.00 0.00 178.16 177.12 2qqp n ALA 213 N -2.42 2.17 -3.97 1.82 0.00 1.32 -4.36 120.51 115.07 2qqp n ALA 213 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.11 2qqp n ALA 213 Cb 0.61 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.91 2qqp n ALA 213 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2qqp s MET 214 N -1.69 1.77 1.07 0.00 -1.94 -0.61 -4.99 119.30 112.90 2qqp s MET 214 Ca 0.00 -1.72 -0.14 0.00 -1.71 0.00 0.00 55.69 52.11 2qqp s MET 214 Cb 0.00 -3.20 0.15 0.00 2.01 0.00 0.00 34.83 33.79 2qqp s MET 214 CO 0.00 -0.86 0.55 0.00 -0.01 0.00 0.00 175.02 174.70 2qqp n ALA 215 N 4.36 -2.95 -1.91 3.03 0.00 -1.26 -4.85 120.51 116.93 2qqp n ALA 215 Ca -0.02 -0.99 -0.08 0.00 0.00 0.00 0.00 53.44 52.35 2qqp n ALA 215 Cb 0.42 -1.82 0.10 0.00 0.00 0.00 0.00 19.45 18.16 2qqp n ALA 215 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2qqp n GLU 216 N -3.10 2.45 -4.09 0.00 4.07 -1.24 -3.64 120.64 115.09 2qqp n GLU 216 Ca 0.04 -3.65 -0.27 0.00 -0.06 0.00 0.00 57.16 53.23 2qqp n GLU 216 Cb 0.56 -1.84 -0.06 0.00 -0.06 0.00 0.00 31.44 30.05 2qqp n GLU 216 CO 0.00 0.00 0.00 0.96 -0.06 0.00 0.00 177.13 178.03 2qqp s ILE 217 N -3.73 4.43 0.07 6.31 -0.00 -1.19 -5.03 121.20 122.06 2qqp s ILE 217 Ca 0.43 -1.07 0.33 0.00 -0.00 0.00 0.00 60.65 60.35 2qqp s ILE 217 Cb 0.39 -3.24 0.38 0.00 -0.00 0.00 0.00 42.46 39.99 2qqp s ILE 217 CO -0.02 -0.08 1.98 1.23 -0.00 0.00 0.00 174.94 178.05 2qqp h GLY 218 N 2.55 0.00 0.00 6.27 0.00 -1.97 -3.37 103.07 106.55 2qqp h GLY 218 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2qqp h GLY 218 CO 0.63 0.00 0.00 1.34 0.00 0.00 0.00 176.54 178.51 2qqp n ASP 219 N -3.01 0.00 -0.12 0.19 -0.08 -1.26 -4.86 116.55 107.41 2qqp n ASP 219 Ca 0.01 0.63 -0.25 0.00 -1.51 0.00 0.00 54.79 53.66 2qqp n ASP 219 Cb 0.29 -0.32 -0.08 0.00 2.34 0.00 0.00 41.12 43.35 2qqp n ASP 219 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2qqp n ARG 220 N -1.46 0.54 -5.23 -0.67 1.74 -1.26 -5.04 116.66 105.29 2qqp n ARG 220 Ca 0.00 0.23 -0.32 0.00 -0.77 0.00 0.00 57.85 57.00 2qqp n ARG 220 Cb 0.00 -1.41 -0.17 0.00 -1.02 0.00 0.00 32.46 29.87 2qqp n ARG 220 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2qqp s THR 221 N -2.52 2.10 0.00 0.55 2.01 -1.26 -4.96 115.64 111.57 2qqp s THR 221 Ca -0.35 -1.03 -0.00 0.00 0.31 0.00 0.00 61.69 60.62 2qqp s THR 221 Cb 0.12 -1.78 -0.01 0.00 0.01 0.00 0.00 72.50 70.85 2qqp s THR 221 CO 0.45 0.56 -0.00 -0.62 -0.69 0.00 0.00 174.62 174.32 2qqp s ASP 222 N 0.06 0.07 0.59 3.53 -1.08 -1.24 -3.20 116.67 115.41 2qqp s ASP 222 Ca -0.10 -0.15 0.00 0.00 -0.52 0.00 0.00 52.55 51.78 2qqp s ASP 222 Cb -0.16 0.05 0.00 0.00 -1.46 0.00 0.00 42.92 41.35 2qqp s ASP 222 CO 0.06 -0.10 0.00 -1.54 0.52 0.00 0.00 175.17 174.11 2qqp n SER 223 N 2.59 -1.18 -4.93 -0.34 3.41 -1.26 -4.66 113.62 107.24 2qqp n SER 223 Ca -0.16 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.25 2qqp n SER 223 Cb 0.58 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.51 2qqp n SER 223 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2qqp s VAL 224 N -0.59 4.15 0.62 -3.33 -7.23 -1.26 -4.72 120.40 108.04 2qqp s VAL 224 Ca 0.00 -1.16 0.29 0.00 -1.81 0.00 0.00 61.98 59.31 2qqp s VAL 224 Cb 0.00 -3.41 0.35 0.00 0.56 0.00 0.00 36.38 33.87 2qqp s VAL 224 CO 0.00 -0.21 1.94 0.71 -0.31 0.00 0.00 175.10 177.23 2qqp h THR 225 N 1.11 0.23 0.00 5.32 1.35 -1.32 -3.45 112.91 116.15 2qqp h THR 225 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 2qqp h THR 225 Cb 1.25 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 2qqp h THR 225 CO 0.57 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.84 2qqp n GLN 226 N -3.39 -3.53 -2.35 4.72 10.64 -1.24 -3.95 117.38 118.29 2qqp n GLN 226 Ca 0.03 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.20 2qqp n GLN 226 Cb 0.50 0.00 0.01 0.00 -0.86 0.00 0.00 30.24 29.88 2qqp n GLN 226 CO 0.00 0.00 0.00 1.97 -1.83 0.00 0.00 177.06 177.20 2qqp n PHE 227 N -0.42 -0.49 -3.79 2.61 1.16 0.32 -1.89 117.46 114.96 2qqp n PHE 227 Ca 0.00 -0.29 -0.13 0.00 -1.87 0.00 0.00 57.45 55.16 2qqp n PHE 227 Cb 0.00 0.14 -0.11 0.00 -1.61 0.00 0.00 39.48 37.90 2qqp n PHE 227 CO 0.00 0.00 0.00 -0.98 -1.87 0.00 0.00 176.76 173.91 2qqp s ARG 228 N -2.01 0.39 -0.75 3.97 1.70 0.40 0.29 118.95 122.94 2qqp s ARG 228 Ca 0.08 0.14 -0.27 0.00 -0.47 0.00 0.00 55.73 55.22 2qqp s ARG 228 Cb -0.01 0.18 0.03 0.00 -0.57 0.00 0.00 34.95 34.58 2qqp s ARG 228 CO 0.01 -0.07 1.33 0.21 -1.08 0.00 0.00 175.30 175.69 2qqp s LYS 229 N -0.36 3.17 0.60 3.89 2.47 -1.26 -1.65 119.74 126.60 2qqp s LYS 229 Ca -0.05 -0.23 0.37 0.00 -1.56 0.00 0.00 55.97 54.50 2qqp s LYS 229 Cb -0.03 -4.26 1.91 0.00 -1.46 0.00 0.00 37.83 33.99 2qqp s LYS 229 CO 0.01 -2.19 2.20 0.28 0.16 0.00 0.00 175.35 175.81 2qqp h VAL 230 N 6.13 0.15 0.00 4.02 2.07 0.17 -3.45 116.25 125.34 2qqp h VAL 230 Ca -0.25 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2qqp h VAL 230 Cb 1.05 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 2qqp h VAL 230 CO 1.28 0.02 0.00 0.00 0.02 0.00 0.00 177.57 178.90 2qqp n TYR 231 N -3.25 0.00 -3.69 1.57 0.18 -0.96 -4.76 117.16 106.25 2qqp n TYR 231 Ca -0.02 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.66 2qqp n TYR 231 Cb 0.17 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.02 2qqp n TYR 231 CO 0.00 0.00 0.00 0.21 -2.08 0.00 0.00 176.86 174.99 2qqp s LYS 232 N -1.50 0.35 0.07 -3.48 2.20 -1.26 -0.60 119.74 115.51 2qqp s LYS 232 Ca 0.00 0.79 0.00 0.00 -0.36 0.00 0.00 55.97 56.40 2qqp s LYS 232 Cb 0.00 0.01 -0.04 0.00 -1.51 0.00 0.00 37.83 36.29 2qqp s LYS 232 CO 0.00 -0.18 -0.04 0.20 -0.36 0.00 0.00 175.35 174.97 2qqp s GLY 233 N 1.58 0.58 -0.11 5.54 0.00 -0.63 0.29 107.32 114.57 2qqp s GLY 233 Ca -0.08 -1.26 -0.11 0.00 0.00 0.00 0.00 44.72 43.27 2qqp s GLY 233 CO -0.12 -1.37 0.30 -0.42 0.00 0.00 0.00 173.10 171.49 2qqp s ILE 234 N -3.80 0.00 -0.10 0.90 1.01 1.00 -0.35 121.20 119.86 2qqp s ILE 234 Ca 0.09 -0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.71 2qqp s ILE 234 Cb 0.07 -0.43 -0.02 0.00 0.01 0.00 0.00 42.46 42.08 2qqp s ILE 234 CO -0.08 -0.02 -0.11 -0.89 0.00 0.00 0.00 174.94 173.84 2qqp s THR 235 N 0.06 3.30 -0.83 2.92 2.01 0.19 0.33 115.64 123.63 2qqp s THR 235 Ca -0.01 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.41 2qqp s THR 235 Cb -0.02 -2.36 0.26 0.00 0.01 0.00 0.00 72.50 70.38 2qqp s THR 235 CO 0.01 0.55 0.99 0.49 -0.69 0.00 0.00 174.62 175.96 2qqp n PHE 236 N 2.94 3.28 -1.64 4.92 3.01 0.52 -0.89 117.46 129.60 2qqp n PHE 236 Ca -0.18 -3.65 -0.53 0.00 1.01 0.00 0.00 57.45 54.10 2qqp n PHE 236 Cb 0.53 -0.88 -0.06 0.00 -0.01 0.00 0.00 39.48 39.06 2qqp n PHE 236 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2qqp n GLU 237 N 1.25 1.29 -2.69 -1.08 -0.58 -0.13 -2.10 120.64 116.61 2qqp n GLU 237 Ca 0.27 0.47 -0.43 0.00 -0.42 0.00 0.00 57.16 57.05 2qqp n GLU 237 Cb 0.38 -2.15 -0.02 0.00 -0.57 0.00 0.00 31.44 29.08 2qqp n GLU 237 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 2qqp s PHE 238 N 1.79 2.85 -0.78 -0.32 5.36 0.70 -2.22 117.98 125.36 2qqp s PHE 238 Ca 0.89 -1.35 -0.25 0.00 -0.96 0.00 0.00 56.93 55.27 2qqp s PHE 238 Cb -0.96 -4.58 0.05 0.00 -0.34 0.00 0.00 43.02 37.19 2qqp s PHE 238 CO 0.53 -1.74 1.22 1.21 -1.46 0.00 0.00 175.22 174.98 2qqp s ASN 239 N 4.21 6.26 0.05 6.13 3.84 -0.04 -4.82 114.94 130.56 2qqp s ASN 239 Ca 0.45 -0.88 0.01 0.00 0.21 0.00 0.00 52.86 52.66 2qqp s ASN 239 Cb -0.00 -2.52 -0.03 0.00 -0.55 0.00 0.00 41.25 38.16 2qqp s ASN 239 CO -0.03 -1.63 -0.06 0.00 -2.79 0.00 0.00 177.10 172.59 2qqp s ALA 240 N 4.98 0.54 0.06 1.71 0.00 -1.26 0.12 121.76 127.90 2qqp s ALA 240 Ca 0.34 -0.86 -0.31 0.00 0.00 0.00 0.00 51.96 51.13 2qqp s ALA 240 Cb -0.08 0.10 -0.08 0.00 0.00 0.00 0.00 23.12 23.06 2qqp s ALA 240 CO 0.08 -0.11 1.60 -1.25 0.00 0.00 0.00 175.76 176.08 2qqp s PRO 241 N -2.09 4.21 0.00 0.00 0.04 -1.26 -4.74 135.00 131.16 2qqp s PRO 241 Ca -0.06 2.26 -0.01 0.00 0.04 0.00 0.00 61.00 63.23 2qqp s PRO 241 Cb -0.06 -3.58 -0.03 0.00 0.04 0.00 0.00 34.50 30.87 2qqp s PRO 241 CO -0.01 -0.70 0.88 2.41 0.04 0.00 0.00 177.00 179.62 2qqp n THR 242 N 4.68 0.59 0.03 1.26 -1.04 -1.26 -1.48 114.28 117.06 2qqp n THR 242 Ca 0.15 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 2qqp n THR 242 Cb 0.41 -1.39 0.00 0.00 -1.82 0.00 0.00 70.33 67.53 2qqp n THR 242 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2qqp n LEU 243 N 2.44 0.21 -3.85 -4.42 0.00 -1.26 -4.89 117.00 105.24 2qqp n LEU 243 Ca 0.06 0.11 -0.28 0.00 0.00 0.00 0.00 56.01 55.89 2qqp n LEU 243 Cb 0.17 -0.01 -0.12 0.00 0.00 0.00 0.00 43.42 43.46 2qqp n LEU 243 CO 0.12 -0.42 -0.09 0.27 0.00 0.00 0.00 177.39 177.27 2qqp s ILE 244 N -2.00 2.53 -0.70 1.96 -4.36 -0.55 -4.87 121.20 113.21 2qqp s ILE 244 Ca 0.00 -3.90 0.16 0.00 -0.26 0.00 0.00 60.65 56.66 2qqp s ILE 244 Cb 0.00 -2.68 0.78 0.00 1.25 0.00 0.00 42.46 41.81 2qqp s ILE 244 CO 0.00 -0.99 1.70 -0.90 0.24 0.00 0.00 174.94 174.99 2qqp n ASP 245 N 2.30 5.31 -4.24 4.36 5.75 -1.23 -4.44 116.55 124.36 2qqp n ASP 245 Ca 0.18 -2.69 -0.31 0.00 -0.01 0.00 0.00 54.79 51.96 2qqp n ASP 245 Cb 0.36 -0.64 0.18 0.00 -1.03 0.00 0.00 41.12 39.99 2qqp n ASP 245 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2qqp n GLN 246 N 0.90 -1.84 0.00 0.11 3.00 -1.26 -3.09 117.38 115.20 2qqp n GLN 246 Ca 0.27 -0.52 0.00 0.00 -0.01 0.00 0.00 57.00 56.74 2qqp n GLN 246 Cb 1.06 -1.73 0.00 0.00 0.00 0.00 0.00 30.24 29.57 2qqp n GLN 246 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2qqp n GLY 247 N 1.97 2.71 3.31 1.08 0.00 -0.97 -4.47 105.19 108.83 2qqp n GLY 247 Ca 0.01 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 2qqp n GLY 247 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2qqp s TRP 248 N -2.66 0.11 0.01 1.61 1.48 -0.34 0.53 118.94 119.69 2qqp s TRP 248 Ca 0.00 -0.48 -0.09 0.00 -1.06 0.00 0.00 56.10 54.47 2qqp s TRP 248 Cb 0.00 0.07 0.00 0.00 -1.16 0.00 0.00 33.47 32.39 2qqp s TRP 248 CO 0.00 -0.68 0.17 1.67 -4.06 0.00 0.00 176.95 174.05 2qqp s TRP 249 N -3.88 0.03 -0.08 1.66 1.48 -0.07 -0.17 118.94 117.91 2qqp s TRP 249 Ca 0.09 -0.15 0.05 0.00 -1.06 0.00 0.00 56.10 55.03 2qqp s TRP 249 Cb 0.03 -0.03 -0.01 0.00 -1.16 0.00 0.00 33.47 32.30 2qqp s TRP 249 CO -0.07 -0.35 -0.24 0.08 -4.06 0.00 0.00 176.95 172.32 2qqp s VAL 250 N -1.80 2.02 0.15 -0.66 1.01 -0.55 -2.61 120.40 117.96 2qqp s VAL 250 Ca -0.11 -1.02 0.10 0.00 0.00 0.00 0.00 61.98 60.94 2qqp s VAL 250 Cb -0.05 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2qqp s VAL 250 CO 0.00 0.56 -0.22 -0.83 0.00 0.00 0.00 175.10 174.60 2qqp s GLY 251 N 0.08 1.48 -0.29 4.51 0.00 -0.32 -1.83 107.32 110.95 2qqp s GLY 251 Ca -0.11 -1.46 -0.23 0.00 0.00 0.00 0.00 44.72 42.91 2qqp s GLY 251 CO 0.06 -1.48 1.13 0.00 0.00 0.00 0.00 173.10 172.81 2qqp s ALA 252 N -1.52 -2.10 0.08 3.20 0.00 -0.83 -1.39 121.76 119.20 2qqp s ALA 252 Ca 0.14 1.88 -0.20 0.00 0.00 0.00 0.00 51.96 53.78 2qqp s ALA 252 Cb -0.08 -1.58 -0.07 0.00 0.00 0.00 0.00 23.12 21.39 2qqp s ALA 252 CO 0.07 -0.22 0.58 -1.01 0.00 0.00 0.00 175.76 175.18 2qqp s HIS 253 N 0.36 3.81 -0.03 0.00 3.76 -1.26 -1.98 115.29 119.94 2qqp s HIS 253 Ca 0.02 1.30 0.00 0.00 -0.15 0.00 0.00 55.06 56.23 2qqp s HIS 253 Cb -0.05 -2.52 0.03 0.00 1.11 0.00 0.00 32.58 31.15 2qqp s HIS 253 CO -0.10 0.57 0.01 0.42 -0.85 0.00 0.00 174.74 174.79 2qqp s ILE 254 N -1.07 0.17 0.27 0.60 1.01 0.61 -4.94 121.20 117.86 2qqp s ILE 254 Ca 0.29 0.12 -0.16 0.00 0.00 0.00 0.00 60.65 60.90 2qqp s ILE 254 Cb -0.20 -0.28 -0.09 0.00 0.01 0.00 0.00 42.46 41.90 2qqp s ILE 254 CO 0.19 0.16 0.71 -2.16 0.00 0.00 0.00 174.94 173.84 2qqp s PRO 255 N 1.19 4.08 -0.09 2.79 0.04 -1.26 -1.48 135.00 140.27 2qqp s PRO 255 Ca -0.07 0.71 -0.06 0.00 0.04 0.00 0.00 61.00 61.62 2qqp s PRO 255 Cb -0.13 -2.62 