#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8j s PRO 2 N 0.00 4.00 0.07 -2.82 0.04 -1.26 -5.11 135.00 129.92 1b8j s PRO 2 Ca 0.00 -0.31 0.04 0.00 0.04 0.00 0.00 61.00 60.77 1b8j s PRO 2 Cb 0.00 -3.48 -0.03 0.00 0.04 0.00 0.00 34.50 31.03 1b8j s PRO 2 CO 0.00 0.04 -0.11 -2.00 0.04 0.00 0.00 177.00 174.97 1b8j s GLU 3 N 1.09 0.74 -0.27 4.56 2.12 -1.26 -5.14 118.70 120.53 1b8j s GLU 3 Ca 0.07 -0.94 -0.12 0.00 0.36 0.00 0.00 54.97 54.34 1b8j s GLU 3 Cb -0.14 -0.60 -0.05 0.00 0.26 0.00 0.00 34.13 33.61 1b8j s GLU 3 CO 0.04 0.12 0.22 -1.64 -0.54 0.00 0.00 175.26 173.47 1b8j s MET 4 N -1.93 3.99 0.38 4.30 -1.94 -1.26 -4.87 119.30 117.97 1b8j s MET 4 Ca -0.03 -0.23 -0.21 0.00 -1.71 0.00 0.00 55.69 53.51 1b8j s MET 4 Cb -0.08 -3.64 -0.10 0.00 2.01 0.00 0.00 34.83 33.02 1b8j s MET 4 CO 0.01 -0.15 0.90 -1.25 -0.01 0.00 0.00 175.02 174.52 1b8j s PRO 5 N 1.69 4.26 -0.04 2.03 0.04 -1.26 -4.95 135.00 136.76 1b8j s PRO 5 Ca 0.09 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.21 1b8j s PRO 5 Cb -0.16 -2.37 -0.03 0.00 0.04 0.00 0.00 34.50 31.99 1b8j s PRO 5 CO 0.10 0.08 -0.01 0.14 0.04 0.00 0.00 177.00 177.34 1b8j s VAL 6 N -2.02 4.11 -0.20 -0.36 -7.23 -1.26 -4.77 120.40 108.68 1b8j s VAL 6 Ca 0.58 -0.46 -0.33 0.00 -1.81 0.00 0.00 61.98 59.96 1b8j s VAL 6 Cb -0.11 -2.77 -0.10 0.00 0.56 0.00 0.00 36.38 33.96 1b8j s VAL 6 CO 0.16 0.50 2.07 0.18 -0.31 0.00 0.00 175.10 177.70 1b8j n LEU 7 N 1.81 3.04 0.03 1.32 4.77 -0.86 -4.83 117.00 122.29 1b8j n LEU 7 Ca -0.17 0.59 -0.14 0.00 -0.03 0.00 0.00 56.01 56.27 1b8j n LEU 7 Cb 0.53 -1.40 -0.03 0.00 -2.33 0.00 0.00 43.42 40.20 1b8j n LEU 7 CO 0.30 -0.42 0.26 -0.08 -1.33 0.00 0.00 177.39 176.13 1b8j h GLU 8 N 11.83 0.54 -1.74 3.23 4.57 -1.96 -3.43 114.58 127.62 1b8j h GLU 8 Ca -0.40 -0.48 0.03 0.00 -1.18 0.00 0.00 59.36 57.32 1b8j h GLU 8 Cb 1.28 0.11 -0.23 0.00 -0.16 0.00 0.00 28.75 29.75 1b8j h GLU 8 CO 0.97 1.11 -0.25 1.21 -1.18 0.00 0.00 179.01 180.87 1b8j s ASN 9 N -7.07 -0.94 -0.23 1.04 3.84 -1.26 -4.98 114.94 105.34 1b8j s ASN 9 Ca -0.07 1.11 0.10 0.00 0.21 0.00 0.00 52.86 54.21 1b8j s ASN 9 Cb 0.09 1.98 0.43 0.00 -0.55 0.00 0.00 41.25 43.21 1b8j s ASN 9 CO 0.87 -0.24 1.23 0.54 -2.79 0.00 0.00 177.10 176.71 1b8j n ARG 10 N 5.42 1.93 -2.24 0.43 5.12 -1.26 -4.89 116.66 121.17 1b8j n ARG 10 Ca -0.07 -3.44 -0.31 0.00 -1.93 0.00 0.00 57.85 52.10 1b8j n ARG 10 Cb 0.50 -1.74 -0.01 0.00 -1.16 0.00 0.00 32.46 30.05 1b8j n ARG 10 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1b8j s ALA 11 N -3.30 3.13 0.17 7.54 0.00 -1.26 -4.73 121.76 123.31 1b8j s ALA 11 Ca 0.41 -0.02 -0.33 0.00 0.00 0.00 0.00 51.96 52.01 1b8j s ALA 11 Cb 0.38 -3.02 -0.15 0.00 0.00 0.00 0.00 23.12 20.33 1b8j s ALA 11 CO -0.05 -0.41 1.37 0.00 0.00 0.00 0.00 175.76 176.67 1b8j n ALA 12 N -2.09 0.24 0.26 0.00 0.00 0.55 -4.32 120.51 115.14 1b8j n ALA 12 Ca 0.05 0.46 0.14 0.00 0.00 0.00 0.00 53.44 54.09 1b8j n ALA 12 Cb 0.54 -2.19 0.68 0.00 0.00 0.00 0.00 19.45 18.49 1b8j n ALA 12 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1b8j h GLN 13 N 4.48 0.00 0.00 0.00 1.08 0.01 -3.48 115.11 117.20 1b8j h GLN 13 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1b8j h GLN 13 Cb 1.30 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.73 1b8j h GLN 13 CO 0.78 0.10 0.00 0.41 -0.95 0.00 0.00 178.83 179.17 1b8j n GLY 14 N -0.24 3.03 3.63 3.46 0.00 0.67 -5.04 105.19 110.70 1b8j n GLY 14 Ca -0.01 0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1b8j n GLY 14 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1b8j s ASP 15 N 1.98 6.81 0.32 1.61 -1.08 -1.25 -4.77 116.67 120.28 1b8j s ASP 15 Ca 0.00 0.91 0.24 0.00 -0.52 0.00 0.00 52.55 53.18 1b8j s ASP 15 Cb 0.00 -2.54 1.15 0.00 -1.46 0.00 0.00 42.92 40.06 1b8j s ASP 15 CO 0.00 -1.02 1.73 0.16 0.52 0.00 0.00 175.17 176.56 1b8j h ILE 16 N 5.91 0.00 -0.00 4.11 3.07 -1.98 -1.74 117.51 126.88 1b8j h ILE 16 Ca -0.22 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 66.06 1b8j h ILE 16 Cb 1.07 0.77 0.00 0.00 -0.27 0.00 0.00 36.82 38.38 1b8j h ILE 16 CO 1.06 0.00 -0.39 0.35 -1.05 0.00 0.00 178.15 178.12 1b8j n THR 17 N -2.32 0.00 -4.17 0.16 -2.24 -1.26 -4.46 114.28 99.99 1b8j n THR 17 Ca 0.00 -0.01 -0.25 0.00 -2.27 0.00 0.00 64.05 61.53 1b8j n THR 17 Cb 0.14 0.12 -0.06 0.00 -2.10 0.00 0.00 70.33 68.42 1b8j n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b8j s ALA 18 N -2.97 3.38 -0.11 6.98 0.00 -0.65 -5.04 121.76 123.34 1b8j s ALA 18 Ca 0.12 -1.40 -0.38 0.00 0.00 0.00 0.00 51.96 50.31 1b8j s ALA 18 Cb 0.18 -1.12 -0.15 0.00 0.00 0.00 0.00 23.12 22.03 1b8j s ALA 18 CO 0.66 0.39 1.66 -2.30 0.00 0.00 0.00 175.76 176.16 1b8j n PRO 19 N -0.58 1.44 -0.86 0.00 -0.02 -1.26 -0.06 135.00 133.65 1b8j n PRO 19 Ca -0.08 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1b8j n PRO 19 Cb 0.56 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 1b8j n PRO 19 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b8j n GLY 20 N 3.75 0.50 0.19 -1.23 0.00 -1.26 -4.87 105.19 102.26 1b8j n GLY 20 Ca 0.23 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.32 1b8j n GLY 20 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1b8j h GLY 21 N 0.00 0.00 -0.76 -0.02 0.00 -0.59 -3.07 103.07 98.64 1b8j h GLY 21 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1b8j h GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1b8j n ALA 22 N -2.22 2.55 -1.76 3.60 0.00 -1.26 -0.24 120.51 121.18 1b8j n ALA 22 Ca 0.01 -0.51 -0.37 0.00 0.00 0.00 0.00 53.44 52.57 1b8j n ALA 22 Cb 0.54 -1.10 0.03 0.00 0.00 0.00 0.00 19.45 18.92 1b8j n ALA 22 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1b8j s ARG 23 N -1.93 3.18 -0.02 0.00 0.52 -1.16 -4.53 118.95 115.01 1b8j s ARG 23 Ca 0.36 1.92 0.15 0.00 -0.52 0.00 0.00 55.73 57.63 1b8j s ARG 23 Cb 0.20 -2.11 -0.22 0.00 0.52 0.00 0.00 34.95 33.34 1b8j s ARG 23 CO 0.31 -1.06 0.36 0.54 0.02 0.00 0.00 175.30 175.47 1b8j n ARG 24 N -1.22 0.70 -3.67 3.54 1.74 -1.26 0.36 116.66 116.86 1b8j n ARG 24 Ca 0.11 -0.11 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 1b8j n ARG 24 Cb 0.48 -1.32 -0.05 0.00 -1.02 0.00 0.00 32.46 30.55 1b8j n ARG 24 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1b8j s LEU 25 N -3.82 4.26 0.00 0.55 1.43 -1.26 -4.50 118.68 115.33 1b8j s LEU 25 Ca -0.04 0.60 0.06 0.00 -1.03 0.00 0.00 54.13 53.72 1b8j s LEU 25 Cb 0.10 -3.32 -0.05 0.00 0.03 0.00 0.00 46.19 42.94 1b8j s LEU 25 CO 0.60 0.05 0.30 0.35 0.23 0.00 0.00 176.35 177.88 1b8j n THR 26 N 0.09 0.00 -3.74 5.49 -2.24 -1.26 -4.99 114.28 107.63 1b8j n THR 26 Ca -0.02 -0.37 0.03 0.00 -2.27 0.00 0.00 64.05 61.42 1b8j n THR 26 Cb 0.52 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1b8j n THR 26 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1b8j s GLY 27 N -1.47 -0.37 0.31 3.38 0.00 -1.26 -5.14 107.32 102.78 1b8j s GLY 27 Ca 0.03 0.59 -0.27 0.00 0.00 0.00 0.00 44.72 45.07 1b8j s GLY 27 CO 0.23 2.45 0.96 1.34 0.00 0.00 0.00 173.10 178.08 1b8j n ASP 28 N -0.69 1.07 -0.55 1.64 2.03 -1.26 -4.93 116.55 113.86 1b8j n ASP 28 Ca -0.04 1.14 0.10 0.00 0.52 0.00 0.00 54.79 56.51 1b8j n ASP 28 Cb 0.62 -1.28 0.02 0.00 -0.72 0.00 0.00 41.12 39.76 1b8j n ASP 28 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1b8j n GLN 29 N 0.64 1.55 0.04 -0.67 1.13 -1.26 -4.68 117.38 114.13 1b8j n GLN 29 Ca 0.10 -1.14 -0.12 0.00 -1.94 0.00 0.00 57.00 53.90 1b8j n GLN 29 Cb 0.33 -1.39 -0.05 0.00 0.11 0.00 0.00 30.24 29.24 1b8j n GLN 29 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 1b8j h THR 30 N 2.69 0.26 -0.72 5.09 2.02 -1.99 0.13 112.91 120.40 1b8j h THR 30 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1b8j h THR 30 Cb 0.72 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1b8j h THR 30 CO 0.00 0.00 0.34 0.00 0.37 0.00 0.00 175.52 176.23 1b8j h ALA 31 N 0.25 1.25 -0.31 6.16 0.00 -1.99 0.13 119.26 124.75 1b8j h ALA 31 Ca 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1b8j h ALA 31 Cb 0.58 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1b8j h ALA 31 CO -0.31 0.57 0.17 0.00 0.00 0.00 0.00 179.25 179.69 1b8j h ALA 32 N 1.36 0.40 -0.61 0.00 0.00 -1.56 -1.99 119.26 116.86 1b8j h ALA 32 Ca 0.25 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1b8j h ALA 32 Cb 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1b8j h ALA 32 CO -0.03 -0.07 0.07 1.25 0.00 0.00 0.00 179.25 180.46 1b8j h LEU 33 N 0.39 1.00 -1.47 0.00 5.85 -0.30 -2.83 115.31 117.95 1b8j h LEU 33 Ca 0.11 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.57 1b8j h LEU 33 Cb 0.06 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1b8j h LEU 33 CO -0.02 1.03 0.37 0.03 -0.34 0.00 0.00 178.44 179.51 1b8j h ARG 34 N 0.94 0.70 0.00 1.25 3.08 -0.79 0.01 114.38 119.56 1b8j h ARG 34 Ca 0.18 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1b8j h ARG 34 Cb 0.47 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1b8j h ARG 34 CO 0.02 0.46 0.00 -0.44 -1.07 0.00 0.00 179.97 178.94 1b8j h ASP 35 N 0.72 0.00 0.83 7.04 5.19 -1.16 -3.01 116.42 126.02 1b8j h ASP 35 Ca 0.21 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 1b8j h ASP 35 Cb -0.04 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.47 1b8j h ASP 35 CO -0.05 0.00 -0.54 -1.20 -3.12 0.00 0.00 179.24 174.34 1b8j n SER 36 N -2.41 0.63 -4.62 6.45 7.64 -0.02 -4.50 113.62 116.79 1b8j n SER 36 Ca 0.03 0.09 -0.42 0.00 1.01 0.00 0.00 58.87 59.58 1b8j n SER 36 Cb 0.30 0.09 -0.05 0.00 -1.01 0.00 0.00 64.21 63.55 1b8j n SER 36 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1b8j s LEU 37 N -3.93 4.08 -0.14 -3.43 1.43 -1.14 -4.68 118.68 110.87 1b8j s LEU 37 Ca 0.08 0.75 -0.08 0.00 -1.03 0.00 0.00 54.13 53.85 1b8j s LEU 37 Cb 0.14 -3.05 0.05 0.00 0.03 0.00 0.00 46.19 43.37 1b8j s LEU 37 CO 0.70 -0.54 0.34 -0.55 0.23 0.00 0.00 176.35 176.53 1b8j s SER 38 N 1.52 -0.40 -0.11 2.29 0.15 -1.26 -5.01 113.70 110.89 1b8j s SER 38 Ca 0.31 0.73 0.18 0.00 0.70 0.00 0.00 55.95 57.87 1b8j s SER 38 Cb -0.15 0.63 0.71 0.00 -1.71 0.00 0.00 66.02 65.50 1b8j s SER 38 CO 0.10 -0.17 1.62 -0.90 1.20 0.00 0.00 173.24 175.09 1b8j n ASP 39 N 4.00 4.68 -4.72 5.45 5.68 -1.26 -0.74 116.55 129.65 1b8j n ASP 39 Ca -0.22 -2.44 -0.33 0.00 -0.50 0.00 0.00 54.79 51.30 1b8j n ASP 39 Cb 0.55 -0.57 0.11 0.00 -1.14 0.00 0.00 41.12 40.07 1b8j n ASP 39 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1b8j s LYS 40 N -1.83 1.87 0.60 0.11 3.01 -1.26 -4.88 119.74 117.36 1b8j s LYS 40 Ca 0.50 1.62 -0.17 0.00 -1.01 0.00 0.00 55.97 56.92 1b8j s LYS 40 Cb 0.32 -1.82 -0.03 0.00 -1.01 0.00 0.00 37.83 35.29 1b8j s LYS 40 CO 0.24 -2.01 1.09 -2.14 0.51 0.00 0.00 175.35 173.04 1b8j s PRO 41 N -4.23 3.19 -0.07 -1.68 0.02 -1.26 -4.36 135.00 126.61 1b8j s PRO 41 Ca 0.70 1.36 -0.14 0.00 0.02 0.00 0.00 61.00 62.94 1b8j s PRO 41 Cb -0.26 -2.01 -0.05 0.00 0.02 0.00 0.00 34.50 32.21 1b8j s PRO 41 CO 0.50 -0.93 0.36 0.00 -0.33 0.00 0.00 177.00 176.59 1b8j s ALA 42 N -2.25 3.67 -0.00 -1.55 0.00 -0.34 -4.91 121.76 116.38 1b8j s ALA 42 Ca 0.67 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.31 1b8j s ALA 42 Cb -0.19 -2.36 -0.26 0.00 0.00 0.00 0.00 23.12 20.31 1b8j s ALA 42 CO 0.35 0.36 0.84 -0.22 0.00 0.00 0.00 175.76 177.09 1b8j h LYS 43 N 5.41 0.19 -5.11 0.00 3.64 -0.86 -3.40 116.57 116.45 1b8j h LYS 43 Ca -0.49 -0.32 -0.38 0.00 -1.27 0.00 0.00 60.65 58.19 1b8j h LYS 43 Cb 1.20 0.12 -0.14 0.00 -0.41 0.00 0.00 32.23 33.00 1b8j h LYS 43 CO 0.66 1.01 -0.66 -0.80 -2.27 0.00 0.00 179.45 177.39 1b8j s ASN 44 N -6.82 1.88 -0.05 4.20 0.01 -0.99 -3.39 114.94 109.78 1b8j s ASN 44 Ca -0.08 -1.20 -0.02 0.00 -0.71 0.00 0.00 52.86 50.85 1b8j s ASN 44 Cb 0.07 -0.00 0.03 0.00 0.41 0.00 0.00 41.25 41.76 1b8j s ASN 44 CO 0.84 -0.49 0.10 -0.63 -1.51 0.00 0.00 177.10 175.41 1b8j s ILE 45 N -3.39 -0.05 -0.23 0.60 1.01 -0.59 -1.91 121.20 116.64 1b8j s ILE 45 Ca 0.28 0.17 0.02 0.00 0.00 0.00 0.00 60.65 61.12 1b8j s ILE 45 Cb 0.05 -0.17 0.05 0.00 0.01 0.00 0.00 42.46 42.40 1b8j s ILE 45 CO 0.08 0.07 -0.13 -0.63 0.00 0.00 0.00 174.94 174.33 1b8j s ILE 46 N 1.01 2.08 -0.27 2.92 1.01 -0.53 -1.41 121.20 126.01 1b8j s ILE 46 Ca -0.08 -1.38 -0.08 0.00 0.00 0.00 0.00 60.65 59.10 1b8j s ILE 46 Cb -0.11 -2.11 -0.02 0.00 0.01 0.00 0.00 42.46 40.23 1b8j s ILE 46 CO -0.04 0.14 0.10 -0.22 0.00 0.00 0.00 174.94 174.93 1b8j s LEU 47 N 1.18 3.71 -0.19 2.97 2.96 -0.10 -1.43 118.68 127.79 1b8j s LEU 47 Ca -0.04 -0.33 -0.04 0.00 -0.22 0.00 0.00 54.13 53.49 1b8j s LEU 47 Cb -0.18 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.53 1b8j s LEU 47 CO -0.08 -0.10 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.08 1b8j s LEU 48 N 1.62 3.17 -0.13 -0.68 2.01 0.10 -0.31 118.68 124.46 1b8j s LEU 48 Ca 0.06 -0.23 0.01 0.00 0.01 0.00 0.00 54.13 53.98 1b8j s LEU 48 Cb -0.16 -1.79 -0.01 0.00 0.01 0.00 0.00 46.19 44.24 1b8j s LEU 48 CO 0.05 0.07 -0.17 -0.63 1.01 0.00 0.00 176.35 176.69 1b8j s ILE 49 N 0.94 2.65 -0.37 -0.59 -1.09 0.09 -1.39 121.20 121.45 1b8j s ILE 49 Ca 0.01 -0.79 -0.11 0.00 -2.23 0.00 0.00 60.65 57.52 1b8j s ILE 49 Cb -0.14 -2.10 0.02 0.00 -1.58 0.00 0.00 42.46 38.66 1b8j s ILE 49 CO 0.01 0.53 0.21 -0.83 -1.23 0.00 0.00 174.94 173.64 1b8j s GLY 50 N 0.56 1.93 -0.08 6.18 0.00 0.10 -0.27 107.32 115.75 1b8j s GLY 50 Ca -0.10 -1.66 -0.29 0.00 0.00 0.00 0.00 44.72 42.66 1b8j s GLY 50 CO 0.04 0.83 1.86 -0.35 0.00 0.00 0.00 173.10 175.48 1b8j s ASP 51 N 1.59 6.33 0.00 1.64 -1.08 -0.96 -1.75 116.67 122.44 1b8j s ASP 51 Ca 0.03 