#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qao n LEU 3 N 0.00 0.00 0.00 6.15 4.77 -1.26 -3.86 117.00 122.80 2qao n LEU 3 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2qao n LEU 3 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2qao n LEU 3 CO 0.00 -1.43 0.00 0.59 -1.33 0.00 0.00 177.39 175.22 2qao n ASN 4 N -2.81 0.00 -0.21 -1.43 5.03 -1.26 -4.22 115.26 110.36 2qao n ASN 4 Ca 0.00 0.00 0.19 0.00 0.87 0.00 0.00 54.58 55.64 2qao n ASN 4 Cb 0.00 0.00 0.34 0.00 -1.02 0.00 0.00 39.78 39.10 2qao n ASN 4 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 2qao n THR 5 N 0.00 -0.19 -2.98 3.41 -2.24 -1.25 -4.35 114.28 106.69 2qao n THR 5 Ca 0.00 1.05 -0.40 0.00 -2.27 0.00 0.00 64.05 62.43 2qao n THR 5 Cb 0.00 -1.72 -0.05 0.00 -2.10 0.00 0.00 70.33 66.46 2qao n THR 5 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 2qao s LEU 6 N -8.07 4.43 0.28 3.22 2.34 -1.26 -5.07 118.68 114.55 2qao s LEU 6 Ca -0.05 1.43 0.05 0.00 0.06 0.00 0.00 54.13 55.62 2qao s LEU 6 Cb 0.18 -3.23 -0.06 0.00 -0.56 0.00 0.00 46.19 42.52 2qao s LEU 6 CO 0.43 -0.02 -0.01 -0.44 -1.06 0.00 0.00 176.35 175.26 2qao s SER 7 N 0.11 2.46 0.98 1.48 0.01 -1.26 -5.09 113.70 112.38 2qao s SER 7 Ca 0.39 -1.25 -0.11 0.00 1.31 0.00 0.00 55.95 56.29 2qao s SER 7 Cb -0.20 -0.11 0.18 0.00 0.21 0.00 0.00 66.02 66.10 2qao s SER 7 CO 0.23 -0.46 1.09 -2.84 0.41 0.00 0.00 173.24 171.67 2qao s PRO 8 N -3.80 0.51 0.34 12.44 0.02 -1.26 -5.02 135.00 138.23 2qao s PRO 8 Ca 0.31 1.12 -0.06 0.00 0.02 0.00 0.00 61.00 62.39 2qao s PRO 8 Cb 0.06 -1.70 0.09 0.00 0.02 0.00 0.00 34.50 32.97 2qao s PRO 8 CO 0.12 -2.84 0.25 0.00 -0.33 0.00 0.00 177.00 174.20 2qao n ALA 9 N -4.33 -1.11 -3.09 -1.55 0.00 -1.26 -4.88 120.51 104.29 2qao n ALA 9 Ca 0.08 -0.40 -0.44 0.00 0.00 0.00 0.00 53.44 52.67 2qao n ALA 9 Cb 0.54 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.96 2qao n ALA 9 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2qao n GLU 10 N -2.67 3.60 0.00 0.00 4.07 -1.26 -3.89 120.64 120.50 2qao n GLU 10 Ca 0.04 -4.20 0.00 0.00 -0.06 0.00 0.00 57.16 52.94 2qao n GLU 10 Cb 0.15 -2.74 0.00 0.00 -0.06 0.00 0.00 31.44 28.79 2qao n GLU 10 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qao n GLY 11 N 3.00 0.24 0.20 8.31 0.00 -1.26 -4.99 105.19 110.68 2qao n GLY 11 Ca 0.30 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.42 2qao n GLY 11 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2qao h SER 12 N 0.00 0.00 -3.38 1.61 0.02 -1.92 -3.41 113.55 106.47 2qao h SER 12 Ca 0.00 0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.49 2qao h SER 12 Cb 0.00 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.40 2qao h SER 12 CO 0.00 0.00 -0.61 -0.54 -1.14 0.00 0.00 176.83 174.54 2qao s LYS 13 N -3.55 1.62 0.00 3.45 -0.14 -1.26 -5.01 119.74 114.85 2qao s LYS 13 Ca -0.02 -1.89 0.02 0.00 -1.36 0.00 0.00 55.97 52.71 2qao s LYS 13 Cb 0.06 -0.81 0.03 0.00 -1.68 0.00 0.00 37.83 35.43 2qao s LYS 13 CO 0.18 -0.19 0.74 1.63 -0.76 0.00 0.00 175.35 176.95 2qao n LYS 14 N -0.66 0.00 0.00 1.68 4.76 -1.26 -5.08 118.16 117.60 2qao n LYS 14 Ca -0.02 -0.52 0.00 0.00 -2.87 0.00 0.00 58.31 54.90 2qao n LYS 14 Cb 0.66 0.08 0.00 0.00 -1.84 0.00 0.00 35.03 33.93 2qao n LYS 14 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qao n ALA 15 N 0.03 0.00 0.00 7.82 0.00 -1.26 -4.79 120.51 122.31 2qao n ALA 15 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2qao n ALA 15 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.07 2qao n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qao n GLY 16 N 0.00 3.45 2.76 0.00 0.00 -1.26 -5.10 105.19 105.04 2qao n GLY 16 Ca 0.00 -1.88 -0.24 0.00 0.00 0.00 0.00 46.02 43.89 2qao n GLY 16 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2qao n LYS 17 N -1.24 -3.99 0.04 1.61 2.85 -1.26 -5.00 118.16 111.17 2qao n LYS 17 Ca 0.00 -1.17 0.00 0.00 -1.05 0.00 0.00 58.31 56.09 2qao n LYS 17 Cb 0.00 -1.60 0.00 0.00 -0.65 0.00 0.00 35.03 32.78 2qao n LYS 17 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2qao n ARG 18 N -4.66 0.00 -1.41 -1.58 1.74 -1.26 -5.17 116.66 104.32 2qao n ARG 18 Ca 0.11 0.00 0.04 0.00 -0.77 0.00 0.00 57.85 57.23 2qao n ARG 18 Cb 0.48 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.90 2qao n ARG 18 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2qao n LEU 19 N -2.68 -1.40 -3.87 0.55 4.32 -1.26 -4.83 117.00 107.82 2qao n LEU 19 Ca 0.00 2.52 -0.31 0.00 -0.02 0.00 0.00 56.01 58.20 2qao n LEU 19 Cb 0.00 -2.79 0.01 0.00 -1.62 0.00 0.00 43.42 39.02 2qao n LEU 19 CO 0.00 -1.03 -0.17 0.61 -1.22 0.00 0.00 177.39 175.58 2qao n GLY 20 N -2.89 -0.62 2.12 -0.72 0.00 -0.32 -4.90 105.19 97.86 2qao n GLY 20 Ca -0.02 0.30 0.02 