0.03 0.00 0.04 0.00 0.00 34.50 31.82 2qqp s PRO 255 CO -0.02 0.26 0.21 0.08 0.04 0.00 0.00 177.00 177.58 2qqp s VAL 256 N -1.79 -0.02 -0.08 -0.36 1.01 -1.26 -4.84 120.40 113.06 2qqp s VAL 256 Ca 0.49 0.09 0.02 0.00 0.00 0.00 0.00 61.98 62.58 2qqp s VAL 256 Cb -0.13 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 2qqp s VAL 256 CO 0.19 0.04 -0.15 -0.54 0.00 0.00 0.00 175.10 174.64 2qqp s LYS 257 N 0.75 2.87 0.62 2.72 1.02 -1.26 -4.82 119.74 121.64 2qqp s LYS 257 Ca -0.05 -0.71 -0.12 0.00 0.02 0.00 0.00 55.97 55.10 2qqp s LYS 257 Cb -0.07 -2.46 -0.04 0.00 -0.52 0.00 0.00 37.83 34.75 2qqp s LYS 257 CO -0.04 0.43 1.03 -1.25 -0.92 0.00 0.00 175.35 174.60 2qqp s PRO 258 N -0.24 3.48 -0.20 -1.68 0.04 -1.26 -4.69 135.00 130.46 2qqp s PRO 258 Ca 0.01 0.87 0.00 0.00 0.04 0.00 0.00 61.00 61.92 2qqp s PRO 258 Cb -0.13 -2.06 0.05 0.00 0.04 0.00 0.00 34.50 32.39 2qqp s PRO 258 CO 0.03 -0.66 -0.06 -1.14 0.04 0.00 0.00 177.00 175.21 2qqp s GLN 259 N -4.88 1.62 -0.67 4.56 -0.44 -0.80 -4.90 119.66 114.16 2qqp s GLN 259 Ca 0.57 -0.78 -0.23 0.00 -2.50 0.00 0.00 55.36 52.42 2qqp s GLN 259 Cb -0.12 -2.35 -0.19 0.00 -1.64 0.00 0.00 33.01 28.72 2qqp s GLN 259 CO 0.49 -0.51 1.88 0.43 0.50 0.00 0.00 175.29 178.09 2qqp n SER 260 N 4.76 2.34 -4.47 6.67 7.64 -1.26 0.10 113.62 129.40 2qqp n SER 260 Ca -0.13 -2.65 -0.37 0.00 1.01 0.00 0.00 58.87 56.74 2qqp n SER 260 Cb 0.46 -1.03 -0.03 0.00 -1.01 0.00 0.00 64.21 62.60 2qqp n SER 260 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qqp n GLU 261 N 7.08 2.41 -1.75 1.43 1.02 0.82 -4.72 120.64 126.93 2qqp n GLU 261 Ca 0.49 -2.82 -0.37 0.00 -0.02 0.00 0.00 57.16 54.44 2qqp n GLU 261 Cb 0.40 -3.55 0.06 0.00 -0.02 0.00 0.00 31.44 28.33 2qqp n GLU 261 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2qqp s THR 262 N 7.06 2.04 -0.00 2.62 -1.32 -1.26 -3.03 115.64 121.75 2qqp s THR 262 Ca 0.60 0.03 -0.15 0.00 -1.21 0.00 0.00 61.69 60.95 2qqp s THR 262 Cb 0.03 -3.01 -0.06 0.00 -1.51 0.00 0.00 72.50 67.95 2qqp s THR 262 CO 0.10 -0.00 0.42 -0.63 -2.21 0.00 0.00 174.62 172.29 2qqp s ILE 263 N -1.36 5.02 0.65 5.08 -1.09 -0.27 -4.80 121.20 124.43 2qqp s ILE 263 Ca 0.79 0.86 -0.16 0.00 -2.23 0.00 0.00 60.65 59.91 2qqp s ILE 263 Cb -0.39 -3.72 -0.00 0.00 -1.58 0.00 0.00 42.46 36.77 2qqp s ILE 263 CO 0.42 0.57 1.17 -2.84 -1.23 0.00 0.00 174.94 173.03 2qqp s PRO 264 N -1.02 2.69 -0.38 2.79 0.02 -1.26 -3.05 135.00 134.78 2qqp s PRO 264 Ca 0.24 1.64 -0.19 0.00 0.02 0.00 0.00 61.00 62.71 2qqp s PRO 264 Cb -0.17 -1.91 0.01 0.00 0.02 0.00 0.00 34.50 32.45 2qqp s PRO 264 CO 0.13 -1.38 0.53 0.00 -0.33 0.00 0.00 177.00 175.95 2qqp s ALA 265 N -1.98 3.44 0.46 -1.55 0.00 -1.26 -4.23 121.76 116.64 2qqp s ALA 265 Ca 0.73 -1.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 2qqp s ALA 265 Cb -0.26 -3.09 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 2qqp s ALA 265 CO 0.39 -1.41 0.70 0.00 0.00 0.00 0.00 175.76 175.44 2qqp s ALA 266 N 2.45 3.64 0.00 0.00 0.00 0.23 -4.88 121.76 123.20 2qqp s ALA 266 Ca 0.18 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.22 2qqp s ALA 266 Cb -0.15 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.72 2qqp s ALA 266 CO 0.15 -0.38 0.00 -1.91 0.00 0.00 0.00 175.76 173.62 2qqp n GLU 267 N -2.13 0.00 0.36 0.00 4.07 -1.26 -0.61 120.64 121.07 2qqp n GLU 267 Ca 0.01 0.00 -0.17 0.00 -0.06 0.00 0.00 57.16 56.93 2qqp n GLU 267 Cb 0.57 0.00 -0.09 0.00 -0.06 0.00 0.00 31.44 31.86 2qqp n GLU 267 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 2qqp h ARG 268 N 0.00 -1.00 -6.06 5.31 2.43 -1.96 -2.84 114.38 110.26 2qqp h ARG 268 Ca 0.00 0.07 -0.58 0.00 -0.81 0.00 0.00 59.98 58.66 2qqp h ARG 268 Cb 0.00 0.23 -0.11 0.00 -0.42 0.00 0.00 29.97 29.67 2qqp h ARG 268 CO 0.00 -0.67 -0.62 -0.06 -1.51 0.00 0.00 179.97 177.11 2qqp s PHE 269 N -5.59 2.56 -0.01 2.20 2.99 -1.26 -2.59 117.98 116.27 2qqp s PHE 269 Ca -0.17 -0.40 -0.06 0.00 0.00 0.00 0.00 56.93 56.31 2qqp s PHE 269 Cb 0.03 -1.43 0.00 0.00 0.00 0.00 0.00 43.02 41.63 2qqp s PHE 269 CO 0.54 0.50 0.12 -1.12 -0.00 0.00 0.00 175.22 175.26 2qqp s SER 270 N -3.70 -0.00 0.42 1.36 0.01 -0.08 -4.78 113.70 106.92 2qqp s SER 270 Ca 0.34 -0.09 -0.22 0.00 1.31 0.00 0.00 55.95 57.29 2qqp s SER 270 Cb -0.01 0.22 -0.10 0.00 0.21 0.00 0.00 66.02 66.33 2qqp s SER 270 CO 0.19 -0.26 0.99 0.00 0.41 0.00 0.00 173.24 174.57 2qqp s ALA 271 N -0.94 3.03 0.33 1.44 0.00 -1.26 0.54 121.76 124.91 2qqp s ALA 271 Ca -0.10 0.52 -0.07 0.00 0.00 0.00 0.00 51.96 52.31 2qqp s ALA 271 Cb -0.06 -3.20 0.01 0.00 0.00 0.00 0.00 23.12 19.87 2qqp s ALA 271 CO 0.01 -0.03 0.54 0.20 0.00 0.00 0.00 175.76 176.48 2qqp s GLY 272 N -1.94 1.10 -0.05 0.00 0.00 0.50 -4.68 107.32 102.26 2qqp s GLY 272 Ca 0.61 -1.26 -0.00 0.00 0.00 0.00 0.00 44.72 44.07 2qqp s GLY 272 CO 0.19 -0.80 -0.01 -0.56 0.00 0.00 0.00 173.10 171.92 2qqp s SER 273 N -3.17 1.11 -0.28 1.64 0.01 -1.26 -0.79 113.70 110.96 2qqp s SER 273 Ca 0.26 -0.08 -0.19 0.00 1.31 0.00 0.00 55.95 57.25 2qqp s SER 273 Cb -0.01 -0.38 -0.02 0.00 0.21 0.00 0.00 66.02 65.82 2qqp s SER 273 CO 0.17 -0.13 0.58 -0.32 0.41 0.00 0.00 173.24 173.94 2qqp s MET 274 N 1.44 4.00 -0.16 12.44 0.00 -1.25 -1.04 119.30 134.73 2qqp s MET 274 Ca -0.03 0.34 -0.05 0.00 0.00 0.00 0.00 55.69 55.95 2qqp s MET 274 Cb -0.13 -3.68 -0.03 0.00 0.00 0.00 0.00 34.83 30.98 2qqp s MET 274 CO -0.03 -0.45 0.02 -0.08 0.00 0.00 0.00 175.02 174.48 2qqp s THR 275 N 2.46 4.41 -0.38 10.11 -1.32 0.55 -2.04 115.64 129.42 2qqp s THR 275 Ca 0.23 -0.18 0.01 0.00 -1.21 0.00 0.00 61.69 60.55 2qqp s THR 275 Cb -0.15 -2.95 0.14 0.00 -1.51 0.00 0.00 72.50 68.02 2qqp s THR 275 CO 0.10 0.49 0.22 -0.69 -2.21 0.00 0.00 174.62 172.53 2qqp s VAL 276 N 0.23 0.61 -0.54 5.08 1.01 -1.17 -1.02 120.40 124.60 2qqp s VAL 276 Ca 0.01 -2.02 -0.23 0.00 0.00 0.00 0.00 61.98 59.75 2qqp s VAL 276 Cb -0.13 -1.44 0.05 0.00 0.00 0.00 0.00 36.38 34.85 2qqp s VAL 276 CO 0.01 -0.95 0.86 -0.94 0.00 0.00 0.00 175.10 174.09 2qqp s SER 277 N 0.81 6.31 0.31 3.32 1.04 -0.45 -2.61 113.70 122.43 2qqp s SER 277 Ca 0.18 -0.48 -0.28 0.00 0.48 0.00 0.00 55.95 55.85 2qqp s SER 277 Cb -0.24 -2.40 -0.09 0.00 0.10 0.00 0.00 66.02 63.39 2qqp s SER 277 CO 0.01 -1.14 1.07 0.00 0.98 0.00 0.00 173.24 174.15 2qqp s ALA 278 N 3.62 3.31 0.25 5.32 0.00 -1.26 -0.67 121.76 132.34 2qqp s ALA 278 Ca 0.27 0.82 -0.00 0.00 0.00 0.00 0.00 51.96 53.04 2qqp s ALA 278 Cb -0.14 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.68 2qqp s ALA 278 CO 0.17 -0.13 0.33 0.45 0.00 0.00 0.00 175.76 176.58 2qqp n SER 279 N 0.88 -0.90 -4.46 0.00 2.88 -1.25 -0.18 113.62 110.58 2qqp n SER 279 Ca 0.00 -2.41 -0.31 0.00 -1.33 0.00 0.00 58.87 54.82 2qqp n SER 279 Cb 0.46 1.73 -0.13 0.00 -0.75 0.00 0.00 64.21 65.52 2qqp n SER 279 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2qqp s ASN 280 N -2.59 3.86 -0.17 -3.46 0.01 -1.26 0.84 114.94 112.17 2qqp s ASN 280 Ca 0.22 -0.38 -0.29 0.00 -0.71 0.00 0.00 52.86 51.71 2qqp s ASN 280 Cb -0.00 -0.67 -0.05 0.00 0.41 0.00 0.00 41.25 40.94 2qqp s ASN 280 CO 0.16 0.27 1.88 0.00 -1.51 0.00 0.00 177.10 177.90 2qqp s ALA 281 N -0.89 3.15 0.62 0.60 0.00 -1.26 -4.68 121.76 119.30 2qqp s ALA 281 Ca 0.14 0.74 0.22 0.00 0.00 0.00 0.00 51.96 53.05 2qqp s ALA 281 Cb -0.11 -3.93 0.94 0.00 0.00 0.00 0.00 23.12 20.03 2qqp s ALA 281 CO 0.05 -2.16 1.45 0.82 0.00 0.00 0.00 175.76 175.92 2qqp h ILE 282 N 6.37 0.08 0.00 0.00 1.08 -1.98 -3.12 117.51 119.94 2qqp h ILE 282 Ca -0.39 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.05 2qqp h ILE 282 Cb 1.20 0.23 -0.00 0.00 -3.07 0.00 0.00 36.82 35.18 2qqp h ILE 282 CO 0.98 0.00 -0.49 0.49 -0.69 0.00 0.00 178.15 178.44 2qqp n PHE 283 N -3.13 0.00 -1.07 1.37 0.99 -1.26 -4.97 117.46 109.40 2qqp n PHE 283 Ca 0.11 0.00 -0.33 0.00 -0.00 0.00 0.00 57.45 57.23 2qqp n PHE 283 Cb 1.06 -0.11 0.13 0.00 -1.00 0.00 0.00 39.48 39.57 2qqp n PHE 283 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 2qqp n GLN 284 N -3.52 0.12 -1.56 -1.08 3.00 -1.18 -4.94 117.38 108.23 2qqp n GLN 284 Ca -0.04 0.12 -0.45 0.00 -0.01 0.00 0.00 57.00 56.61 2qqp n GLN 284 Cb 0.23 -2.41 -0.04 0.00 0.00 0.00 0.00 30.24 28.01 2qqp n GLN 284 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 2qqp n PRO 285 N -3.29 1.72 -0.19 -1.09 -0.04 -1.26 -4.47 135.00 126.37 2qqp n PRO 285 Ca 0.13 0.47 -0.07 0.00 -0.04 0.00 0.00 63.50 63.99 2qqp n PRO 285 Cb 0.51 -3.02 -0.02 0.00 -0.04 0.00 0.00 33.50 30.93 2qqp n PRO 285 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2qqp h SER 286 N 14.31 -1.34 0.00 3.54 0.02 -1.86 0.52 113.55 128.74 2qqp h SER 286 Ca -0.37 0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2qqp h SER 286 Cb 1.26 0.62 0.00 0.00 0.14 0.00 0.00 62.40 64.43 2qqp h SER 286 CO 0.98 -0.33 0.00 -0.46 -1.14 0.00 0.00 176.83 175.88 2qqp n ASN 287 N -5.42 0.00 0.01 3.07 6.94 -1.26 -3.12 115.26 115.49 2qqp n ASN 287 Ca 0.02 -0.26 0.00 0.00 -0.02 0.00 0.00 54.58 54.32 2qqp n ASN 287 Cb 0.35 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.77 2qqp n ASN 287 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2qqp n THR 288 N -0.57 0.04 -4.89 5.53 -1.04 0.11 -4.67 114.28 108.79 2qqp n THR 288 Ca 0.00 0.01 -0.31 0.00 -2.04 0.00 0.00 64.05 61.72 2qqp n THR 288 Cb 0.00 -0.86 -0.14 0.00 -1.82 0.00 0.00 70.33 67.52 2qqp n THR 288 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2qqp s VAL 289 N -2.00 2.42 0.42 12.58 0.11 0.14 -4.19 120.40 129.88 2qqp s VAL 289 Ca 0.00 -1.21 0.06 0.00 -2.93 0.00 0.00 61.98 57.90 2qqp s VAL 289 Cb 0.00 -1.95 -0.07 0.00 -1.53 0.00 0.00 36.38 32.82 2qqp s VAL 289 CO 0.00 0.42 0.02 0.00 -3.33 0.00 0.00 175.10 172.21 2qqp s ALA 290 N -0.80 3.29 -0.31 1.54 0.00 -0.77 -4.21 121.76 120.49 2qqp s ALA 290 Ca 0.12 -2.11 0.18 0.00 0.00 0.00 0.00 51.96 50.16 2qqp s ALA 290 Cb -0.10 0.12 0.47 0.00 0.00 0.00 0.00 23.12 23.61 2qqp s ALA 290 CO 0.02 -0.11 0.99 -2.13 0.00 0.00 0.00 175.76 174.53 2qqp n ARG 291 N -1.02 1.38 -1.75 0.00 0.63 0.25 -1.82 116.66 114.34 2qqp n ARG 291 Ca -0.06 -3.36 -0.35 0.00 -0.92 0.00 0.00 57.85 53.15 2qqp n ARG 291 Cb 0.67 -1.37 0.06 0.00 0.45 0.00 0.00 32.46 32.27 2qqp n ARG 291 CO 0.00 0.00 0.00 0.96 -2.51 0.00 0.00 177.63 176.08 2qqp s ILE 292 N -3.37 2.46 -0.17 5.15 -0.00 -1.11 -3.87 121.20 120.29 2qqp s ILE 292 Ca 0.28 0.26 -0.04 0.00 -0.00 0.00 0.00 60.65 61.15 2qqp s ILE 292 Cb 0.43 -2.98 -0.03 0.00 -0.00 0.00 0.00 42.46 39.89 2qqp s ILE 292 CO 0.01 -0.09 -0.03 -0.69 -0.00 0.00 0.00 174.94 174.14 2qqp s VAL 293 N -1.75 3.86 -0.22 8.37 1.01 0.16 -2.75 120.40 129.08 2qqp s VAL 293 Ca 0.76 -0.36 -0.00 0.00 0.00 0.00 0.00 61.98 62.38 2qqp s VAL 293 Cb -0.30 -2.71 0.06 0.00 0.00 0.00 0.00 36.38 33.43 2qqp s VAL 293 CO 0.39 0.47 -0.03 0.86 0.00 0.00 0.00 175.10 176.80 2qqp s TRP 294 N 0.57 1.96 0.36 5.22 -0.00 -0.08 -1.34 118.94 125.63 2qqp s TRP 294 Ca -0.02 -1.46 0.05 0.00 -0.00 0.00 0.00 56.10 54.67 2qqp s TRP 294 Cb -0.14 -1.40 -0.07 0.00 -0.00 0.00 0.00 33.47 31.85 2qqp s TRP 294 CO 0.02 -0.72 0.03 -1.54 -0.00 0.00 0.00 176.95 174.75 2qqp s SER 295 N 1.54 3.06 -0.24 5.86 1.04 -0.19 0.24 113.70 125.01 2qqp s SER 295 Ca -0.04 -1.37 -0.03 0.00 0.48 0.00 0.00 55.95 54.99 2qqp s SER 295 Cb -0.18 -0.23 0.11 0.00 0.10 0.00 0.00 66.02 65.82 2qqp s SER 295 CO -0.07 -0.53 0.23 -0.63 0.98 0.00 0.00 173.24 173.23 2qqp s ILE 296 N -3.02 -0.31 0.00 -1.02 1.01 0.19 -0.33 121.20 117.72 2qqp s ILE 296 Ca 0.36 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.67 2qqp s ILE 296 Cb 0.09 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.73 2qqp s ILE 296 CO 0.17 -0.37 0.00 0.41 0.00 0.00 0.00 174.94 175.14 2qqp n THR 297 N 5.31 0.00 0.50 2.92 -1.04 -0.21 -2.03 114.28 119.73 2qqp n THR 297 Ca -0.04 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.02 2qqp n THR 297 Cb 0.47 