2.23 0.00 0.00 -0.52 0.00 0.00 52.55 54.29 1b8j s ASP 51 Cb -0.19 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.74 1b8j s ASP 51 CO 0.07 -1.20 0.00 0.61 0.52 0.00 0.00 175.17 175.17 1b8j n GLY 52 N 4.65 0.48 2.94 2.66 0.00 -1.23 -0.26 105.19 114.42 1b8j n GLY 52 Ca 0.21 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1b8j n GLY 52 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1b8j n MET 53 N -3.00 3.34 -0.71 1.61 1.56 -0.71 -3.89 117.12 115.31 1b8j n MET 53 Ca 0.00 -3.27 -0.10 0.00 -0.27 0.00 0.00 57.70 54.06 1b8j n MET 53 Cb 0.00 -3.09 0.07 0.00 2.15 0.00 0.00 33.22 32.35 1b8j n MET 53 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1b8j n GLY 54 N 3.50 -1.13 0.32 -5.12 0.00 -1.26 -4.46 105.19 97.04 1b8j n GLY 54 Ca 0.44 -1.70 0.01 0.00 0.00 0.00 0.00 46.02 44.76 1b8j n GLY 54 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1b8j h ASP 55 N -0.59 0.69 -0.66 1.61 3.32 -1.93 -1.74 116.42 117.12 1b8j h ASP 55 Ca -0.15 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 56.79 1b8j h ASP 55 Cb 0.42 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.77 1b8j h ASP 55 CO 0.11 0.57 0.19 -1.28 -1.72 0.00 0.00 179.24 177.10 1b8j h SER 56 N 0.78 0.99 0.11 6.45 0.87 -1.92 -1.02 113.55 119.82 1b8j h SER 56 Ca 0.20 -0.19 -0.11 0.00 -1.23 0.00 0.00 61.79 60.46 1b8j h SER 56 Cb 0.04 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 1b8j h SER 56 CO -0.03 0.94 -0.38 -0.33 -0.53 0.00 0.00 176.83 176.50 1b8j h GLU 57 N 1.01 0.36 -0.38 2.24 3.07 -1.64 -1.17 114.58 118.07 1b8j h GLU 57 Ca 0.22 -0.17 -0.12 0.00 -0.50 0.00 0.00 59.36 58.79 1b8j h GLU 57 Cb 0.32 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.22 1b8j h GLU 57 CO -0.00 0.69 -0.25 0.82 -1.40 0.00 0.00 179.01 178.87 1b8j h ILE 58 N 0.30 1.28 -0.05 3.13 2.04 -1.15 -2.09 117.51 120.98 1b8j h ILE 58 Ca 0.03 -1.40 -0.00 0.00 1.00 0.00 0.00 64.86 64.48 1b8j h ILE 58 Cb 0.81 1.36 -0.00 0.00 -0.74 0.00 0.00 36.82 38.25 1b8j h ILE 58 CO 0.06 0.47 0.01 0.74 0.00 0.00 0.00 178.15 179.43 1b8j h THR 59 N 0.64 1.20 -0.65 -0.27 2.02 -0.85 -0.47 112.91 114.53 1b8j h THR 59 Ca 0.08 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.67 1b8j h THR 59 Cb 0.82 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.70 1b8j h THR 59 CO 0.07 0.16 0.42 0.00 0.37 0.00 0.00 175.52 176.54 1b8j h ALA 60 N 0.78 0.82 -0.63 6.16 0.00 -1.24 0.99 119.26 126.14 1b8j h ALA 60 Ca 0.01 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1b8j h ALA 60 Cb 0.25 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1b8j h ALA 60 CO 0.00 0.25 0.09 0.00 0.00 0.00 0.00 179.25 179.59 1b8j h ALA 61 N 1.23 0.96 0.04 0.00 0.00 -1.22 -2.02 119.26 118.25 1b8j h ALA 61 Ca 0.24 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1b8j h ALA 61 Cb -0.09 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.45 1b8j h ALA 61 CO -0.05 0.65 -0.02 -0.09 0.00 0.00 0.00 179.25 179.74 1b8j h ARG 62 N 0.98 -0.05 -0.47 0.00 2.43 -0.33 -1.50 114.38 115.44 1b8j h ARG 62 Ca 0.19 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.46 1b8j h ARG 62 Cb 0.44 0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.91 1b8j h ARG 62 CO 0.01 0.32 -0.13 -0.91 -1.51 0.00 0.00 179.97 177.76 1b8j h ASN 63 N -0.44 -0.46 -0.15 -3.80 2.35 -0.61 0.43 115.58 112.90 1b8j h ASN 63 Ca -0.01 0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.85 1b8j h ASN 63 Cb 0.40 0.30 -0.00 0.00 0.05 0.00 0.00 38.32 39.07 1b8j h ASN 63 CO 0.01 -0.16 -0.07 0.22 -1.65 0.00 0.00 177.43 175.78 1b8j h TYR 64 N -0.01 0.35 0.00 1.19 5.03 -1.40 -2.38 116.97 119.75 1b8j h TYR 64 Ca 0.23 -0.09 -0.14 0.00 2.58 0.00 0.00 58.73 61.31 1b8j h TYR 64 Cb 0.36 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 38.53 1b8j h TYR 64 CO -0.41 0.63 -1.52 0.00 -1.32 0.00 0.00 178.16 175.54 1b8j n ALA 65 N -2.37 2.11 -0.06 1.82 0.00 -0.57 -1.54 120.51 119.90 1b8j n ALA 65 Ca -0.06 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1b8j n ALA 65 Cb 0.29 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.86 1b8j n ALA 65 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1b8j n GLU 66 N -2.76 3.23 0.00 0.00 -0.58 0.14 -4.88 120.64 115.80 1b8j n GLU 66 Ca -0.10 -0.17 0.00 0.00 -0.42 0.00 0.00 57.16 56.47 1b8j n GLU 66 Cb 0.79 -0.63 0.00 0.00 -0.57 0.00 0.00 31.44 31.02 1b8j n GLU 66 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1b8j n GLY 67 N 0.51 -1.33 0.37 0.62 0.00 -0.70 -3.22 105.19 101.44 1b8j n GLY 67 Ca 0.00 -1.48 0.17 0.00 0.00 0.00 0.00 46.02 44.71 1b8j n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8j h ALA 68 N 0.00 1.91 -0.43 4.61 0.00 -1.80 0.16 119.26 123.70 1b8j h ALA 68 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1b8j h ALA 68 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1b8j h ALA 68 CO 0.00 -0.30 0.00 0.41 0.00 0.00 0.00 179.25 179.36 1b8j n GLY 69 N -1.38 1.19 0.00 0.00 0.00 -1.26 -4.89 105.19 98.84 1b8j n GLY 69 Ca 0.24 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1b8j n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8j n GLY 70 N 1.29 -1.57 3.64 -0.02 0.00 0.54 -0.33 105.19 108.73 1b8j n GLY 70 Ca 0.17 -1.58 -0.08 0.00 0.00 0.00 0.00 46.02 44.53 1b8j n GLY 70 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1b8j s PHE 71 N -0.81 -0.95 -0.22 1.61 5.36 -1.26 -4.65 117.98 117.05 1b8j s PHE 71 Ca 0.00 1.97 -0.28 0.00 -0.96 0.00 0.00 56.93 57.66 1b8j s PHE 71 Cb 0.00 0.54 0.00 0.00 -0.34 0.00 0.00 43.02 43.22 1b8j s PHE 71 CO 0.00 -0.47 0.98 -0.06 -1.46 0.00 0.00 175.22 174.21 1b8j s PHE 72 N 1.35 3.35 0.53 10.12 0.08 -1.26 -4.91 117.98 127.24 1b8j s PHE 72 Ca -0.08 1.40 0.40 0.00 0.12 0.00 0.00 56.93 58.77 1b8j s PHE 72 Cb -0.05 -3.21 2.10 0.00 -0.57 0.00 0.00 43.02 41.30 1b8j s PHE 72 CO -0.15 -0.43 2.27 0.87 -0.10 0.00 0.00 175.22 177.67 1b8j h LYS 73 N 7.47 0.00 0.00 0.44 1.57 -1.96 -2.07 116.57 122.02 1b8j h LYS 73 Ca -0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1b8j h LYS 73 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1b8j h LYS 73 CO 0.94 0.01 -0.15 0.41 -0.57 0.00 0.00 179.45 180.09 1b8j n GLY 74 N -0.85 -0.48 0.37 3.86 0.00 -1.26 -4.35 105.19 102.48 1b8j n GLY 74 Ca -0.02 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1b8j n GLY 74 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1b8j h ILE 75 N -0.15 0.85 -0.00 -0.61 2.04 -1.81 -1.62 117.51 116.21 1b8j h ILE 75 Ca 0.00 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1b8j h ILE 75 Cb 0.15 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1b8j h ILE 75 CO 0.00 0.08 -0.60 0.47 0.00 0.00 0.00 178.15 178.09 1b8j n ASP 76 N -4.47 0.80 -0.04 1.72 8.00 -0.78 -4.24 116.55 117.54 1b8j n ASP 76 Ca 0.12 -0.62 0.13 0.00 0.71 0.00 0.00 54.79 55.14 1b8j n ASP 76 Cb 0.45 0.46 0.51 0.00 -0.02 0.00 0.00 41.12 42.51 1b8j n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1b8j n ALA 77 N -1.30 2.83 -2.43 2.24 0.00 -0.61 -4.85 120.51 116.40 1b8j n ALA 77 Ca 0.06 -0.23 -0.42 0.00 0.00 0.00 0.00 53.44 52.85 1b8j n ALA 77 Cb 0.34 -1.32 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 1b8j n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1b8j s LEU 78 N -2.83 4.34 0.36 0.00 1.43 -1.26 -2.03 118.68 118.68 1b8j s LEU 78 Ca 0.18 1.95 0.19 0.00 -1.03 0.00 0.00 54.13 55.42 1b8j s LEU 78 Cb 0.19 -3.57 0.43 0.00 0.03 0.00 0.00 46.19 43.26 1b8j s LEU 78 CO 0.56 -0.51 1.61 1.55 0.23 0.00 0.00 176.35 179.79 1b8j h PRO 79 N 7.07 0.00 -5.06 1.29 0.13 -1.86 -3.44 132.00 130.12 1b8j h PRO 79 Ca -0.39 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.09 1b8j h PRO 79 Cb 1.20 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.09 1b8j h PRO 79 CO 0.84 0.35 -0.66 -0.51 -0.23 0.00 0.00 178.00 177.78 1b8j s LEU 80 N -6.58 3.24 0.14 1.56 2.01 -1.16 -5.00 118.68 112.87 1b8j s LEU 80 Ca 0.03 -0.23 0.05 0.00 0.01 0.00 0.00 54.13 53.98 1b8j s LEU 80 Cb 0.08 -1.83 -0.04 0.00 0.01 0.00 0.00 46.19 44.41 1b8j s LEU 80 CO 0.70 0.03 -0.11 0.42 1.01 0.00 0.00 176.35 178.40 1b8j s THR 81 N 1.22 1.16 0.00 5.49 -4.23 -1.26 -1.05 115.64 116.96 1b8j s THR 81 Ca 0.03 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 1b8j s THR 81 Cb -0.15 -1.72 0.00 0.00 1.34 0.00 0.00 72.50 71.97 1b8j s THR 81 CO 0.01 -0.67 0.00 0.61 -0.54 0.00 0.00 174.62 174.04 1b8j n GLY 82 N 0.03 2.49 3.01 3.99 0.00 0.22 -3.95 105.19 110.98 1b8j n GLY 82 Ca -0.12 -0.86 -0.19 0.00 0.00 0.00 0.00 46.02 44.85 1b8j n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b8j s GLN 83 N -0.32 0.83 0.16 1.61 1.11 -0.93 -1.82 119.66 120.31 1b8j s GLN 83 Ca 0.00 -0.30 0.06 0.00 0.01 0.00 0.00 55.36 55.13 1b8j s GLN 83 Cb 0.00 -0.79 -0.04 0.00 -1.01 0.00 0.00 33.01 31.17 1b8j s GLN 83 CO 0.00 0.14 -0.13 1.52 0.01 0.00 0.00 175.29 176.83 1b8j s TYR 84 N 0.02 1.49 -0.05 0.91 -0.85 -0.49 -2.06 117.35 116.32 1b8j s TYR 84 Ca -0.00 -0.63 -0.09 0.00 -0.52 0.00 0.00 57.07 55.84 1b8j s TYR 84 Cb -0.06 -0.73 -0.05 0.00 0.38 0.00 0.00 41.96 41.50 1b8j s TYR 84 CO 0.00 0.22 0.24 0.95 -1.52 0.00 0.00 175.55 175.44 1b8j s THR 85 N -2.86 5.33 -0.09 -3.49 -4.23 -0.56 -2.34 115.64 107.40 1b8j s THR 85 Ca 0.17 0.34 0.15 0.00 -1.18 0.00 0.00 61.69 61.18 1b8j s THR 85 Cb -0.01 -3.53 0.33 0.00 1.34 0.00 0.00 72.50 70.63 1b8j s THR 85 CO 0.04 0.53 1.15 0.00 -0.54 0.00 0.00 174.62 175.80 1b8j n HIS 86 N 1.66 0.00 -1.73 3.99 1.44 -1.26 -0.93 115.22 118.39 1b8j n HIS 86 Ca -0.16 -0.82 -0.38 0.00 -2.01 0.00 0.00 57.72 54.36 1b8j n HIS 86 Cb 0.54 -0.16 0.06 0.00 0.12 0.00 0.00 29.99 30.54 1b8j n HIS 86 CO 0.00 0.00 0.00 2.48 -2.81 0.00 0.00 176.34 176.01 1b8j n TYR 87 N -0.43 2.09 -2.53 -1.40 4.11 -1.26 -4.47 117.16 113.26 1b8j n TYR 87 Ca 0.11 0.42 0.00 0.00 -0.00 0.00 0.00 57.90 58.43 1b8j n TYR 87 Cb 0.84 -2.31 0.00 0.00 -0.00 0.00 0.00 39.34 37.87 1b8j n TYR 87 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1b8j n ALA 88 N -1.52 0.00 -2.55 -3.48 0.00 -0.57 -4.91 120.51 107.48 1b8j n ALA 88 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.34 1b8j n ALA 88 Cb 0.46 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.78 1b8j n ALA 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1b8j s LEU 89 N 0.00 2.22 0.00 0.00 1.43 0.00 -1.09 118.68 121.25 1b8j s LEU 89 Ca 0.00 -0.58 -0.30 0.00 -1.03 0.00 0.00 54.13 52.22 1b8j s LEU 89 Cb 0.00 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.33 1b8j s LEU 89 CO 0.00 0.09 1.13 0.21 0.23 0.00 0.00 176.35 178.01 1b8j s ASN 90 N -1.48 7.15 0.13 2.29 3.84 0.15 -4.08 114.94 122.94 1b8j s ASN 90 Ca 0.05 1.84 -0.22 0.00 0.21 0.00 0.00 52.86 54.75 1b8j s ASN 90 Cb -0.09 -2.57 -0.04 0.00 -0.55 0.00 0.00 41.25 38.00 1b8j s ASN 90 CO 0.03 -0.45 1.68 0.50 -2.79 0.00 0.00 177.10 176.07 1b8j h LYS 91 N 7.00 -0.15 0.38 0.43 3.64 -1.93 0.96 116.57 126.90 1b8j h LYS 91 Ca -0.39 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.98 1b8j h LYS 91 Cb 1.20 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1b8j h LYS 91 CO 0.82 -0.10 -0.18 0.87 -2.27 0.00 0.00 179.45 178.59 1b8j h LYS 92 N -0.15 -0.49 0.00 1.90 1.57 -1.93 -3.34 116.57 114.13 1b8j h LYS 92 Ca 0.08 0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.77 1b8j h LYS 92 Cb 0.27 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1b8j h LYS 92 CO -0.20 -0.31 -1.13 1.79 -0.57 0.00 0.00 179.45 179.03 1b8j h THR 93 N -0.53 0.47 0.00 -0.16 1.35 -1.97 -3.48 112.91 108.59 1b8j h THR 93 Ca -0.05 -1.84 0.00 0.00 -0.55 0.00 0.00 66.41 63.97 1b8j h THR 93 Cb 0.40 2.