0.00 0.00 0.00 0.00 46.02 46.32 2qao n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qao n ARG 21 N -4.41 0.91 0.00 1.61 5.12 -1.26 -4.99 116.66 113.63 2qao n ARG 21 Ca -0.20 -2.77 0.00 0.00 -1.93 0.00 0.00 57.85 52.95 2qao n ARG 21 Cb 0.63 -0.82 0.00 0.00 -1.16 0.00 0.00 32.46 31.11 2qao n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2qao n GLY 22 N -0.07 0.32 0.34 -0.13 0.00 -1.26 -4.34 105.19 100.06 2qao n GLY 22 Ca 0.07 -1.56 0.15 0.00 0.00 0.00 0.00 46.02 44.69 2qao n GLY 22 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qao h ILE 23 N 0.00 0.56 -0.39 -0.61 5.03 -1.96 -2.30 117.51 117.84 2qao h ILE 23 Ca 0.00 -0.20 0.08 0.00 -0.12 0.00 0.00 64.86 64.62 2qao h ILE 23 Cb 0.00 -0.06 -0.09 0.00 -3.03 0.00 0.00 36.82 33.64 2qao h ILE 23 CO 0.00 0.10 -0.30 1.23 -0.68 0.00 0.00 178.15 178.51 2qao h GLY 24 N 0.57 -0.17 -0.62 5.37 0.00 -2.00 -0.83 103.07 105.38 2qao h GLY 24 Ca 0.60 0.38 0.34 0.00 0.00 0.00 0.00 47.33 48.65 2qao h GLY 24 CO -0.47 -0.21 0.98 1.48 0.00 0.00 0.00 176.54 178.33 2qao h SER 25 N -0.23 0.00 0.00 0.19 4.64 -1.60 -3.44 113.55 113.11 2qao h SER 25 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2qao h SER 25 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2qao h SER 25 CO -0.52 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.05 2qao n GLY 26 N -1.74 1.07 2.49 -0.77 0.00 -0.32 -4.90 105.19 101.02 2qao n GLY 26 Ca 0.25 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.08 2qao n GLY 26 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qao n LEU 27 N 0.00 2.23 0.00 0.99 4.32 -1.26 -4.95 117.00 118.33 2qao n LEU 27 Ca 0.00 -4.94 0.00 0.00 -0.02 0.00 0.00 56.01 51.05 2qao n LEU 27 Cb 0.00 0.24 0.00 0.00 -1.62 0.00 0.00 43.42 42.04 2qao n LEU 27 CO 0.00 2.16 0.00 0.61 -1.22 0.00 0.00 177.39 178.94 2qao n GLY 28 N 0.01 -2.39 3.21 -0.72 0.00 -1.25 -1.17 105.19 102.87 2qao n GLY 28 Ca 0.25 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.49 2qao n GLY 28 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2qao n LYS 29 N 0.00 -2.33 -0.65 1.61 2.85 -1.26 -2.08 118.16 116.30 2qao n LYS 29 Ca 0.00 -0.67 0.00 0.00 -1.05 0.00 0.00 58.31 56.59 2qao n LYS 29 Cb 0.00 -1.71 0.00 0.00 -0.65 0.00 0.00 35.03 32.67 2qao n LYS 29 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2qao n THR 30 N -4.68 0.00 -3.24 0.58 -2.24 -1.26 -3.69 114.28 99.75 2qao n THR 30 Ca 0.04 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.65 2qao n THR 30 Cb 0.54 -0.65 -0.04 0.00 -2.10 0.00 0.00 70.33 68.07 2qao n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qao n GLY 31 N -0.04 -0.10 3.80 3.38 0.00 -0.89 0.84 105.19 112.18 2qao n GLY 31 Ca 0.00 0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 2qao n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qao n GLY 32 N -1.46 -0.49 0.89 -0.02 0.00 -1.24 -4.89 105.19 97.98 2qao n GLY 32 Ca -0.09 0.20 0.04 0.00 0.00 0.00 0.00 46.02 46.17 2qao n GLY 32 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2qao n ARG 33 N -4.72 0.42 -0.38 1.61 1.85 0.25 -5.14 116.66 110.55 2qao n ARG 33 Ca -0.01 -2.01 0.05 0.00 -1.00 0.00 0.00 57.85 54.88 2qao n ARG 33 Cb 0.55 -0.60 -0.01 0.00 -1.05 0.00 0.00 32.46 31.35 2qao n ARG 33 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2qao n GLY 34 N -0.15 -1.88 3.50 2.89 0.00 -1.26 -4.61 105.19 103.69 2qao n GLY 34 Ca 0.08 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.43 2qao n GLY 34 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qao s HIS 35 N -0.90 3.12 0.11 1.61 3.76 -1.26 -4.84 115.29 116.89 2qao s HIS 35 Ca 0.00 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.65 2qao s HIS 35 Cb 0.00 -2.17 0.00 0.00 1.11 0.00 0.00 32.58 31.52 2qao s HIS 35 CO 0.00 -0.19 0.00 1.63 -0.85 0.00 0.00 174.74 175.33 2qao n LYS 36 N 4.43 -0.98 0.00 1.40 5.02 -1.26 -5.04 118.16 121.72 2qao n LYS 36 Ca -0.16 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 56.77 2qao n LYS 36 Cb 0.52 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 2qao n LYS 36 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qao n GLY 37 N -1.52 1.45 0.18 0.72 0.00 -1.26 -4.53 105.19 100.23 2qao n GLY 37 Ca 0.00 -1.81 0.01 0.00 0.00 0.00 0.00 46.02 44.22 2qao n GLY 37 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2qao h GLN 38 N 0.00 0.08 -0.14 1.61 4.15 -1.98 -2.85 115.11 115.97 2qao h GLN 38 Ca 0.00 -0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.43 2qao h GLN 38 Cb 0.00 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 2qao h GLN 38 CO 0.00 0.48 0.29 0.87 -1.93 0.00 0.00 178.83 178.54 2qao h LYS 39 N 0.06 0.00 0.00 1.69 1.79 -1.85 -3.06 116.57 115.21 2qao h LYS 39 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2qao