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 68.96 2qqp n THR 297 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2qqp n PRO 298 N -2.87 2.48 -2.27 -2.82 -0.04 -1.26 -4.51 135.00 123.71 2qqp n PRO 298 Ca 0.00 -0.44 -0.41 0.00 -0.04 0.00 0.00 63.50 62.61 2qqp n PRO 298 Cb 0.00 -1.08 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 2qqp n PRO 298 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2qqp s LEU 299 N -1.95 4.42 0.31 1.53 2.96 -0.86 -4.91 118.68 120.19 2qqp s LEU 299 Ca 0.08 2.33 -0.29 0.00 -0.22 0.00 0.00 54.13 56.03 2qqp s LEU 299 Cb 0.09 -3.61 -0.11 0.00 0.50 0.00 0.00 46.19 43.06 2qqp s LEU 299 CO 0.33 -0.49 1.51 -2.84 -1.32 0.00 0.00 176.35 173.54 2qqp s PRO 300 N -0.04 4.16 -0.04 0.98 0.02 -1.26 0.74 135.00 139.58 2qqp s PRO 300 Ca 0.56 2.49 -0.36 0.00 0.02 0.00 0.00 61.00 63.72 2qqp s PRO 300 Cb -0.35 -3.03 -0.14 0.00 0.02 0.00 0.00 34.50 31.00 2qqp s PRO 300 CO 0.37 -0.52 1.69 1.55 -0.33 0.00 0.00 177.00 179.75 2qqp n VAL 301 N 1.57 0.28 -3.75 3.83 3.14 -0.26 -3.90 118.33 119.24 2qqp n VAL 301 Ca 0.05 -0.05 -0.16 0.00 -2.96 0.00 0.00 64.34 61.22 2qqp n VAL 301 Cb 0.39 -1.49 -0.16 0.00 -1.06 0.00 0.00 33.84 31.52 2qqp n VAL 301 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qqp s ALA 302 N 2.59 0.09 -0.18 1.55 0.00 -1.26 -4.83 121.76 119.72 2qqp s ALA 302 Ca 0.89 0.30 -0.36 0.00 0.00 0.00 0.00 51.96 52.80 2qqp s ALA 302 Cb -0.81 -0.33 -0.12 0.00 0.00 0.00 0.00 23.12 21.86 2qqp s ALA 302 CO 0.50 -0.19 1.91 2.41 0.00 0.00 0.00 175.76 180.39 2qqp n THR 303 N 4.41 0.46 -3.22 0.00 -1.04 -1.26 -4.91 114.28 108.72 2qqp n THR 303 Ca -0.23 -0.13 -0.42 0.00 -2.04 0.00 0.00 64.05 61.23 2qqp n THR 303 Cb 0.50 -1.71 -0.08 0.00 -1.82 0.00 0.00 70.33 67.22 2qqp n THR 303 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2qqp s VAL 304 N 4.57 4.97 -0.10 12.58 1.01 -1.26 -4.45 120.40 137.72 2qqp s VAL 304 Ca 0.97 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 63.05 2qqp s VAL 304 Cb -0.80 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 31.50 2qqp s VAL 304 CO 0.54 -0.39 -0.07 0.00 0.00 0.00 0.00 175.10 175.18 2qqp s ALA 305 N 2.47 2.92 -0.13 5.51 0.00 0.12 -4.78 121.76 127.88 2qqp s ALA 305 Ca 0.18 -0.87 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 2qqp s ALA 305 Cb -0.15 -1.31 -0.02 0.00 0.00 0.00 0.00 23.12 21.63 2qqp s ALA 305 CO 0.15 0.41 1.23 -1.17 0.00 0.00 0.00 175.76 176.39 2qqp s LEU 306 N -0.28 4.21 -0.15 0.00 0.20 -1.26 0.41 118.68 121.82 2qqp s LEU 306 Ca 0.04 1.73 -0.14 0.00 0.69 0.00 0.00 54.13 56.44 2qqp s LEU 306 Cb -0.13 -3.55 -0.06 0.00 -0.43 0.00 0.00 46.19 42.03 2qqp s LEU 306 CO 0.03 -0.69 -0.29 0.35 -0.29 0.00 0.00 176.35 175.45 2qqp n THR 307 N 5.09 1.42 0.11 3.68 -2.24 -0.35 -4.81 114.28 117.17 2qqp n THR 307 Ca 0.13 0.10 -0.17 0.00 -2.27 0.00 0.00 64.05 61.84 2qqp n THR 307 Cb 0.45 -2.14 -0.13 0.00 -2.10 0.00 0.00 70.33 66.41 2qqp n THR 307 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2qqp h THR 308 N -0.82 1.47 -2.02 4.28 2.02 -1.78 -3.49 112.91 112.57 2qqp h THR 308 Ca -0.11 -2.97 0.00 0.00 0.77 0.00 0.00 66.41 64.11 2qqp h THR 308 Cb 0.95 2.91 0.00 0.00 -1.74 0.00 0.00 68.15 70.27 2qqp h THR 308 CO -0.06 0.87 0.00 0.61 0.37 0.00 0.00 175.52 177.31 2qqp n GLY 309 N 1.50 -0.76 0.23 2.16 0.00 -1.22 -4.65 105.19 102.44 2qqp n GLY 309 Ca -0.09 -1.71 -0.09 0.00 0.00 0.00 0.00 46.02 44.13 2qqp n GLY 309 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2qqp h THR 310 N -0.73 1.24 0.00 2.61 2.02 -1.92 -3.45 112.91 112.67 2qqp h THR 310 Ca 0.00 -0.88 0.00 0.00 0.77 0.00 0.00 66.41 66.30 2qqp h THR 310 Cb 0.00 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2qqp h THR 310 CO 0.00 0.31 0.00 0.61 0.37 0.00 0.00 175.52 176.81 2qqp n GLY 311 N -0.54 3.00 0.00 2.16 0.00 -1.26 -5.12 105.19 103.43 2qqp n GLY 311 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.04 2qqp n GLY 311 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqp n GLY 312 N -1.25 0.70 3.35 -0.02 0.00 -1.26 -4.54 105.19 102.16 2qqp n GLY 312 Ca 0.00 -0.69 -0.18 0.00 0.00 0.00 0.00 46.02 45.15 2qqp n GLY 312 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2qqp s THR 313 N -0.54 1.18 -0.47 2.61 -1.32 -1.26 -0.06 115.64 115.77 2qqp s THR 313 Ca 0.00 -2.06 0.06 0.00 -1.21 0.00 0.00 61.69 58.49 2qqp s THR 313 Cb 0.00 -2.33 0.19 0.00 -1.51 0.00 0.00 72.50 68.85 2qqp s THR 313 CO 0.00 -0.35 0.73 0.20 -2.21 0.00 0.00 174.62 172.99 2qqp s ASN 314 N -3.32 -1.38 0.43 8.08 0.01 0.70 -4.93 114.94 114.52 2qqp s ASN 314 Ca 0.28 -1.36 -0.22 0.00 -0.71 0.00 0.00 52.86 50.85 2qqp s ASN 314 Cb 0.05 1.80 -0.10 0.00 0.41 0.00 0.00 41.25 43.41 2qqp s ASN 314 CO 0.09 -0.08 0.98 0.54 -1.51 0.00 0.00 177.10 177.12 2qqp s ASN 315 N 1.18 6.83 0.27 -1.22 4.22 -1.26 -2.02 114.94 122.93 2qqp s ASN 315 Ca 0.25 1.80 0.00 0.00 -2.14 0.00 0.00 52.86 52.77 2qqp s ASN 315 Cb -0.00 -2.55 0.00 0.00 1.28 0.00 0.00 41.25 39.97 2qqp s ASN 315 CO -0.06 -0.44 0.00 0.35 -2.04 0.00 0.00 177.10 174.91 2qqp n THR 316 N -0.51 0.00 -1.13 0.54 -2.24 -1.18 -4.94 114.28 104.81 2qqp n THR 316 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 2qqp n THR 316 Cb 0.53 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 2qqp n THR 316 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qqp n SER 317 N -0.81 0.00 -4.23 3.42 3.41 -1.26 -5.03 113.62 109.12 2qqp n SER 317 Ca 0.00 -0.93 -0.29 0.00 -0.26 0.00 0.00 58.87 57.39 2qqp n SER 317 Cb 0.00 0.00 0.26 0.00 -0.26 0.00 0.00 64.21 64.21 2qqp n SER 317 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2qqp s GLY 318 N 0.00 1.51 0.20 5.00 0.00 -1.26 -4.93 107.32 107.84 2qqp s GLY 318 Ca 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 44.72 44.35 2qqp s GLY 318 CO 0.00 0.46 1.53 0.07 0.00 0.00 0.00 173.10 175.16 2qqp h LYS 319 N -2.84 0.54 -6.52 2.90 2.10 -1.97 -3.41 116.57 107.37 2qqp h LYS 319 Ca -0.58 -0.33 -0.49 0.00 -2.00 0.00 0.00 60.65 57.26 2qqp h LYS 319 Cb 1.34 0.03 0.01 0.00 -0.90 0.00 0.00 32.23 32.71 2qqp h LYS 319 CO 0.46 0.93 -0.17 -0.06 -2.00 0.00 0.00 179.45 178.61 2qqp s PHE 320 N -4.05 3.50 -0.27 0.07 0.08 -1.26 -1.10 117.98 114.94 2qqp s PHE 320 Ca -0.07 0.44 -0.29 0.00 0.12 0.00 0.00 56.93 57.13 2qqp s PHE 320 Cb 0.12 -1.96 0.00 0.00 -0.57 0.00 0.00 43.02 40.60 2qqp s PHE 320 CO 0.83 0.12 1.27 0.12 -0.10 0.00 0.00 175.22 177.46 2qqp s PHE 321 N -2.27 2.78 0.05 0.36 5.36 0.23 -3.85 117.98 120.63 2qqp s PHE 321 Ca 0.41 0.94 -0.07 0.00 -0.96 0.00 0.00 56.93 57.26 2qqp s PHE 321 Cb -0.10 -3.79 -0.01 0.00 -0.34 0.00 0.00 43.02 38.78 2qqp s PHE 321 CO 0.35 -1.59 0.13 0.45 -1.46 0.00 0.00 175.22 173.10 2qqp s SER 322 N 2.48 0.15 0.02 6.13 0.15 -1.26 0.56 113.70 121.93 2qqp s SER 322 Ca 0.55 -0.54 -0.02 0.00 0.70 0.00 0.00 55.95 56.64 2qqp s SER 322 Cb -0.17 0.26 -0.01 0.00 -1.71 0.00 0.00 66.02 64.38 2qqp s SER 322 CO 0.20 -0.56 0.02 -0.69 1.20 0.00 0.00 173.24 173.41 2qqp s VAL 323 N -2.86 0.11 -0.28 4.45 1.01 0.14 -3.11 120.40 119.85 2qqp s VAL 323 Ca -0.03 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.10 2qqp s VAL 323 Cb 0.00 -0.36 0.07 0.00 0.00 0.00 0.00 36.38 36.10 2qqp s VAL 323 CO -0.06 -0.49 -0.07 -0.70 0.00 0.00 0.00 175.10 173.79 2qqp s GLU 324 N -1.54 2.02 -0.10 2.72 2.56 -0.86 -0.90 118.70 122.60 2qqp s GLU 324 Ca -0.15 -1.47 -0.09 0.00 0.00 0.00 0.00 54.97 53.26 2qqp s GLU 324 Cb -0.09 -2.96 0.03 0.00 2.00 0.00 0.00 34.13 33.11 2qqp s GLU 324 CO -0.01 -0.67 0.27 0.96 -0.56 0.00 0.00 175.26 175.26 2qqp s ILE 325 N 1.06 -0.00 0.02 -3.70 -4.36 -1.11 0.25 121.20 113.36 2qqp s ILE 325 Ca -0.04 0.01 0.07 0.00 -0.26 0.00 0.00 60.65 60.44 2qqp s ILE 325 Cb -0.20 -0.38 -0.02 0.00 1.25 0.00 0.00 42.46 43.11 2qqp s ILE 325 CO -0.06 0.00 -0.22 1.51 0.24 0.00 0.00 174.94 176.41 2qqp s ASP 326 N 0.22 2.63 0.00 4.36 -4.77 0.91 -2.75 116.67 117.27 2qqp s ASP 326 Ca -0.01 -0.49 0.00 0.00 -3.30 0.00 0.00 52.55 48.75 2qqp s ASP 326 Cb -0.02 -0.25 0.00 0.00 -1.09 0.00 0.00 42.92 41.56 2qqp s ASP 326 CO -0.00 0.21 0.00 0.61 0.70 0.00 0.00 175.17 176.69 2qqp n GLY 327 N 2.05 -0.69 4.01 2.12 0.00 -0.75 -4.14 105.19 107.78 2qqp n GLY 327 Ca -0.17 -0.96 -0.23 0.00 0.00 0.00 0.00 46.02 44.66 2qqp n GLY 327 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qqp s ASN 328 N 0.00 4.40 0.00 1.61 0.01 -1.26 -1.86 114.94 117.84 2qqp s ASN 328 Ca 0.00 -0.61 0.00 0.00 -0.71 0.00 0.00 52.86 51.54 2qqp s ASN 328 Cb 0.00 0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.95 2qqp s ASN 328 CO 0.00 -1.85 0.65 0.52 -1.51 0.00 0.00 177.10 174.91 2qqp n VAL 329 N -2.74 0.00 -0.39 1.60 0.31 -1.26 -3.13 118.33 112.72 2qqp n VAL 329 Ca 0.17 1.15 0.33 0.00 -0.01 0.00 0.00 64.34 65.98 2qqp n VAL 329 Cb 0.61 -1.99 0.56 0.00 -0.91 0.00 0.00 33.84 32.11 2qqp n VAL 329 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2qqp n ASN 330 N -1.15 0.18 -4.46 4.52 0.23 -1.26 -3.97 115.26 109.34 2qqp n ASN 330 Ca 0.00 1.16 -0.38 0.00 -0.53 0.00 0.00 54.58 54.83 2qqp n ASN 330 Cb 0.00 -0.57 0.04 0.00 -2.08 0.00 0.00 39.78 37.17 2qqp n ASN 330 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2qqp n SER 331 N -4.37 -1.12 -3.67 0.53 7.64 -1.18 -4.43 113.62 107.01 2qqp n SER 331 Ca 0.33 0.72 -0.09 0.00 1.01 0.00 0.00 58.87 60.85 2qqp n SER 331 Cb 1.29 -1.17 -0.10 0.00 -1.01 0.00 0.00 64.21 63.23 2qqp n SER 331 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2qqp s VAL 332 N -1.74 -0.41 0.39 0.44 1.01 -1.26 -4.25 120.40 114.59 2qqp s VAL 332 Ca 0.68 0.12 0.03 0.00 0.00 0.00 0.00 61.98 62.82 2qqp s VAL 332 Cb -0.44 -0.68 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 2qqp s VAL 332 CO 0.55 0.05 0.57 0.26 0.00 0.00 0.00 175.10 176.53 2qqp s TRP 333 N 2.14 3.17 0.21 5.22 0.51 -0.61 -1.21 118.94 128.37 2qqp s TRP 333 Ca -0.05 0.00 -0.06 0.00 -2.12 0.00 0.00 56.10 53.87 2qqp s TRP 333 Cb -0.10 -2.15 -0.03 0.00 -0.81 0.00 0.00 33.47 30.38 2qqp s TRP 333 CO -0.13 -0.18 0.25 -0.08 -0.51 0.00 0.00 176.95 176.30 2qqp s THR 334 N -2.36 0.01 0.00 2.01 -1.32 0.16 -2.25 115.64 111.89 2qqp s THR 334 Ca 0.47 -1.76 0.00 0.00 -1.21 0.00 0.00 61.69 59.19 2qqp s THR 334 Cb -0.10 -2.34 0.00 0.00 -1.51 0.00 0.00 72.50 68.55 2qqp s THR 334 CO 0.34 -0.04 0.00 2.22 -2.21 0.00 0.00 174.62 174.93 2qqp n PHE 335 N -0.30 0.00 -2.80 9.09 1.16 -0.89 -0.70 117.46 123.02 2qqp n PHE 335 Ca -0.00 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.15 2qqp n PHE 335 Cb 0.64 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.48 2qqp n PHE 335 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 2qqp s THR 336 N -1.96 4.49 -0.36 1.97 2.01 -1.26 -0.83 115.64 119.69 2qqp s THR 336 Ca 0.00 0.92 -0.31 0.00 0.31 0.00 0.00 61.69 62.61 2qqp s THR 336 Cb 0.00 -4.42 -0.09 0.00 0.01 0.00 0.00 72.50 68.00 2qqp s THR 336 CO 0.00 -0.76 2.26 0.00 -0.69 0.00 0.00 174.62 175.44 2qqp n ALA 337 N 7.10 1.23 -0.14 7.40 0.00 -0.04 -4.84 120.51 131.21 2qqp n ALA 337 Ca 0.07 -0.26 0.26 0.00 0.00 0.00 0.00 53.44 53.51 2qqp n ALA 337 Cb 0.48 -2.75 0.71 0.00 0.00 0.00 0.00 19.45 17.89 2qqp n ALA 337 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2qqp h PRO 338 N 14.32 0.01 -3.51 0.00 0.11 -1.83 -3.37 132.00 137.73 2qqp h PRO 338 Ca -0.30 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.77 2qqp h PRO 338 Cb 1.29 -0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.30 2qqp h PRO 338 CO 1.04 0.01 -0.07 0.00 -0.21 0.00 0.00 178.00 178.77 2qqp s ALA 339 N -5.00 -0.51 0.57 -0.75 0.00 -1.26 -4.64 121.76 110.16 2qqp s ALA 339 Ca -0.05 -0.63 -0.18 0.00 0.00 0.00 0.00 51.96 51.10 2qqp s ALA 339 Cb 0.21 0.96 -0.08 0.00 0.00 0.00 0.00 23.12 24.21 2qqp s ALA 339 CO 0.76 -0.83 0.64 0.43 0.00 0.00 0.00 175.76 176.76 2qqp n SER 340 N -0.36 -0.57 -3.71 0.00 7.64 -1.26 -4.25 113.62 111.10 2qqp n SER 340 Ca -0.05 0.77 -0.12 