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.84 1b8j h THR 93 CO 0.08 0.27 0.00 0.61 -0.25 0.00 0.00 175.52 176.23 1b8j n GLY 94 N 1.32 0.56 3.91 5.82 0.00 0.33 -4.99 105.19 112.13 1b8j n GLY 94 Ca -0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 1b8j n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b8j s LYS 95 N -0.21 3.38 0.44 1.61 1.02 -1.26 -4.70 119.74 120.03 1b8j s LYS 95 Ca 0.00 0.16 -0.25 0.00 0.02 0.00 0.00 55.97 55.89 1b8j s LYS 95 Cb 0.00 -2.34 -0.08 0.00 -0.52 0.00 0.00 37.83 34.88 1b8j s LYS 95 CO 0.00 -0.34 1.40 -2.14 -0.92 0.00 0.00 175.35 173.35 1b8j s PRO 96 N -4.82 3.74 -0.30 -1.68 0.02 -1.26 0.30 135.00 131.01 1b8j s PRO 96 Ca 0.49 2.36 -0.02 0.00 0.02 0.00 0.00 61.00 63.86 1b8j s PRO 96 Cb -0.10 -2.67 0.05 0.00 0.02 0.00 0.00 34.50 31.79 1b8j s PRO 96 CO 0.45 -0.76 -0.00 0.34 -0.33 0.00 0.00 177.00 176.70 1b8j s ASP 97 N -0.56 4.86 0.59 2.53 -1.08 -0.25 -4.54 116.67 118.22 1b8j s ASP 97 Ca 0.60 -1.24 0.34 0.00 -0.52 0.00 0.00 52.55 51.73 1b8j s ASP 97 Cb -0.42 -1.71 1.88 0.00 -1.46 0.00 0.00 42.92 41.20 1b8j s ASP 97 CO 0.55 -0.25 2.23 1.88 0.52 0.00 0.00 175.17 180.09 1b8j h TYR 98 N 8.00 0.00 -3.67 -5.34 0.05 -1.94 -1.51 116.97 112.56 1b8j h TYR 98 Ca -0.22 0.00 -0.67 0.00 0.05 0.00 0.00 58.73 57.89 1b8j h TYR 98 Cb 1.06 0.00 -0.36 0.00 1.01 0.00 0.00 36.73 38.45 1b8j h TYR 98 CO 0.61 0.03 -0.80 0.08 -1.05 0.00 0.00 178.16 177.04 1b8j s VAL 99 N -4.31 2.27 0.68 -2.88 1.01 -1.26 -4.51 120.40 111.40 1b8j s VAL 99 Ca -0.04 -1.43 -0.08 0.00 0.00 0.00 0.00 61.98 60.43 1b8j s VAL 99 Cb 0.14 -2.25 0.03 0.00 0.00 0.00 0.00 36.38 34.30 1b8j s VAL 99 CO 0.52 0.09 1.02 0.28 0.00 0.00 0.00 175.10 177.01 1b8j s THR 100 N 1.17 2.99 0.00 3.92 -1.32 -1.26 -4.83 115.64 116.31 1b8j s THR 100 Ca -0.05 0.04 0.00 0.00 -1.21 0.00 0.00 61.69 60.47 1b8j s THR 100 Cb -0.18 -3.27 0.00 0.00 -1.51 0.00 0.00 72.50 67.54 1b8j s THR 100 CO -0.06 -0.31 0.00 -0.90 -2.21 0.00 0.00 174.62 171.14 1b8j n ASP 101 N -2.88 0.00 0.00 8.08 5.75 -1.26 -4.91 116.55 121.33 1b8j n ASP 101 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.85 1b8j n ASP 101 Cb 0.59 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.68 1b8j n ASP 101 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1b8j n ALA 103 N -3.00 0.00 0.10 2.12 0.00 -1.26 -3.19 120.51 115.27 1b8j n ALA 103 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1b8j n ALA 103 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.66 1b8j n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b8j h ALA 104 N 0.00 1.07 -0.14 0.00 0.00 -1.76 -2.09 119.26 116.34 1b8j h ALA 104 Ca 0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.38 1b8j h ALA 104 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1b8j h ALA 104 CO 0.00 0.61 -0.28 0.66 0.00 0.00 0.00 179.25 180.24 1b8j h SER 105 N 0.19 0.49 -0.66 0.00 4.64 -1.87 -1.75 113.55 114.58 1b8j h SER 105 Ca 0.01 -0.55 0.03 0.00 -0.47 0.00 0.00 61.79 60.81 1b8j h SER 105 Cb 0.86 -0.14 -0.04 0.00 -0.31 0.00 0.00 62.40 62.77 1b8j h SER 105 CO 0.07 0.96 0.41 0.00 -0.87 0.00 0.00 176.83 177.40 1b8j h ALA 106 N 0.55 0.86 -0.68 5.18 0.00 -1.81 -0.59 119.26 122.77 1b8j h ALA 106 Ca 0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1b8j h ALA 106 Cb 0.87 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 1b8j h ALA 106 CO 0.06 0.17 0.30 1.15 0.00 0.00 0.00 179.25 180.94 1b8j h THR 107 N 0.81 1.23 -0.50 0.00 2.02 -1.31 -0.58 112.91 114.57 1b8j h THR 107 Ca 0.27 -0.67 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 1b8j h THR 107 Cb 0.02 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1b8j h THR 107 CO -0.11 0.28 0.27 0.00 0.37 0.00 0.00 175.52 176.33 1b8j h ALA 108 N 1.36 0.64 0.00 6.16 0.00 -0.18 0.17 119.26 127.40 1b8j h ALA 108 Ca 0.23 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1b8j h ALA 108 Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1b8j h ALA 108 CO -0.03 0.17 -0.44 0.11 0.00 0.00 0.00 179.25 179.06 1b8j h TRP 109 N 0.66 0.00 0.00 0.00 0.09 -1.30 0.16 115.95 115.56 1b8j h TRP 109 Ca 0.18 0.00 -0.12 0.00 0.09 0.00 0.00 58.89 59.03 1b8j h TRP 109 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 29.16 29.29 1b8j h TRP 109 CO -0.01 0.26 -1.04 0.66 0.09 0.00 0.00 178.44 178.40 1b8j h SER 110 N 0.00 0.00 0.00 0.11 4.64 -0.89 -3.23 113.55 114.18 1b8j h SER 110 Ca -0.02 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.23 1b8j h SER 110 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1b8j h SER 110 CO 0.03 0.47 -1.35 0.35 -0.87 0.00 0.00 176.83 175.46 1b8j n THR 111 N -2.98 0.27 -0.40 2.95 -2.24 0.56 -1.00 114.28 111.45 1b8j n THR 111 Ca -0.04 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1b8j n THR 111 Cb 0.76 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1b8j n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b8j n GLY 112 N 2.52 0.79 3.01 3.38 0.00 0.04 -4.92 105.19 110.02 1b8j n GLY 112 Ca -0.07 -0.13 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 1b8j n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b8j s VAL 113 N -2.00 0.71 0.53 1.61 0.11 -1.25 -4.90 120.40 115.21 1b8j s VAL 113 Ca 0.00 -0.37 -0.19 0.00 -2.93 0.00 0.00 61.98 58.49 1b8j s VAL 113 Cb 0.00 -0.60 -0.06 0.00 -1.53 0.00 0.00 36.38 34.19 1b8j s VAL 113 CO 0.00 0.21 1.08 -0.54 -3.33 0.00 0.00 175.10 172.51 1b8j s LYS 114 N -0.11 3.50 0.11 1.54 -0.14 -1.26 -3.85 119.74 119.54 1b8j s LYS 114 Ca 0.02 1.42 0.01 0.00 -1.36 0.00 0.00 55.97 56.06 1b8j s LYS 114 Cb -0.05 -2.04 -0.00 0.00 -1.68 0.00 0.00 37.83 34.06 1b8j s LYS 114 CO -0.00 -0.69 0.13 -2.37 -0.76 0.00 0.00 175.35 171.66 1b8j n THR 115 N -1.36 0.00 -3.29 2.17 5.66 -1.26 -4.46 114.28 111.74 1b8j n THR 115 Ca 0.10 -0.66 -0.23 0.00 -3.05 0.00 0.00 64.05 60.21 1b8j n THR 115 Cb 0.52 0.37 -0.00 0.00 -1.55 0.00 0.00 70.33 69.67 1b8j n THR 115 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 1b8j s TYR 116 N -3.62 3.37 0.04 1.09 1.13 -1.26 -0.82 117.35 117.29 1b8j s TYR 116 Ca 0.11 0.24 -0.30 0.00 -1.41 0.00 0.00 57.07 55.70 1b8j s TYR 116 Cb 0.00 -2.02 -0.08 0.00 -1.10 0.00 0.00 41.96 38.76 1b8j s TYR 116 CO 0.08 -0.03 1.63 -0.80 -2.51 0.00 0.00 175.55 173.92 1b8j s ASN 117 N -4.10 6.64 0.00 -0.18 0.01 -1.26 -1.87 114.94 114.18 1b8j s ASN 117 Ca 0.43 2.40 0.00 0.00 -0.71 0.00 0.00 52.86 54.98 1b8j s ASN 117 Cb -0.10 -2.56 0.00 0.00 0.41 0.00 0.00 41.25 39.01 1b8j s ASN 117 CO 0.36 -0.87 0.00 0.61 -1.51 0.00 0.00 177.10 175.68 1b8j n GLY 118 N 3.98 2.01 3.83 0.66 0.00 -1.26 -4.97 105.19 109.44 1b8j n GLY 118 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 1b8j n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8j s ALA 119 N -2.37 3.13 -0.17 4.61 0.00 -0.78 -0.45 121.76 125.73 1b8j s ALA 119 Ca 0.00 0.31 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 1b8j s ALA 119 Cb 0.00 -3.05 0.04 0.00 0.00 0.00 0.00 23.12 20.11 1b8j s ALA 119 CO 0.00 0.19 -0.08 -0.51 0.00 0.00 0.00 175.76 175.36 1b8j s LEU 120 N -3.06 1.78 -0.89 0.00 1.43 -0.87 -3.75 118.68 113.32 1b8j s LEU 120 Ca 0.59 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 1b8j s LEU 120 Cb -0.10 -1.03 0.00 0.00 0.03 0.00 0.00 46.19 45.10 1b8j s LEU 120 CO 0.15 -0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.18 1b8j n GLY 121 N 4.82 0.93 3.19 -3.19 0.00 -1.25 -0.87 105.19 108.82 1b8j n GLY 121 Ca -0.13 -0.21 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 1b8j n GLY 121 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b8j s VAL 122 N -2.03 0.97 0.00 1.61 -7.23 -1.26 -2.13 120.40 110.33 1b8j s VAL 122 Ca 0.00 -1.70 0.00 0.00 -1.81 0.00 0.00 61.98 58.47 1b8j s VAL 122 Cb 0.00 -1.43 0.00 0.00 0.56 0.00 0.00 36.38 35.51 1b8j s VAL 122 CO 0.00 -0.59 0.00 -0.90 -0.31 0.00 0.00 175.10 173.30 1b8j n ASP 123 N 0.45 0.00 0.16 4.85 5.68 -0.37 -4.78 116.55 122.55 1b8j n ASP 123 Ca -0.15 -0.81 0.13 0.00 -0.50 0.00 0.00 54.79 53.46 1b8j n ASP 123 Cb 0.58 0.00 0.54 0.00 -1.14 0.00 0.00 41.12 41.10 1b8j n ASP 123 CO 0.00 0.00 0.00 0.16 -1.33 0.00 0.00 177.20 176.03 1b8j h ILE 124 N -0.39 0.00 -0.51 2.12 3.07 -1.91 -1.18 117.51 118.71 1b8j h ILE 124 Ca 0.00 -0.27 0.00 0.00 1.55 0.00 0.00 64.86 66.14 1b8j h ILE 124 Cb 0.00 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 37.59 1b8j h ILE 124 CO 0.00 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 178.51 1b8j n HIS 125 N -2.41 0.68 -1.75 0.16 8.25 -1.26 -4.91 115.22 113.98 1b8j n HIS 125 Ca 0.02 -0.34 -0.18 0.00 -0.26 0.00 0.00 57.72 56.95 1b8j n HIS 125 Cb 0.23 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.28 1b8j n HIS 125 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1b8j n GLU 126 N 1.00 -1.31 -3.24 -0.41 1.02 -0.45 -5.00 120.64 112.26 1b8j n GLU 126 Ca 0.17 1.07 -0.39 0.00 -0.02 0.00 0.00 57.16 57.99 1b8j n GLU 126 Cb 0.43 -5.40 -0.06 0.00 -0.02 0.00 0.00 31.44 26.40 1b8j n GLU 126 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1b8j s LYS 127 N -3.91 4.26 0.46 3.49 2.20 -1.26 -4.77 119.74 120.22 1b8j s LYS 127 Ca 0.00 0.73 -0.23 0.00 -0.36 0.00 0.00 55.97 56.12 1b8j s LYS 127 Cb 0.00 -3.29 -0.07 0.00 -1.51 0.00 0.00 37.83 32.95 1b8j s LYS 127 CO 0.00 0.49 1.17 -0.51 -0.36 0.00 0.00 175.35 176.15 1b8j s ASP 128 N -0.62 6.14 -0.03 1.43 1.11 -1.26 -1.23 116.67 122.21 1b8j s ASP 128 Ca 0.30 2.32 0.02 0.00 0.18 0.00 0.00 52.55 55.37 1b8j s ASP 128 Cb -0.19 -2.60 0.01 0.00 1.07 0.00 0.00 42.92 41.20 1b8j s ASP 128 CO 0.18 -0.94 -0.07 -1.00 1.18 0.00 0.00 175.17 174.51 1b8j s HIS 129 N -1.54 0.83 0.51 4.23 3.76 -0.90 -4.93 115.29 117.25 1b8j s HIS 129 Ca 0.64 -0.21 -0.22 0.00 -0.15 0.00 0.00 55.06 55.12 1b8j s HIS 129 Cb -0.29 -0.62 -0.06 0.00 1.11 0.00 0.00 32.58 32.73 1b8j s HIS 129 CO 0.35 -0.11 1.31 -1.25 -0.85 0.00 0.00 174.74 174.20 1b8j s PRO 130 N 0.31 3.38 0.30 8.40 0.04 -1.26 -4.83 135.00 141.34 1b8j s PRO 130 Ca -0.04 2.13 0.04 0.00 0.04 0.00 0.00 61.00 63.17 1b8j s PRO 130 Cb -0.09 -2.35 -0.02 0.00 0.04 0.00 0.00 34.50 32.08 1b8j s PRO 130 CO 0.00 -0.97 0.45 0.95 0.04 0.00 0.00 177.00 177.48 1b8j s THR 131 N -1.35 4.82 0.40 1.26 -4.23 -1.26 -4.47 115.64 110.81 1b8j s THR 131 Ca 0.68 -0.85 0.08 0.00 -1.18 0.00 0.00 61.69 60.43 1b8j s THR 131 Cb -0.38 -3.71 0.29 0.00 1.34 0.00 0.00 72.50 70.04 1b8j s THR 131 CO 0.45 -0.33 2.01 -0.29 -0.54 0.00 0.00 174.62 175.93 1b8j h ILE 132 N 0.95 1.03 -0.13 2.99 6.09 -1.40 0.13 117.51 127.18 1b8j h ILE 132 Ca -0.49 -0.20 -0.04 0.00 -1.37 0.00 0.00 64.86 62.76 1b8j h ILE 132 Cb 1.24 0.41 -0.00 0.00 0.47 0.00 0.00 36.82 38.93 1b8j h ILE 132 CO 0.59 0.11 -0.08 0.25 -3.07 0.00 0.00 178.15 175.94 1b8j h LEU 133 N 0.58 0.30 -0.52 2.19 6.46 -1.85 0.20 115.31 122.66 1b8j h LEU 133 Ca 0.22 -0.43 0.00 0.00 -0.12 0.00 0.00 57.88 57.55 1b8j h LEU 133 Cb 0.17 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 39.99 1b8j h LEU 133 CO -0.06 0.67 0.33 -0.33 -0.62 0.00 0.00 178.44 178.43 1b8j h GLU 134 N -0.06 0.69 -0.43 1.25 5.08 -1.61 0.65 114.58 120.16 1b8j h GLU 134 Ca 0.03 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 1b8j h GLU 134 Cb 0.56 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1b8j h GLU 134 CO 0.02 0.48 0.00 0.52 -1.00 0.00 0.00 179.01 179.03 1b8j h MET 135 N 0.70 0.69 -0.17 2.33 2.86 -0.64 -0.25 114.93 120.44 1b8j h MET 135 Ca 0.19 -0.17 -0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1b8j h MET 135 Cb -0.05 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 1b8j h MET 135 CO -0.04 0.70 0.06 0.00 1.06 0.00 0.00 176.91 178.69 1b8j h ALA 136 N 1.36 0.22 -0.85 6.32 0.00 0.36 -1.54 119.26 125.12 1b8j h ALA 136 Ca 0.13 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1b8j h ALA 136 Cb 0.40 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1b8j h ALA 136 CO 0.02 -0.17 0.55 -0.22 0.00 0.00 0.00 179.25 179.42 1b8j h LYS 137 N 0.11 1.04 -0.06 0.00 3.64 -0.69 -0.97 116.57 119.65 1b8j h LYS 137 Ca 0.06 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 1b8j h LYS 137 Cb 0.20 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 1b8j h LYS 137 CO -0.00 0.69 -0.21 0.00 -2.27 0.00 0.00 179.45 177.66 1b8j h ALA 138 N 1.35 1.55 -0.00 5.00 0.00 -0.54 0.35 119.26 126.97 1b8j h ALA 138 Ca 0.33 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1b8j h ALA 138 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1b8j h ALA 138 CO -0.11 0.33 -0.02 0.00 0.00 0.00 0.00 179.25 179.45 1b8j n ALA 139 N -2.49 2.66 -0.33 0.00 0.00 -0.63 -4.88 120.51 114.84 1b8j n ALA 139 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1b8j n ALA 139 Cb 0.29 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1b8j n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b8j n GLY 140 N 1.12 0.82 3.90 0.00 0.00 0.11 -5.07 105.19 106.08 1b8j n GLY 140 Ca 0.20 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1b8j n GLY 140 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b8j s LEU 141 N 0.00 3.86 0.64 0.99 1.43 -0.46 -4.80 118.68 120.34 1b8j s LEU 141 Ca 0.00 0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 53.86 1b8j s LEU 141 Cb 0.00 -3.77 -0.02 0.00 0.03 0.00 0.00 46.19 42.43 1b8j s LEU 141 CO 0.00 -0.38 1.04 0.00 0.23 0.00 0.00 176.35 177.25 1b8j s ALA 142 N -2.38 2.82 -0.03 4.21 0.00 -0.34 -4.17 121.76 121.88 1b8j s ALA 142 Ca 0.47 0.12 -0.05 0.00 0.00 0.00 0.00 51.96 52.50 1b8j s ALA 142 Cb -0.10 -3.16 0.01 0.00 0.00 0.00 0.00 23.12 19.86 1b8j s ALA 142 CO 0.35 -0.92 0.12 0.95 0.00 0.00 0.00 175.76 176.27 1b8j s THR 143 N -2.91 0.04 0.04 0.00 -4.23 -1.26 -1.47 115.64 105.85 1b8j s THR 143 Ca 0.59 -0.29 -0.00 0.00 -1.18 0.00 0.00 61.69 60.80 1b8j s THR 143 Cb -0.13 -0.28 -0.03 0.00 1.34 0.00 0.00 72.50 73.40 1b8j s THR 143 CO 0.48 -0.16 -0.03 -0.83 -0.54 0.00 0.00 174.62 173.54 1b8j s GLY 144 N -0.52 0.37 -0.21 3.99 0.00 0.19 -1.80 107.32 109.35 1b8j s GLY 144 Ca -0.06 -0.92 -0.04 0.00 0.00 0.00 0.00 44.72 43.71 1b8j s GLY 144 CO 0.01 -1.01 0.27 0.21 0.00 0.00 0.00 173.10 172.58 1b8j s ASN 145 N -2.22 0.90 -0.02 1.64 2.47 0.40 -2.25 114.94 115.85 1b8j s ASN 145 Ca -0.04 0.02 0.05 0.00 0.42 0.00 0.00 52.86 53.31 1b8j s ASN 145 Cb -0.01 0.64 -0.01 0.00 -1.45 0.00 0.00 41.25 40.43 1b8j s ASN 145 CO -0.06 -0.31 -0.17 -0.69 -3.72 0.00 0.00 177.10 172.16 1b8j s VAL 146 N 2.40 1.35 0.12 -5.21 1.01 0.26 -1.54 120.40 118.79 1b8j s VAL 146 Ca 0.08 -0.71 -0.22 0.00 0.00 0.00 0.00 61.98 61.13 1b8j s VAL 146 Cb -0.15 -1.14 0.06 0.00 0.00 0.00 0.00 36.38 35.15 1b8j s VAL 146 CO -0.13 0.39 0.55 -0.55 0.00 0.00 0.00 175.10 175.36 1b8j s SER 147 N -0.22 -0.48 0.00 3.32 0.15 -0.22 -0.61 113.70 115.64 1b8j s SER 147 Ca 0.03 0.01 0.25 0.00 0.70 0.00 0.00 55.95 56.94 1b8j s SER 147 Cb -0.08 0.55 0.48 0.00 -1.71 0.00 0.00 66.02 65.26 1b8j s SER 147 CO 0.00 -0.88 1.40 0.35 1.20 0.00 0.00 173.24 175.31 1b8j n THR 148 N -0.12 0.00 -2.28 6.45 -2.24 -1.13 -3.94 114.28 111.02 1b8j n THR 148 Ca -0.17 -0.21 -0.19 0.00 -2.27 0.00 0.00 64.05 61.21 1b8j n THR 148 Cb 0.63 0.78 0.11 0.00 -2.10 0.00 0.00 70.33 69.76 1b8j n THR 148 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b8j n ALA 149 N -0.21 -0.25 -1.77 6.98 0.00 -1.26 -1.11 120.51 122.89 1b8j n ALA 149 Ca 0.12 -1.46 -0.40 0.00 0.00 0.00 0.00 53.44 51.70 1b8j n ALA 149 Cb 0.41 0.15 -0.01 0.00 0.00 0.00 0.00 19.45 20.00 1b8j n ALA 149 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1b8j s GLU 150 N -4.71 4.24 0.17 0.00 2.02 -1.26 -1.65 118.70 117.51 1b8j s GLU 150 Ca 0.53 2.24 0.15 0.00 0.02 0.00 0.00 54.97 57.91 1b8j s GLU 150 Cb -0.02 -2.98 0.73 0.00 0.10 0.00 0.00 34.13 31.95 1b8j s GLU 150 CO 0.36 -0.30 1.46 1.28 0.02 0.00 0.00 175.26 178.08 1b8j n LEU 151 N 0.60 0.34 -0.00 1.80 4.77 -0.37 -0.85 117.00 123.29 1b8j n LEU 151 Ca 0.01 0.63 0.13 0.00 -0.03 0.00 0.00 56.01 56.75 1b8j n LEU 151 Cb 0.42 -0.64 0.42 0.00 -2.33 0.00 0.00 43.42 41.29 1b8j n LEU 151 CO 0.59 -0.64 0.68 0.00 -1.33 0.00 0.00 177.39 176.69 1b8j n GLN 152 N -1.93 0.02 -1.17 3.23 3.00 -1.26 -3.83 117.38 115.44 1b8j n GLN 152 Ca 0.00 -0.01 -0.33 0.00 -0.01 0.00 0.00 57.00 56.66 1b8j n GLN 152 Cb 0.09 -1.50 0.12 0.00 0.00 0.00 0.00 30.24 28.95 1b8j n GLN 152 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1b8j s ASP 153 N -2.99 3.75 0.21 1.08 2.15 -0.03 -4.67 116.67 116.17 1b8j s ASP 153 Ca 0.13 2.29 -0.18 0.00 0.43 0.00 0.00 52.55 55.23 1b8j s ASP 153 Cb 0.18 -2.58 0.20 0.00 -0.30 0.00 0.00 42.92 40.42 1b8j s ASP 153 CO 0.62 -2.56 1.58 0.00 -0.17 0.00 0.00 175.17 174.64 1b8j h ALA 154 N -0.87 0.14 0.14 3.66 0.00 -1.89 -1.78 119.26 118.67 1b8j h ALA 154 Ca -0.46 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1b8j h ALA 154 Cb 1.29 0.80 -0.00 0.00 0.00 0.00 0.00 17.79 19.87 1b8j h ALA 154 CO 0.47 -0.60 -0.09 1.15 0.00 0.00 0.00 179.25 180.18 1b8j h THR 155 N -0.08 0.80 0.00 0.00 2.02 -1.94 -1.13 112.91 112.58 1b8j h THR 155 Ca 0.30 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.30 1b8j h THR 155 Cb 0.57 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 1b8j h THR 155 CO -0.79 0.00 -0.83 1.55 0.37 0.00 0.00 175.52 175.82 1b8j h PRO 156 N -0.23 0.00 -0.46 6.66 0.13 -1.82 -3.28 132.00 132.99 1b8j h PRO 156 Ca -0.01 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.07 1b8j h PRO 156 Cb 0.