h LYS 39 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 2qao h LYS 39 CO 0.06 0.00 0.00 -1.13 -1.08 0.00 0.00 179.45 177.30 2qao n SER 40 N -3.33 0.00 -1.03 0.86 3.41 -1.08 -4.62 113.62 107.83 2qao n SER 40 Ca 0.01 -0.78 0.00 0.00 -0.26 0.00 0.00 58.87 57.84 2qao n SER 40 Cb 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 2qao n SER 40 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2qao n ARG 41 N -0.78 -2.83 -1.64 4.33 1.74 -1.26 -3.74 116.66 112.48 2qao n ARG 41 Ca 0.00 2.15 -0.40 0.00 -0.77 0.00 0.00 57.85 58.84 2qao n ARG 41 Cb 0.00 -2.57 0.03 0.00 -1.02 0.00 0.00 32.46 28.90 2qao n ARG 41 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2qao n SER 42 N -1.65 1.47 0.00 0.55 3.41 -1.26 0.05 113.62 116.18 2qao n SER 42 Ca 0.00 0.95 0.00 0.00 -0.26 0.00 0.00 58.87 59.56 2qao n SER 42 Cb 0.17 -1.42 0.00 0.00 -0.26 0.00 0.00 64.21 62.70 2qao n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qao n GLY 43 N 1.11 1.13 3.67 5.00 0.00 -1.26 -4.90 105.19 109.94 2qao n GLY 43 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 2qao n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qao n GLY 44 N -1.94 1.64 0.00 -0.02 0.00 0.11 -4.87 105.19 100.12 2qao n GLY 44 Ca 0.00 0.82 0.00 0.00 0.00 0.00 0.00 46.02 46.84 2qao n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qao n GLY 45 N 4.40 3.94 3.89 -0.02 0.00 -1.16 -4.67 105.19 111.58 2qao n GLY 45 Ca 0.21 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 2qao n GLY 45 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qao s VAL 46 N -1.82 4.89 1.35 1.61 -7.23 -1.26 -5.03 120.40 112.90 2qao s VAL 46 Ca 0.00 0.33 -0.21 0.00 -1.81 0.00 0.00 61.98 60.29 2qao s VAL 46 Cb 0.00 -3.78 0.34 0.00 0.56 0.00 0.00 36.38 33.50 2qao s VAL 46 CO 0.00 -0.57 0.98 0.00 -0.31 0.00 0.00 175.10 175.20 2qao s ARG 47 N -4.05 -2.34 0.29 4.82 1.70 -1.26 -4.95 118.95 113.16 2qao s ARG 47 Ca 0.48 0.15 -0.29 0.00 -0.47 0.00 0.00 55.73 55.61 2qao s ARG 47 Cb -0.10 -1.45 -0.09 0.00 -0.57 0.00 0.00 34.95 32.74 2qao s ARG 47 CO 0.35 -4.49 1.09 1.03 -1.08 0.00 0.00 175.30 172.20 2qao s ARG 48 N -5.09 4.58 -1.37 3.89 0.52 -1.26 -3.40 118.95 116.81 2qao s ARG 48 Ca 0.69 1.76 -0.06 0.00 -0.52 0.00 0.00 55.73 57.60 2qao s ARG 48 Cb -0.14 -3.11 0.04 0.00 0.52 0.00 0.00 34.95 32.26 2qao s ARG 48 CO 0.58 0.18 0.48 0.41 0.02 0.00 0.00 175.30 176.96 2qao n GLY 49 N 1.10 -0.50 2.85 -3.53 0.00 -1.26 -4.87 105.19 98.98 2qao n GLY 49 Ca -0.00 0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2qao n GLY 49 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2qao n PHE 50 N -4.10 2.78 -1.52 1.61 -0.00 -1.22 -4.71 117.46 110.30 2qao n PHE 50 Ca -0.07 -2.75 -0.21 0.00 -0.00 0.00 0.00 57.45 54.42 2qao n PHE 50 Cb 0.58 -1.82 -0.16 0.00 -0.00 0.00 0.00 39.48 38.08 2qao n PHE 50 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 2qao n GLU 51 N 3.28 0.24 0.00 -4.13 -0.58 -1.26 -4.60 120.64 113.59 2qao n GLU 51 Ca 0.39 -0.29 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 2qao n GLU 51 Cb 0.35 -2.06 0.00 0.00 -0.57 0.00 0.00 31.44 29.16 2qao n GLU 51 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qao n GLY 52 N 6.04 1.67 0.00 0.62 0.00 -1.26 -2.37 105.19 109.89 2qao n GLY 52 Ca 0.59 0.61 0.00 0.00 0.00 0.00 0.00 46.02 47.23 2qao n GLY 52 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qao n GLY 53 N 0.00 0.00 0.59 -0.02 0.00 -1.26 -5.08 105.19 99.42 2qao n GLY 53 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2qao n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qao n GLN 54 N -1.24 -2.35 -2.39 1.61 10.64 -1.00 -4.91 117.38 117.75 2qao n GLN 54 Ca 0.00 -0.27 -0.42 0.00 -1.83 0.00 0.00 57.00 54.47 2qao n GLN 54 Cb 0.12 -0.34 -0.03 0.00 -0.86 0.00 0.00 30.24 29.14 2qao n GLN 54 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.06 176.64 2qao s MET 55 N -3.39 4.32 1.07 2.61 -2.45 -1.26 -4.75 119.30 115.45 2qao s MET 55 Ca 0.12 1.75 -0.14 0.00 -1.25 0.00 0.00 55.69 56.17 2qao s MET 55 Cb -0.02 -3.60 0.15 0.00 1.25 0.00 0.00 34.83 32.61 2qao s MET 55 CO 0.10 -0.52 0.54 -2.30 1.05 0.00 0.00 175.02 173.89 2qao n PRO 56 N 5.46 -1.39 0.02 4.11 -0.02 -1.26 -4.80 135.00 137.13 2qao n PRO 56 Ca 0.12 -0.37 -0.11 0.00 -2.02 0.00 0.00 63.50 61.12 2qao n PRO 56 Cb 0.45 -1.96 0.03 0.00 -0.02 0.00 0.00 33.50 32.00 2qao n PRO 56 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2qao h LEU 57 N -2.11 0.59 -2.29 2.45 5.85 -1.95 -2.90 115.31 114.96 2qao h LEU 57 Ca -0.52 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 57.79 2qao h LEU 57 Cb 1.32 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 2qao h LEU 57 CO 0.41 1.10 0.06 0.00 -0.34 0.00 0.00 178.44 179.66 