0.00 1.01 0.00 0.00 58.87 60.47 2qqp n SER 340 Cb 0.62 -1.22 -0.13 0.00 -1.01 0.00 0.00 64.21 62.47 2qqp n SER 340 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2qqp s ILE 341 N -1.65 -0.10 0.53 0.44 1.01 0.13 -1.26 121.20 120.29 2qqp s ILE 341 Ca 0.70 0.16 0.07 0.00 0.00 0.00 0.00 60.65 61.58 2qqp s ILE 341 Cb -0.45 -0.41 0.07 0.00 0.01 0.00 0.00 42.46 41.68 2qqp s ILE 341 CO 0.53 0.07 0.57 0.18 0.00 0.00 0.00 174.94 176.28 2qqp n LEU 342 N 4.43 0.00 0.00 2.97 4.77 0.67 0.74 117.00 130.58 2qqp n LEU 342 Ca -0.22 -2.49 0.00 0.00 -0.03 0.00 0.00 56.01 53.27 2qqp n LEU 342 Cb 0.53 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 2qqp n LEU 342 CO 0.12 -0.63 0.00 0.00 -1.33 0.00 0.00 177.39 175.54 2qqp n ALA 343 N -2.16 0.00 -3.97 -1.18 0.00 -0.96 -3.35 120.51 108.89 2qqp n ALA 343 Ca -0.14 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.04 2qqp n ALA 343 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 2qqp n ALA 343 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2qqp n GLU 344 N -0.33 -3.35 0.00 0.00 1.02 -1.26 -2.77 120.64 113.94 2qqp n GLU 344 Ca 0.00 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 2qqp n GLU 344 Cb 0.00 -4.59 0.00 0.00 -0.02 0.00 0.00 31.44 26.83 2qqp n GLU 344 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qqp n GLY 345 N -1.94 1.06 3.77 0.62 0.00 -1.26 -4.90 105.19 102.54 2qqp n GLY 345 Ca -0.28 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.33 2qqp n GLY 345 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qqp s GLU 346 N 0.00 3.86 0.48 1.61 0.41 -1.12 -4.95 118.70 119.00 2qqp s GLU 346 Ca 0.00 2.49 -0.23 0.00 -0.41 0.00 0.00 54.97 56.82 2qqp s GLU 346 Cb 0.00 -2.79 -0.07 0.00 -1.78 0.00 0.00 34.13 29.50 2qqp s GLU 346 CO 0.00 -0.70 1.27 -1.25 -0.49 0.00 0.00 175.26 174.09 2qqp s PRO 347 N -2.30 3.55 -0.08 0.39 0.04 -1.26 -2.27 135.00 133.07 2qqp s PRO 347 Ca 0.57 2.04 -0.09 0.00 0.04 0.00 0.00 61.00 63.56 2qqp s PRO 347 Cb -0.45 -2.42 -0.04 0.00 0.04 0.00 0.00 34.50 31.63 2qqp s PRO 347 CO 0.59 -0.80 -0.19 0.34 0.04 0.00 0.00 177.00 176.99 2qqp n PHE 348 N -0.58 0.00 -4.46 0.56 -0.00 0.23 -4.70 117.46 108.51 2qqp n PHE 348 Ca 0.08 0.00 -0.22 0.00 -0.00 0.00 0.00 57.45 57.31 2qqp n PHE 348 Cb 0.46 -0.36 -0.10 0.00 -0.00 0.00 0.00 39.48 39.47 2qqp n PHE 348 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2qqp s ALA 349 N -2.40 2.43 0.08 3.13 0.00 -0.37 -4.62 121.76 120.01 2qqp s ALA 349 Ca -0.17 -1.95 0.01 0.00 0.00 0.00 0.00 51.96 49.85 2qqp s ALA 349 Cb 0.04 0.67 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 2qqp s ALA 349 CO 0.24 -0.31 -0.06 -1.21 0.00 0.00 0.00 175.76 174.42 2qqp s GLU 350 N -3.88 0.76 0.05 0.00 2.02 -1.26 -0.70 118.70 115.69 2qqp s GLU 350 Ca 0.35 -1.26 -0.10 0.00 0.02 0.00 0.00 54.97 53.99 2qqp s GLU 350 Cb 0.08 -0.14 -0.02 0.00 0.10 0.00 0.00 34.13 34.15 2qqp s GLU 350 CO 0.15 -0.03 0.74 -1.91 0.02 0.00 0.00 175.26 174.23 2qqp n GLU 351 N 0.14 -0.13 0.00 1.61 0.00 -1.26 0.12 120.64 121.12 2qqp n GLU 351 Ca -0.14 0.73 0.01 0.00 0.00 0.00 0.00 57.16 57.76 2qqp n GLU 351 Cb 0.60 -1.08 0.04 0.00 0.00 0.00 0.00 31.44 31.00 2qqp n GLU 351 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2qqp n GLY 352 N -1.08 -0.74 3.91 8.31 0.00 -1.26 -4.16 105.19 110.17 2qqp n GLY 352 Ca 0.01 -0.01 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 2qqp n GLY 352 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qqp s ASP 353 N -1.30 4.57 -0.23 1.61 -0.00 0.33 -4.90 116.67 116.75 2qqp s ASP 353 Ca 0.02 0.70 -0.01 0.00 -0.00 0.00 0.00 52.55 53.26 2qqp s ASP 353 Cb 0.01 -1.23 0.07 0.00 -0.00 0.00 0.00 42.92 41.77 2qqp s ASP 353 CO 0.01 -1.84 0.02 -0.89 -0.00 0.00 0.00 175.17 172.47 2qqp s THR 354 N -3.50 0.89 0.16 -1.27 2.01 -1.26 -0.86 115.64 111.80 2qqp s THR 354 Ca 0.62 -0.91 -0.25 0.00 0.31 0.00 0.00 61.69 61.46 2qqp s THR 354 Cb -0.11 -1.38 -0.08 0.00 0.01 0.00 0.00 72.50 70.94 2qqp s THR 354 CO 0.48 -0.26 0.75 -0.89 -0.69 0.00 0.00 174.62 174.01 2qqp s THR 355 N 1.67 4.41 -0.16 -0.82 2.01 -0.01 -3.24 115.64 119.51 2qqp s THR 355 Ca -0.00 1.65 0.00 0.00 0.31 0.00 0.00 61.69 63.64 2qqp s THR 355 Cb -0.18 -4.11 0.03 0.00 0.01 0.00 0.00 72.50 68.25 2qqp s THR 355 CO -0.10 0.53 -0.09 -0.44 -0.69 0.00 0.00 174.62 173.82 2qqp s SER 356 N -1.14 2.78 -0.16 3.53 0.01 0.19 -2.10 113.70 116.80 2qqp s SER 356 Ca 0.35 -0.59 -0.04 0.00 1.31 0.00 0.00 55.95 56.98 2qqp s SER 356 Cb -0.23 -1.05 -0.03 0.00 0.21 0.00 0.00 66.02 64.92 2qqp s SER 356 CO 0.25 -0.12 -0.01 0.12 0.41 0.00 0.00 173.24 173.89 2qqp s PHE 357 N 1.55 3.10 0.32 2.43 5.36 -0.95 0.22 117.98 130.01 2qqp s PHE 357 Ca 0.02 -0.15 0.05 0.00 -0.96 0.00 0.00 56.93 55.89 2qqp s PHE 357 Cb -0.14 -1.97 -0.03 0.00 -0.34 0.00 0.00 43.02 40.54 2qqp s PHE 357 CO -0.09 0.06 0.29 0.45 -1.46 0.00 0.00 175.22 174.47 2qqp s SER 358 N 0.24 1.42 -0.09 6.13 0.15 0.54 -1.57 113.70 120.53 2qqp s SER 358 Ca -0.01 -1.69 -0.00 0.00 0.70 0.00 0.00 55.95 54.95 2qqp s SER 358 Cb -0.13 0.55 0.03 0.00 -1.71 0.00 0.00 66.02 64.75 2qqp s SER 358 CO 0.02 -1.07 -0.04 0.00 1.20 0.00 0.00 173.24 173.35 2qqp s MET 359 N -3.47 1.08 -0.05 5.44 0.23 -1.25 0.45 119.30 121.72 2qqp s MET 359 Ca 0.39 -0.09 -0.20 0.00 -1.03 0.00 0.00 55.69 54.76 2qqp s MET 359 Cb 0.02 -1.24 -0.15 0.00 -1.53 0.00 0.00 34.83 31.94 2qqp s MET 359 CO 0.25 -0.25 0.83 1.15 -2.03 0.00 0.00 175.02 174.98 2qqp h THR 360 N 6.23 0.77 -4.16 3.16 2.02 -1.45 -3.39 112.91 116.09 2qqp h THR 360 Ca -0.27 -1.10 -0.64 0.00 0.77 0.00 0.00 66.41 65.17 2qqp h THR 360 Cb 1.13 1.30 -0.25 0.00 -1.74 0.00 0.00 68.15 68.60 2qqp h THR 360 CO 0.36 0.20 -0.86 -0.89 0.37 0.00 0.00 175.52 174.70 2qqp s THR 361 N -3.35 1.97 -0.37 3.16 2.01 -1.20 -4.88 115.64 112.98 2qqp s THR 361 Ca -0.12 -1.41 0.01 0.00 0.31 0.00 0.00 61.69 60.48 2qqp s THR 361 Cb 0.00 -1.71 0.15 0.00 0.01 0.00 0.00 72.50 70.95 2qqp s THR 361 CO 0.45 0.23 0.24 -0.63 -0.69 0.00 0.00 174.62 174.21 2qqp s ILE 362 N -0.88 0.29 0.85 1.82 1.01 -1.26 -1.63 121.20 121.40 2qqp s ILE 362 Ca 0.10 -1.96 -0.11 0.00 0.00 0.00 0.00 60.65 58.68 2qqp s ILE 362 Cb -0.10 -1.22 0.10 0.00 0.01 0.00 0.00 42.46 41.25 2qqp s ILE 362 CO 0.03 -1.03 1.10 -0.89 0.00 0.00 0.00 174.94 174.15 2qqp s THR 363 N 0.82 2.84 -1.62 2.92 2.01 -0.64 -4.05 115.64 117.92 2qqp s THR 363 Ca 0.21 0.27 0.03 0.00 0.31 0.00 0.00 61.69 62.51 2qqp s THR 363 Cb -0.18 -2.88 0.06 0.00 0.01 0.00 0.00 72.50 69.51 2qqp s THR 363 CO -0.03 -0.35 0.82 0.00 -0.69 0.00 0.00 174.62 174.36 2qqp n ALA 364 N -3.67 1.42 0.00 7.40 0.00 -1.26 -3.55 120.51 120.86 2qqp n ALA 364 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2qqp n ALA 364 Cb 0.56 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.96 2qqp n ALA 364 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qqp n ASP 365 N -1.19 0.00 -4.75 0.00 5.75 -1.26 -4.47 116.55 110.63 2qqp n ASP 365 Ca 0.02 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.57 2qqp n ASP 365 Cb 0.02 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.05 2qqp n ASP 365 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2qqp s THR 366 N -0.14 3.70 -0.11 2.12 -4.23 -1.23 -1.22 115.64 114.53 2qqp s THR 366 Ca 0.00 -1.63 -0.08 0.00 -1.18 0.00 0.00 61.69 58.80 2qqp s THR 366 Cb 0.00 -3.10 0.04 0.00 1.34 0.00 0.00 72.50 70.78 2qqp s THR 366 CO 0.00 -0.30 0.28 -0.69 -0.54 0.00 0.00 174.62 173.37 2qqp s VAL 367 N -2.28 -0.02 -0.03 2.29 1.01 -1.12 -1.62 120.40 118.64 2qqp s VAL 367 Ca 0.34 0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.44 2qqp s VAL 367 Cb -0.06 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 2qqp s VAL 367 CO 0.23 0.02 -0.21 -0.69 0.00 0.00 0.00 175.10 174.45 2qqp s VAL 368 N 0.64 2.46 0.23 2.92 1.01 -0.65 -1.14 120.40 125.87 2qqp s VAL 368 Ca -0.04 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2qqp s VAL 368 Cb -0.05 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 2qqp s VAL 368 CO -0.04 0.58 0.13 -0.72 0.00 0.00 0.00 175.10 175.05 2qqp s TYR 369 N -0.66 1.30 0.00 5.22 -0.85 -1.12 -1.21 117.35 120.04 2qqp s TYR 369 Ca 0.11 -1.34 0.01 0.00 -0.52 0.00 0.00 57.07 55.33 2qqp s TYR 369 Cb -0.10 -0.67 -0.00 0.00 0.38 0.00 0.00 41.96 41.56 2qqp s TYR 369 CO -0.00 -0.56 -0.03 -1.54 -1.52 0.00 0.00 175.55 171.89 2qqp s SER 370 N -3.22 0.34 -0.14 -0.18 1.04 0.17 -3.06 113.70 108.65 2qqp s SER 370 Ca 0.39 -0.11 0.02 0.00 0.48 0.00 0.00 55.95 56.72 2qqp s SER 370 Cb 0.07 -0.02 0.01 0.00 0.10 0.00 0.00 66.02 66.18 2qqp s SER 370 CO 0.13 -0.01 -0.20 -0.69 0.98 0.00 0.00 173.24 173.45 2qqp s VAL 371 N -0.25 2.23 -0.09 5.02 1.01 0.15 -0.34 120.40 128.13 2qqp s VAL 371 Ca -0.01 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.05 2qqp s VAL 371 Cb -0.02 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.48 2qqp s VAL 371 CO -0.00 0.54 -0.11 -0.44 0.00 0.00 0.00 175.10 175.09 2qqp s SER 372 N 0.74 1.96 0.15 3.32 0.01 0.13 -1.48 113.70 118.54 2qqp s SER 372 Ca -0.08 -0.31 -0.10 0.00 1.31 0.00 0.00 55.95 56.77 2qqp s SER 372 Cb -0.16 -0.85 -0.06 0.00 0.21 0.00 0.00 66.02 65.16 2qqp s SER 372 CO 0.00 -0.03 0.47 -0.55 0.41 0.00 0.00 173.24 173.55 2qqp s SER 373 N 1.08 6.65 0.00 2.44 0.15 -1.26 -0.64 113.70 122.12 2qqp s SER 373 Ca -0.07 0.86 -0.06 0.00 0.70 0.00 0.00 55.95 57.38 2qqp s SER 373 Cb -0.14 -2.20 -0.03 0.00 -1.71 0.00 0.00 66.02 61.93 2qqp s SER 373 CO -0.01 0.06 0.84 0.28 1.20 0.00 0.00 173.24 175.61 2qqp h SER 374 N 3.17 -0.19 0.00 5.45 0.02 -1.84 -3.44 113.55 116.73 2qqp h SER 374 Ca -0.48 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.42 2qqp h SER 374 Cb 1.18 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 2qqp h SER 374 CO 0.68 -0.11 0.16 -0.11 -1.14 0.00 0.00 176.83 176.31 2qqp n LEU 375 N -2.74 0.04 -4.75 5.07 7.94 -1.26 -4.81 117.00 116.49 2qqp n LEU 375 Ca -0.03 0.03 -0.37 0.00 -1.11 0.00 0.00 56.01 54.54 2qqp n LEU 375 Cb 0.09 -0.09 0.03 0.00 0.53 0.00 0.00 43.42 43.98 2qqp n LEU 375 CO 0.07 -0.07 0.87 0.42 -1.11 0.00 0.00 177.39 177.56 2qqp s THR 376 N 0.77 2.59 0.00 1.96 -4.23 -1.26 -2.73 115.64 112.73 2qqp s THR 376 Ca 0.13 0.39 0.00 0.00 -1.18 0.00 0.00 61.69 61.02 2qqp s THR 376 Cb -0.13 -3.17 0.00 0.00 1.34 0.00 0.00 72.50 70.54 2qqp s THR 376 CO 0.05 -0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 2qqp n GLY 377 N 0.55 1.14 3.91 3.99 0.00 -1.26 -5.05 105.19 108.47 2qqp n GLY 377 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 2qqp n GLY 377 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qqp s SER 378 N -2.01 6.37 0.27 1.61 1.04 -1.11 -5.05 113.70 114.82 2qqp s SER 378 Ca 0.00 0.80 0.09 0.00 0.48 0.00 0.00 55.95 57.33 2qqp s SER 378 Cb 0.00 -2.19 -0.04 0.00 0.10 0.00 0.00 66.02 63.89 2qqp s SER 378 CO 0.00 -0.38 0.01 -0.94 0.98 0.00 0.00 173.24 172.91 2qqp s SER 379 N -3.65 4.58 0.51 7.02 1.04 -1.26 -4.99 113.70 116.94 2qqp s SER 379 Ca 0.46 -0.64 -0.18 0.00 0.48 0.00 0.00 55.95 56.06 2qqp s SER 379 Cb -0.10 -0.86 -0.07 0.00 0.10 0.00 0.00 66.02 65.09 2qqp s SER 379 CO 0.36 -0.01 1.01 -0.69 0.98 0.00 0.00 173.24 174.90 2qqp s VAL 380 N -2.32 4.11 -0.11 5.02 1.01 -1.26 -4.80 120.40 122.04 2qqp s VAL 380 Ca 0.32 1.14 -0.02 0.00 0.00 0.00 0.00 61.98 63.42 2qqp s VAL 380 Cb -0.06 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 2qqp s VAL 380 CO 0.20 -0.45 -0.01 -0.63 0.00 0.00 0.00 175.10 174.22 2qqp s ILE 381 N -2.32 4.21 0.05 2.22 1.01 -0.55 -4.94 121.20 120.89 2qqp s ILE 381 Ca 0.63 -0.27 -0.01 0.00 0.00 0.00 0.00 60.65 61.00 2qqp s ILE 381 Cb -0.13 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 2qqp s ILE 381 CO 0.26 0.57 -0.03 -0.69 0.00 0.00 0.00 174.94 175.05 2qqp s VAL 382 N -0.53 0.24 -0.14 2.92 1.01 -1.26 0.33 120.40 122.98 2qqp s VAL 382 Ca 0.09 -1.62 -0.30 0.00 0.00 0.00 0.00 61.98 60.15 2qqp s VAL 382 Cb -0.12 -1.26 