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.31 1b8j h PRO 156 CO 0.01 0.83 0.07 0.00 -0.23 0.00 0.00 178.00 178.68 1b8j h ALA 157 N 1.17 1.26 -0.21 -0.56 0.00 -1.15 -2.88 119.26 116.89 1b8j h ALA 157 Ca -0.01 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.76 1b8j h ALA 157 Cb 1.61 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 1b8j h ALA 157 CO 0.11 0.51 0.33 0.00 0.00 0.00 0.00 179.25 180.20 1b8j h ALA 158 N 1.40 1.75 0.00 0.00 0.00 -1.27 0.14 119.26 121.28 1b8j h ALA 158 Ca 0.15 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1b8j h ALA 158 Cb 0.32 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1b8j h ALA 158 CO 0.00 -0.44 -0.10 -0.07 0.00 0.00 0.00 179.25 178.65 1b8j h LEU 159 N 0.00 0.00 -0.02 0.00 3.38 -1.71 -3.39 115.31 113.57 1b8j h LEU 159 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1b8j h LEU 159 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1b8j h LEU 159 CO -0.00 0.02 0.00 1.33 0.09 0.00 0.00 178.44 179.88 1b8j n VAL 160 N -3.08 0.00 -4.33 1.22 0.24 0.23 -4.44 118.33 108.18 1b8j n VAL 160 Ca 0.04 -0.31 -0.22 0.00 -2.04 0.00 0.00 64.34 61.81 1b8j n VAL 160 Cb 0.54 1.01 -0.11 0.00 -1.47 0.00 0.00 33.84 33.81 1b8j n VAL 160 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b8j s ALA 161 N -0.60 1.99 -0.27 2.33 0.00 0.20 -4.39 121.76 121.01 1b8j s ALA 161 Ca 0.00 -1.48 -0.03 0.00 0.00 0.00 0.00 51.96 50.45 1b8j s ALA 161 Cb 0.00 -0.18 0.09 0.00 0.00 0.00 0.00 23.12 23.03 1b8j s ALA 161 CO 0.00 0.23 0.11 -1.01 0.00 0.00 0.00 175.76 175.09 1b8j s HIS 162 N -2.03 0.67 0.05 0.00 0.09 -1.25 -3.74 115.29 109.08 1b8j s HIS 162 Ca 0.15 -0.98 -0.01 0.00 -0.00 0.00 0.00 55.06 54.22 1b8j s HIS 162 Cb -0.06 -1.06 -0.04 0.00 -0.00 0.00 0.00 32.58 31.43 1b8j s HIS 162 CO 0.06 -0.77 -0.03 0.14 -0.00 0.00 0.00 174.74 174.14 1b8j s VAL 163 N 1.98 0.23 -0.79 -0.90 -7.23 -0.05 -4.96 120.40 108.67 1b8j s VAL 163 Ca 0.07 -1.76 0.26 0.00 -1.81 0.00 0.00 61.98 58.75 1b8j s VAL 163 Cb -0.16 -1.44 0.21 0.00 0.56 0.00 0.00 36.38 35.54 1b8j s VAL 163 CO -0.28 -0.96 1.70 0.35 -0.31 0.00 0.00 175.10 175.60 1b8j n THR 164 N 0.20 0.37 -3.79 5.32 -2.24 -1.26 -2.05 114.28 110.84 1b8j n THR 164 Ca -0.15 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.30 1b8j n THR 164 Cb 0.61 -0.42 -0.14 0.00 -2.10 0.00 0.00 70.33 68.28 1b8j n THR 164 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1b8j s SER 165 N -4.02 -0.08 0.49 3.42 0.15 -1.25 -4.33 113.70 108.08 1b8j s SER 165 Ca 0.11 0.22 0.33 0.00 0.70 0.00 0.00 55.95 57.31 1b8j s SER 165 Cb 0.14 0.15 1.62 0.00 -1.71 0.00 0.00 66.02 66.22 1b8j s SER 165 CO 0.61 -0.10 2.00 0.08 1.20 0.00 0.00 173.24 177.04 1b8j h ARG 166 N 6.75 0.00 0.00 5.44 0.11 -1.07 -2.84 114.38 122.76 1b8j h ARG 166 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 1b8j h ARG 166 Cb 1.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.24 1b8j h ARG 166 CO 0.44 0.00 0.00 1.63 0.10 0.00 0.00 179.97 182.14 1b8j n LYS 167 N -2.78 0.06 -1.75 0.08 5.02 -1.26 -4.42 118.16 113.11 1b8j n LYS 167 Ca -0.01 0.15 -0.41 0.00 -2.02 0.00 0.00 58.31 56.03 1b8j n LYS 167 Cb 0.16 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.66 1b8j n LYS 167 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1b8j h TYR 169 N 5.40 -1.25 -3.21 0.00 -1.99 -1.89 -0.22 116.97 113.81 1b8j h TYR 169 Ca 0.66 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 61.37 1b8j h TYR 169 Cb 0.47 0.42 0.00 0.00 2.00 0.00 0.00 36.73 39.62 1b8j h TYR 169 CO 1.58 -0.74 0.00 0.41 -0.00 0.00 0.00 178.16 179.41 1b8j n GLY 170 N -1.64 4.38 0.22 3.88 0.00 -1.26 -1.51 105.19 109.25 1b8j n GLY 170 Ca -0.16 -2.00 -0.01 0.00 0.00 0.00 0.00 46.02 43.85 1b8j n GLY 170 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1b8j h PRO 171 N 0.00 0.07 -0.47 1.61 0.11 -1.91 -2.05 132.00 129.36 1b8j h PRO 171 Ca 0.00 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.00 1b8j h PRO 171 Cb 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 1b8j h PRO 171 CO 0.00 0.05 -0.12 0.66 -0.21 0.00 0.00 178.00 178.37 1b8j h SER 172 N 0.07 0.91 0.19 -2.05 4.64 -1.97 -2.05 113.55 113.29 1b8j h SER 172 Ca 0.28 -0.36 -0.17 0.00 -0.47 0.00 0.00 61.79 61.06 1b8j h SER 172 Cb 0.44 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1b8j h SER 172 CO -0.51 1.07 -0.66 0.00 -0.87 0.00 0.00 176.83 175.85 1b8j h ALA 173 N 0.88 0.65 -0.67 5.18 0.00 -1.87 -3.18 119.26 120.25 1b8j h ALA 173 Ca 0.12 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1b8j h ALA 173 Cb 0.67 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1b8j h ALA 173 CO 0.05 0.73 0.21 1.15 0.00 0.00 0.00 179.25 181.39 1b8j h THR 174 N 0.32 1.25 -0.85 0.00 2.02 -1.26 0.94 112.91 115.33 1b8j h THR 174 Ca -0.02 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.30 1b8j h THR 174 Cb 1.22 0.55 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1b8j h THR 174 CO 0.12 0.33 0.53 0.28 0.37 0.00 0.00 175.52 177.15 1b8j h SER 175 N 0.97 1.01 0.44 4.18 0.02 -1.38 0.25 113.55 119.05 1b8j h SER 175 Ca 0.22 -0.06 -0.31 0.00 -0.84 0.00 0.00 61.79 60.80 1b8j h SER 175 Cb 0.30 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.57 1b8j h SER 175 CO -0.01 0.77 -1.57 1.05 -1.14 0.00 0.00 176.83 175.93 1b8j h GLU 176 N 1.16 0.23 0.00 3.45 4.11 -1.44 -3.35 114.58 118.74 1b8j h GLU 176 Ca 0.31 -0.38 -0.34 0.00 0.07 0.00 0.00 59.36 59.01 1b8j h GLU 176 Cb -0.07 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.26 1b8j h GLU 176 CO -0.06 1.07 -2.32 1.63 0.07 0.00 0.00 179.01 179.39 1b8j n LYS 177 N -3.42 0.68 -3.13 1.06 5.02 0.32 -4.62 118.16 114.07 1b8j n LYS 177 Ca -0.17 -0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 55.88 1b8j n LYS 177 Cb 1.04 -1.54 -0.05 0.00 -0.02 0.00 0.00 35.03 34.47 1b8j n LYS 177 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1b8j h PRO 179 N 3.34 0.19 0.00 0.00 0.11 -1.64 0.47 132.00 134.47 1b8j h PRO 179 Ca 0.13 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 1b8j h PRO 179 Cb 0.72 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.79 1b8j h PRO 179 CO 0.68 0.13 -0.01 0.78 -0.21 0.00 0.00 178.00 179.37 1b8j h GLY 180 N 0.20 0.00 0.21 -0.55 0.00 -1.92 -1.03 103.07 99.97 1b8j h GLY 180 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.79 1b8j h GLY 180 CO -0.61 0.00 -1.17 0.70 0.00 0.00 0.00 176.54 175.47 1b8j n ASN 181 N -3.11 0.68 -4.66 0.19 5.03 0.15 -4.09 115.26 109.44 1b8j n ASN 181 Ca -0.01 -0.56 -0.46 0.00 0.87 0.00 0.00 54.58 54.42 1b8j n ASN 181 Cb 0.20 1.10 -0.04 0.00 -1.02 0.00 0.00 39.78 40.02 1b8j n ASN 181 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1b8j n ALA 182 N -1.73 1.14 -0.11 5.41 0.00 -0.39 -0.40 120.51 124.43 1b8j n ALA 182 Ca 0.02 0.45 -0.09 0.00 0.00 0.00 0.00 53.44 53.82 1b8j n ALA 182 Cb 0.40 -2.32 -0.01 0.00 0.00 0.00 0.00 19.45 17.52 1b8j n ALA 182 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1b8j h LEU 183 N 5.52 0.41 0.00 0.00 5.85 -1.88 0.53 115.31 125.74 1b8j h LEU 183 Ca -0.45 -0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1b8j h LEU 183 Cb 1.26 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1b8j h LEU 183 CO 0.86 0.35 0.00 -1.84 -0.34 0.00 0.00 178.44 177.47 1b8j n GLU 184 N -4.81 0.04 -0.43 1.25 0.00 -1.26 -0.64 120.64 114.79 1b8j n GLU 184 Ca -0.01 0.29 0.08 0.00 0.00 0.00 0.00 57.16 57.52 1b8j n GLU 184 Cb 0.06 -1.50 0.26 0.00 0.00 0.00 0.00 31.44 30.26 1b8j n GLU 184 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1b8j n LYS 185 N -1.45 3.24 -0.62 3.44 4.01 -0.58 -4.93 118.16 121.27 1b8j n LYS 185 Ca 0.03 -2.62 0.00 0.00 -0.51 0.00 0.00 58.31 55.21 1b8j n LYS 185 Cb 0.11 -1.69 0.00 0.00 -0.51 0.00 0.00 35.03 32.94 1b8j n LYS 185 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1b8j n GLY 186 N 0.41 0.76 3.76 0.72 0.00 0.19 -4.90 105.19 106.13 1b8j n GLY 186 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1b8j n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8j n GLY 187 N -2.24 -1.40 0.23 -0.02 0.00 0.18 -4.95 105.19 96.99 1b8j n GLY 187 Ca 0.00 -1.72 0.12 0.00 0.00 0.00 0.00 46.02 44.42 1b8j n GLY 187 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b8j h LYS 188 N 0.00 0.00 0.00 1.61 1.57 -1.78 -3.38 116.57 114.59 1b8j h LYS 188 Ca -0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 1b8j h LYS 188 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 1b8j h LYS 188 CO 0.30 0.13 0.00 0.41 -0.57 0.00 0.00 179.45 179.72 1b8j n GLY 189 N 0.41 1.99 3.70 3.86 0.00 0.46 -4.59 105.19 111.02 1b8j n GLY 189 Ca 0.01 -2.20 -0.29 0.00 0.00 0.00 0.00 46.02 43.55 1b8j n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b8j s SER 190 N 0.00 2.49 0.18 1.61 1.04 -1.26 -4.67 113.70 113.09 1b8j s SER 190 Ca 0.00 0.97 -0.15 0.00 0.48 0.00 0.00 55.95 57.25 1b8j s SER 190 Cb 0.00 -1.51 0.15 0.00 0.10 0.00 0.00 66.02 64.77 1b8j s SER 190 CO 0.00 -3.19 1.66 0.40 0.98 0.00 0.00 173.24 173.09 1b8j h ILE 191 N -1.94 0.54 -0.87 -1.02 2.04 -0.94 -0.15 117.51 115.17 1b8j h ILE 191 Ca -0.52 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 1b8j h ILE 191 Cb 1.32 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.88 1b8j h ILE 191 CO 0.54 0.00 0.46 0.74 0.00 0.00 0.00 178.15 179.89 1b8j h THR 192 N 0.02 1.26 -0.33 -0.27 2.02 -1.52 0.12 112.91 114.21 1b8j h THR 192 Ca 0.23 -0.66 -0.06 0.00 0.77 0.00 0.00 66.41 66.70 1b8j h THR 192 Cb 0.36 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 1b8j h THR 192 CO -0.48 0.29 -0.02 -0.33 0.37 0.00 0.00 175.52 175.35 1b8j h GLU 193 N 1.23 0.59 -0.10 6.66 5.08 -1.59 -1.55 114.58 124.91 1b8j h GLU 193 Ca 0.31 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.38 1b8j h GLU 193 Cb 0.05 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1b8j h GLU 193 CO -0.05 0.74 -0.34 1.96 -1.00 0.00 0.00 179.01 180.32 1b8j h GLN 194 N 0.38 0.19 -0.39 2.33 4.20 -0.76 -1.52 115.11 119.54 1b8j h GLN 194 Ca 0.09 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1b8j h GLN 194 Cb 0.48 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 1b8j h GLN 194 CO 0.02 0.51 0.26 1.25 -0.67 0.00 0.00 178.83 180.20 1b8j h LEU 195 N 0.17 0.45 -1.25 1.46 6.46 -0.35 0.84 115.31 123.08 1b8j h LEU 195 Ca 0.02 -0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.73 1b8j h LEU 195 Cb 0.69 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 1b8j h LEU 195 CO 0.05 0.33 0.09 -0.07 -0.62 0.00 0.00 178.44 178.22 1b8j h LEU 196 N 0.53 0.55 -0.26 2.25 3.38 -0.87 -2.73 115.31 118.16 1b8j h LEU 196 Ca 0.14 -0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.82 1b8j h LEU 196 Cb -0.05 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1b8j h LEU 196 CO -0.03 0.56 -0.85 0.78 0.09 0.00 0.00 178.44 179.00 1b8j h ASN 197 N 0.58 0.55 -0.94 -0.43 2.35 -0.71 -3.20 115.58 113.78 1b8j h ASN 197 Ca 0.13 -0.40 0.06 0.00 -0.55 0.00 0.00 56.30 55.54 1b8j h ASN 197 Cb 0.24 -0.16 -0.06 0.00 0.05 0.00 0.00 38.32 38.38 1b8j h ASN 197 CO -0.00 1.17 0.60 0.00 -1.65 0.00 0.00 177.43 177.56 1b8j h ALA 198 N 0.80 1.29 -5.64 -0.83 0.00 -0.56 -3.47 119.26 110.86 1b8j h ALA 198 Ca -0.06 -0.02 -0.30 0.00 0.00 0.00 0.00 54.91 54.53 1b8j h ALA 198 Cb 1.46 -0.29 0.17 0.00 0.00 0.00 0.00 17.79 19.13 1b8j h ALA 198 CO 0.15 0.40 -0.86 -2.13 0.00 0.00 0.00 179.25 176.81 1b8j n ARG 199 N -4.54 -2.71 -2.21 0.00 0.63 -1.07 -4.99 116.66 101.77 1b8j n ARG 199 Ca 0.14 0.79 -0.34 0.00 -0.92 0.00 0.00 57.85 57.51 1b8j n ARG 199 Cb 0.16 -5.52 0.00 0.00 0.45 0.00 0.00 32.46 27.55 1b8j n ARG 199 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1b8j s ALA 200 N -3.41 2.69 0.30 5.13 0.00 -1.26 -4.94 121.76 120.27 1b8j s ALA 200 Ca 0.39 0.72 0.01 0.00 0.00 0.00 0.00 51.96 53.07 1b8j s ALA 200 Cb -0.07 -3.33 0.49 0.00 0.00 0.00 0.00 23.12 20.21 1b8j s ALA 200 CO 0.76 -0.77 1.87 -0.44 0.00 0.00 0.00 175.76 177.18 1b8j h ASP 201 N 1.03 0.71 -3.24 0.00 3.32 -1.68 -3.41 116.42 113.14 1b8j h ASP 201 Ca -0.49 -0.11 -0.47 0.00 0.02 0.00 0.00 57.03 55.99 1b8j h ASP 201 Cb 1.25 -0.18 -0.38 0.00 0.22 0.00 0.00 39.33 40.24 1b8j h ASP 201 CO 0.57 0.67 -0.78 -0.69 -1.72 0.00 0.00 179.24 177.30 1b8j s VAL 202 N -5.27 0.56 -0.07 -1.35 1.01 -0.96 -0.43 120.40 113.90 1b8j s VAL 202 Ca -0.09 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.86 1b8j s VAL 202 Cb 0.16 -0.70 0.02 0.00 0.00 0.00 0.00 36.38 35.85 1b8j s VAL 202 CO 0.79 0.26 -0.09 -0.89 0.00 0.00 0.00 175.10 175.17 1b8j s THR 203 N 1.89 0.91 -0.01 3.92 2.01 -0.84 -0.46 115.64 123.06 1b8j s THR 203 Ca 0.05 -0.31 -0.01 0.00 0.31 0.00 0.00 61.69 61.73 1b8j s THR 203 Cb -0.13 -0.88 0.01 0.00 0.01 0.00 0.00 72.50 71.52 1b8j s THR 203 CO -0.06 0.32 0.03 -0.76 -0.69 0.00 0.00 174.62 173.46 1b8j s LEU 204 N 1.00 1.60 0.00 4.42 1.43 -0.59 -0.96 118.68 125.58 1b8j s LEU 204 Ca -0.09 0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1b8j s LEU 204 Cb -0.15 0.05 0.00 0.00 0.03 0.00 0.00 46.19 46.12 1b8j s LEU 204 CO -0.00 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.14 1b8j n GLY 205 N 3.46 -0.61 0.00 -3.19 0.00 0.01 -1.06 105.19 103.81 1b8j n GLY 205 Ca -0.18 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.93 1b8j n GLY 205 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8j n GLY 206 N 0.00 2.50 0.85 -0.02 0.00 -0.66 -0.59 105.19 107.27 1b8j n GLY 206 Ca 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1b8j n GLY 206 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8j n GLY 207 N 5.00 0.90 0.22 -0.02 0.00 0.00 -1.24 105.19 110.05 1b8j n GLY 207 Ca 0.00 -0.44 0.06 0.00 0.00 0.00 0.00 46.02 45.64 1b8j n GLY 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8j h ALA 208 N 0.00 1.51 -0.42 4.61 0.00 -0.92 -3.22 119.26 120.82 1b8j h ALA 208 Ca 0.00 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.78 1b8j h ALA 208 Cb 0.12 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.78 1b8j h ALA 208 CO 0.00 0.29 -0.24 -0.22 0.00 0.00 0.00 179.25 179.08 1b8j h LYS 209 N 0.00 -0.15 0.00 0.00 3.64 -1.65 -1.18 116.57 117.23 1b8j h LYS 209 Ca -0.00 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1b8j h LYS 209 Cb 0.44 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1b8j h LYS 209 CO 0.03 -0.10 -0.18 1.15 -2.27 0.00 0.00 179.45 178.07 1b8j h THR 210 N -0.16 1.00 0.00 1.00 2.02 -1.81 -2.15 112.91 112.81 1b8j h THR 210 Ca 0.20 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.73 1b8j h THR 210 Cb 0.47 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1b8j h THR 210 CO -0.51 0.18 0.00 0.49 0.37 0.00 0.00 175.52 176.04 1b8j n PHE 211 N -4.13 0.00 0.17 3.16 3.01 -0.45 -1.38 117.46 117.85 1b8j n PHE 211 Ca -0.02 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.50 1b8j n PHE 211 Cb 0.25 -0.16 0.08 0.00 -0.01 0.00 0.00 39.48 39.65 1b8j n PHE 211 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1b8j h ALA 212 N 2.50 0.81 -2.27 4.37 0.00 -1.45 -1.37 119.26 121.85 1b8j h ALA 212 Ca 0.00 -0.26 -0.51 0.00 0.00 0.00 0.00 54.91 54.14 1b8j h ALA 212 Cb 0.05 -0.04 0.18 0.00 0.00 0.00 0.00 17.79 17.97 1b8j h ALA 212 CO 0.00 0.36 0.23 -1.21 0.00 0.00 0.00 179.25 178.63 1b8j s GLU 213 N -3.07 1.15 0.01 0.00 2.02 -0.48 -4.68 118.70 113.66 1b8j s GLU 213 Ca 0.05 1.36 0.06 0.00 0.02 0.00 0.00 54.97 56.46 1b8j s GLU 213 Cb 0.06 -1.76 -0.03 0.00 0.10 0.00 0.00 34.13 32.51 1b8j s GLU 213 CO 0.71 -2.48 -0.15 0.95 0.02 0.00 0.00 175.26 174.32 1b8j s THR 214 N -2.71 3.03 0.33 3.63 -4.23 -1.26 -0.66 115.64 113.77 1b8j s THR 214 Ca 0.65 -1.00 -0.29 0.00 -1.18 0.00 0.00 61.69 59.88 1b8j s THR 214 Cb -0.21 -2.27 -0.10 0.00 1.34 0.00 0.00 72.50 71.26 1b8j s THR 214 CO 0.58 0.41 1.29 0.00 -0.54 0.00 0.00 174.62 176.35 1b8j s ALA 215 N -0.90 3.48 -0.69 3.99 0.00 -0.86 -4.82 121.76 121.97 1b8j s ALA 215 Ca 0.15 1.23 0.24 0.00 0.00 0.00 0.00 51.96 53.57 1b8j s ALA 215 Cb -0.11 -3.46 0.37 0.00 0.00 0.00 0.00 23.12 19.92 1b8j s ALA 215 CO 0.05 -0.60 1.33 0.25 0.00 0.00 0.00 175.76 176.79 1b8j n THR 216 N 0.82 0.30 -3.28 0.00 -2.24 -1.26 -0.55 114.28 108.06 1b8j n THR 216 Ca -0.00 -0.23 -0.03 0.00 -2.27 0.00 0.00 64.05 61.52 1b8j n THR 216 Cb 0.42 -0.08 0.01 0.00 -2.10 0.00 0.00 70.33 68.58 1b8j n THR 216 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b8j n ALA 217 N -1.78 -0.45 -0.07 6.98 0.00 -1.26 -4.83 120.51 119.09 1b8j n ALA 217 Ca 0.04 -0.37 0.01 0.00 0.00 0.00 0.00 53.44 53.12 1b8j n ALA 217 Cb 0.42 0.29 -0.00 0.00 0.00 0.00 0.00 19.45 20.16 1b8j n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b8j n GLY 218 N -0.15 -1.61 0.40 0.00 0.00 -1.26 -3.30 105.19 99.27 1b8j n GLY 218 Ca -0.02 -1.50 0.22 0.00 0.00 0.00 0.00 46.02 44.71 1b8j n GLY 218 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1b8j h GLU 219 N -0.07 0.06 -0.54 1.61 4.81 -2.01 -0.67 114.58 117.76 1b8j h GLU 219 Ca -0.00 -0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 58.89 1b8j h GLU 219 Cb 0.07 -0.01 -0.21 0.00 0.63 0.00 0.00 28.75 29.22 1b8j h GLU 219 CO 0.00 0.04 -0.10 0.91 -0.73 0.00 0.00 179.01 179.13 1b8j n TRP 220 N -4.37 1.80 -1.72 0.92 8.01 -1.26 -5.03 117.44 115.78 1b8j n TRP 220 Ca 0.13 -1.95 -0.37 0.00 -1.31 0.00 0.00 57.50 53.99 1b8j n TRP 220 Cb 0.69 -0.61 0.07 0.00 -2.01 0.00 0.00 31.31 29.45 1b8j n TRP 220 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.69 177.62 1b8j n GLN 221 N -1.01 1.17 0.00 -0.99 7.27 -0.26 -2.35 117.38 121.21 1b8j n GLN 221 Ca 0.40 0.46 0.00 0.00 0.07 0.00 0.00 57.00 57.93 1b8j n GLN 221 Cb 0.99 -2.52 0.00 0.00 2.41 0.00 0.00 30.24 31.12 1b8j n GLN 221 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1b8j n GLY 222 N 0.92 2.64 3.84 1.69 0.00 0.29 -4.89 105.19 109.69 1b8j n GLY 222 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1b8j n GLY 222 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b8j s LYS 223 N 0.00 3.07 0.81 1.61 -2.85 -0.99 -4.79 119.74 116.59 1b8j s LYS 223 Ca 0.00 -0.79 -0.13 0.00 -1.00 0.00 0.00 55.97 54.05 1b8j s LYS 223 Cb 0.00 -2.74 0.08 0.00 -2.06 0.00 0.00 37.83 33.11 1b8j s LYS 223 CO 0.00 0.49 1.18 0.95 0.10 0.00 0.00 175.35 178.08 1b8j s THR 224 N -1.76 2.21 0.42 3.79 -4.23 -1.26 -2.02 115.64 112.79 1b8j s THR 224 Ca 0.32 0.09 0.15 0.00 -1.18 0.00 0.00 61.69 61.07 1b8j s THR 224 Cb -0.10 -2.45 0.17 0.00 1.34 0.00 0.00 72.50 71.46 1b8j s THR 224 CO 0.25 -0.07 1.95 -0.07 -0.54 0.00 0.00 174.62 176.14 1b8j h LEU 225 N -0.99 0.00 -0.38 4.79 3.38 -0.61 0.13 115.31 121.63 1b8j h LEU 225 Ca -0.46 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 1b8j h LEU 225 Cb 1.28 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 1b8j h LEU 225 CO 0.46 0.23 0.13 -0.09 0.09 0.00 0.00 178.44 179.26 1b8j h ARG 226 N 0.00 0.59 -0.03 1.13 2.43 -1.52 0.24 114.38 117.21 1b8j h ARG 226 Ca -0.00 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1b8j h ARG 226 Cb 0.42 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1b8j h ARG 226 CO 0.03 0.59 0.02 0.93 -1.51 0.00 0.00 179.97 180.02 1b8j h GLU 227 N 0.47 0.05 -0.85 0.20 5.08 -1.58 -1.98 114.58 115.96 1b8j h GLU 227 Ca 0.12 -0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.61 1b8j h GLU 227 Cb 0.24 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.39 1b8j h GLU 227 CO -0.01 0.16 0.46 0.37 -1.00 0.00 0.00 179.01 178.99 1b8j h GLN 228 N -0.07 0.67 -0.04 2.33 4.15 -0.65 0.14 115.11 121.64 1b8j h GLN 228 Ca 0.01 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.41 1b8j h GLN 228 Cb 0.12 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.65 1b8j h GLN 228 CO -0.00 0.44 -0.06 0.00 -1.93 0.00 0.00 178.83 177.28 1b8j h ALA 229 N 1.53 -0.02 -0.29 3.38 0.00 -0.48 0.26 119.26 123.63 1b8j h ALA 229 Ca 0.44 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.27 1b8j h ALA 229 Cb 0.56 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1b8j h ALA 229 CO -0.32 -0.54 -0.26 -0.56 0.00 0.00 0.00 179.25 177.57 1b8j h GLN 230 N -0.08 0.58 -0.61 0.00 3.07 -0.64 -2.20 115.11 115.22 1b8j h GLN 230 Ca 0.04 -0.23 -0.00 0.00 0.09 0.00 0.00 58.65 58.54 1b8j h GLN 230 Cb 0.13 -0.03 -0.03 0.00 0.08 0.00 0.00 27.48 27.64 1b8j h GLN 230 CO -0.09 0.79 0.37 0.00 0.09 0.00 0.00 178.83 179.99 1b8j h ALA 231 N 1.21 1.49 -0.25 0.06 0.00 -0.43 -1.86 119.26 119.48 1b8j h ALA 231 Ca 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b8j h ALA 231 Cb 0.72 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1b8j h ALA 231 CO 0.06 0.44 0.00 0.54 0.00 0.00 0.00 179.25 180.29 1b8j n ARG 232 N -4.41 1.66 -0.27 0.00 1.74 0.05 -4.92 116.66 110.50 1b8j n ARG 232 Ca 0.06 -1.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.13 1b8j n ARG 232 Cb 0.07 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1b8j n ARG 232 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1b8j n GLY 233 N 0.99 0.86 3.78 -0.13 0.00 -0.70 -4.99 105.19 105.00 1b8j n GLY 233 Ca 0.11 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1b8j n GLY 233 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b8j s TYR 234 N -2.00 3.30 -0.35 1.61 1.51 -0.87 -4.10 117.35 116.45 1b8j s TYR 234 Ca 0.00 1.65 -0.17 0.00 -1.01 0.00 0.00 57.07 57.54 1b8j s TYR 234 Cb 0.00 -3.13 -0.00 0.00 -0.11 0.00 0.00 41.96 38.71 1b8j s TYR 234 CO 0.00 -0.60 0.46 -0.65 -1.11 0.00 0.00 175.55 173.65 1b8j s GLN 235 N -2.41 3.55 0.02 -0.62 -0.21 0.04 -4.61 119.66 115.43 1b8j s GLN 235 Ca 0.57 -0.29 -0.17 0.00 0.02 0.00 0.00 55.36 55.48 1b8j s GLN 235 Cb -0.23 -3.82 -0.06 0.00 1.00 0.00 0.00 33.01 29.90 1b8j s GLN 235 CO 0.28 -0.63 0.49 -0.51 -2.12 0.00 0.00 175.29 172.81 1b8j s LEU 236 N 2.27 4.47 0.02 2.90 1.02 -1.26 -0.66 118.68 127.44 1b8j s LEU 236 Ca 0.16 1.08 0.00 0.00 0.02 0.00 0.00 54.13 55.40 1b8j s LEU 236 Cb -0.16 -2.74 -0.01 0.00 0.02 0.00 0.00 46.19 43.29 1b8j s LEU 236 CO 0.13 0.26 -0.03 -0.69 0.02 0.00 0.00 176.35 176.04 1b8j s VAL 237 N -0.87 0.12 0.00 -1.59 1.01 -0.49 -4.96 120.40 113.62 1b8j s VAL 237 Ca 0.27 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1b8j s VAL 237 Cb -0.18 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 35.98 1b8j s VAL 237 CO 0.16 -0.36 0.56 -1.54 0.00 0.00 0.00 175.10 173.92 1b8j n SER 238 N 1.99 0.00 -3.69 3.32 3.41 -1.26 -1.69 113.62 115.69 1b8j n SER 238 Ca -0.21 -1.24 -0.10 0.00 -0.26 0.00 0.00 58.87 57.07 1b8j n SER 238 Cb 0.56 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1b8j n SER 238 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1b8j s ASP 239 N -0.24 0.07 0.25 4.04 1.47 -1.26 -4.58 116.67 116.41 1b8j s ASP 239 Ca 0.00 -1.00 -0.02 0.00 1.18 0.00 0.00 52.55 52.70 1b8j s ASP 239 Cb 0.00 0.66 0.29 0.00 -0.34 0.00 0.00 42.92 43.54 1b8j s ASP 239 CO 0.00 -1.28 1.71 0.00 0.68 0.00 0.00 175.17 176.28 1b8j h ALA 240 N 2.15 1.03 0.47 2.11 0.00 -0.98 -2.08 119.26 121.96 1b8j h ALA 240 Ca -0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 1b8j h ALA 240 Cb 1.25 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1b8j h ALA 240 CO 0.35 0.59 -0.28 0.00 0.00 0.00 0.00 179.25 179.91 1b8j h ALA 241 N 1.20 -0.71 -0.71 0.00 0.00 -1.89 -1.01 119.26 116.15 1b8j h ALA 241 Ca 0.12 -0.14 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1b8j h ALA 241 Cb 0.57 0.33 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 1b8j h ALA 241 CO 0.04 -0.91 0.37 0.77 0.00 0.00 0.00 179.25 179.52 1b8j h SER 242 N -0.71 0.51 -0.64 0.00 0.02 -1.95 -1.79 113.55 108.99 1b8j h SER 242 Ca -0.06 0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.00 1b8j h SER 242 Cb 0.57 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 63.02 1b8j h SER 242 CO 0.07 0.30 0.35 0.25 -1.14 0.00 0.00 176.83 176.66 1b8j h LEU 243 N 0.65 0.51 -1.34 5.07 5.85 -0.97 -1.13 115.31 123.94 1b8j h LEU 243 Ca 0.34 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 59.03 1b8j h LEU 243 Cb 0.31 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1b8j h LEU 243 CO -0.24 0.33 -0.29 0.78 -0.34 0.00 0.00 178.44 178.68 1b8j h ASN 244 N 0.64 0.00 0.53 1.25 2.35 -0.38 -2.66 115.58 117.31 1b8j h ASN 244 Ca 0.29 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 56.01 1b8j h ASN 244 Cb 0.19 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 1b8j h ASN 244 CO -0.19 0.29 -0.14 0.28 -1.65 0.00 0.00 177.43 176.02 1b8j h SER 245 N 0.00 0.00 -3.04 5.81 0.02 -0.49 -3.44 113.55 112.42 1b8j h SER 245 Ca -0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1b8j h SER 245 Cb 0.64 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.21 1b8j h SER 245 CO 0.04 0.14 0.75 -0.69 -1.14 0.00 0.00 176.83 175.93 1b8j s VAL 246 N -4.03 3.11 0.00 2.27 1.01 -1.00 -4.91 120.40 116.85 1b8j s VAL 246 Ca -0.02 0.82 0.00 0.00 0.00 0.00 0.00 61.98 62.78 1b8j s VAL 246 Cb 0.12 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1b8j s VAL 246 CO 0.59 0.08 0.20 0.35 0.00 0.00 0.00 175.10 176.32 1b8j n THR 247 N 3.69 0.00 -3.61 3.92 -2.24 -1.26 -5.01 114.28 109.76 1b8j n THR 247 Ca 0.11 -0.49 -0.15 0.00 -2.27 0.00 0.00 64.05 61.25 1b8j n THR 247 Cb 0.41 1.01 -0.07 0.00 -2.10 0.00 0.00 70.33 69.58 1b8j n THR 247 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1b8j s GLU 248 N -0.58 0.86 -0.07 -0.78 -1.05 -1.26 -4.99 118.70 110.84 1b8j s GLU 248 Ca 0.00 0.71 -0.03 0.00 -0.15 0.00 0.00 54.97 55.51 1b8j s GLU 248 Cb 0.00 0.41 0.04 0.00 -0.44 0.00 