2qao n TYR 58 N -3.90 0.25 0.10 1.25 0.18 -1.26 -3.48 117.16 110.31 2qao n TYR 58 Ca -0.04 -0.69 0.00 0.00 1.88 0.00 0.00 57.90 59.05 2qao n TYR 58 Cb 0.67 -0.35 0.00 0.00 -0.38 0.00 0.00 39.34 39.29 2qao n TYR 58 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2qao n ARG 59 N 0.50 0.00 0.28 -3.48 5.12 -1.10 -4.79 116.66 113.19 2qao n ARG 59 Ca 0.05 0.00 0.17 0.00 -1.93 0.00 0.00 57.85 56.14 2qao n ARG 59 Cb 0.58 -0.22 0.93 0.00 -1.16 0.00 0.00 32.46 32.59 2qao n ARG 59 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2qao h ARG 60 N 0.00 0.00 -5.21 5.56 3.08 -1.61 -3.40 114.38 112.80 2qao h ARG 60 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.43 2qao h ARG 60 Cb 0.00 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 29.91 2qao h ARG 60 CO 0.00 0.00 -0.30 -0.51 -1.07 0.00 0.00 179.97 178.09 2qao s LEU 61 N -5.50 4.09 1.14 3.04 1.02 -1.23 -5.08 118.68 116.16 2qao s LEU 61 Ca -0.04 0.30 -0.17 0.00 0.02 0.00 0.00 54.13 54.25 2qao s LEU 61 Cb 0.10 -2.36 0.17 0.00 0.02 0.00 0.00 46.19 44.11 2qao s LEU 61 CO 0.31 -0.08 0.35 -2.65 0.02 0.00 0.00 176.35 174.29 2qao n PRO 62 N 4.80 -1.88 -4.04 1.29 -0.02 -1.26 -4.94 135.00 128.95 2qao n PRO 62 Ca -0.10 -0.53 -0.31 0.00 -2.02 0.00 0.00 63.50 60.54 2qao n PRO 62 Cb 0.51 -1.86 -0.16 0.00 -0.02 0.00 0.00 33.50 31.98 2qao n PRO 62 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2qao s LYS 63 N -3.76 2.34 -0.97 -0.52 -2.85 -1.26 -5.06 119.74 107.66 2qao s LYS 63 Ca 0.60 -0.81 -0.14 0.00 -1.00 0.00 0.00 55.97 54.61 2qao s LYS 63 Cb -0.17 -2.42 0.20 0.00 -2.06 0.00 0.00 37.83 33.39 2qao s LYS 63 CO 0.66 -0.34 1.03 -0.59 0.10 0.00 0.00 175.35 176.21 2qao s PHE 64 N 1.37 3.65 0.00 1.78 -0.12 -1.26 -5.03 117.98 118.36 2qao s PHE 64 Ca 0.01 -1.98 0.00 0.00 -0.05 0.00 0.00 56.93 54.91 2qao s PHE 64 Cb -0.15 -4.03 0.00 0.00 -0.63 0.00 0.00 43.02 38.21 2qao s PHE 64 CO -0.10 -1.18 0.00 0.41 -0.05 0.00 0.00 175.22 174.30 2qao n GLY 65 N 4.17 -1.85 0.02 1.99 0.00 -1.26 -5.04 105.19 103.22 2qao n GLY 65 Ca 0.22 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2qao n GLY 65 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2qao n PHE 66 N -0.53 0.00 -3.84 1.61 7.35 -1.26 -5.09 117.46 115.70 2qao n PHE 66 Ca 0.00 0.00 -0.22 0.00 -0.76 0.00 0.00 57.45 56.47 2qao n PHE 66 Cb 0.00 -0.72 -0.17 0.00 0.35 0.00 0.00 39.48 38.94 2qao n PHE 66 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2qao s THR 67 N -0.43 0.42 0.05 -2.13 -4.23 -1.26 -5.05 115.64 103.00 2qao s THR 67 Ca 0.00 0.07 -0.05 0.00 -1.18 0.00 0.00 61.69 60.53 2qao s THR 67 Cb 0.00 -0.55 0.03 0.00 1.34 0.00 0.00 72.50 73.32 2qao s THR 67 CO 0.00 0.26 0.34 -1.54 -0.54 0.00 0.00 174.62 173.14 2qao n SER 68 N 4.94 -0.18 -1.44 3.99 3.41 -1.26 -4.71 113.62 118.37 2qao n SER 68 Ca -0.11 0.39 -0.18 0.00 -0.26 0.00 0.00 58.87 58.71 2qao n SER 68 Cb 0.50 -0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.30 2qao n SER 68 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2qao n ARG 69 N -4.31 -1.27 0.00 4.33 0.00 -1.26 -4.57 116.66 109.58 2qao n ARG 69 Ca 0.02 1.12 0.00 0.00 -0.00 0.00 0.00 57.85 58.98 2qao n ARG 69 Cb 0.08 -5.40 0.00 0.00 0.00 0.00 0.00 32.46 27.13 2qao n ARG 69 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 2qao n LYS 70 N -2.49 0.31 0.22 -0.14 4.81 -1.26 -4.83 118.16 114.77 2qao n LYS 70 Ca -0.18 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.41 2qao n LYS 70 Cb 0.60 -0.28 0.67 0.00 0.02 0.00 0.00 35.03 36.04 2qao n LYS 70 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2qao h ALA 71 N 0.00 1.00 -0.16 3.14 0.00 -1.92 -1.96 119.26 119.36 2qao h ALA 71 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2qao h ALA 71 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2qao h ALA 71 CO 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 179.25 178.90 2qao h ALA 72 N 2.10 1.11 -0.58 0.00 0.00 -1.95 -2.32 119.26 117.62 2qao h ALA 72 Ca 0.00 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 2qao h ALA 72 Cb 0.34 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2qao h ALA 72 CO 0.00 0.57 0.09 0.44 0.00 0.00 0.00 179.25 180.35 2qao n ILE 73 N -4.07 2.59 -4.15 0.00 -5.35 -0.74 -4.74 119.36 102.90 2qao n ILE 73 Ca -0.01 -1.34 -0.33 0.00 -0.27 0.00 0.00 62.75 60.80 2qao n ILE 73 Cb 0.45 -0.34 -0.16 0.00 -1.74 0.00 0.00 39.64 37.85 2qao n ILE 73 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 2qao s THR 74 N -2.66 2.01 0.51 7.28 2.01 -0.87 0.12 115.64 124.03 2qao s THR 74 Ca 0.50 -0.91 0.09 0.00 0.31 0.00 0.00 61.69 61.68 2qao s THR 74 Cb 0.39 -1.82 0.05 0.00 0.01 0.00 0.00 72.50 71.13 2qao s THR 74 CO 0.14 0.53 0.67 0.00 -0.69 0.00 0.00 174.62 175.27 2qao s ALA 75 N 1.27 