0.12 0.00 0.00 0.00 0.00 36.38 35.13 2qqp s VAL 382 CO 0.02 -0.87 0.98 -0.60 0.00 0.00 0.00 175.10 174.62 2qqp s ARG 383 N -3.36 0.63 -0.14 2.72 6.06 -1.17 -4.99 118.95 118.70 2qqp s ARG 383 Ca 0.02 0.09 -0.13 0.00 -2.50 0.00 0.00 55.73 53.21 2qqp s ARG 383 Cb 0.04 0.30 -0.05 0.00 0.06 0.00 0.00 34.95 35.30 2qqp s ARG 383 CO -0.08 -0.21 0.28 0.20 -2.50 0.00 0.00 175.30 172.99 2qqp s GLY 384 N -1.30 2.22 0.18 8.12 0.00 -1.26 -2.79 107.32 112.49 2qqp s GLY 384 Ca -0.01 -0.46 0.02 0.00 0.00 0.00 0.00 44.72 44.26 2qqp s GLY 384 CO 0.01 0.31 0.07 3.33 0.00 0.00 0.00 173.10 176.82 2qqp n VAL 385 N 3.27 0.00 -3.34 1.40 0.24 -0.29 -4.83 118.33 114.77 2qqp n VAL 385 Ca -0.13 -1.06 -0.11 0.00 -2.04 0.00 0.00 64.34 61.00 2qqp n VAL 385 Cb 0.52 0.39 -0.07 0.00 -1.47 0.00 0.00 33.84 33.20 2qqp n VAL 385 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2qqp s THR 386 N -2.24 -0.57 0.58 3.34 -4.23 -1.26 -2.79 115.64 108.47 2qqp s THR 386 Ca 0.10 -0.28 -0.18 0.00 -1.18 0.00 0.00 61.69 60.15 2qqp s THR 386 Cb 0.00 -0.94 -0.09 0.00 1.34 0.00 0.00 72.50 72.81 2qqp s THR 386 CO 0.07 -0.28 0.41 2.29 -0.54 0.00 0.00 174.62 176.56 2qqp n LYS 387 N 5.35 0.40 -0.85 3.99 2.85 -0.36 -0.26 118.16 129.29 2qqp n LYS 387 Ca -0.01 0.16 0.00 0.00 -1.05 0.00 0.00 58.31 57.41 2qqp n LYS 387 Cb 0.49 -1.60 0.00 0.00 -0.65 0.00 0.00 35.03 33.27 2qqp n LYS 387 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2qqp n GLY 388 N 1.90 0.27 0.00 2.58 0.00 0.74 -4.82 105.19 105.86 2qqp n GLY 388 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2qqp n GLY 388 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2qqp n SER 389 N -0.33 1.95 -4.29 1.61 2.88 0.65 -3.89 113.62 112.20 2qqp n SER 389 Ca 0.00 -0.85 -0.33 0.00 -1.33 0.00 0.00 58.87 56.35 2qqp n SER 389 Cb 0.16 0.00 0.12 0.00 -0.75 0.00 0.00 64.21 63.75 2qqp n SER 389 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2qqp n GLY 390 N 4.88 -2.55 3.92 0.46 0.00 -1.26 -4.71 105.19 105.93 2qqp n GLY 390 Ca 0.00 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 45.04 2qqp n GLY 390 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qqp s VAL 391 N -2.27 3.89 -0.24 1.61 1.01 -1.26 -4.49 120.40 118.65 2qqp s VAL 391 Ca 0.53 -0.06 -0.07 0.00 0.00 0.00 0.00 61.98 62.38 2qqp s VAL 391 Cb -0.15 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.69 2qqp s VAL 391 CO 0.69 -0.50 0.04 -0.94 0.00 0.00 0.00 175.10 174.39 2qqp s SER 392 N -4.26 4.94 0.24 3.32 1.04 -1.07 -4.97 113.70 112.94 2qqp s SER 392 Ca 0.52 -0.25 -0.05 0.00 0.48 0.00 0.00 55.95 56.65 2qqp s SER 392 Cb -0.10 -1.88 -0.05 0.00 0.10 0.00 0.00 66.02 64.08 2qqp s SER 392 CO 0.44 -0.03 0.49 -0.63 0.98 0.00 0.00 173.24 174.49 2qqp s ILE 393 N 1.58 5.06 -0.38 -1.02 -1.09 -1.26 -3.04 121.20 121.06 2qqp s ILE 393 Ca 0.06 0.05 0.11 0.00 -2.23 0.00 0.00 60.65 58.65 2qqp s ILE 393 Cb -0.15 -3.69 0.36 0.00 -1.58 0.00 0.00 42.46 37.39 2qqp s ILE 393 CO 0.02 -0.19 0.83 0.41 -1.23 0.00 0.00 174.94 174.78 2qqp n THR 394 N -0.58 -0.03 0.00 2.92 -1.04 -0.87 -4.92 114.28 109.76 2qqp n THR 394 Ca -0.02 -3.84 0.00 0.00 -2.04 0.00 0.00 64.05 58.15 2qqp n THR 394 Cb 0.53 0.16 0.00 0.00 -1.82 0.00 0.00 70.33 69.20 2qqp n THR 394 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2qqp n PRO 395 N 0.25 0.00 -3.09 -2.82 -0.01 -1.26 -3.77 135.00 124.29 2qqp n PRO 395 Ca 0.20 0.00 -0.18 0.00 -0.01 0.00 0.00 63.50 63.51 2qqp n PRO 395 Cb 0.69 0.00 0.01 0.00 -0.01 0.00 0.00 33.50 34.19 2qqp n PRO 395 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 175.50 175.57 2qqp s VAL 396 N 0.00 2.83 -0.07 -1.45 1.01 0.03 -4.22 120.40 118.53 2qqp s VAL 396 Ca 0.00 -1.05 -0.03 0.00 0.00 0.00 0.00 61.98 60.90 2qqp s VAL 396 Cb 0.00 -2.87 0.04 0.00 0.00 0.00 0.00 36.38 33.55 2qqp s VAL 396 CO 0.00 0.00 0.16 -0.89 0.00 0.00 0.00 175.10 174.37 2qqp s THR 397 N -2.41 -0.09 -0.16 3.92 2.01 -1.21 -0.37 115.64 117.32 2qqp s THR 397 Ca 0.55 0.21 0.01 0.00 0.31 0.00 0.00 61.69 62.76 2qqp s THR 397 Cb -0.09 -0.26 0.00 0.00 0.01 0.00 0.00 72.50 72.17 2qqp s THR 397 CO 0.33 0.09 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.49 2qqp s VAL 398 N 1.39 2.52 -0.99 3.82 1.01 0.19 -0.24 120.40 128.10 2qqp s VAL 398 Ca -0.07 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.86 2qqp s VAL 398 Cb -0.12 -2.06 -0.13 0.00 0.00 0.00 0.00 36.38 34.07 2qqp s VAL 398 CO -0.06 0.52 1.92 0.61 0.00 0.00 0.00 175.10 178.09 2qqp n GLY 399 N 4.15 1.42 3.29 4.51 0.00 -0.39 -0.91 105.19 117.27 2qqp n GLY 399 Ca -0.19 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.88 2qqp n GLY 399 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qqp s ILE 400 N 9.22 -0.02 0.34 -0.61 2.07 -1.07 -4.23 121.20 126.89 2qqp s ILE 400 Ca 0.65 0.08 -0.29 0.00 -1.41 0.00 0.00 60.65 59.69 2qqp s ILE 400 Cb 0.05 -0.63 -0.12 0.00 0.13 0.00 0.00 42.46 41.89 2qqp s ILE 400 CO 0.14 0.03 1.47 0.47 -1.91 0.00 0.00 174.94 175.15 2qqp n ASP 401 N 4.19 3.53 -4.05 4.50 10.43 -1.07 -4.02 116.55 130.06 2qqp n ASP 401 Ca -0.23 1.20 -0.32 0.00 2.57 0.00 0.00 54.79 58.01 2qqp n ASP 401 Cb 0.55 -1.57 -0.15 0.00 1.84 0.00 0.00 41.12 41.80 2qqp n ASP 401 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 2qqp s THR 402 N -0.72 2.35 0.31 -3.53 2.01 0.22 -4.95 115.64 111.33 2qqp s THR 402 Ca 0.58 -2.08 -0.29 0.00 0.31 0.00 0.00 61.69 60.21 2qqp s THR 402 Cb -0.51 -2.61 -0.13 0.00 0.01 0.00 0.00 72.50 69.26 2qqp s THR 402 CO 0.58 -0.42 1.23 -1.84 -0.69 0.00 0.00 174.62 173.49 2qqp n GLU 403 N 4.34 1.89 -3.16 4.92 0.28 -1.26 0.75 120.64 128.40 2qqp n GLU 403 Ca -0.02 0.66 -0.36 0.00 -0.16 0.00 0.00 57.16 57.28 2qqp n GLU 403 Cb 0.42 -2.20 -0.06 0.00 1.43 0.00 0.00 31.44 31.03 2qqp n GLU 403 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2qqp s ALA 404 N -0.90 3.44 -0.20 -1.84 0.00 -1.26 -4.69 121.76 116.32 2qqp s ALA 404 Ca 0.59 0.09 -0.16 0.00 0.00 0.00 0.00 51.96 52.48 2qqp s ALA 404 Cb -0.62 -2.75 0.06 0.00 0.00 0.00 0.00 23.12 19.80 2qqp s ALA 404 CO 0.59 0.36 0.51 0.08 0.00 0.00 0.00 175.76 177.30 2qqp s VAL 405 N -1.54 -0.01 0.54 0.00 1.01 -1.17 -4.93 120.40 114.30 2qqp s VAL 405 Ca 0.42 0.02 -0.17 0.00 0.00 0.00 0.00 61.98 62.26 2qqp s VAL 405 Cb -0.16 -0.73 -0.06 0.00 0.00 0.00 0.00 36.38 35.43 2qqp s VAL 405 CO 0.20 0.01 1.02 0.20 0.00 0.00 0.00 175.10 176.53 2qqp s ASN 406 N 0.66 6.28 -0.07 3.32 0.01 -1.26 -1.11 114.94 122.77 2qqp s ASN 406 Ca -0.03 1.69 -0.02 0.00 -0.71 0.00 0.00 52.86 53.79 2qqp s ASN 406 Cb -0.05 -2.52 -0.03 0.00 0.41 0.00 0.00 41.25 39.06 2qqp s ASN 406 CO -0.04 -0.82 0.02 -0.60 -1.51 0.00 0.00 177.10 174.14 2qqp s ARG 407 N -4.00 2.99 -0.42 -0.60 6.06 -1.17 -1.68 118.95 120.14 2qqp s ARG 407 Ca 0.61 -0.42 -0.13 0.00 -2.50 0.00 0.00 55.73 53.29 2qqp s ARG 407 Cb -0.13 -2.81 0.04 0.00 0.06 0.00 0.00 34.95 32.12 2qqp s ARG 407 CO 0.32 0.69 0.29 -0.51 -2.50 0.00 0.00 175.30 173.60 2qqp s LEU 408 N -1.06 5.14 -0.69 -0.88 1.43 0.50 -0.13 118.68 122.98 2qqp s LEU 408 Ca 0.15 -1.13 -0.27 0.00 -1.03 0.00 0.00 54.13 51.85 2qqp s LEU 408 Cb -0.11 -2.10 0.01 0.00 0.03 0.00 0.00 46.19 44.02 2qqp s LEU 408 CO 0.04 -0.50 1.50 -0.55 0.23 0.00 0.00 176.35 177.08 2qqp s SER 409 N 1.94 5.82 -0.17 2.29 0.15 0.29 -0.73 113.70 123.28 2qqp s SER 409 Ca 0.03 -0.15 -0.01 0.00 0.70 0.00 0.00 55.95 56.52 2qqp s SER 409 Cb -0.21 -2.55 -0.00 0.00 -1.71 0.00 0.00 66.02 61.55 2qqp s SER 409 CO 0.07 -2.05 -0.12 -0.63 1.20 0.00 0.00 173.24 171.71 2qqp s ILE 410 N 7.02 2.84 -0.21 6.45 1.01 -0.69 -1.91 121.20 135.71 2qqp s ILE 410 Ca 0.47 -0.70 -0.29 0.00 0.00 0.00 0.00 60.65 60.14 2qqp s ILE 410 Cb -0.10 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 2qqp s ILE 410 CO 0.17 0.49 1.78 -0.70 0.00 0.00 0.00 174.94 176.68 2qqp s GLU 411 N 1.02 3.65 -0.05 2.79 2.12 -1.26 -1.78 118.70 125.19 2qqp s GLU 411 Ca -0.01 1.78 -0.33 0.00 0.36 0.00 0.00 54.97 56.77 2qqp s GLU 411 Cb -0.15 -4.13 -0.11 0.00 0.26 0.00 0.00 34.13 30.00 2qqp s GLU 411 CO -0.02 -1.48 1.91 -1.33 -0.54 0.00 0.00 175.26 173.79 2qqp n MET 412 N 7.96 2.39 -1.65 4.30 2.81 0.32 -4.88 117.12 128.36 2qqp n MET 412 Ca 0.21 0.88 -0.37 0.00 -1.81 0.00 0.00 57.70 56.61 2qqp n MET 412 Cb 0.45 -2.76 0.06 0.00 -0.71 0.00 0.00 33.22 30.26 2qqp n MET 412 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2qqp n PRO 413 N 6.89 0.95 -1.16 0.03 -0.04 -1.26 -4.69 135.00 135.72 2qqp n PRO 413 Ca 0.22 0.37 -0.53 0.00 -0.04 0.00 0.00 63.50 63.52 2qqp n PRO 413 Cb 0.33 -2.29 -0.10 0.00 -0.04 0.00 0.00 33.50 31.40 2qqp n PRO 413 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qqp n ALA 414 N -1.83 -0.06 0.86 0.55 0.00 -1.26 -4.72 120.51 114.05 2qqp n ALA 414 Ca 0.15 0.21 0.09 0.00 0.00 0.00 0.00 53.44 53.89 2qqp n ALA 414 Cb 0.48 -1.78 -0.07 0.00 0.00 0.00 0.00 19.45 18.08 2qqp n ALA 414 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qqp n LEU 415 N 5.94 1.18 -4.68 0.00 4.77 -1.26 -4.64 117.00 118.31 2qqp n LEU 415 Ca 0.44 -0.59 -0.42 0.00 -0.03 0.00 0.00 56.01 55.41 2qqp n LEU 415 Cb -0.04 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.03 2qqp n LEU 415 CO 0.77 0.26 1.22 -0.89 -1.33 0.00 0.00 177.39 177.42 2qqp s THR 416 N -2.55 3.61 0.11 -5.08 2.01 -1.26 -4.85 115.64 107.64 2qqp s THR 416 Ca 0.10 0.92 0.03 0.00 0.31 0.00 0.00 61.69 63.05 2qqp s THR 416 Cb 0.14 -3.60 0.14 0.00 0.01 0.00 0.00 72.50 69.20 2qqp s THR 416 CO 0.66 -0.03 0.54 0.41 -0.69 0.00 0.00 174.62 175.51 2qqp n THR 417 N 4.97 -0.14 -0.71 -0.82 -1.04 -1.26 0.42 114.28 115.70 2qqp n THR 417 Ca 0.15 0.74 0.01 0.00 -2.04 0.00 0.00 64.05 62.91 2qqp n THR 417 Cb 0.43 -1.11 0.02 0.00 -1.82 0.00 0.00 70.33 67.85 2qqp n THR 417 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2qqp n GLU 418 N -4.14 1.44 -0.03 -2.82 -0.58 -1.26 -4.70 120.64 108.54 2qqp n GLU 418 Ca 0.10 -1.28 -0.12 0.00 -0.42 0.00 0.00 57.16 55.44 2qqp n GLU 418 Cb 0.32 -0.86 -0.10 0.00 -0.57 0.00 0.00 31.44 30.23 2qqp n GLU 418 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 2qqp h GLU 419 N 0.00 -0.04 -0.75 3.49 4.81 -0.40 -3.23 114.58 118.47 2qqp h GLU 419 Ca 0.00 0.00 0.13 0.00 -0.13 0.00 0.00 59.36 59.36 2qqp h GLU 419 Cb 0.84 0.01 -0.13 0.00 0.63 0.00 0.00 28.75 30.09 2qqp h GLU 419 CO 0.00 0.66 -0.33 -0.39 -0.73 0.00 0.00 179.01 178.22 2qqp h VAL 420 N -0.87 0.12 -0.53 0.32 -1.51 -1.81 1.16 116.25 113.13 2qqp h VAL 420 Ca -0.00 0.00 0.15 0.00 -1.23 0.00 0.00 66.70 65.62 2qqp h VAL 420 Cb 0.72 0.12 -0.02 0.00 -2.13 0.00 0.00 31.29 29.98 2qqp h VAL 420 CO 0.01 0.00 0.74 0.71 -1.23 0.00 0.00 177.57 177.80 2qqp h THR 421 N -0.09 0.16 0.00 7.19 1.35 -1.82 -1.64 112.91 118.06 2qqp h THR 421 Ca 0.29 0.00 -0.15 0.00 -0.55 0.00 0.00 66.41 66.01 2qqp h THR 421 Cb 0.57 0.37 -0.02 0.00 -1.73 0.00 0.00 68.15 67.34 2qqp h THR 421 CO -0.80 0.00 -1.48 0.41 -0.25 0.00 0.00 175.52 173.40 2qqp n THR 422 N -3.33 1.50 1.10 6.82 -1.04 0.39 -4.51 114.28 115.21 2qqp n THR 422 Ca 0.11 -0.02 0.09 0.00 -2.04 0.00 0.00 64.05 62.18 2qqp n THR 422 Cb 0.93 -2.19 0.53 0.00 -1.82 0.00 0.00 70.33 67.77 2qqp n THR 422 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2qqp n ASN 423 N -4.38 0.00 -3.88 8.00 4.13 -0.55 -4.58 115.26 114.00 2qqp n ASN 423 Ca -0.27 -0.48 -0.26 0.00 1.68 0.00 0.00 54.58 55.25 2qqp n ASN 423 Cb 0.63 -0.04 -0.17 0.00 -1.54 0.00 0.00 39.78 38.66 2qqp n ASN 423 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2qqp s VAL 424 N -2.09 0.93 -0.06 2.41 1.01 -0.63 -5.00 120.40 116.97 2qqp s VAL 424 Ca 0.26 -0.29 0.10 0.00 0.00 0.00 0.00 61.98 62.05 2qqp s VAL 424 Cb 0.12 -1.01 -0.24 0.00 0.00 0.00 0.00 36.38 35.26 2qqp s VAL 424 CO 0.22 0.29 0.58 -0.81 0.00 0.00 0.00 175.10 175.39 2qqp n PRO 425 N 4.96 0.65 0.00 2.72 -0.04 -1.26 -4.02 135.00 138.02 2qqp n PRO 425 Ca -0.11 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2qqp n PRO 