0.00 34.13 34.15 1b8j s GLU 248 CO 0.00 -0.16 0.13 0.00 0.95 0.00 0.00 175.26 176.18 1b8j s ALA 249 N -0.13 -0.14 0.27 -0.84 0.00 -1.26 -4.91 121.76 114.75 1b8j s ALA 249 Ca -0.04 0.55 -0.09 0.00 0.00 0.00 0.00 51.96 52.38 1b8j s ALA 249 Cb -0.03 -0.62 0.04 0.00 0.00 0.00 0.00 23.12 22.51 1b8j s ALA 249 CO 0.04 -0.37 0.53 0.27 0.00 0.00 0.00 175.76 176.23 1b8j n ASN 250 N 4.81 -1.54 0.29 0.00 0.23 -0.95 -4.86 115.26 113.23 1b8j n ASN 250 Ca -0.15 -2.13 0.17 0.00 -0.53 0.00 0.00 54.58 51.95 1b8j n ASN 250 Cb 0.51 2.58 0.95 0.00 -2.08 0.00 0.00 39.78 41.74 1b8j n ASN 250 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 1b8j h GLN 251 N 0.00 0.00 0.23 -3.83 1.08 -1.93 0.44 115.11 111.10 1b8j h GLN 251 Ca -0.23 0.00 -0.33 0.00 -1.45 0.00 0.00 58.65 56.64 1b8j h GLN 251 Cb 0.86 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 28.31 1b8j h GLN 251 CO 0.29 0.00 -1.52 1.96 -0.95 0.00 0.00 178.83 178.62 1b8j h GLN 252 N 0.00 0.48 -2.11 1.46 7.50 -1.95 -3.39 115.11 117.10 1b8j h GLN 252 Ca 0.02 -0.82 -0.58 0.00 0.50 0.00 0.00 58.65 57.78 1b8j h GLN 252 Cb 0.14 0.30 -0.41 0.00 0.05 0.00 0.00 27.48 27.56 1b8j h GLN 252 CO -0.00 1.39 -0.82 1.63 -1.50 0.00 0.00 178.83 179.53 1b8j n LYS 253 N -3.72 1.78 -2.00 1.46 4.01 -0.72 -4.80 118.16 114.16 1b8j n LYS 253 Ca -0.19 -4.06 -0.38 0.00 -0.51 0.00 0.00 58.31 53.17 1b8j n LYS 253 Cb 1.07 -1.82 0.02 0.00 -0.51 0.00 0.00 35.03 33.79 1b8j n LYS 253 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 1b8j s PRO 254 N -2.01 3.40 -0.04 1.97 0.04 0.15 -2.23 135.00 136.28 1b8j s PRO 254 Ca 0.38 2.02 -0.13 0.00 0.04 0.00 0.00 61.00 63.31 1b8j s PRO 254 Cb 0.17 -2.31 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 1b8j s PRO 254 CO -0.06 -0.91 0.35 -1.17 0.04 0.00 0.00 177.00 175.25 1b8j s LEU 255 N -3.33 4.43 -0.16 -3.56 2.96 0.42 -0.78 118.68 118.67 1b8j s LEU 255 Ca 0.68 0.83 -0.03 0.00 -0.22 0.00 0.00 54.13 55.39 1b8j s LEU 255 Cb -0.35 -2.48 0.05 0.00 0.50 0.00 0.00 46.19 43.92 1b8j s LEU 255 CO 0.41 0.31 0.03 -0.22 -1.32 0.00 0.00 176.35 175.56 1b8j s LEU 256 N -0.86 0.96 -0.27 -0.68 2.96 0.17 -1.99 118.68 118.96 1b8j s LEU 256 Ca 0.22 -0.60 -0.06 0.00 -0.22 0.00 0.00 54.13 53.47 1b8j s LEU 256 Cb -0.15 -0.53 0.00 0.00 0.50 0.00 0.00 46.19 46.01 1b8j s LEU 256 CO 0.11 -0.28 0.05 -0.83 -1.32 0.00 0.00 176.35 174.08 1b8j s GLY 257 N 1.91 1.74 -0.44 7.98 0.00 -0.13 -1.40 107.32 116.98 1b8j s GLY 257 Ca 0.01 -1.38 -0.03 0.00 0.00 0.00 0.00 44.72 43.31 1b8j s GLY 257 CO -0.07 0.59 0.24 1.08 0.00 0.00 0.00 173.10 174.94 1b8j s LEU 258 N 1.49 5.29 0.00 0.66 1.43 -0.68 -0.81 118.68 126.06 1b8j s LEU 258 Ca 0.03 -2.12 0.24 0.00 -1.03 0.00 0.00 54.13 51.26 1b8j s LEU 258 Cb -0.16 -1.84 0.36 0.00 0.03 0.00 0.00 46.19 44.57 1b8j s LEU 258 CO 0.01 -0.54 1.32 0.49 0.23 0.00 0.00 176.35 177.87 1b8j n PHE 259 N 4.49 0.00 -3.63 0.29 3.72 0.24 -4.47 117.46 118.11 1b8j n PHE 259 Ca -0.01 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.29 1b8j n PHE 259 Cb 0.41 -0.04 -0.02 0.00 -0.94 0.00 0.00 39.48 38.89 1b8j n PHE 259 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1b8j s ALA 260 N -2.37 -1.43 -0.02 4.37 0.00 -1.26 -4.96 121.76 116.09 1b8j s ALA 260 Ca 0.24 0.12 -0.23 0.00 0.00 0.00 0.00 51.96 52.09 1b8j s ALA 260 Cb 0.19 0.86 -0.21 0.00 0.00 0.00 0.00 23.12 23.96 1b8j s ALA 260 CO 0.49 -0.90 1.13 -0.44 0.00 0.00 0.00 175.76 176.05 1b8j h ASP 261 N 2.00 0.29 0.00 0.00 5.19 -1.93 -1.35 116.42 120.62 1b8j h ASP 261 Ca -0.27 -0.68 0.00 0.00 -0.62 0.00 0.00 57.03 55.47 1b8j h ASP 261 Cb 1.28 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.70 1b8j h ASP 261 CO 0.31 0.93 0.00 0.61 -3.12 0.00 0.00 179.24 177.96 1b8j n GLY 262 N 0.78 1.33 3.83 2.75 0.00 -1.26 -2.09 105.19 110.53 1b8j n GLY 262 Ca -0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 1b8j n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1b8j s ASN 263 N 0.23 6.87 0.74 1.61 0.01 -1.26 -0.82 114.94 122.33 1b8j s ASN 263 Ca 0.00 1.52 -0.13 0.00 -0.71 0.00 0.00 52.86 53.54 1b8j s ASN 263 Cb 0.00 -2.47 0.05 0.00 0.41 0.00 0.00 41.25 39.24 1b8j s ASN 263 CO 0.00 -0.29 1.14 -0.04 -1.51 0.00 0.00 177.10 176.39 1b8j s MET 264 N -3.09 2.21 0.58 -0.60 -1.94 -0.27 -4.89 119.30 111.30 1b8j s MET 264 Ca 0.59 1.47 -0.21 0.00 -1.71 0.00 0.00 55.69 55.83 1b8j s MET 264 Cb -0.10 -1.87 -0.04 0.00 2.01 0.00 0.00 34.83 34.84 1b8j s MET 264 CO 0.15 -1.72 1.33 -1.25 -0.01 0.00 0.00 175.02 173.51 1b8j s PRO 265 N -4.31 2.98 0.38 2.03 0.04 -1.26 -4.96 135.00 129.90 1b8j s PRO 265 Ca 0.68 2.15 -0.23 0.00 0.04 0.00 0.00 61.00 63.64 1b8j s PRO 265 Cb -0.23 -2.12 -0.10 0.00 0.04 0.00 0.00 34.50 32.09 1b8j s PRO 265 CO 0.48 -1.29 0.93 0.14 0.04 0.00 0.00 177.00 177.31 1b8j s VAL 266 N -1.35 4.33 0.13 -0.36 -7.23 -1.26 -4.97 120.40 109.69 1b8j s VAL 266 Ca 0.75 1.60 -0.14 0.00 -1.81 0.00 0.00 61.98 62.38 1b8j s VAL 266 Cb -0.39 -3.77 -0.00 0.00 0.56 0.00 0.00 36.38 32.78 1b8j s VAL 266 CO 0.44 -0.11 1.61 -0.09 -0.31 0.00 0.00 175.10 176.64 1b8j h ARG 267 N 2.48 0.72 -6.02 4.82 2.43 -1.89 -3.42 114.38 113.50 1b8j h ARG 267 Ca -0.48 -0.20 -0.54 0.00 -0.81 0.00 0.00 59.98 57.95 1b8j h ARG 267 Cb 1.18 -0.08 -0.23 0.00 -0.42 0.00 0.00 29.97 30.42 1b8j h ARG 267 CO 0.63 0.76 -0.82 -1.58 -1.51 0.00 0.00 179.97 177.45 1b8j s TRP 268 N -5.16 1.71 0.19 2.20 0.51 -1.26 -0.07 118.94 117.05 1b8j s TRP 268 Ca -0.13 -0.40 0.08 0.00 -2.12 0.00 0.00 56.10 53.53 1b8j s TRP 268 Cb 0.10 -0.97 -0.04 0.00 -0.81 0.00 0.00 33.47 31.76 1b8j s TRP 268 CO 0.79 0.15 -0.04 -0.51 -0.51 0.00 0.00 176.95 176.83 1b8j s LEU 269 N -1.64 3.17 -0.05 2.99 1.43 0.80 -3.69 118.68 121.68 1b8j s LEU 269 Ca 0.06 -0.49 -0.31 0.00 -1.03 0.00 0.00 54.13 52.36 1b8j s LEU 269 Cb -0.10 -1.82 0.11 0.00 0.03 0.00 0.00 46.19 44.42 1b8j s LEU 269 CO 0.03 0.09 1.03 -0.83 0.23 0.00 0.00 176.35 176.90 1b8j s GLY 270 N -2.97 -0.38 0.79 -3.19 0.00 -1.26 -1.47 107.32 98.84 1b8j s GLY 270 Ca 0.27 1.10 -0.11 0.00 0.00 0.00 0.00 44.72 45.98 1b8j s GLY 270 CO 0.17 0.35 1.09 2.56 0.00 0.00 0.00 173.10 177.27 1b8j s PRO 271 N -2.85 2.12 0.52 2.90 0.04 -1.26 -4.91 135.00 131.55 1b8j s PRO 271 Ca 0.08 0.98 -0.18 0.00 0.04 0.00 0.00 61.00 61.91 1b8j s PRO 271 Cb -0.01 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 32.57 1b8j s PRO 271 CO -0.06 -1.68 1.03 0.21 0.04 0.00 0.00 177.00 176.53 1b8j s LYS 272 N -4.97 3.72 0.51 4.56 2.20 -1.26 -4.62 119.74 119.88 1b8j s LYS 272 Ca 0.61 1.23 -0.21 0.00 -0.36 0.00 0.00 55.97 57.24 1b8j s LYS 272 Cb -0.16 -2.09 -0.06 0.00 -1.51 0.00 0.00 37.83 34.00 1b8j s LYS 272 CO 0.56 -0.48 1.15 0.00 -0.36 0.00 0.00 175.35 176.22 1b8j s ALA 273 N -2.24 2.80 0.24 3.13 0.00 0.39 -5.01 121.76 121.08 1b8j s ALA 273 Ca 0.64 0.89 0.03 0.00 0.00 0.00 0.00 51.96 53.52 1b8j s ALA 273 Cb -0.14 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 1b8j s ALA 273 CO 0.26 -0.76 0.03 0.95 0.00 0.00 0.00 175.76 176.24 1b8j s THR 274 N -1.66 0.90 0.14 0.00 -4.23 -0.87 -4.69 115.64 105.22 1b8j s THR 274 Ca 0.69 -2.01 -0.31 0.00 -1.18 0.00 0.00 61.69 58.88 1b8j s THR 274 Cb -0.26 -2.44 -0.10 0.00 1.34 0.00 0.00 72.50 71.04 1b8j s THR 274 CO 0.31 -0.23 1.62 -0.47 -0.54 0.00 0.00 174.62 175.31 1b8j s TYR 275 N -3.51 2.80 -1.76 3.99 5.04 -1.26 -1.30 117.35 121.34 1b8j s TYR 275 Ca 0.31 0.47 0.00 0.00 -2.44 0.00 0.00 57.07 55.41 1b8j s TYR 275 Cb 0.07 -3.97 0.00 0.00 0.35 0.00 0.00 41.96 38.40 1b8j s TYR 275 CO 0.10 -3.73 0.00 0.72 -1.34 0.00 0.00 175.55 171.30 1b8j n HIS 276 N 4.56 -0.69 0.29 4.97 8.25 -1.26 -4.87 115.22 126.47 1b8j n HIS 276 Ca 0.15 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.78 1b8j n HIS 276 Cb 0.39 -3.48 0.89 0.00 1.12 0.00 0.00 29.99 28.90 1b8j n HIS 276 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1b8j h GLY 277 N 0.00 0.00 2.00 -1.41 0.00 -1.44 0.29 103.07 102.51 1b8j h GLY 277 Ca -0.42 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 1b8j h GLY 277 CO 0.54 0.00 -0.22 3.45 0.00 0.00 0.00 176.54 180.31 1b8j h ASN 278 N 0.00 0.00 0.00 0.19 -1.07 -1.83 -2.64 115.58 110.23 1b8j h ASN 278 Ca -0.00 0.00 -0.41 0.00 0.07 0.00 0.00 56.30 55.95 1b8j h ASN 278 Cb 0.25 0.00 -0.07 0.00 -2.07 0.00 0.00 38.32 36.44 1b8j h ASN 278 CO 0.01 0.22 -2.45 2.30 0.07 0.00 0.00 177.43 177.57 1b8j n ILE 279 N -3.19 1.44 0.13 6.14 -5.35 -0.63 -4.60 119.36 113.31 1b8j n ILE 279 Ca 0.02 -0.45 -0.01 0.00 -0.27 0.00 0.00 62.75 62.05 1b8j n ILE 279 Cb 0.57 -1.65 0.16 0.00 -1.74 0.00 0.00 39.64 36.98 1b8j n ILE 279 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 1b8j h ASP 280 N -0.53 0.00 -2.09 7.28 3.32 -0.63 -3.46 116.42 120.32 1b8j h ASP 280 Ca -0.62 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 55.84 1b8j h ASP 280 Cb 1.71 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 41.14 1b8j h ASP 280 CO -0.27 0.63 -0.68 -0.54 -1.72 0.00 0.00 179.24 176.66 1b8j s LYS 281 N -3.51 1.96 0.74 3.56 1.02 -0.99 -5.03 119.74 117.47 1b8j s LYS 281 Ca -0.01 -1.71 -0.11 0.00 0.02 0.00 0.00 55.97 54.17 1b8j s LYS 281 Cb 0.12 -1.90 0.03 0.00 -0.52 0.00 0.00 37.83 35.57 1b8j s LYS 281 CO 0.76 0.26 1.08 -1.25 -0.92 0.00 0.00 175.35 175.27 1b8j s PRO 282 N -3.62 2.58 0.47 -1.68 0.04 -1.26 -4.65 135.00 126.88 1b8j s PRO 282 Ca 0.32 1.04 -0.23 0.00 0.04 0.00 0.00 61.00 62.17 1b8j s PRO 282 Cb -0.03 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.50 1b8j s PRO 282 CO 0.18 -1.37 1.18 0.00 0.04 0.00 0.00 177.00 177.03 1b8j s ALA 283 N -2.98 2.96 -0.04 8.56 0.00 -1.26 -4.74 121.76 124.25 1b8j s ALA 283 Ca 0.60 0.97 -0.03 0.00 0.00 0.00 0.00 51.96 53.50 1b8j s ALA 283 Cb -0.15 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 1b8j s ALA 283 CO 0.55 -0.72 0.12 0.08 0.00 0.00 0.00 175.76 175.79 1b8j s VAL 284 N -1.52 5.06 -0.10 0.00 1.01 0.77 -4.81 120.40 120.82 1b8j s VAL 284 Ca 0.64 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.48 1b8j s VAL 284 Cb -0.30 -3.29 -0.00 0.00 0.00 0.00 0.00 36.38 32.79 1b8j s VAL 284 CO 0.36 0.43 -0.24 -0.89 0.00 0.00 0.00 175.10 174.76 1b8j s THR 285 N -1.17 2.08 0.52 3.92 2.01 -1.26 -0.85 115.64 120.90 1b8j s THR 285 Ca 0.21 -1.02 -0.19 0.00 0.31 0.00 0.00 61.69 61.00 1b8j s THR 285 Cb -0.12 -1.79 -0.07 0.00 0.01 0.00 0.00 72.50 70.53 1b8j s THR 285 CO 0.12 0.56 1.07 0.00 -0.69 0.00 0.00 174.62 175.68 1b8j s THR 287 N -1.98 1.83 0.44 0.00 -1.32 -0.54 -4.95 115.64 109.12 1b8j s THR 287 Ca 0.68 -0.92 -0.24 0.00 -1.21 0.00 0.00 61.69 60.00 1b8j s THR 287 Cb -0.18 -1.57 -0.09 0.00 -1.51 0.00 0.00 72.50 69.15 1b8j s THR 287 CO 0.24 0.51 1.10 -2.65 -2.21 0.00 0.00 174.62 171.61 1b8j n PRO 288 N 3.20 1.50 -2.45 7.08 -0.02 -1.26 -0.14 135.00 142.90 1b8j n PRO 288 Ca -0.18 0.54 -0.43 0.00 -2.02 0.00 0.00 63.50 61.41 1b8j n PRO 288 Cb 0.52 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.80 1b8j n PRO 288 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1b8j s ASN 289 N -0.74 6.82 0.45 2.55 2.47 0.90 -4.65 114.94 122.75 1b8j s ASN 289 Ca 0.64 1.39 0.31 0.00 0.42 0.00 0.00 52.86 55.62 1b8j s ASN 289 Cb -0.52 -2.54 1.46 0.00 -1.45 0.00 0.00 41.25 38.20 1b8j s ASN 289 CO 0.56 -0.92 1.93 1.55 -3.72 0.00 0.00 177.10 176.50 1b8j h PRO 290 N 8.68 0.00 -0.43 0.43 0.13 -1.89 -3.03 132.00 135.88 1b8j h PRO 290 Ca -0.25 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 1b8j h PRO 290 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1b8j h PRO 290 CO 1.01 0.00 0.03 0.00 -0.23 0.00 0.00 178.00 178.80 1b8j n GLN 291 N -2.68 3.72 0.05 0.86 10.64 -1.26 -4.44 117.38 124.27 1b8j n GLN 291 Ca -0.00 -3.01 -0.03 0.00 -1.83 0.00 0.00 57.00 52.12 1b8j n GLN 291 Cb 0.18 -2.05 0.19 0.00 -0.86 0.00 0.00 30.24 27.71 1b8j n GLN 291 CO 0.00 0.00 0.00 0.07 -1.83 0.00 0.00 177.06 175.30 1b8j h ARG 292 N 2.69 0.37 -0.11 2.61 0.11 -1.81 -3.47 114.38 114.77 1b8j h ARG 292 Ca 0.04 -0.17 0.00 0.00 0.10 0.00 0.00 59.98 59.95 1b8j h ARG 292 Cb 1.76 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.83 1b8j h ARG 292 CO 0.39 0.69 -0.03 -1.71 0.10 0.00 0.00 179.97 179.41 1b8j n ASN 293 N -4.05 -0.68 0.21 0.08 2.85 -1.26 -4.49 115.26 107.91 1b8j n ASN 293 Ca -0.01 0.05 0.12 0.00 -0.11 0.00 0.00 54.58 54.62 1b8j n ASN 293 Cb 0.47 0.83 0.19 0.00 1.24 0.00 0.00 39.78 42.50 1b8j n ASN 293 CO 0.00 0.00 0.00 -0.78 -2.11 0.00 0.00 177.26 174.37 1b8j h ASP 294 N 0.02 0.00 0.05 1.20 3.58 -1.95 -2.91 116.42 116.42 1b8j h ASP 294 Ca 0.00 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1b8j h ASP 294 Cb 0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 1b8j h ASP 294 CO 0.00 0.00 -0.55 -1.54 -2.88 0.00 0.00 179.24 174.27 1b8j n SER 295 N -3.02 1.60 -4.46 2.28 3.41 -1.26 -4.79 113.62 107.38 1b8j n SER 295 Ca 0.04 -1.26 -0.36 0.00 -0.26 0.00 0.00 58.87 57.03 1b8j n SER 295 Cb 0.52 0.51 -0.12 0.00 -0.26 0.00 0.00 64.21 64.86 1b8j n SER 295 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1b8j s VAL 296 N -2.61 4.25 0.52 -3.33 1.01 -1.10 -0.32 120.40 118.83 1b8j s VAL 296 Ca 0.17 -0.20 -0.19 0.00 0.00 0.00 0.00 61.98 61.76 1b8j s VAL 296 Cb 0.18 -2.96 -0.07 0.00 0.00 0.00 0.00 36.38 33.53 1b8j s VAL 296 CO 0.63 0.37 1.09 -2.16 0.00 0.00 0.00 175.10 175.03 1b8j s PRO 297 N 1.36 3.53 0.76 2.72 0.04 -1.26 -4.82 135.00 137.32 1b8j s PRO 297 Ca 0.05 1.48 -0.08 0.00 0.04 0.00 0.00 61.00 62.49 1b8j s PRO 297 Cb -0.15 -2.04 0.09 0.00 0.04 0.00 0.00 34.50 32.44 1b8j s PRO 297 CO 0.03 -0.68 1.07 0.95 0.04 0.00 0.00 177.00 178.41 1b8j s THR 298 N -1.91 2.19 0.34 1.26 -4.23 -1.26 -4.90 115.64 107.14 1b8j s THR 298 Ca 0.70 -0.25 0.04 0.00 -1.18 0.00 0.00 61.69 61.00 1b8j s THR 298 Cb -0.20 -2.95 0.17 0.00 1.34 0.00 0.00 72.50 70.87 1b8j s THR 298 CO 0.25 0.00 1.90 0.25 -0.54 0.00 0.00 174.62 176.47 1b8j h LEU 299 N -0.79 0.51 -0.42 4.79 5.85 -1.95 -0.90 115.31 122.40 1b8j h LEU 299 Ca -0.44 -0.08 -0.17 0.00 0.84 0.00 0.00 57.88 58.03 1b8j h LEU 299 Cb 1.30 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.19 1b8j h LEU 299 CO 0.55 0.55 -0.58 0.00 -0.34 0.00 0.00 178.44 178.61 1b8j h ALA 300 N 1.52 0.59 -0.14 1.25 0.00 -1.89 0.13 119.26 120.73 1b8j h ALA 300 Ca 0.12 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1b8j h ALA 300 Cb 0.27 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1b8j h ALA 300 CO 0.00 0.69 0.06 1.96 0.00 0.00 0.00 179.25 181.97 1b8j h GLN 301 N 0.49 0.20 -0.52 0.00 4.20 -1.75 0.12 115.11 117.85 1b8j h GLN 301 Ca 0.00 -0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.73 1b8j h GLN 301 Cb 1.15 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.85 1b8j h GLN 301 CO 0.12 0.26 0.25 0.52 -0.67 0.00 0.00 178.83 179.31 1b8j h MET 302 N 0.08 0.46 -0.49 1.46 2.86 -1.02 0.18 114.93 118.47 1b8j h MET 302 Ca 0.05 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 1b8j h MET 302 Cb 0.13 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.65 1b8j h MET 302 CO -0.01 0.31 0.27 1.15 1.06 0.00 0.00 176.91 179.69 1b8j h THR 303 N 0.48 1.01 -0.10 2.22 2.02 -0.52 0.15 112.91 118.16 1b8j h THR 303 Ca 0.24 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 67.23 1b8j h THR 303 Cb 0.17 0.43 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1b8j h THR 303 CO -0.18 0.10 0.05 0.44 0.37 0.00 0.00 175.52 176.30 1b8j h ASP 304 N 0.53 0.13 -0.54 4.18 3.32 0.07 0.14 116.42 124.25 1b8j h ASP 304 Ca 0.20 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 1b8j h ASP 304 Cb 0.07 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1b8j h ASP 304 CO -0.12 0.20 0.25 0.50 -1.72 0.00 0.00 179.24 178.35 1b8j h LYS 305 N 0.05 0.79 -0.28 3.56 1.63 -0.74 -0.35 116.57 121.23 1b8j h LYS 305 Ca 0.03 -0.12 0.03 0.00 -0.85 0.00 0.00 60.65 59.74 1b8j h LYS 305 Cb 0.10 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 31.56 1b8j h LYS 305 CO -0.00 0.66 0.10 0.00 -3.45 0.00 0.00 179.45 176.76 1b8j h ALA 306 N 1.09 0.32 -0.57 5.00 0.00 -0.50 -1.10 119.26 123.51 1b8j h ALA 306 Ca 0.19 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1b8j h ALA 306 Cb 0.14 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1b8j h ALA 306 CO -0.02 -0.30 0.37 0.82 0.00 0.00 0.00 179.25 180.12 1b8j h ILE 307 N 0.23 1.12 0.11 0.00 2.04 -0.61 0.71 117.51 121.10 1b8j h ILE 307 Ca 0.12 -0.26 0.01 0.00 1.00 0.00 0.00 64.86 65.74 1b8j h ILE 307 Cb 0.09 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1b8j h ILE 307 CO -0.12 0.14 -0.15 -0.08 0.00 0.00 0.00 178.15 177.93 1b8j h GLU 308 N 0.74 -0.30 -0.07 2.37 4.81 -0.51 -0.58 114.58 121.05 1b8j h GLU 308 Ca 0.22 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1b8j h GLU 308 Cb -0.05 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 1b8j h GLU 308 CO -0.06 -0.20 0.03 -0.07 -0.73 0.00 0.00 179.01 177.98 1b8j h LEU 309 N -0.31 0.09 -1.51 1.64 3.38 -0.88 -3.11 115.31 114.61 1b8j h LEU 309 Ca 0.02 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1b8j h LEU 309 Cb 0.31 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1b8j h LEU 309 CO -0.07 0.21 -0.13 -0.07 0.09 0.00 0.00 178.44 178.47 1b8j h LEU 310 N -0.04 0.00 0.00 1.67 3.38 -0.76 -2.79 115.31 116.77 1b8j h LEU 310 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1b8j h LEU 310 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1b8j h LEU 310 CO -0.00 0.13 0.00 -1.54 0.09 0.00 0.00 178.44 177.12 1b8j n SER 311 N -3.36 0.00 0.25 -0.43 3.41 -0.23 -3.22 113.62 110.04 1b8j n SER 311 Ca -0.00 -0.27 0.14 0.00 -0.26 0.00 0.00 58.87 58.48 1b8j n SER 311 Cb 0.33 -0.24 0.47 0.00 -0.26 0.00 0.00 64.21 64.51 1b8j n SER 311 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1b8j h LYS 312 N 0.00 0.00 -6.51 4.33 1.57 -1.60 -3.42 116.57 110.94 1b8j h LYS 312 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 1b8j h LYS 312 Cb 0.23 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.49 1b8j h LYS 312 CO 0.00 0.03 1.06 1.21 -0.57 0.00 0.00 179.45 181.18 1b8j s ASN 313 N -5.93 6.38 0.63 0.86 3.84 -1.20 -4.89 114.94 114.62 1b8j s ASN 313 Ca 0.03 0.88 0.40 0.00 0.21 0.00 0.00 52.86 54.38 1b8j s ASN 313 Cb 0.08 -2.54 2.11 0.00 -0.55 0.00 0.00 41.25 40.34 1b8j s ASN 313 CO 0.60 -1.39 2.27 -0.33 -2.79 0.00 0.00 177.10 175.46 1b8j h GLU 314 N 10.53 0.00 -0.03 0.43 4.39 -1.91 -2.19 114.58 125.80 1b8j h GLU 314 Ca -0.27 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.29 1b8j h GLU 314 Cb 1.10 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.74 1b8j h GLU 314 CO 1.08 0.01 -0.60 -0.22 -1.16 0.00 0.00 179.01 178.12 1b8j h LYS 315 N 0.00 0.11 0.00 2.33 1.63 -1.90 -3.50 116.57 115.24 1b8j h LYS 315 Ca -0.00 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 1b8j h LYS 315 Cb 0.13 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.77 1b8j h LYS 315 CO 0.00 0.67 0.00 0.41 -3.45 0.00 0.00 179.45 177.08 1b8j n GLY 316 N 0.21 0.90 3.41 5.01 0.00 -0.82 -4.94 105.19 108.95 1b8j n GLY 316 Ca -0.02 -2.28 -0.10 0.00 0.00 0.00 0.00 46.02 43.62 1b8j n GLY 316 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1b8j s PHE 317 N -1.00 -0.20 -0.09 1.61 -0.12 -1.22 -1.20 117.98 115.77 1b8j s PHE 317 Ca 0.00 -0.12 0.02 0.00 -0.05 0.00 0.00 56.93 56.78 1b8j s PHE 317 Cb 0.00 0.34 0.01 0.00 -0.63 0.00 0.00 43.02 42.74 1b8j s PHE 317 CO 0.00 -0.80 -0.16 0.12 -0.05 0.00 0.00 175.22 174.33 1b8j s PHE 318 N -3.83 1.92 -0.02 3.49 2.19 -0.54 -1.54 117.98 119.66 1b8j s PHE 318 Ca 0.05 -0.84 0.01 0.00 0.33 0.00 0.00 56.93 56.49 1b8j s PHE 318 Cb 0.00 -1.37 0.01 0.00 -1.31 0.00 0.00 43.02 40.35 1b8j s PHE 318 CO -0.08 -0.41 -0.04 -1.17 1.83 0.00 0.00 175.22 175.35 1b8j s LEU 319 N 0.79 1.66 -0.08 6.12 2.96 -0.50 -0.63 118.68 129.00 1b8j s LEU 319 Ca -0.11 -0.09 0.05 0.00 -0.22 0.00 0.00 54.13 53.76 1b8j s LEU 319 Cb -0.16 -0.31 -0.01 0.00 0.50 0.00 0.00 46.19 46.22 1b8j s LEU 319 CO 0.02 0.00 -0.24 -1.58 -1.32 0.00 0.00 176.35 173.23 1b8j s GLN 320 N 0.37 2.80 -0.10 1.98 0.74 -0.96 -0.92 119.66 123.57 1b8j s GLN 320 Ca -0.04 -0.88 0.03 0.00 0.05 0.00 0.00 55.36 54.51 1b8j s GLN 320 Cb -0.08 -2.25 0.01 0.00 1.10 0.00 0.00 33.01 31.80 1b8j s GLN 320 CO -0.00 0.30 -0.18 0.08 -0.55 0.00 0.00 175.29 174.93 1b8j s VAL 321 N 0.06 1.66 -0.12 1.34 1.01 0.58 -0.58 120.40 124.35 1b8j s VAL 321 Ca -0.10 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.15 1b8j s VAL 321 Cb -0.16 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.74 1b8j s VAL 321 CO 0.06 0.47 -0.22 -0.70 0.00 0.00 0.00 175.10 174.72 1b8j s GLU 322 N 0.73 3.10 -1.06 2.72 2.12 0.22 -0.73 118.70 125.80 1b8j s GLU 322 Ca -0.11 -0.84 -0.15 0.00 0.36 0.00 0.00 54.97 54.23 1b8j s GLU 322 Cb -0.16 -2.40 0.18 0.00 0.26 0.00 0.00 34.13 32.02 1b8j s GLU 322 CO 0.02 0.13 1.21 0.20 -0.54 0.00 0.00 175.26 176.27 1b8j s GLY 323 N 0.49 2.42 0.21 -1.50 0.00 0.63 -2.82 107.32 106.75 1b8j s GLY 323 Ca -0.14 -3.25 -0.07 0.00 0.00 0.00 0.00 44.72 41.26 1b8j s GLY 323 CO 0.05 1.83 1.67 0.00 0.00 0.00 0.00 173.10 176.65 1b8j h ALA 324 N 7.68 0.91 0.00 3.20 0.00 -1.91 -2.56 119.26 126.58 1b8j h ALA 324 Ca 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1b8j h ALA 324 Cb 0.94 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1b8j h ALA 324 CO 1.10 0.65 0.00 0.43 0.00 0.00 0.00 179.25 181.43 1b8j n SER 325 N -4.18 0.00 -0.01 0.00 7.64 -1.26 -3.56 113.62 112.25 1b8j n SER 325 Ca 0.03 -0.54 -0.10 0.00 1.01 0.00 0.00 58.87 59.27 1b8j n SER 325 Cb 0.34 -0.14 -0.04 0.00 -1.01 0.00 0.00 64.21 63.37 1b8j n SER 325 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1b8j h ILE 326 N 0.00 0.81 -0.19 0.44 2.04 -1.74 0.13 117.51 119.00 1b8j h ILE 326 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1b8j h ILE 326 Cb 0.13 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 1b8j h ILE 326 CO 0.00 0.00 0.10 -0.78 0.00 0.00 0.00 178.15 177.47 1b8j h ASP 327 N -0.05 0.24 -0.84 1.72 1.82 -0.68 -0.82 116.42 117.82 1b8j h ASP 327 Ca 0.07 -0.09 -0.02 0.00 -0.39 0.00 0.00 57.03 56.60 1b8j h ASP 327 Cb 0.15 -0.06 -0.04 0.00 0.68 0.00 0.00 39.33 40.06 1b8j h ASP 327 CO -0.15 0.26 0.45 0.11 -1.61 0.00 0.00 179.24 178.30 1b8j h LYS 328 N 0.20 1.17 0.00 0.28 1.57 -1.63 -0.47 116.57 117.68 1b8j h LYS 328 Ca 0.07 -0.14 -0.13 0.00 -1.87 0.00 0.00 60.65 58.57 1b8j h LYS 328 Cb 0.08 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1b8j h LYS 328 CO -0.01 0.87 -0.62 1.96 -0.57 0.00 0.00 179.45 181.08 1b8j h GLN 329 N 1.17 0.00 -0.43 3.15 1.08 -0.76 -0.92 115.11 118.40 1b8j h GLN 329 Ca 0.29 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.43 1b8j h GLN 329 Cb 0.04 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 1b8j h GLN 329 CO -0.05 0.62 0.03 0.22 -0.95 0.00 0.00 178.83 178.70 1b8j h ASP 330 N 0.00 0.73 -0.51 1.46 1.82 -0.77 -0.84 116.42 118.30 1b8j h ASP 330 Ca -0.01 -0.29 -0.04 0.00 -0.39 0.00 0.00 57.03 56.30 1b8j h ASP 330 Cb 1.17 -0.19 -0.03 0.00 0.68 0.00 0.00 39.33 40.96 1b8j h ASP 330 CO 0.08 0.84 0.17 0.45 -1.61 0.00 0.00 179.24 179.17 1b8j h HIS 331 N 0.59 0.86 0.00 0.28 3.86 -0.52 -1.55 115.15 118.67 1b8j h HIS 331 Ca 0.13 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1b8j h HIS 331 Cb 0.45 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.66 1b8j h HIS 331 CO 0.03 0.70 0.00 0.00 0.86 0.00 0.00 177.93 179.52 1b8j n ALA 332 N -2.46 2.21 -3.55 2.45 0.00 -0.40 -1.64 120.51 117.12 1b8j n ALA 332 Ca 0.04 -0.11 -0.23 0.00 0.00 0.00 0.00 53.44 53.15 1b8j n ALA 332 Cb 0.20 -1.40 0.08 0.00 0.00 0.00 0.00 19.45 18.33 1b8j n ALA 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1b8j n ALA 333 N -1.34 -1.35 -3.89 0.00 0.00 -0.51 -4.73 120.51 108.70 1b8j n ALA 333 Ca 0.10 0.35 -0.32 0.00 0.00 0.00 0.00 53.44 53.57 1b8j n ALA 333 Cb 0.22 -5.09 -0.13 0.00 0.00 0.00 0.00 19.45 14.45 1b8j n ALA 333 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1b8j s ASN 334 N -3.42 4.72 0.20 0.00 3.84 -0.44 -0.46 114.94 119.38 1b8j s ASN 334 Ca 0.51 -2.73 -0.14 0.00 0.21 0.00 0.00 52.86 50.71 1b8j s ASN 334 Cb -0.23 -1.71 0.20 0.00 -0.55 0.00 0.00 41.25 38.96 1b8j s ASN 334 CO 0.71 -0.32 1.65 -0.65 -2.79 0.00 0.00 177.10 175.70 1b8j h PRO 335 N 6.98 0.02 -0.41 0.43 0.11 -1.83 -1.64 132.00 135.66 1b8j h PRO 335 Ca -0.06 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 1b8j h PRO 335 Cb 0.94 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1b8j h PRO 335 CO 0.67 0.01 0.25 0.00 -0.21 0.00 0.00 178.00 178.72 1b8j h GLY 337 N 0.54 0.43 0.85 0.00 0.00 -1.56 0.41 103.07 103.74 1b8j h GLY 337 Ca 0.15 -0.18 0.02 0.00 0.00 0.00 0.00 47.33 47.31 1b8j h GLY 337 CO -0.03 0.18 0.07 -1.61 0.00 0.00 0.00 176.54 175.15 1b8j h GLN 338 N 0.38 0.16 -0.31 4.80 4.15 -1.02 -1.06 115.11 122.21 1b8j h GLN 338 Ca 0.11 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.42 1b8j h GLN 338 Cb 0.02 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 1b8j h GLN 338 CO -0.02 0.11 -0.17 0.82 -1.93 0.00 0.00 178.83 177.64 1b8j h ILE 339 N 0.16 1.29 -0.90 2.39 2.04 -0.42 -2.79 117.51 119.28 1b8j h ILE 339 Ca 0.08 -1.28 0.09 0.00 1.00 0.00 0.00 64.86 64.75 1b8j h ILE 339 Cb 0.05 1.46 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 1b8j h ILE 339 CO -0.08 0.41 0.55 1.23 0.00 0.00 0.00 178.15 180.26 1b8j h GLY 340 N 0.42 1.41 2.00 5.37 0.00 0.07 -1.25 103.07 111.08 1b8j h GLY 340 Ca 0.07 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.95 1b8j h GLY 340 CO 0.05 0.20 -0.33 0.83 0.00 0.00 0.00 176.54 177.28 1b8j h GLU 341 N 0.94 0.00 -0.07 4.80 4.39 -1.00 -1.15 114.58 122.48 1b8j h GLU 341 Ca 0.42 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.92 1b8j h GLU 341 Cb 0.32 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1b8j h GLU 341 CO -0.22 0.33 -0.79 1.15 -1.16 0.00 0.00 179.01 178.32 1b8j h THR 342 N 0.00 1.36 -0.70 1.13 2.02 -1.00 -2.11 112.91 113.61 1b8j h THR 342 Ca -0.00 -2.17 -0.07 0.00 0.77 0.00 0.00 66.41 64.94 1b8j h THR 342 Cb 0.66 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 69.19 1b8j h THR 342 CO 0.04 0.66 0.18 0.58 0.37 0.00 0.00 175.52 177.36 1b8j h VAL 343 N 0.32 1.26 -0.50 3.16 2.07 -0.92 -0.43 116.25 121.21 1b8j h VAL 343 Ca -0.05 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 1b8j h VAL 343 Cb 1.39 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1b8j h VAL 343 CO 0.14 0.37 0.26 -0.78 0.02 0.00 0.00 177.57 177.57 1b8j h ASP 344 N 1.05 0.64 -0.38 0.57 3.58 -1.20 -2.18 116.42 118.50 1b8j h ASP 344 Ca 0.22 -0.11 -0.08 0.00 0.42 0.00 0.00 57.03 57.48 1b8j h ASP 344 Cb 0.35 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.22 1b8j h ASP 344 CO -0.00 0.56 -0.04 0.25 -2.88 0.00 0.00 179.24 177.13 1b8j h LEU 345 N 0.66 0.77 -0.89 2.28 5.85 -1.05 -2.51 115.31 120.43 1b8j h LEU 345 Ca 0.17 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1b8j h LEU 345 Cb 0.08 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 1b8j h LEU 345 CO -0.03 0.87 0.56 -0.78 -0.34 0.00 0.00 178.44 178.73 1b8j h ASP 346 N 0.73 0.90 -0.63 1.25 3.58 -0.47 -0.75 116.42 121.04 1b8j h ASP 346 Ca 0.14 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.57 1b8j h ASP 346 