4.60 -0.36 7.40 0.00 0.21 -4.94 121.76 129.94 2qao s ALA 75 Ca 0.04 -1.91 -0.00 0.00 0.00 0.00 0.00 51.96 50.09 2qao s ALA 75 Cb -0.13 -1.46 0.12 0.00 0.00 0.00 0.00 23.12 21.65 2qao s ALA 75 CO -0.12 -0.59 0.18 -2.00 0.00 0.00 0.00 175.76 173.23 2qao s GLU 76 N -4.50 0.78 0.60 0.00 2.12 -1.26 -3.20 118.70 113.23 2qao s GLU 76 Ca 0.57 -1.37 -0.15 0.00 0.36 0.00 0.00 54.97 54.38 2qao s GLU 76 Cb -0.07 -1.81 -0.04 0.00 0.26 0.00 0.00 34.13 32.48 2qao s GLU 76 CO 0.35 -1.11 1.05 0.42 -0.54 0.00 0.00 175.26 175.43 2qao s ILE 77 N 1.13 3.93 0.20 -3.70 1.01 -0.14 -4.96 121.20 118.67 2qao s ILE 77 Ca 0.14 0.88 0.10 0.00 0.00 0.00 0.00 60.65 61.77 2qao s ILE 77 Cb -0.21 -3.43 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 2qao s ILE 77 CO -0.11 -0.57 -0.21 -0.13 0.00 0.00 0.00 174.94 173.91 2qao s ARG 78 N -4.20 1.45 0.49 2.79 0.52 -1.18 -4.03 118.95 114.80 2qao s ARG 78 Ca 0.62 -1.52 0.14 0.00 -0.52 0.00 0.00 55.73 54.45 2qao s ARG 78 Cb -0.15 -1.61 1.18 0.00 0.52 0.00 0.00 34.95 34.88 2qao s ARG 78 CO 0.38 0.33 2.12 -0.07 0.02 0.00 0.00 175.30 178.08 2qao h LEU 79 N 3.05 0.07 -2.00 2.53 3.38 -1.62 -0.29 115.31 120.42 2qao h LEU 79 Ca -0.43 -0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.61 2qao h LEU 79 Cb 1.22 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2qao h LEU 79 CO 0.51 0.07 0.20 0.77 0.09 0.00 0.00 178.44 180.09 2qao h SER 80 N 0.08 0.00 0.00 -0.43 4.64 -1.87 -3.36 113.55 112.61 2qao h SER 80 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2qao h SER 80 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2qao h SER 80 CO -0.00 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.43 2qao n ASP 81 N -4.45 0.00 0.00 4.97 8.00 -0.12 -4.29 116.55 120.66 2qao n ASP 81 Ca 0.04 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.54 2qao n ASP 81 Cb 0.36 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 2qao n ASP 81 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2qao n LEU 82 N 0.00 0.00 0.00 0.64 4.32 -1.26 -4.18 117.00 116.52 2qao n LEU 82 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 56.01 56.00 2qao n LEU 82 Cb 0.00 0.00 0.05 0.00 -1.62 0.00 0.00 43.42 41.85 2qao n LEU 82 CO 0.00 0.00 0.51 0.00 -1.22 0.00 0.00 177.39 176.68 2qao n ALA 83 N 0.00 1.15 -0.88 -1.18 0.00 -1.26 -0.21 120.51 118.12 2qao n ALA 83 Ca 0.00 -0.01 0.03 0.00 0.00 0.00 0.00 53.44 53.46 2qao n ALA 83 Cb 0.00 -1.04 0.05 0.00 0.00 0.00 0.00 19.45 18.46 2qao n ALA 83 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2qao n LYS 84 N -1.45 1.38 0.00 0.00 2.85 -1.26 -4.71 118.16 114.97 2qao n LYS 84 Ca 0.01 -1.59 0.00 0.00 -1.05 0.00 0.00 58.31 55.68 2qao n LYS 84 Cb 0.02 -0.99 0.00 0.00 -0.65 0.00 0.00 35.03 33.42 2qao n LYS 84 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 2qao n VAL 85 N -0.63 0.00 -2.79 0.58 3.14 0.70 -4.88 118.33 114.45 2qao n VAL 85 Ca 0.05 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.41 2qao n VAL 85 Cb 0.50 -0.20 0.00 0.00 -1.06 0.00 0.00 33.84 33.08 2qao n VAL 85 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2qao n GLU 86 N -0.30 -3.06 0.00 1.45 4.07 -1.26 -4.78 120.64 116.75 2qao n GLU 86 Ca 0.00 2.52 0.00 0.00 -0.06 0.00 0.00 57.16 59.62 2qao n GLU 86 Cb 0.06 -5.09 0.00 0.00 -0.06 0.00 0.00 31.44 26.35 2qao n GLU 86 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2qao n GLY 87 N 0.55 -1.76 0.00 8.31 0.00 -1.26 -4.97 105.19 106.06 2qao n GLY 87 Ca 0.02 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2qao n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qao n GLY 88 N 0.00 0.44 2.66 -0.02 0.00 -1.26 -4.91 105.19 102.11 2qao n GLY 88 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.22 2qao n GLY 88 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2qao n VAL 89 N 0.00 -0.87 -2.67 1.61 3.14 -1.25 -4.77 118.33 113.52 2qao n VAL 89 Ca 0.00 0.00 -0.43 0.00 -2.96 0.00 0.00 64.34 60.95 2qao n VAL 89 Cb 0.00 -2.16 0.00 0.00 -1.06 0.00 0.00 33.84 30.62 2qao n VAL 89 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2qao n VAL 90 N 2.33 4.09 -0.67 1.55 0.31 -1.04 -4.80 118.33 120.09 2qao n VAL 90 Ca 0.00 -4.34 -0.32 0.00 -0.01 0.00 0.00 64.34 59.67 2qao n VAL 90 Cb 0.00 -2.42 0.17 0.00 -0.91 0.00 0.00 33.84 30.68 2qao n VAL 90 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2qao n ASP 91 N 6.65 -1.86 -0.33 4.52 -0.08 -1.25 0.11 116.55 124.31 2qao n ASP 91 Ca 0.43 0.07 0.21 0.00 -1.51 0.00 0.00 54.79 53.99 2qao n ASP 91 Cb 0.43 -1.15 0.46 0.00 2.34 0.00 0.00 41.12 43.20 2qao n ASP 91 CO 0.00 0.00 0.00 0.17 0.12 0.00 0.00 177.20 177.49 2qao h LEU 92 N -2.01 0.53 0.00 -2.67 -0.00 -1.25 -3.38 115.31 106.53 2qao h LEU 92 Ca -0.51 0.10 0.00 0.00 -0.00 0.00 