425 Cb 0.50 -1.77 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 2qqp n PRO 425 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2qqp n LYS 426 N -3.09 1.00 -3.60 0.54 4.76 -1.26 -4.84 118.16 111.66 2qqp n LYS 426 Ca -0.20 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 54.92 2qqp n LYS 426 Cb 1.06 -1.21 -0.05 0.00 -1.84 0.00 0.00 35.03 32.99 2qqp n LYS 426 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 2qqp s TYR 427 N -0.41 3.48 0.45 2.13 1.13 -1.26 -4.50 117.35 118.37 2qqp s TYR 427 Ca 0.00 0.66 0.05 0.00 -1.41 0.00 0.00 57.07 56.37 2qqp s TYR 427 Cb 0.00 -2.09 -0.05 0.00 -1.10 0.00 0.00 41.96 38.72 2qqp s TYR 427 CO 0.00 0.42 0.04 -1.21 -2.51 0.00 0.00 175.55 172.28 2qqp s GLU 428 N -2.54 2.07 -0.30 -3.49 2.02 -0.49 -4.98 118.70 111.00 2qqp s GLU 428 Ca 0.41 -2.18 -0.21 0.00 0.02 0.00 0.00 54.97 53.01 2qqp s GLU 428 Cb -0.12 -1.65 0.20 0.00 0.10 0.00 0.00 34.13 32.66 2qqp s GLU 428 CO 0.23 -0.18 1.36 -1.14 0.02 0.00 0.00 175.26 175.55 2qqp s GLN 429 N -3.80 0.06 0.33 1.61 -0.44 -1.26 -1.18 119.66 114.97 2qqp s GLN 429 Ca 0.26 0.08 -0.04 0.00 -2.50 0.00 0.00 55.36 53.16 2qqp s GLN 429 Cb 0.06 0.02 0.00 0.00 -1.64 0.00 0.00 33.01 31.45 2qqp s GLN 429 CO 0.13 -0.01 0.47 -0.06 0.50 0.00 0.00 175.29 176.32 2qqp s PHE 430 N 0.46 0.96 0.49 1.67 0.40 -1.07 -4.99 117.98 115.90 2qqp s PHE 430 Ca 0.01 -1.22 -0.18 0.00 -0.60 0.00 0.00 56.93 54.94 2qqp s PHE 430 Cb -0.04 -0.05 -0.09 0.00 0.51 0.00 0.00 43.02 43.36 2qqp s PHE 430 CO -0.13 -1.11 0.98 -0.51 0.70 0.00 0.00 175.22 175.15 2qqp s LEU 431 N -3.20 3.73 0.27 -0.37 1.02 -1.26 -0.89 118.68 117.98 2qqp s LEU 431 Ca 0.29 1.65 -0.04 0.00 0.02 0.00 0.00 54.13 56.06 2qqp s LEU 431 Cb -0.00 -4.52 0.34 0.00 0.02 0.00 0.00 46.19 42.03 2qqp s LEU 431 CO 0.18 -0.57 1.90 0.00 0.02 0.00 0.00 176.35 177.89 2qqp h LYS 433 N 1.14 -0.43 0.00 0.00 3.64 -1.63 -3.19 116.57 116.10 2qqp h LYS 433 Ca 0.29 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 2qqp h LYS 433 Cb -0.01 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 2qqp h LYS 433 CO -0.05 -0.28 0.00 0.39 -2.27 0.00 0.00 179.45 177.23 2qqp n GLU 434 N -5.43 0.00 -1.60 1.90 -0.58 -1.01 -4.16 120.64 109.77 2qqp n GLU 434 Ca -0.03 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.36 2qqp n GLU 434 Cb 0.36 -0.65 -0.03 0.00 -0.57 0.00 0.00 31.44 30.55 2qqp n GLU 434 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2qqp s SER 435 N -1.86 4.47 0.00 1.62 1.04 -0.80 -4.70 113.70 113.47 2qqp s SER 435 Ca 0.00 0.98 0.00 0.00 0.48 0.00 0.00 55.95 57.41 2qqp s SER 435 Cb 0.00 -2.50 0.00 0.00 0.10 0.00 0.00 66.02 63.62 2qqp s SER 435 CO 0.00 -2.89 0.00 0.61 0.98 0.00 0.00 173.24 171.94 2qqp n GLY 436 N 6.01 0.00 0.00 7.32 0.00 -1.21 -4.34 105.19 112.98 2qqp n GLY 436 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2qqp n GLY 436 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqp n GLY 437 N 0.21 0.55 3.29 -0.02 0.00 -1.25 0.25 105.19 108.23 2qqp n GLY 437 Ca 0.00 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.00 2qqp n GLY 437 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qqp s ALA 438 N -1.00 2.04 -0.14 4.61 0.00 -0.89 -1.45 121.76 124.92 2qqp s ALA 438 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 50.84 2qqp s ALA 438 Cb 0.00 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.65 2qqp s ALA 438 CO 0.00 0.49 -0.15 -0.47 0.00 0.00 0.00 175.76 175.63 2qqp s TYR 439 N -0.69 2.78 -0.06 0.00 5.04 0.32 0.20 117.35 124.94 2qqp s TYR 439 Ca 0.10 -0.89 0.03 0.00 -2.44 0.00 0.00 57.07 53.86 2qqp s TYR 439 Cb -0.09 -1.87 0.01 0.00 0.35 0.00 0.00 41.96 40.36 2qqp s TYR 439 CO 0.01 -0.38 -0.13 -1.50 -1.34 0.00 0.00 175.55 172.21 2qqp s ILE 440 N 0.64 1.19 -0.22 3.14 2.07 0.15 0.12 121.20 128.29 2qqp s ILE 440 Ca -0.08 -0.53 0.01 0.00 -1.41 0.00 0.00 60.65 58.64 2qqp s ILE 440 Cb -0.16 -1.07 0.05 0.00 0.13 0.00 0.00 42.46 41.41 2qqp s ILE 440 CO 0.03 0.36 -0.10 -0.69 -1.91 0.00 0.00 174.94 172.63 2qqp s VAL 441 N 0.50 1.76 0.88 4.00 1.01 0.16 -0.00 120.40 128.71 2qqp s VAL 441 Ca -0.12 -1.20 -0.12 0.00 0.00 0.00 0.00 61.98 60.54 2qqp s VAL 441 Cb -0.15 -1.87 0.12 0.00 0.00 0.00 0.00 36.38 34.48 2qqp s VAL 441 CO 0.03 0.08 1.13 -1.00 0.00 0.00 0.00 175.10 175.34 2qqp s HIS 442 N 1.32 2.61 0.12 5.22 0.09 0.15 -4.43 115.29 120.37 2qqp s HIS 442 Ca -0.04 0.93 -0.21 0.00 -0.00 0.00 0.00 55.06 55.74 2qqp s HIS 442 Cb -0.18 -3.32 0.06 0.00 -0.00 0.00 0.00 32.58 29.14 2qqp s HIS 442 CO -0.07 -2.19 0.53 1.52 -0.00 0.00 0.00 174.74 174.53 2qqp s TYR 443 N -3.26 -0.43 -0.84 1.40 -0.85 -1.26 -4.46 117.35 107.65 2qqp s TYR 443 Ca 0.63 0.28 -0.22 0.00 -0.52 0.00 0.00 57.07 57.24 2qqp s TYR 443 Cb -0.15 0.43 -0.19 0.00 0.38 0.00 0.00 41.96 42.43 2qqp s TYR 443 CO 0.53 -0.76 2.30 1.17 -1.52 0.00 0.00 175.55 177.27 2qqp n LYS 444 N -0.12 0.38 -0.10 -3.49 0.00 -1.26 -0.43 118.16 113.15 2qqp n LYS 444 Ca -0.17 -0.72 -0.20 0.00 0.00 0.00 0.00 58.31 57.22 2qqp n LYS 444 Cb 0.63 -3.06 -0.12 0.00 0.00 0.00 0.00 35.03 32.49 2qqp n LYS 444 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.40 179.38 2qqp h MET 445 N 12.14 0.00 -0.00 1.64 4.05 -1.12 -3.43 114.93 128.21 2qqp h MET 445 Ca 0.01 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.39 2qqp h MET 445 Cb 1.03 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.83 2qqp h MET 445 CO 1.14 0.99 -0.14 -0.91 0.23 0.00 0.00 176.91 178.22 2qqp h ASN 446 N -1.00 0.12 -2.71 1.39 2.35 -0.83 -3.45 115.58 111.45 2qqp h ASN 446 Ca -0.29 -0.77 -0.66 0.00 -0.55 0.00 0.00 56.30 54.03 2qqp h ASN 446 Cb 1.24 -0.04 -0.07 0.00 0.05 0.00 0.00 38.32 39.51 2qqp h ASN 446 CO -0.17 0.88 -0.43 0.21 -1.65 0.00 0.00 177.43 176.26 2qqp s ASN 447 N -6.17 6.46 0.35 5.81 2.47 -1.25 -4.97 114.94 117.64 2qqp s ASN 447 Ca -0.17 0.55 0.04 0.00 0.42 0.00 0.00 52.86 53.70 2qqp s ASN 447 Cb 0.00 -2.10 0.65 0.00 -1.45 0.00 0.00 41.25 38.35 2qqp s ASN 447 CO 0.72 0.39 1.94 -0.65 -3.72 0.00 0.00 177.10 175.78 2qqp h PRO 448 N 4.90 0.64 -5.92 0.43 0.11 -1.89 -3.43 132.00 126.83 2qqp h PRO 448 Ca -0.54 -0.09 -0.56 0.00 0.11 0.00 0.00 66.00 64.92 2qqp h PRO 448 Cb 1.23 -0.12 -0.07 0.00 0.11 0.00 0.00 31.00 32.15 2qqp h PRO 448 CO 0.59 0.53 -0.45 0.08 -0.21 0.00 0.00 178.00 178.54 2qqp s VAL 449 N -5.29 2.23 -1.11 3.15 1.01 -1.26 -5.06 120.40 114.07 2qqp s VAL 449 Ca -0.09 -1.61 -0.17 0.00 0.00 0.00 0.00 61.98 60.11 2qqp s VAL 449 Cb 0.16 -2.84 0.13 0.00 0.00 0.00 0.00 36.38 33.84 2qqp s VAL 449 CO 0.76 0.00 1.38 -0.36 0.00 0.00 0.00 175.10 176.88 2qqp s PHE 450 N -2.61 3.16 0.00 5.22 2.99 -1.26 -5.02 117.98 120.46 2qqp s PHE 450 Ca 0.40 -1.67 -0.00 0.00 0.00 0.00 0.00 56.93 55.66 2qqp s PHE 450 Cb 0.02 -4.41 0.00 0.00 0.00 0.00 0.00 43.02 38.63 2qqp s PHE 450 CO 0.22 -1.55 0.00 0.39 -0.00 0.00 0.00 175.22 174.29 2qqp n GLU 451 N 6.70 -1.57 -3.44 0.44 1.02 -1.26 -4.98 120.64 117.55 2qqp n GLU 451 Ca 0.34 -0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 57.21 2qqp n GLU 451 Cb 0.46 -0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.80 2qqp n GLU 451 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2qqp n MET 452 N -1.79 2.33 -1.37 3.49 2.81 -1.26 -4.71 117.12 116.61 2qqp n MET 452 Ca 0.00 -4.54 -0.60 0.00 -1.81 0.00 0.00 57.70 50.74 2qqp n MET 452 Cb 0.00 -2.18 -0.11 0.00 -0.71 0.00 0.00 33.22 30.22 2qqp n MET 452 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2qqp n THR 453 N 0.99 0.03 -3.59 2.03 -1.04 0.14 -4.09 114.28 108.75 2qqp n THR 453 Ca 0.29 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.27 2qqp n THR 453 Cb 0.41 -0.64 0.00 0.00 -1.82 0.00 0.00 70.33 68.28 2qqp n THR 453 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qqp n GLY 454 N 6.68 4.12 0.40 3.41 0.00 -1.26 -0.52 105.19 118.02 2qqp n GLY 454 Ca 0.48 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 44.47 2qqp n GLY 454 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qqp h GLU 455 N 0.00 0.00 -0.15 1.61 4.81 -1.88 -2.99 114.58 115.99 2qqp h GLU 455 Ca 0.00 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2qqp h GLU 455 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2qqp h GLU 455 CO 0.00 0.00 -0.09 0.93 -0.73 0.00 0.00 179.01 179.12 2qqp h GLU 456 N 0.00 -0.01 -4.22 1.92 3.07 -1.93 -2.84 114.58 110.57 2qqp h GLU 456 Ca 0.18 0.00 -0.76 0.00 -0.50 0.00 0.00 59.36 58.28 2qqp h GLU 456 Cb 2.06 0.00 -0.23 0.00 -0.84 0.00 0.00 28.75 29.74 2qqp h GLU 456 CO -0.00 -0.00 0.32 0.54 -1.40 0.00 0.00 179.01 178.46 2qqp s ASN 457 N -3.36 6.70 0.02 1.42 4.22 -1.13 -4.95 114.94 117.86 2qqp s ASN 457 Ca -0.02 -2.44 -0.01 0.00 -2.14 0.00 0.00 52.86 48.24 2qqp s ASN 457 Cb 0.02 -2.27 -0.02 0.00 1.28 0.00 0.00 41.25 40.26 2qqp s ASN 457 CO 0.10 -0.74 0.00 0.12 -2.04 0.00 0.00 177.10 174.54 2qqp s PHE 458 N 1.03 0.25 -5.00 1.54 5.36 -1.08 -1.75 117.98 118.34 2qqp s PHE 458 Ca 0.22 -0.53 0.00 0.00 -0.96 0.00 0.00 56.93 55.66 2qqp s PHE 458 Cb -0.09 -0.19 0.00 0.00 -0.34 0.00 0.00 43.02 42.40 2qqp s PHE 458 CO -0.08 -0.24 0.00 0.41 -1.46 0.00 0.00 175.22 173.85 2qqp n GLY 459 N 1.37 0.83 3.56 13.12 0.00 -1.08 -4.68 105.19 118.32 2qqp n GLY 459 Ca -0.22 -1.83 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 2qqp n GLY 459 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2qqp s GLY 460 N 0.00 1.10 0.18 -0.02 0.00 -0.67 -2.18 107.32 105.73 2qqp s GLY 460 Ca 0.00 -1.03 -0.32 0.00 0.00 0.00 0.00 44.72 43.37 2qqp s GLY 460 CO 0.00 2.49 1.71 0.69 0.00 0.00 0.00 173.10 177.99 2qqp n PHE 461 N 8.58 2.62 -3.54 1.90 0.99 0.15 0.19 117.46 128.33 2qqp n PHE 461 Ca 0.06 0.07 -0.29 0.00 -0.00 0.00 0.00 57.45 57.29 2qqp n PHE 461 Cb 0.49 -2.65 -0.15 0.00 -1.00 0.00 0.00 39.48 36.17 2qqp n PHE 461 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.76 175.62 2qqp s GLN 462 N 1.36 0.19 -0.05 -1.08 0.74 0.09 -3.90 119.66 117.00 2qqp s GLN 462 Ca 0.77 -0.52 -0.27 0.00 0.05 0.00 0.00 55.36 55.39 2qqp s GLN 462 Cb -0.55 -1.17 -0.03 0.00 1.10 0.00 0.00 33.01 32.36 2qqp s GLN 462 CO 0.35 -1.01 0.88 -0.06 -0.55 0.00 0.00 175.29 174.90 2qqp s PHE 463 N 2.10 3.59 0.32 1.67 0.40 -1.25 -1.70 117.98 123.12 2qqp s PHE 463 Ca 0.09 1.50 0.08 0.00 -0.60 0.00 0.00 56.93 58.00 2qqp s PHE 463 Cb -0.16 -3.02 -0.04 0.00 0.51 0.00 0.00 43.02 40.31 2qqp s PHE 463 CO -0.36 -0.03 0.15 -3.38 0.70 0.00 0.00 175.22 172.29 2qqp s HIS 464 N 1.21 2.77 0.24 0.36 -3.43 -0.74 -4.80 115.29 110.90 2qqp s HIS 464 Ca 0.46 -0.32 -0.21 0.00 -0.80 0.00 0.00 55.06 54.18 2qqp s HIS 464 Cb -0.19 -1.58 0.06 0.00 -1.43 0.00 0.00 32.58 29.43 2qqp s HIS 464 CO 0.22 0.37 0.90 -0.47 -2.00 0.00 0.00 174.74 173.75 2qqp s TYR 465 N -2.37 -0.03 0.69 0.38 5.04 -1.26 -0.53 117.35 119.27 2qqp s TYR 465 Ca 0.37 -0.42 -0.11 0.00 -2.44 0.00 0.00 57.07 54.47 2qqp s TYR 465 Cb -0.04 0.72 0.00 0.00 0.35 0.00 0.00 41.96 42.99 2qqp s TYR 465 CO 0.23 -1.10 1.06 -1.25 -1.34 0.00 0.00 175.55 173.14 2qqp s PRO 466 N -2.89 3.02 0.00 4.97 0.04 -1.26 -3.14 135.00 135.74 2qqp s PRO 466 Ca 0.15 0.86 0.00 0.00 0.04 0.00 0.00 61.00 62.06 2qqp s PRO 466 Cb -0.03 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2qqp s PRO 466 CO 0.06 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.50 2qqp n GLY 467 N -2.21 0.33 3.70 0.56 0.00 -1.26 -4.90 105.19 101.40 2qqp n GLY 467 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2qqp n GLY 467 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2qqp s TYR 468 N -0.54 3.61 -0.22 1.61 5.04 -1.19 -5.03 117.35 120.63 2qqp s TYR 468 Ca 0.00 1.66 -0.14 0.00 -2.44 0.00 0.00 57.07 56.15 2qqp s TYR 468 Cb 0.00 -3.15 -0.04 0.00 0.35 0.00 0.00 41.96 39.12 2qqp s TYR 468 CO 0.00 -0.11 0.30 0.34 -1.34 0.00 0.00 175.55 174.74 2qqp s ASP 469 N 1.04 6.30 0.46 4.32 -1.08 -1.26 -4.75 116.67 121.71 2qqp s ASP 469 Ca 0.51 0.34 0.26 0.00 -0.52 0.00 0.00 