0.00 57.88 57.47 2qao h LEU 92 Cb 1.32 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 42.00 2qao h LEU 92 CO 0.39 0.10 0.00 -0.46 -0.00 0.00 0.00 178.44 178.48 2qao n ASN 93 N -4.71 0.00 0.00 0.17 6.94 -1.26 -4.84 115.26 111.56 2qao n ASN 93 Ca 0.26 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.82 2qao n ASN 93 Cb 0.82 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.24 2qao n ASN 93 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 2qao n THR 94 N 0.00 0.00 -0.27 5.53 -1.04 -1.26 -3.66 114.28 113.58 2qao n THR 94 Ca 0.00 0.00 0.29 0.00 -2.04 0.00 0.00 64.05 62.30 2qao n THR 94 Cb 0.00 0.00 0.66 0.00 -1.82 0.00 0.00 70.33 69.17 2qao n THR 94 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2qao h LEU 95 N 0.00 0.15 0.82 -4.42 4.07 -1.86 1.11 115.31 115.17 2qao h LEU 95 Ca 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 57.88 57.95 2qao h LEU 95 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2qao h LEU 95 CO 0.00 0.04 -0.44 0.11 -1.08 0.00 0.00 178.44 177.07 2qao h LYS 96 N 0.13 -1.11 0.00 1.13 1.57 -1.90 -0.37 116.57 116.02 2qao h LYS 96 Ca 0.52 0.08 0.00 0.00 -1.87 0.00 0.00 60.65 59.38 2qao h LYS 96 Cb 1.81 0.25 0.00 0.00 0.08 0.00 0.00 32.23 34.37 2qao h LYS 96 CO -0.09 -0.74 0.00 0.00 -0.57 0.00 0.00 179.45 178.05 2qao h ALA 97 N -1.36 1.00 -0.36 3.86 0.00 -1.07 0.18 119.26 121.51 2qao h ALA 97 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2qao h ALA 97 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2qao h ALA 97 CO 0.15 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.40 2qao n ALA 98 N -1.94 3.11 -3.43 0.00 0.00 0.36 -4.96 120.51 113.64 2qao n ALA 98 Ca -0.01 -1.03 -0.35 0.00 0.00 0.00 0.00 53.44 52.05 2qao n ALA 98 Cb 0.16 -1.05 0.04 0.00 0.00 0.00 0.00 19.45 18.59 2qao n ALA 98 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2qao n ASN 99 N 0.45 -5.78 -0.03 0.00 4.13 0.64 -4.89 115.26 109.78 2qao n ASN 99 Ca 0.16 -0.07 0.00 0.00 1.68 0.00 0.00 54.58 56.35 2qao n ASN 99 Cb 0.70 -2.03 0.00 0.00 -1.54 0.00 0.00 39.78 36.91 2qao n ASN 99 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qao n ILE 100 N -0.15 0.00 0.04 2.41 3.06 -0.58 -5.00 119.36 119.14 2qao n ILE 100 Ca -0.06 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.19 2qao n ILE 100 Cb 0.66 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.84 2qao n ILE 100 CO 0.00 0.00 0.00 -0.38 -2.50 0.00 0.00 176.55 173.67 2qao n ILE 101 N 0.00 0.04 0.00 9.51 2.08 -1.24 -4.88 119.36 124.87 2qao n ILE 101 Ca 0.00 0.01 0.00 0.00 0.56 0.00 0.00 62.75 63.32 2qao n ILE 101 Cb 0.06 -0.26 0.00 0.00 -0.75 0.00 0.00 39.64 38.69 2qao n ILE 101 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2qao n GLY 102 N 1.73 3.72 0.36 7.39 0.00 -1.26 -4.75 105.19 112.38 2qao n GLY 102 Ca 0.00 -0.95 0.17 0.00 0.00 0.00 0.00 46.02 45.24 2qao n GLY 102 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qao h ILE 103 N 0.00 0.13 0.00 -0.61 5.03 -1.99 0.18 117.51 120.25 2qao h ILE 103 Ca 0.00 0.00 -0.12 0.00 -0.12 0.00 0.00 64.86 64.62 2qao h ILE 103 Cb 0.00 0.59 -0.02 0.00 -3.03 0.00 0.00 36.82 34.36 2qao h ILE 103 CO 0.00 0.00 -1.04 1.56 -0.68 0.00 0.00 178.15 177.99 2qao h GLN 104 N 0.00 0.00 -7.00 2.37 1.08 -1.96 -3.48 115.11 106.13 2qao h GLN 104 Ca 0.09 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.74 2qao h GLN 104 Cb 0.98 0.00 0.19 0.00 -0.05 0.00 0.00 27.48 28.60 2qao h GLN 104 CO -0.00 0.30 0.02 -0.89 -0.95 0.00 0.00 178.83 177.31 2qao n ILE 105 N -2.96 1.79 0.00 2.54 2.08 0.05 -4.72 119.36 118.14 2qao n ILE 105 Ca -0.04 -0.26 0.00 0.00 0.56 0.00 0.00 62.75 63.00 2qao n ILE 105 Cb 0.75 -1.01 0.00 0.00 -0.75 0.00 0.00 39.64 38.64 2qao n ILE 105 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2qao n GLU 106 N -2.35 0.93 -4.27 0.38 1.02 0.33 -4.98 120.64 111.71 2qao n GLU 106 Ca 0.12 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 57.08 2qao n GLU 106 Cb 0.51 -0.53 -0.13 0.00 -0.02 0.00 0.00 31.44 31.27 2qao n GLU 106 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2qao s PHE 107 N -0.93 1.04 -0.01 -0.32 0.08 -0.69 -5.03 117.98 112.11 2qao s PHE 107 Ca 0.00 -0.36 -0.26 0.00 0.12 0.00 0.00 56.93 56.44 2qao s PHE 107 Cb 0.00 -0.62 0.06 0.00 -0.57 0.00 0.00 43.02 41.89 2qao s PHE 107 CO 0.00 0.01 0.57 0.00 -0.10 0.00 0.00 175.22 175.70 2qao s ALA 108 N -0.89 -1.48 -0.01 5.36 0.00 -1.26 0.63 121.76 124.10 2qao s ALA 108 Ca -0.01 0.93 0.03 0.00 0.00 0.00 0.00 51.96 52.92 2qao s ALA 108 Cb -0.08 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.16 2qao s ALA 108 CO 0.01 -0.40 -0.08 0.15 0.00 0.00 0.00 175.76 175.43 2qao s LYS 109 N -1.64 2.55 0.01 0.00 -0.14 -1.19 -3.11 119.74 116.22 2qao s LYS 