52.55 53.14 2qqp s ASP 469 Cb -0.20 -2.18 0.67 0.00 -1.46 0.00 0.00 42.92 39.74 2qqp s ASP 469 CO 0.25 -0.03 1.73 1.55 0.52 0.00 0.00 175.17 179.19 2qqp h PRO 470 N 7.47 0.00 -0.69 4.34 0.13 -1.98 -3.13 132.00 138.15 2qqp h PRO 470 Ca -0.37 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 64.96 2qqp h PRO 470 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 2qqp h PRO 470 CO 0.69 0.04 0.63 1.05 -0.23 0.00 0.00 178.00 180.18 2qqp h GLU 471 N 0.00 0.00 -0.40 0.86 4.11 -2.04 2.64 114.58 119.74 2qqp h GLU 471 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2qqp h GLU 471 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2qqp h GLU 471 CO 0.01 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.18 2qqp n ASN 472 N -3.85 1.25 -4.70 3.06 4.13 -1.18 -4.84 115.26 109.13 2qqp n ASN 472 Ca 0.14 -2.07 -0.38 0.00 1.68 0.00 0.00 54.58 53.96 2qqp n ASN 472 Cb 0.88 -0.25 -0.07 0.00 -1.54 0.00 0.00 39.78 38.80 2qqp n ASN 472 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2qqp s ASN 473 N -0.73 6.50 0.53 6.41 0.01 0.88 -4.85 114.94 123.69 2qqp s ASN 473 Ca 0.11 0.59 -0.21 0.00 -0.71 0.00 0.00 52.86 52.64 2qqp s ASN 473 Cb 0.07 -2.23 -0.05 0.00 0.41 0.00 0.00 41.25 39.44 2qqp s ASN 473 CO 0.06 -0.01 1.23 0.00 -1.51 0.00 0.00 177.10 176.88 2qqp s ALA 474 N 0.90 2.78 0.00 0.60 0.00 -1.26 -5.03 121.76 119.75 2qqp s ALA 474 Ca 0.20 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.23 2qqp s ALA 474 Cb -0.14 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2qqp s ALA 474 CO 0.07 -1.03 0.00 1.28 0.00 0.00 0.00 175.76 176.08 2qqp n LEU 475 N -1.02 0.00 0.00 0.00 4.77 -1.26 -4.92 117.00 114.56 2qqp n LEU 475 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2qqp n LEU 475 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2qqp n LEU 475 CO 0.48 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 2qqp n GLY 476 N 0.61 0.00 3.57 -0.72 0.00 -1.26 -4.62 105.19 102.76 2qqp n GLY 476 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2qqp n GLY 476 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qqp s LEU 477 N 0.00 3.29 0.25 0.99 2.96 -1.26 -4.90 118.68 120.01 2qqp s LEU 477 Ca 0.00 -1.32 0.01 0.00 -0.22 0.00 0.00 54.13 52.60 2qqp s LEU 477 Cb 0.00 -2.57 -0.05 0.00 0.50 0.00 0.00 46.19 44.07 2qqp s LEU 477 CO 0.00 -2.39 0.10 0.00 -1.32 0.00 0.00 176.35 172.75 2qqp s ARG 478 N 6.11 1.39 0.00 1.98 1.70 -1.26 -4.95 118.95 123.92 2qqp s ARG 478 Ca 0.63 -1.75 0.00 0.00 -0.47 0.00 0.00 55.73 54.14 2qqp s ARG 478 Cb -0.02 -0.19 0.00 0.00 -0.57 0.00 0.00 34.95 34.17 2qqp s ARG 478 CO 0.02 -0.31 0.00 0.41 -1.08 0.00 0.00 175.30 174.34 2qqp n GLY 479 N -0.44 -1.77 3.78 3.88 0.00 1.29 -4.60 105.19 107.32 2qqp n GLY 479 Ca 0.00 -2.09 -0.33 0.00 0.00 0.00 0.00 46.02 43.61 2qqp n GLY 479 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qqp s ILE 480 N -0.10 3.35 -0.12 -0.61 1.01 -1.25 -4.42 121.20 119.06 2qqp s ILE 480 Ca 0.00 0.65 -0.02 0.00 0.00 0.00 0.00 60.65 61.28 2qqp s ILE 480 Cb 0.00 -3.18 0.04 0.00 0.01 0.00 0.00 42.46 39.34 2qqp s ILE 480 CO 0.00 -0.37 0.02 -0.69 0.00 0.00 0.00 174.94 173.89 2qqp s VAL 481 N -2.31 0.44 -0.01 2.92 1.01 -1.25 0.30 120.40 121.49 2qqp s VAL 481 Ca 0.67 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 62.19 2qqp s VAL 481 Cb -0.20 -0.75 0.10 0.00 0.00 0.00 0.00 36.38 35.54 2qqp s VAL 481 CO 0.39 0.06 1.01 -0.62 0.00 0.00 0.00 175.10 175.94 2qqp s ASP 482 N 1.93 -0.25 -0.22 3.32 3.68 -0.92 -4.90 116.67 119.31 2qqp s ASP 482 Ca 0.03 -0.09 -0.24 0.00 2.13 0.00 0.00 52.55 54.38 2qqp s ASP 482 Cb -0.14 0.33 -0.01 0.00 -1.45 0.00 0.00 42.92 41.65 2qqp s ASP 482 CO -0.07 -0.56 0.78 -0.89 0.13 0.00 0.00 175.17 174.56 2qqp s THR 483 N -2.94 4.89 -0.38 1.71 2.01 -1.26 -2.62 115.64 117.05 2qqp s THR 483 Ca 0.08 1.49 -0.16 0.00 0.31 0.00 0.00 61.69 63.41 2qqp s THR 483 Cb -0.01 -4.08 0.01 0.00 0.01 0.00 0.00 72.50 68.43 2qqp s THR 483 CO -0.05 -0.01 0.40 0.12 -0.69 0.00 0.00 174.62 174.39 2qqp s PHE 484 N 2.47 3.19 -0.79 4.92 5.36 -0.72 -0.48 117.98 131.94 2qqp s PHE 484 Ca 0.34 -0.21 -0.25 0.00 -0.96 0.00 0.00 56.93 55.85 2qqp s PHE 484 Cb -0.16 -2.78 -0.15 0.00 -0.34 0.00 0.00 43.02 39.59 2qqp s PHE 484 CO 0.09 -0.57 2.41 -1.91 -1.46 0.00 0.00 175.22 173.78 2qqp n GLU 485 N 5.49 0.56 0.00 10.12 4.07 0.10 -4.73 120.64 136.25 2qqp n GLU 485 Ca -0.08 -0.79 0.01 0.00 -0.06 0.00 0.00 57.16 56.24 2qqp n GLU 485 Cb 0.48 -3.58 0.03 0.00 -0.06 0.00 0.00 31.44 28.31 2qqp n GLU 485 CO 0.00 0.00 0.00 0.27 -0.06 0.00 0.00 177.13 177.34 2qqp n ASN 486 N 18.14 0.00 -0.02 4.31 6.94 -1.26 -2.52 115.26 140.85 2qqp n ASN 486 Ca 0.47 0.42 -0.21 0.00 -0.02 0.00 0.00 54.58 55.24 2qqp n ASN 486 Cb 0.42 -0.43 -0.13 0.00 -2.36 0.00 0.00 39.78 37.28 2qqp n ASN 486 CO 0.00 0.00 0.00 0.78 -1.03 0.00 0.00 177.26 177.01 2qqp h ASN 487 N 0.00 0.30 -4.26 0.53 -0.26 -1.93 -3.41 115.58 106.54 2qqp h ASN 487 Ca 0.00 -0.81 -0.51 0.00 -0.56 0.00 0.00 56.30 54.42 2qqp h ASN 487 Cb 0.02 -0.10 0.14 0.00 -1.06 0.00 0.00 38.32 37.32 2qqp h ASN 487 CO 0.00 1.60 0.30 -0.36 -1.06 0.00 0.00 177.43 177.91 2qqp s PHE 488 N -2.46 2.48 -0.31 1.19 0.40 -1.05 -0.22 117.98 118.02 2qqp s PHE 488 Ca -0.22 1.51 -0.27 0.00 -0.60 0.00 0.00 56.93 57.35 2qqp s PHE 488 Cb 0.05 -3.08 0.01 0.00 0.51 0.00 0.00 43.02 40.51 2qqp s PHE 488 CO 0.73 -1.97 0.99 0.45 0.70 0.00 0.00 175.22 176.12 2qqp s SER 489 N -3.36 6.86 0.99 1.36 0.15 0.43 -4.55 113.70 115.58 2qqp s SER 489 Ca 0.62 0.94 -0.12 0.00 0.70 0.00 0.00 55.95 58.09 2qqp s SER 489 Cb -0.18 -2.50 0.18 0.00 -1.71 0.00 0.00 66.02 61.81 2qqp s SER 489 CO 0.56 -0.79 1.08 -0.55 1.20 0.00 0.00 173.24 174.74 2qqp s SER 490 N 1.62 2.62 -0.23 5.45 0.15 -0.55 -4.54 113.70 118.22 2qqp s SER 490 Ca 0.41 1.46 -0.29 0.00 0.70 0.00 0.00 55.95 58.23 2qqp s SER 490 Cb -0.13 -2.14 0.16 0.00 -1.71 0.00 0.00 66.02 62.20 2qqp s SER 490 CO 0.14 -3.17 1.17 0.00 1.20 0.00 0.00 173.24 172.58 2qqp s ALA 491 N -2.82 -2.03 0.30 5.45 0.00 -0.39 -0.28 121.76 122.00 2qqp s ALA 491 Ca 0.65 1.73 0.06 0.00 0.00 0.00 0.00 51.96 54.41 2qqp s ALA 491 Cb -0.20 -1.17 -0.06 0.00 0.00 0.00 0.00 23.12 21.69 2qqp s ALA 491 CO 0.59 -0.26 -0.02 0.14 0.00 0.00 0.00 175.76 176.21 2qqp s VAL 492 N -0.86 1.56 -0.27 0.00 -7.23 -0.84 0.18 120.40 112.95 2qqp s VAL 492 Ca 0.03 -2.08 -0.09 0.00 -1.81 0.00 0.00 61.98 58.03 2qqp s VAL 492 Cb -0.01 -2.59 0.12 0.00 0.56 0.00 0.00 36.38 34.45 2qqp s VAL 492 CO -0.04 -0.19 0.58 0.54 -0.31 0.00 0.00 175.10 175.67 2qqp s VAL 493 N -3.06 -0.85 -0.13 1.32 0.11 0.18 -1.96 120.40 116.02 2qqp s VAL 493 Ca 0.32 0.05 -0.04 0.00 -2.93 0.00 0.00 61.98 59.38 2qqp s VAL 493 Cb 0.06 -0.89 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 2qqp s VAL 493 CO 0.13 0.02 0.03 -1.00 -3.33 0.00 0.00 175.10 170.95 2qqp s HIS 494 N 2.75 3.22 0.11 1.54 3.76 -0.76 0.05 115.29 125.96 2qqp s HIS 494 Ca -0.05 0.13 0.03 0.00 -0.15 0.00 0.00 55.06 55.02 2qqp s HIS 494 Cb -0.12 -1.91 -0.04 0.00 1.11 0.00 0.00 32.58 31.63 2qqp s HIS 494 CO -0.17 0.35 0.16 -0.06 -0.85 0.00 0.00 174.74 174.16 2qqp s PHE 495 N -0.39 3.30 -0.06 1.40 0.40 0.51 -1.48 117.98 121.67 2qqp s PHE 495 Ca 0.08 0.10 -0.10 0.00 -0.60 0.00 0.00 56.93 56.41 2qqp s PHE 495 Cb -0.12 -1.63 0.02 0.00 0.51 0.00 0.00 43.02 41.80 2qqp s PHE 495 CO 0.02 0.54 0.25 -0.46 0.70 0.00 0.00 175.22 176.27 2qqp s TRP 496 N -1.56 -0.19 -1.49 0.36 -0.00 0.75 -2.49 118.94 114.32 2qqp s TRP 496 Ca 0.32 0.42 -0.01 0.00 -0.00 0.00 0.00 56.10 56.83 2qqp s TRP 496 Cb -0.12 0.07 0.00 0.00 -0.00 0.00 0.00 33.47 33.42 2qqp s TRP 496 CO 0.25 -0.24 0.13 0.41 -0.00 0.00 0.00 176.95 177.50 2qqp n GLY 497 N 2.19 -0.37 2.26 5.86 0.00 -1.25 -1.19 105.19 112.69 2qqp n GLY 497 Ca -0.17 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 2qqp n GLY 497 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2qqp n ILE 498 N -4.10 0.00 -4.09 -0.61 -5.35 -1.20 -2.29 119.36 101.72 2qqp n ILE 498 Ca -0.18 -0.95 -0.31 0.00 -0.27 0.00 0.00 62.75 61.04 2qqp n ILE 498 Cb 0.65 -1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 37.44 2qqp n ILE 498 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2qqp s SER 499 N -3.32 5.46 0.41 7.28 0.15 -1.26 -2.08 113.70 120.33 2qqp s SER 499 Ca 0.38 -0.00 0.18 0.00 0.70 0.00 0.00 55.95 57.21 2qqp s SER 499 Cb -0.02 -1.46 1.10 0.00 -1.71 0.00 0.00 66.02 63.93 2qqp s SER 499 CO 0.25 0.20 1.80 1.56 1.20 0.00 0.00 173.24 178.25 2qqp h GLN 500 N 3.53 0.39 -0.32 5.44 1.08 -1.87 0.35 115.11 123.71 2qqp h GLN 500 Ca -0.47 -0.02 -0.16 0.00 -1.45 0.00 0.00 58.65 56.55 2qqp h GLN 500 Cb 1.17 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 28.50 2qqp h GLN 500 CO 0.64 0.26 -0.42 0.77 -0.95 0.00 0.00 178.83 179.12 2qqp h SER 501 N 0.40 0.85 -2.97 1.46 0.02 -1.93 -3.41 113.55 107.96 2qqp h SER 501 Ca 0.55 -0.40 -0.53 0.00 -0.84 0.00 0.00 61.79 60.57 2qqp h SER 501 Cb 1.39 -0.24 0.02 0.00 0.14 0.00 0.00 62.40 63.71 2qqp h SER 501 CO -0.24 1.16 0.75 0.00 -1.14 0.00 0.00 176.83 177.35 2qqp s ALA 502 N -4.29 3.61 0.16 3.77 0.00 0.12 -4.74 121.76 120.39 2qqp s ALA 502 Ca -0.10 1.12 0.09 0.00 0.00 0.00 0.00 51.96 53.08 2qqp s ALA 502 Cb 0.11 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2qqp s ALA 502 CO 0.86 -0.66 -0.19 -0.08 0.00 0.00 0.00 175.76 175.69 2qqp s THR 503 N 1.23 1.85 -0.27 0.00 -1.32 0.32 -4.65 115.64 112.79 2qqp s THR 503 Ca 0.65 -1.86 -0.05 0.00 -1.21 0.00 0.00 61.69 59.22 2qqp s THR 503 Cb -0.37 -1.82 0.01 0.00 -1.51 0.00 0.00 72.50 68.81 2qqp s THR 503 CO 0.30 -0.25 0.04 -0.63 -2.21 0.00 0.00 174.62 171.87 2qqp s ILE 504 N -1.85 3.71 -0.45 5.08 1.01 0.34 -0.86 121.20 128.18 2qqp s ILE 504 Ca 0.14 -0.68 -0.23 0.00 0.00 0.00 0.00 60.65 59.89 2qqp s ILE 504 Cb -0.07 -2.86 0.03 0.00 0.01 0.00 0.00 42.46 39.56 2qqp s ILE 504 CO 0.06 0.17 0.75 -0.69 0.00 0.00 0.00 174.94 175.24 2qqp s VAL 505 N 1.47 4.69 -0.78 2.92 1.01 -0.94 0.12 120.40 128.89 2qqp s VAL 505 Ca 0.03 0.34 -0.16 0.00 0.00 0.00 0.00 61.98 62.19 2qqp s VAL 505 Cb -0.16 -4.30 0.17 0.00 0.00 0.00 0.00 36.38 32.09 2qqp s VAL 505 CO 0.00 -0.70 0.81 0.00 0.00 0.00 0.00 175.10 175.21 2qqp s LYS 507 N 1.34 3.66 0.06 0.00 1.02 -0.07 -2.20 119.74 123.55 2qqp s LYS 507 Ca 0.18 0.42 0.05 0.00 0.02 0.00 0.00 55.97 56.64 2qqp s LYS 507 Cb -0.14 -3.91 -0.04 0.00 -0.52 0.00 0.00 37.83 33.23 2qqp s LYS 507 CO -0.05 -1.29 -0.05 -0.08 -0.92 0.00 0.00 175.35 172.97 2qqp s THR 508 N 4.11 3.75 -0.34 2.17 -1.32 -1.00 0.54 115.64 123.56 2qqp s THR 508 Ca 0.43 -0.97 0.00 0.00 -1.21 0.00 0.00 61.69 59.94 2qqp s THR 508 Cb -0.09 -2.73 0.11 0.00 -1.51 0.00 0.00 72.50 68.29 2qqp s THR 508 CO 0.29 0.22 0.13 -0.31 -2.21 0.00 0.00 174.62 172.73 2qqp s TYR 509 N -1.18 1.87 -0.23 9.09 1.51 0.53 -3.74 117.35 125.20 2qqp s TYR 509 Ca 0.22 -1.97 -0.10 0.00 -1.01 0.00 0.00 57.07 54.21 2qqp s TYR 509 Cb -0.11 -1.81 -0.05 0.00 -0.11 0.00 0.00 41.96 39.88 2qqp s TYR 509 CO 0.13 -0.86 0.13 0.34 -1.11 0.00 0.00 175.55 174.19 2qqp s ASP 510 N 1.28 5.93 -0.30 2.29 -1.08 0.07 -1.61 116.67 123.26 2qqp s ASP 510 Ca 0.12 0.07 0.02 0.00 -0.52 0.00 0.00 52.55 52.24 2qqp s ASP 510 Cb -0.19 -2.06 0.07 0.00 -1.46 0.00 0.00 42.92 39.28 2qqp s ASP 510 CO -0.18 0.07 -0.02 -0.83 0.52 0.00 0.00 175.17 174.73 2qqp s GLY 511 N 1.00 1.79 0.16 2.66 0.00 0.23 0.52 107.32 113.67 2qqp s GLY 511 Ca 0.07 -2.06 0.10 0.00 0.00 0.00 0.00 44.72 42.82 2qqp s GLY 511 CO 0.04 0.76 -0.18 0.66 0.00 0.00 0.00 173.10 174.38 2qqp s TRP 512 N 1.06 2.49 -0.07 1.90 1.48 -0.70 0.19 118.94 125.29 2qqp s TRP 512 Ca -0.01 -0.28 -0.05 0.00 -1.06 0.00 0.00 56.10 54.70 2qqp s TRP 512 Cb -0.20 -1.27 0.03 0.00 -1.16 0.00 0.00 33.47 30.87 2qqp s TRP 512 CO -0.05 0.45 0.17 -2.00 -4.06 0.00 0.00 176.95 171.46 2qqp s GLU 513 N -2.47 0.16 0.31 3.25 2.12 -0.66 -1.44 118.70 119.97 2qqp s GLU 