109 Ca -0.10 -0.70 -0.26 0.00 -1.36 0.00 0.00 55.97 53.55 2qao s LYS 109 Cb -0.01 -2.48 -0.15 0.00 -1.68 0.00 0.00 37.83 33.51 2qao s LYS 109 CO 0.05 0.61 1.15 0.28 -0.76 0.00 0.00 175.35 176.68 2qao h VAL 110 N 3.93 0.16 -3.75 3.17 2.07 -1.71 -0.36 116.25 119.77 2qao h VAL 110 Ca -0.48 -0.35 0.14 0.00 0.82 0.00 0.00 66.70 66.83 2qao h VAL 110 Cb 1.17 0.22 -0.08 0.00 -1.52 0.00 0.00 31.29 31.08 2qao h VAL 110 CO 0.53 0.02 -1.12 -0.38 0.02 0.00 0.00 177.57 176.64 2qao n ILE 111 N -5.35 -2.21 -3.70 4.57 2.08 -1.26 -3.08 119.36 110.41 2qao n ILE 111 Ca -0.11 1.30 -0.36 0.00 0.56 0.00 0.00 62.75 64.13 2qao n ILE 111 Cb 0.35 -2.10 -0.07 0.00 -0.75 0.00 0.00 39.64 37.08 2qao n ILE 111 CO 0.00 0.00 0.00 -1.48 0.56 0.00 0.00 176.55 175.63 2qao s LEU 112 N -6.19 4.30 -0.00 1.39 2.34 -1.26 -2.48 118.68 116.77 2qao s LEU 112 Ca 0.00 0.45 0.03 0.00 0.06 0.00 0.00 54.13 54.67 2qao s LEU 112 Cb 0.00 -2.21 -0.04 0.00 -0.56 0.00 0.00 46.19 43.38 2qao s LEU 112 CO 0.00 0.24 0.12 0.00 -1.06 0.00 0.00 176.35 175.65 2qao n ALA 113 N 2.92 2.33 0.00 1.48 0.00 -1.26 -4.62 120.51 121.36 2qao n ALA 113 Ca -0.16 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2qao n ALA 113 Cb 0.53 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2qao n ALA 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qao n GLY 114 N 1.54 1.76 3.53 0.00 0.00 -1.26 -4.79 105.19 105.97 2qao n GLY 114 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2qao n GLY 114 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qao s GLU 115 N -0.24 1.72 0.00 1.61 8.01 -1.26 -4.95 118.70 123.58 2qao s GLU 115 Ca 0.00 -1.51 0.00 0.00 0.01 0.00 0.00 54.97 53.47 2qao s GLU 115 Cb 0.00 0.45 0.00 0.00 -4.31 0.00 0.00 34.13 30.27 2qao s GLU 115 CO 0.00 -0.71 0.00 1.55 0.01 0.00 0.00 175.26 176.11 2qao n VAL 116 N -0.46 0.00 0.00 2.63 3.14 -1.26 -4.52 118.33 117.86 2qao n VAL 116 Ca -0.01 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 2qao n VAL 116 Cb 0.62 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.40 2qao n VAL 116 CO 0.00 0.00 0.00 0.41 -6.46 0.00 0.00 176.83 170.78 2qao n THR 117 N 0.00 0.00 -1.99 1.55 -1.04 -1.26 -4.65 114.28 106.89 2qao n THR 117 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 2qao n THR 117 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 2qao n THR 117 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2qao s THR 118 N 0.00 2.74 0.04 12.58 -1.32 -1.26 -4.79 115.64 123.62 2qao s THR 118 Ca 0.00 0.54 -0.30 0.00 -1.21 0.00 0.00 61.69 60.72 2qao s THR 118 Cb 0.00 -3.35 -0.09 0.00 -1.51 0.00 0.00 72.50 67.55 2qao s THR 118 CO 0.00 0.05 1.95 -2.84 -2.21 0.00 0.00 174.62 171.57 2qao s PRO 119 N 0.85 4.14 0.10 7.08 0.02 -1.19 -4.93 135.00 141.07 2qao s PRO 119 Ca 0.67 2.61 0.06 0.00 0.02 0.00 0.00 61.00 64.36 2qao s PRO 119 Cb -0.42 -4.11 -0.03 0.00 0.02 0.00 0.00 34.50 29.96 2qao s PRO 119 CO 0.33 -0.94 -0.16 0.08 -0.33 0.00 0.00 177.00 175.98 2qao s VAL 120 N 4.29 1.33 -0.53 3.83 1.01 -1.26 -4.97 120.40 124.11 2qao s VAL 120 Ca 0.88 -1.51 0.04 0.00 0.00 0.00 0.00 61.98 61.38 2qao s VAL 120 Cb -0.43 -1.35 0.13 0.00 0.00 0.00 0.00 36.38 34.73 2qao s VAL 120 CO 0.41 -0.26 0.28 0.42 0.00 0.00 0.00 175.10 175.95 2qao s THR 121 N -1.57 2.44 0.42 3.92 -4.23 -1.26 -2.64 115.64 112.72 2qao s THR 121 Ca 0.04 -3.31 -0.25 0.00 -1.18 0.00 0.00 61.69 56.99 2qao s THR 121 Cb -0.08 -2.69 -0.10 0.00 1.34 0.00 0.00 72.50 70.97 2qao s THR 121 CO 0.03 -0.83 1.19 1.33 -0.54 0.00 0.00 174.62 175.80 2qao n VAL 122 N 3.06 2.58 -4.41 2.29 0.24 -0.98 -2.50 118.33 118.60 2qao n VAL 122 Ca 0.07 -0.50 -0.19 0.00 -2.04 0.00 0.00 64.34 61.68 2qao n VAL 122 Cb 0.33 -1.43 -0.14 0.00 -1.47 0.00 0.00 33.84 31.12 2qao n VAL 122 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2qao s ARG 123 N -2.17 0.85 -1.49 7.34 1.81 0.12 -2.42 118.95 122.99 2qao s ARG 123 Ca 0.62 -0.47 -0.12 0.00 -1.72 0.00 0.00 55.73 54.04 2qao s ARG 123 Cb -0.52 -0.82 0.07 0.00 -0.45 0.00 0.00 34.95 33.23 2qao s ARG 123 CO 0.57 0.22 0.98 0.41 -0.68 0.00 0.00 175.30 176.80 2qao n GLY 124 N 2.57 -0.48 3.44 -3.53 0.00 -1.26 -1.10 105.19 104.83 2qao n GLY 124 Ca -0.15 0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 2qao n GLY 124 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qao s LEU 125 N -7.22 0.92 0.00 0.99 1.43 -1.26 -4.04 118.68 109.50 2qao s LEU 125 Ca 0.58 -1.35 0.07 0.00 -1.03 0.00 0.00 54.13 52.40 2qao s LEU 125 Cb -0.29 1.26 0.07 0.00 0.03 0.00 0.00 46.19 47.26 2qao s LEU 125 CO 0.82 -1.15 0.59 0.54 0.23 0.00 0.00 176.35 177.38 2qao n ARG 126 N -0.46 0.64 -3.64 1.70 1.74 -1.18 -4.30 116.66 111.15 2qao n ARG 126 Ca 0.01 -3.31 -0.04 0.00 -0.77 0.00 0.00 57.85 53.74 2qao n ARG 126 Cb 0.63 0.10 -0.07 0.00 -1.02 0.00 0.00 32.46 32.09 2qao n ARG 126 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2qao s VAL 127 N -2.68 0.00 0.60 1.55 0.11 -1.26 -2.49 120.40 116.22 2qao s VAL 127 Ca 0.45 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 59.32 2qao s VAL 127 Cb -0.04 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.78 2qao s VAL 127 CO 0.28 0.00 1.14 0.42 -3.33 0.00 0.00 175.10 173.61 2qao s THR 128 N -0.04 3.07 -1.36 5.04 -4.23 -1.26 -4.77 115.64 112.10 2qao s THR 128 Ca 0.07 0.60 0.15 0.00 -1.18 0.00 0.00 61.69 61.33 2qao s THR 128 Cb -0.05 -3.18 0.24 0.00 1.34 0.00 0.00 72.50 70.86 2qao s THR 128 CO -0.13 -0.21 1.43 2.29 -0.54 0.00 0.00 174.62 177.47 2qao n LYS 129 N -1.78 0.18 0.01 3.99 2.85 -1.26 -0.23 118.16 121.93 2qao n LYS 129 Ca 0.12 0.16 0.11 0.00 -1.05 0.00 0.00 58.31 57.64 2qao n LYS 129 Cb 0.51 -1.50 0.04 0.00 -0.65 0.00 0.00 35.03 33.43 2qao n LYS 129 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2qao n GLY 130 N 0.01 -1.16 0.08 2.58 0.00 -1.26 -4.14 105.19 101.31 2qao n GLY 130 Ca 0.07 -0.45 -0.11 0.00 0.00 0.00 0.00 46.02 45.53 2qao n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qao n ALA 131 N -1.66 1.64 0.58 4.61 0.00 -0.13 -4.01 120.51 121.54 2qao n ALA 131 Ca 0.03 -0.75 0.01 0.00 0.00 0.00 0.00 53.44 52.74 2qao n ALA 131 Cb 0.38 0.09 0.07 0.00 0.00 0.00 0.00 19.45 19.99 2qao n ALA 131 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2qao n ARG 132 N -2.94 0.29 -0.03 0.00 1.85 0.68 -0.12 116.66 116.40 2qao n ARG 132 Ca -0.29 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.50 2qao n ARG 132 Cb 0.84 -1.12 -0.02 0.00 -1.05 0.00 0.00 32.46 31.10 2qao n ARG 132 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qao n ALA 133 N -0.62 1.74 0.23 2.89 0.00 -1.26 -4.03 120.51 119.45 2qao n ALA 133 Ca 0.02 -0.49 0.11 0.00 0.00 0.00 0.00 53.44 53.07 2qao n ALA 133 Cb 0.01 0.12 0.68 0.00 0.00 0.00 0.00 19.45 20.26 2qao n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qao h ALA 134 N -0.60 2.01 -0.38 0.00 0.00 -1.57 0.85 119.26 119.58 2qao h ALA 134 Ca -0.01 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 2qao h ALA 134 Cb 0.61 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2qao h ALA 134 CO -0.00 -0.10 -0.40 0.97 0.00 0.00 0.00 179.25 179.72 2qao h ILE 135 N 0.00 1.27 0.00 0.00 2.10 -0.76 -2.75 117.51 117.37 2qao h ILE 135 Ca 0.04 -1.57 -0.05 0.00 1.08 0.00 0.00 64.86 64.35 2qao h ILE 135 Cb 0.15 1.41 -0.01 0.00 -1.09 0.00 0.00 36.82 37.28 2qao h ILE 135 CO -0.00 0.53 -0.26 -0.33 -1.08 0.00 0.00 178.15 177.01 2qao h GLU 136 N 0.75 0.00 -0.02 2.19 5.08 -1.15 -0.04 114.58 121.39 2qao h GLU 136 Ca 0.06 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2qao h GLU 136 Cb 1.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.25 2qao h GLU 136 CO 0.10 0.26 0.04 0.00 -1.00 0.00 0.00 179.01 178.41 2qao h ALA 137 N 1.74 1.31 -0.83 3.43 0.00 0.94 0.18 119.26 126.03 2qao h ALA 137 Ca -0.00 -0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 2qao h ALA 137 Cb 1.17 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.55 2qao h ALA 137 CO 0.03 -0.05 -0.61 0.00 0.00 0.00 0.00 179.25 178.62 2qao n ALA 138 N -2.19 5.18 -3.40 0.00 0.00 -1.14 -4.94 120.51 114.04 2qao n ALA 138 Ca -0.02 -3.79 -0.18 0.00 0.00 0.00 0.00 53.44 49.45 2qao n ALA 138 Cb 0.12 -0.51 0.07 0.00 0.00 0.00 0.00 19.45 19.14 2qao n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qao n GLY 139 N -0.72 -0.76 0.00 0.00 0.00 0.05 -3.17 105.19 100.59 2qao n GLY 139 Ca 0.46 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.82 2qao n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qao n GLY 140 N -1.26 0.24 3.65 -0.02 0.00 -0.04 -4.01 105.19 103.75 2qao n GLY 140 Ca -0.18 -1.82 -0.03 0.00 0.00 0.00 0.00 46.02 44.00 2qao n GLY 140 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qao s LYS 141 N -0.09 0.28 -0.14 1.61 2.36 -1.08 -4.81 119.74 117.86 2qao s LYS 141 Ca 0.00 0.42 -0.07 0.00 -2.55 0.00 0.00 55.97 53.77 2qao s LYS 141 Cb 0.00 0.09 -0.04 0.00 -1.05 0.00 0.00 37.83 36.82 2qao s LYS 141 CO 0.00 -0.05 0.11 0.42 1.55 0.00 0.00 175.35 177.39 2qao s ILE 142 N 0.86 5.28 0.00 5.43 1.09 -1.26 -2.31 121.20 130.29 2qao s ILE 142 Ca -0.04 0.13 0.00 0.00 -1.10 0.00 0.00 60.65 59.64 2qao s ILE 142 Cb -0.04 -3.33 0.00 0.00 -1.06 0.00 0.00 42.46 38.04 2qao s ILE 142 CO -0.12 0.56 0.02 -1.84 -0.10 0.00 0.00 174.94 173.46 2qao n GLU 143 N 2.52 0.00 -0.57 2.79 0.00 -1.02 -4.99 120.64 119.37 2qao n GLU 143 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.97 2qao n GLU 143 Cb 0.54 -0.21 0.00 0.00 0.00 0.00 0.00 31.44 31.77 2qao n GLU 143 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22