513 Ca 0.20 0.34 -0.19 0.00 0.36 0.00 0.00 54.97 55.69 2qqp s GLU 513 Cb -0.09 -0.05 0.03 0.00 0.26 0.00 0.00 34.13 34.28 2qqp s GLU 513 CO 0.11 -0.10 0.72 0.20 -0.54 0.00 0.00 175.26 175.65 2qqp s GLY 514 N 0.70 0.11 -0.24 -1.50 0.00 -0.55 -0.45 107.32 105.38 2qqp s GLY 514 Ca -0.05 -0.49 -0.10 0.00 0.00 0.00 0.00 44.72 44.08 2qqp s GLY 514 CO -0.04 -0.20 0.15 -0.51 0.00 0.00 0.00 173.10 172.51 2qqp s THR 515 N -3.46 5.30 0.27 0.90 -4.23 -0.79 -0.93 115.64 112.71 2qqp s THR 515 Ca 0.13 0.16 -0.21 0.00 -1.18 0.00 0.00 61.69 60.59 2qqp s THR 515 Cb -0.05 -3.47 -0.09 0.00 1.34 0.00 0.00 72.50 70.22 2qqp s THR 515 CO 0.09 0.35 0.81 0.42 -0.54 0.00 0.00 174.62 175.74 2qqp s THR 516 N 1.08 4.45 0.00 3.99 -4.23 -1.26 -0.89 115.64 118.78 2qqp s THR 516 Ca 0.07 1.45 0.00 0.00 -1.18 0.00 0.00 61.69 62.03 2qqp s THR 516 Cb -0.14 -3.87 0.00 0.00 1.34 0.00 0.00 72.50 69.83 2qqp s THR 516 CO 0.05 0.13 0.00 -3.20 -0.54 0.00 0.00 174.62 171.05 2qqp n ASN 517 N 0.51 0.00 -4.22 3.99 5.15 -1.26 -4.78 115.26 114.64 2qqp n ASN 517 Ca 0.00 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.85 2qqp n ASN 517 Cb 0.51 0.00 -0.10 0.00 -0.53 0.00 0.00 39.78 39.66 2qqp n ASN 517 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qqp s ALA 518 N -3.04 1.29 0.00 5.20 0.00 -1.26 -4.70 121.76 119.25 2qqp s ALA 518 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 50.50 2qqp s ALA 518 Cb 0.00 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.28 2qqp s ALA 518 CO 0.00 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 175.99 2qqp n GLY 519 N -0.16 0.00 3.66 0.00 0.00 -1.26 -4.82 105.19 102.62 2qqp n GLY 519 Ca -0.10 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.42 2qqp n GLY 519 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qqp n SER 520 N 0.00 3.23 0.00 1.61 7.64 -1.26 -4.75 113.62 120.09 2qqp n SER 520 Ca 0.00 0.91 0.01 0.00 1.01 0.00 0.00 58.87 60.80 2qqp n SER 520 Cb 0.00 -1.34 0.07 0.00 -1.01 0.00 0.00 64.21 61.92 2qqp n SER 520 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2qqp n THR 521 N 5.37 0.00 0.00 0.44 -2.24 -1.26 -3.13 114.28 113.46 2qqp n THR 521 Ca 0.25 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.03 2qqp n THR 521 Cb 0.28 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 2qqp n THR 521 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2qqp n VAL 522 N -0.55 0.00 -0.43 2.28 0.31 -1.26 -4.77 118.33 113.91 2qqp n VAL 522 Ca 0.02 0.00 0.37 0.00 -0.01 0.00 0.00 64.34 64.71 2qqp n VAL 522 Cb 0.01 -0.53 0.56 0.00 -0.91 0.00 0.00 33.84 32.97 2qqp n VAL 522 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qqp n GLY 523 N 2.19 -0.76 0.00 2.92 0.00 -1.18 0.19 105.19 108.55 2qqp n GLY 523 Ca 0.00 0.47 0.03 0.00 0.00 0.00 0.00 46.02 46.52 2qqp n GLY 523 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qqp n GLN 524 N -3.34 0.66 -0.00 1.61 10.64 -1.26 -2.45 117.38 123.24 2qqp n GLN 524 Ca 0.30 0.00 0.01 0.00 -1.83 0.00 0.00 57.00 55.48 2qqp n GLN 524 Cb 1.54 -1.12 -0.01 0.00 -0.86 0.00 0.00 30.24 29.78 2qqp n GLN 524 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2qqp n PHE 525 N -0.62 0.00 -2.19 2.61 3.01 0.49 -5.04 117.46 115.72 2qqp n PHE 525 Ca 0.04 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.12 2qqp n PHE 525 Cb 0.02 -0.02 -0.01 0.00 -0.01 0.00 0.00 39.48 39.46 2qqp n PHE 525 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qqp s ALA 526 N -1.54 3.11 0.00 4.37 0.00 -1.03 -4.78 121.76 121.89 2qqp s ALA 526 Ca 0.00 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.01 2qqp s ALA 526 Cb 0.01 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.71 2qqp s ALA 526 CO 0.08 -0.70 0.00 0.72 0.00 0.00 0.00 175.76 175.86 2qqp n HIS 527 N -0.15 0.00 -1.95 0.00 8.25 -0.90 -4.87 115.22 115.60 2qqp n HIS 527 Ca 0.05 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.16 2qqp n HIS 527 Cb 0.46 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.61 2qqp n HIS 527 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2qqp s THR 528 N -1.03 2.66 0.48 1.59 2.01 -1.26 0.14 115.64 120.23 2qqp s THR 528 Ca 0.00 0.40 -0.17 0.00 0.31 0.00 0.00 61.69 62.23 2qqp s THR 528 Cb 0.00 -3.12 -0.09 0.00 0.01 0.00 0.00 72.50 69.31 2qqp s THR 528 CO 0.00 -0.10 0.95 -0.83 -0.69 0.00 0.00 174.62 173.95 2qqp s GLY 529 N -1.71 2.14 0.52 4.40 0.00 -1.18 -4.47 107.32 107.03 2qqp s GLY 529 Ca 0.76 0.20 -0.20 0.00 0.00 0.00 0.00 44.72 45.49 2qqp s GLY 529 CO 0.34 0.47 0.56 0.00 0.00 0.00 0.00 173.10 174.47 2qqp n ALA 530 N -1.31 -1.15 -1.92 3.20 0.00 -1.26 -4.86 120.51 113.22 2qqp n ALA 530 Ca 0.06 0.04 -0.35 0.00 0.00 0.00 0.00 53.44 53.20 2qqp n ALA 530 Cb 0.54 -1.83 -0.06 0.00 0.00 0.00 0.00 19.45 18.10 2qqp n ALA 530 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2qqp s GLU 531 N -1.94 4.31 -0.40 0.00 2.02 -1.26 -1.88 118.70 119.55 2qqp s GLU 531 Ca 0.67 1.05 -0.28 0.00 0.02 0.00 0.00 54.97 56.43 2qqp s GLU 531 Cb -0.49 -2.57 -0.01 0.00 0.10 0.00 0.00 34.13 31.16 2qqp s GLU 531 CO 0.56 0.19 1.68 -2.00 0.02 0.00 0.00 175.26 175.71 2qqp s GLU 532 N -2.54 3.31 -0.39 1.61 2.12 -1.25 -3.48 118.70 118.08 2qqp s GLU 532 Ca 0.53 1.14 0.06 0.00 0.36 0.00 0.00 54.97 57.07 2qqp s GLU 532 Cb -0.14 -4.17 0.43 0.00 0.26 0.00 0.00 34.13 30.51 2qqp s GLU 532 CO 0.19 -1.90 1.13 -1.91 -0.54 0.00 0.00 175.26 172.23 2qqp n GLU 533 N 8.44 3.36 -0.38 4.30 4.07 0.26 -4.74 120.64 135.95 2qqp n GLU 533 Ca 0.20 -4.35 0.31 0.00 -0.06 0.00 0.00 57.16 53.26 2qqp n GLU 533 Cb 0.48 -2.21 0.50 0.00 -0.06 0.00 0.00 31.44 30.15 2qqp n GLU 533 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 2qqp n ASP 534 N -0.53 0.09 -0.26 4.31 5.68 -1.25 0.21 116.55 124.80 2qqp n ASP 534 Ca 0.39 0.84 -0.08 0.00 -0.50 0.00 0.00 54.79 55.44 2qqp n ASP 534 Cb 0.75 -0.41 -0.07 0.00 -1.14 0.00 0.00 41.12 40.25 2qqp n ASP 534 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2qqp h GLU 535 N 0.00 -0.03 0.00 0.11 4.39 -1.94 0.25 114.58 117.36 2qqp h GLU 535 Ca 0.61 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.31 2qqp h GLU 535 Cb 2.17 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.83 2qqp h GLU 535 CO -0.20 -0.02 0.00 0.28 -1.16 0.00 0.00 179.01 177.91 2qqp n VAL 536 N -4.51 0.00 0.00 3.13 0.31 0.13 -3.31 118.33 114.08 2qqp n VAL 536 Ca 0.01 1.18 0.00 0.00 -0.01 0.00 0.00 64.34 65.52 2qqp n VAL 536 Cb 0.18 -2.18 0.00 0.00 -0.91 0.00 0.00 33.84 30.93 2qqp n VAL 536 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2qqp n VAL 537 N -1.07 0.00 -0.05 2.52 0.31 -1.00 0.28 118.33 119.32 2qqp n VAL 537 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2qqp n VAL 537 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 2qqp n VAL 537 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2qqp h GLN 538 N 0.00 -0.45 -0.52 5.55 4.15 -0.59 0.60 115.11 123.85 2qqp h GLN 538 Ca 0.00 0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.50 2qqp h GLN 538 Cb 0.00 0.10 -0.06 0.00 0.21 0.00 0.00 27.48 27.73 2qqp h GLN 538 CO 0.00 -0.30 -0.31 -0.11 -1.93 0.00 0.00 178.83 176.18 2qqp n LEU 539 N -5.14 -0.55 -0.08 -2.39 7.94 0.81 -0.22 117.00 117.37 2qqp n LEU 539 Ca -0.05 1.28 -0.02 0.00 -1.11 0.00 0.00 56.01 56.11 2qqp n LEU 539 Cb 0.33 -0.30 -0.02 0.00 0.53 0.00 0.00 43.42 43.97 2qqp n LEU 539 CO 0.05 -0.93 0.47 0.00 -1.11 0.00 0.00 177.39 175.87 2qqp n ALA 540 N -3.15 -0.12 -0.34 1.96 0.00 -0.39 0.51 120.51 118.98 2qqp n ALA 540 Ca 0.01 0.15 0.20 0.00 0.00 0.00 0.00 53.44 53.80 2qqp n ALA 540 Cb 0.14 0.36 0.38 0.00 0.00 0.00 0.00 19.45 20.33 2qqp n ALA 540 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2qqp h ASN 541 N 0.00 -0.25 0.84 0.00 2.35 0.14 0.34 115.58 119.01 2qqp h ASN 541 Ca 0.03 0.28 -0.04 0.00 -0.55 0.00 0.00 56.30 56.01 2qqp h ASN 541 Cb 0.07 0.43 0.01 0.00 0.05 0.00 0.00 38.32 38.88 2qqp h ASN 541 CO -0.17 -0.38 -0.40 0.03 -1.65 0.00 0.00 177.43 174.85 2qqp h ARG 542 N 0.01 -1.09 -0.04 0.81 3.08 0.33 -0.28 114.38 117.19 2qqp h ARG 542 Ca 0.68 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.81 2qqp h ARG 542 Cb 1.54 0.25 -0.01 0.00 0.08 0.00 0.00 29.97 31.83 2qqp h ARG 542 CO -0.88 -0.73 -0.03 -0.07 -1.07 0.00 0.00 179.97 177.19 2qqp h LEU 543 N -1.23 -0.10 -0.48 3.04 3.38 0.21 1.12 115.31 121.26 2qqp h LEU 543 Ca -0.12 0.01 0.04 0.00 0.09 0.00 0.00 57.88 57.91 2qqp h LEU 543 Cb 0.87 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.60 2qqp h LEU 543 CO 0.19 -0.01 -0.28 0.00 0.09 0.00 0.00 178.44 178.43 2qqp n GLN 544 N -3.05 -0.21 -0.01 1.13 1.13 0.20 0.21 117.38 116.78 2qqp n GLN 544 Ca 0.00 1.05 -0.12 0.00 -1.94 0.00 0.00 57.00 55.98 2qqp n GLN 544 Cb 0.01 -1.55 -0.06 0.00 0.11 0.00 0.00 30.24 28.75 2qqp n GLN 544 CO 0.00 0.00 0.00 1.98 -1.44 0.00 0.00 177.06 177.60 2qqp h MET 545 N 0.00 -0.47 -0.56 -1.09 4.05 0.38 0.25 114.93 117.50 2qqp h MET 545 Ca 0.08 0.03 0.16 0.00 -0.28 0.00 0.00 59.70 59.69 2qqp h MET 545 Cb 0.20 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.08 2qqp h MET 545 CO -0.45 -0.31 0.48 1.49 0.23 0.00 0.00 176.91 178.35 2qqp h GLU 546 N -0.49 0.00 -6.32 0.39 4.81 0.48 -3.43 114.58 110.03 2qqp h GLU 546 Ca 0.08 0.00 -0.47 0.00 -0.13 0.00 0.00 59.36 58.84 2qqp h GLU 546 Cb 0.63 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.00 2qqp h GLU 546 CO -0.42 0.00 -0.30 -0.51 -0.73 0.00 0.00 179.01 177.06 2qqp s LEU 547 N -7.96 3.44 -0.22 1.64 1.43 0.57 -5.04 118.68 112.54 2qqp s LEU 547 Ca -0.05 -0.65 -0.08 0.00 -1.03 0.00 0.00 54.13 52.32 2qqp s LEU 547 Cb 0.18 -2.22 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 2qqp s LEU 547 CO 0.64 -0.79 0.09 0.28 0.23 0.00 0.00 176.35 176.80 2qqp s THR 548 N -2.46 4.82 -1.51 5.49 -1.32 -1.26 -4.85 115.64 114.55 2qqp s THR 548 Ca 0.52 -0.01 0.00 0.00 -1.21 0.00 0.00 61.69 60.98 2qqp s THR 548 Cb -0.06 -3.22 0.00 0.00 -1.51 0.00 0.00 72.50 67.71 2qqp s THR 548 CO 0.31 0.39 0.33 0.61 -2.21 0.00 0.00 174.62 174.05 2qqp n GLY 549 N 4.15 0.10 3.32 6.08 0.00 -1.26 -4.66 105.19 112.92 2qqp n GLY 549 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 2qqp n GLY 549 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qqp s VAL 550 N -1.51 2.06 0.23 1.61 1.01 -1.26 0.38 120.40 122.93 2qqp s VAL 550 Ca 0.00 -1.21 -0.05 0.00 0.00 0.00 0.00 61.98 60.72 2qqp s VAL 550 Cb 0.00 -1.73 0.02 0.00 0.00 0.00 0.00 36.38 34.67 2qqp s VAL 550 CO 0.00 0.49 0.39 -1.22 0.00 0.00 0.00 175.10 174.76 2qqp n TYR 551 N 2.19 -1.44 -3.64 5.22 4.02 0.32 -4.84 117.16 118.99 2qqp n TYR 551 Ca -0.16 -1.29 -0.34 0.00 -0.01 0.00 0.00 57.90 56.10 2qqp n TYR 551 Cb 0.51 0.45 -0.05 0.00 -0.02 0.00 0.00 39.34 40.23 2qqp n TYR 551 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 176.86 175.20 2qqp s GLN 552 N -2.28 3.69 0.00 -0.72 -0.21 -1.26 0.12 119.66 119.00 2qqp s GLN 552 Ca 0.14 0.07 0.00 0.00 0.02 0.00 0.00 55.36 55.59 2qqp s GLN 552 Cb -0.02 -3.00 0.00 0.00 1.00 0.00 0.00 33.01 31.00 2qqp s GLN 552 CO 0.10 0.57 0.27 0.00 -2.12 0.00 0.00 175.29 174.11 2qqp n ALA 553 N 0.83 1.70 0.13 6.09 0.00 -0.53 0.75 120.51 129.49 2qqp n ALA 553 Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.39 2qqp n ALA 553 Cb 0.52 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.93 2qqp n ALA 553 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2qqp n ASP 554 N -0.08 1.93 -0.29 0.00 8.00 -1.26 -4.04 116.55 120.80 2qqp n ASP 554 Ca 0.00 -0.32 0.08 0.00 0.71 0.00 0.00 54.79 55.25 2qqp n ASP 554 Cb 0.05 1.13 -0.02 0.00 -0.02 0.00 0.00 41.12 42.26 2qqp n ASP 554 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2qqp n ASP 555 N -1.41 1.43 0.00 -2.24 8.00 0.23 -5.08 116.55 117.48 2qqp n ASP 555 Ca 0.00 -1.22 0.00 0.00 0.71 0.00 0.00 54.79 54.28 2qqp n ASP 555 Cb 0.12 0.56 0.00 0.00 -0.02 0.00 0.00 41.12 41.78 2qqp n ASP 555 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61