Cb 0.51 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.35 1b8j h ASP 346 CO 0.03 0.59 0.29 -0.33 -2.88 0.00 0.00 179.24 176.93 1b8j h GLU 347 N 1.05 0.93 -0.69 0.28 5.08 -1.02 -0.89 114.58 119.31 1b8j h GLU 347 Ca 0.38 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.54 1b8j h GLU 347 Cb 0.12 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1b8j h GLU 347 CO -0.16 0.76 0.22 0.00 -1.00 0.00 0.00 179.01 178.83 1b8j h ALA 348 N 1.12 1.08 -0.64 3.43 0.00 -1.08 -2.32 119.26 120.86 1b8j h ALA 348 Ca 0.22 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1b8j h ALA 348 Cb 0.15 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1b8j h ALA 348 CO -0.02 0.63 0.18 0.28 0.00 0.00 0.00 179.25 180.31 1b8j h VAL 349 N 1.02 1.24 -0.49 0.00 2.07 -0.73 -1.14 116.25 118.23 1b8j h VAL 349 Ca 0.23 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.90 1b8j h VAL 349 Cb 0.28 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 1b8j h VAL 349 CO -0.01 0.33 0.31 1.56 0.02 0.00 0.00 177.57 179.78 1b8j h GLN 350 N 0.94 0.62 -0.18 1.57 4.20 -0.85 -0.43 115.11 120.99 1b8j h GLN 350 Ca 0.21 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.89 1b8j h GLN 350 Cb 0.30 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 1b8j h GLN 350 CO -0.01 0.41 0.09 0.00 -0.67 0.00 0.00 178.83 178.66 1b8j h ARG 351 N 0.64 0.19 -0.92 1.46 2.47 -0.85 -0.97 114.38 116.40 1b8j h ARG 351 Ca 0.18 -0.01 0.04 0.00 -1.26 0.00 0.00 59.98 58.93 1b8j h ARG 351 Cb -0.05 -0.04 -0.06 0.00 -1.65 0.00 0.00 29.97 28.17 1b8j h ARG 351 CO -0.05 0.13 0.60 0.00 0.56 0.00 0.00 179.97 181.20 1b8j h ALA 352 N 1.09 1.23 -0.15 0.04 0.00 -0.92 -2.21 119.26 118.34 1b8j h ALA 352 Ca 0.07 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 1b8j h ALA 352 Cb 0.01 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1b8j h ALA 352 CO -0.04 0.44 -0.46 -0.07 0.00 0.00 0.00 179.25 179.12 1b8j h LEU 353 N 1.14 0.41 0.22 0.00 3.38 -0.62 -1.38 115.31 118.47 1b8j h LEU 353 Ca 0.38 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1b8j h LEU 353 Cb 0.04 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1b8j h LEU 353 CO -0.13 0.82 -0.11 -0.33 0.09 0.00 0.00 178.44 178.78 1b8j h GLU 354 N 0.31 -0.28 -0.40 1.13 3.07 -0.70 -0.42 114.58 117.29 1b8j h GLU 354 Ca 0.02 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 58.95 1b8j h GLU 354 Cb 0.93 0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 28.86 1b8j h GLU 354 CO 0.08 -0.10 0.13 0.35 -1.40 0.00 0.00 179.01 178.07 1b8j h PHE 355 N -0.41 0.22 -0.57 4.33 3.57 -1.31 -2.37 116.94 120.40 1b8j h PHE 355 Ca -0.03 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1b8j h PHE 355 Cb 0.32 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 1b8j h PHE 355 CO -0.03 0.08 0.23 0.00 -2.23 0.00 0.00 178.31 176.36 1b8j h ALA 356 N 1.27 0.74 -0.78 2.41 0.00 -1.07 0.15 119.26 121.98 1b8j h ALA 356 Ca 0.19 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1b8j h ALA 356 Cb 0.19 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1b8j h ALA 356 CO -0.20 0.35 0.50 0.87 0.00 0.00 0.00 179.25 180.77 1b8j h LYS 357 N 0.78 0.97 0.09 0.00 1.57 -0.76 0.39 116.57 119.62 1b8j h LYS 357 Ca 0.19 -0.06 -0.28 0.00 -1.87 0.00 0.00 60.65 58.64 1b8j h LYS 357 Cb 0.20 -0.22 0.02 0.00 0.08 0.00 0.00 32.23 32.30 1b8j h LYS 357 CO -0.02 0.64 -1.17 1.57 -0.57 0.00 0.00 179.45 179.91 1b8j h LYS 358 N 1.00 0.51 -0.19 3.15 2.10 -1.11 -3.35 116.57 118.68 1b8j h LYS 358 Ca 0.30 -0.67 -0.16 0.00 -2.00 0.00 0.00 60.65 58.12 1b8j h LYS 358 Cb -0.05 0.22 0.00 0.00 -0.90 0.00 0.00 32.23 31.50 1b8j h LYS 358 CO -0.09 1.28 -0.50 1.49 -2.00 0.00 0.00 179.45 179.63 1b8j h GLU 359 N 0.23 0.68 0.00 0.07 4.22 -0.59 -3.48 114.58 115.71 1b8j h GLU 359 Ca -0.15 -0.47 0.00 0.00 0.08 0.00 0.00 59.36 58.82 1b8j h GLU 359 Cb 1.84 0.07 0.00 0.00 0.50 0.00 0.00 28.75 31.16 1b8j h GLU 359 CO 0.21 1.10 0.00 0.41 -2.18 0.00 0.00 179.01 178.55 1b8j n GLY 360 N 0.50 2.34 0.81 1.92 0.00 0.11 -4.82 105.19 106.05 1b8j n GLY 360 Ca -0.06 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.01 1b8j n GLY 360 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1b8j n ASN 361 N 0.00 1.54 -4.41 1.61 3.02 -1.26 -4.80 115.26 110.96 1b8j n ASN 361 Ca 0.00 -3.43 -0.33 0.00 -0.03 0.00 0.00 54.58 50.79 1b8j n ASN 361 Cb 0.00 -0.47 -0.14 0.00 -0.61 0.00 0.00 39.78 38.56 1b8j n ASN 361 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1b8j s THR 362 N -2.44 3.21 -0.25 3.41 2.01 -1.26 -0.16 115.64 120.16 1b8j s THR 362 Ca 0.37 -0.62 -0.14 0.00 0.31 0.00 0.00 61.69 61.62 1b8j s THR 362 Cb 0.37 -2.34 -0.04 0.00 0.01 0.00 0.00 72.50 70.50 1b8j s THR 362 CO -0.09 0.53 0.31 -0.22 -0.69 0.00 0.00 174.62 174.46 1b8j s LEU 363 N 0.14 4.08 -0.08 4.42 2.96 -0.80 -4.21 118.68 125.19 1b8j s LEU 363 Ca -0.06 0.27 0.01 0.00 -0.22 0.00 0.00 54.13 54.13 1b8j s LEU 363 Cb -0.15 -2.34 -0.03 0.00 0.50 0.00 0.00 46.19 44.18 1b8j s LEU 363 CO 0.04 -0.08 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.20 1b8j s VAL 364 N 1.62 3.43 -0.03 1.68 1.01 0.59 -1.46 120.40 127.24 1b8j s VAL 364 Ca 0.13 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1b8j s VAL 364 Cb -0.15 -2.40 0.01 0.00 0.00 0.00 0.00 36.38 33.83 1b8j s VAL 364 CO 0.08 0.57 -0.07 -0.63 0.00 0.00 0.00 175.10 175.05 1b8j s ILE 365 N -0.44 0.69 -0.09 2.22 1.01 -0.51 -0.53 121.20 123.55 1b8j s ILE 365 Ca 0.06 -0.28 0.02 0.00 0.00 0.00 0.00 60.65 60.45 1b8j s ILE 365 Cb -0.12 -0.64 0.01 0.00 0.01 0.00 0.00 42.46 41.72 1b8j s ILE 365 CO 0.02 0.23 -0.14 -0.69 0.00 0.00 0.00 174.94 174.37 1b8j s VAL 366 N 0.41 1.33 0.10 2.92 1.01 0.19 -0.72 120.40 125.64 1b8j s VAL 366 Ca -0.06 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.30 1b8j s VAL 366 Cb -0.10 -1.21 0.02 0.00 0.00 0.00 0.00 36.38 35.08 1b8j s VAL 366 CO 0.01 0.40 0.28 1.07 0.00 0.00 0.00 175.10 176.86 1b8j n THR 367 N 4.03 0.00 -4.39 3.92 5.66 -0.48 -2.15 114.28 120.86 1b8j n THR 367 Ca -0.20 -0.26 -0.20 0.00 -3.05 0.00 0.00 64.05 60.34 1b8j n THR 367 Cb 0.51 0.28 -0.10 0.00 -1.55 0.00 0.00 70.33 69.48 1b8j n THR 367 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1b8j s ALA 368 N -1.34 2.17 0.04 1.79 0.00 -1.26 -0.72 121.76 122.45 1b8j s ALA 368 Ca 0.06 -1.83 -0.08 0.00 0.00 0.00 0.00 51.96 50.11 1b8j s ALA 368 Cb -0.01 0.20 -0.31 0.00 0.00 0.00 0.00 23.12 23.00 1b8j s ALA 368 CO 0.03 -0.08 1.01 0.38 0.00 0.00 0.00 175.76 177.10 1b8j h ASP 369 N 2.37 0.55 -5.06 0.00 2.03 -1.93 -3.48 116.42 110.90 1b8j h ASP 369 Ca -0.39 -0.63 0.06 0.00 -0.73 0.00 0.00 57.03 55.34 1b8j h ASP 369 Cb 1.23 -0.18 -0.03 0.00 -0.83 0.00 0.00 39.33 39.51 1b8j h ASP 369 CO 0.66 1.50 0.30 -1.38 -1.03 0.00 0.00 179.24 179.29 1b8j s HIS 370 N -2.63 -0.06 0.76 4.15 -3.43 -1.26 -4.85 115.29 107.97 1b8j s HIS 370 Ca -0.07 -0.45 -0.06 0.00 -0.80 0.00 0.00 55.06 53.68 1b8j s HIS 370 Cb 0.06 0.75 0.12 0.00 -1.43 0.00 0.00 32.58 32.07 1b8j s HIS 370 CO 0.89 -1.28 1.06 0.00 -2.00 0.00 0.00 174.74 173.41 1b8j s ALA 371 N -3.20 3.23 0.00 -1.38 0.00 -1.19 -3.58 121.76 115.64 1b8j s ALA 371 Ca 0.13 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.74 1b8j s ALA 371 Cb -0.05 -2.35 0.00 0.00 0.00 0.00 0.00 23.12 20.72 1b8j s ALA 371 CO 0.08 -1.58 0.00 1.58 0.00 0.00 0.00 175.76 175.84 1b8j n HIS 372 N -3.03 0.00 0.02 0.00 -0.00 -1.25 -2.12 115.22 108.84 1b8j n HIS 372 Ca 0.12 0.00 -0.17 0.00 0.46 0.00 0.00 57.72 58.14 1b8j n HIS 372 Cb 0.60 0.00 -0.14 0.00 -0.12 0.00 0.00 29.99 30.33 1b8j n HIS 372 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1b8j h ALA 373 N 1.00 0.44 -2.44 1.57 0.00 -1.85 -3.38 119.26 114.60 1b8j h ALA 373 Ca 0.00 -1.29 -0.57 0.00 0.00 0.00 0.00 54.91 53.05 1b8j h ALA 373 Cb 0.00 0.48 0.09 0.00 0.00 0.00 0.00 17.79 18.35 1b8j h ALA 373 CO 0.00 1.30 0.65 -1.13 0.00 0.00 0.00 179.25 180.07 1b8j n SER 374 N -3.37 2.97 -4.19 0.00 3.41 -1.26 -4.67 113.62 106.50 1b8j n SER 374 Ca -0.22 1.15 -0.23 0.00 -0.26 0.00 0.00 58.87 59.32 1b8j n SER 374 Cb 1.05 -1.47 -0.14 0.00 -0.26 0.00 0.00 64.21 63.39 1b8j n SER 374 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1b8j s GLN 375 N -0.62 1.15 -0.33 4.33 -0.21 -0.02 -4.78 119.66 119.18 1b8j s GLN 375 Ca 0.66 -0.84 -0.20 0.00 0.02 0.00 0.00 55.36 55.00 1b8j s GLN 375 Cb -0.61 -1.21 -0.00 0.00 1.00 0.00 0.00 33.01 32.19 1b8j s GLN 375 CO 0.51 0.30 0.61 0.42 -2.12 0.00 0.00 175.29 175.01 1b8j s ILE 376 N -0.82 4.94 0.37 1.08 1.01 -1.26 -0.29 121.20 126.23 1b8j s ILE 376 Ca 0.04 0.67 0.08 0.00 0.00 0.00 0.00 60.65 61.44 1b8j s ILE 376 Cb -0.08 -4.01 -0.07 0.00 0.01 0.00 0.00 42.46 38.30 1b8j s ILE 376 CO 0.01 -0.21 -0.02 0.68 0.00 0.00 0.00 174.94 175.40 1b8j s VAL 377 N 2.60 1.99 0.63 2.92 -7.23 -0.69 -4.99 120.40 115.63 1b8j s VAL 377 Ca 0.24 -2.07 -0.18 0.00 -1.81 0.00 0.00 61.98 58.15 1b8j s VAL 377 Cb -0.15 -2.84 -0.02 0.00 0.56 0.00 0.00 36.38 33.94 1b8j s VAL 377 CO 0.13 -0.08 1.24 0.00 -0.31 0.00 0.00 175.10 176.07 1b8j n ALA 378 N -0.87 1.00 0.06 1.32 0.00 -1.26 -3.86 120.51 116.90 1b8j n ALA 378 Ca -0.05 0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.44 1b8j n ALA 378 Cb 0.66 -2.29 0.43 0.00 0.00 0.00 0.00 19.45 18.25 1b8j n ALA 378 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1b8j h PRO 379 N 0.58 0.41 -0.29 0.00 0.11 -1.93 -2.33 132.00 128.55 1b8j h PRO 379 Ca -0.50 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1b8j h PRO 379 Cb 1.34 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1b8j h PRO 379 CO 0.53 0.33 0.00 -0.40 -0.21 0.00 0.00 178.00 178.25 1b8j n ASP 380 N -4.43 1.62 -4.66 -2.05 5.75 -1.26 -4.83 116.55 106.69 1b8j n ASP 380 Ca 0.01 -1.95 -0.47 0.00 -0.01 0.00 0.00 54.79 52.37 1b8j n ASP 380 Cb 0.12 -0.19 -0.04 0.00 -1.03 0.00 0.00 41.12 39.97 1b8j n ASP 380 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1b8j n THR 381 N 0.37 0.02 -3.70 2.12 -1.04 -0.88 -4.96 114.28 106.21 1b8j n THR 381 Ca 0.11 -0.01 -0.38 0.00 -2.04 0.00 0.00 64.05 61.74 1b8j n THR 381 Cb 0.26 -1.43 -0.10 0.00 -1.82 0.00 0.00 70.33 67.24 1b8j n THR 381 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1b8j s LYS 382 N 0.82 2.19 0.15 -2.82 1.02 -1.26 -4.86 119.74 114.97 1b8j s LYS 382 Ca 0.79 -1.84 0.05 0.00 0.02 0.00 0.00 55.97 54.99 1b8j s LYS 382 Cb -0.72 -3.71 -0.04 0.00 -0.52 0.00 0.00 37.83 32.85 1b8j s LYS 382 CO 0.39 -1.12 0.11 0.00 -0.92 0.00 0.00 175.35 173.81 1b8j s ALA 383 N 1.15 3.52 0.01 5.17 0.00 -1.26 -5.02 121.76 125.32 1b8j s ALA 383 Ca 0.08 -1.19 0.32 0.00 0.00 0.00 0.00 51.96 51.17 1b8j s ALA 383 Cb -0.24 -1.33 1.33 0.00 0.00 0.00 0.00 23.12 22.88 1b8j s ALA 383 CO -0.03 0.55 1.94 -1.00 0.00 0.00 0.00 175.76 177.23 1b8j h PRO 384 N 2.64 0.00 0.00 0.00 0.13 -1.96 -3.42 132.00 129.39 1b8j h PRO 384 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1b8j h PRO 384 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1b8j h PRO 384 CO 0.63 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.81 1b8j n GLY 385 N -0.02 2.25 3.68 1.56 0.00 -1.26 -5.01 105.19 106.40 1b8j n GLY 385 Ca 0.01 -1.74 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 1b8j n GLY 385 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b8j s LEU 386 N 0.00 4.10 0.24 0.99 1.43 -0.57 -4.03 118.68 120.84 1b8j s LEU 386 Ca 0.00 0.15 0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1b8j s LEU 386 Cb 0.00 -2.08 -0.05 0.00 0.03 0.00 0.00 46.19 44.09 1b8j s LEU 386 CO 0.00 0.13 0.01 0.42 0.23 0.00 0.00 176.35 177.14 1b8j s THR 387 N 0.67 0.99 -0.26 5.49 -4.23 -0.42 -0.72 115.64 117.16 1b8j s THR 387 Ca 0.07 -2.03 -0.21 0.00 -1.18 0.00 0.00 61.69 58.35 1b8j s THR 387 Cb -0.12 -2.38 0.07 0.00 1.34 0.00 0.00 72.50 71.41 1b8j s THR 387 CO 0.01 -0.29 0.68 -1.58 -0.54 0.00 0.00 174.62 172.90 1b8j s GLN 388 N -3.88 0.76 -0.17 3.99 0.74 -0.78 -2.05 119.66 118.27 1b8j s GLN 388 Ca 0.29 1.03 -0.14 0.00 0.05 0.00 0.00 55.36 56.59 1b8j s GLN 388 Cb 0.06 0.30 -0.04 0.00 1.10 0.00 0.00 33.01 34.42 1b8j s GLN 388 CO 0.09 -0.12 0.32 0.00 -0.55 0.00 0.00 175.29 175.03 1b8j s ALA 389 N 0.81 3.58 0.05 1.58 0.00 -1.26 -1.27 121.76 125.24 1b8j s ALA 389 Ca -0.04 -0.48 0.08 0.00 0.00 0.00 0.00 51.96 51.53 1b8j s ALA 389 Cb -0.05 -2.45 -0.03 0.00 0.00 0.00 0.00 23.12 20.58 1b8j s ALA 389 CO -0.06 -0.02 -0.21 -0.51 0.00 0.00 0.00 175.76 174.96 1b8j s LEU 390 N 0.70 2.46 -0.45 0.00 1.43 0.91 -0.16 118.68 123.57 1b8j s LEU 390 Ca 0.17 -0.49 -0.21 0.00 -1.03 0.00 0.00 54.13 52.57 1b8j s LEU 390 Cb -0.13 -1.43 0.03 0.00 0.03 0.00 0.00 46.19 44.68 1b8j s LEU 390 CO 0.05 0.25 0.66 0.20 0.23 0.00 0.00 176.35 177.74 1b8j s ASN 391 N -1.42 6.32 0.79 2.29 0.02 -0.02 -1.15 114.94 121.77 1b8j s ASN 391 Ca 0.14 -0.37 -0.07 0.00 -1.02 0.00 0.00 52.86 51.54 1b8j s ASN 391 Cb -0.10 -2.32 0.14 0.00 0.02 0.00 0.00 41.25 38.98 1b8j s ASN 391 CO 0.04 -0.81 1.10 0.42 0.02 0.00 0.00 177.10 177.87 1b8j s THR 392 N 2.86 2.13 0.52 1.60 -4.23 -0.24 -4.82 115.64 113.46 1b8j s THR 392 Ca 0.23 -0.34 0.41 0.00 -1.18 0.00 0.00 61.69 60.81 1b8j s THR 392 Cb -0.14 -2.79 0.42 0.00 1.34 0.00 0.00 72.50 71.33 1b8j s THR 392 CO 0.19 0.00 2.27 0.50 -0.54 0.00 0.00 174.62 177.03 1b8j h LYS 393 N -0.88 0.00 0.00 3.99 3.64 -1.42 0.98 116.57 122.88 1b8j h LYS 393 Ca -0.41 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 1b8j h LYS 393 Cb 1.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 1b8j h LYS 393 CO 0.44 0.00 -0.16 -0.25 -2.27 0.00 0.00 179.45 177.20 1b8j n ASP 394 N -2.99 0.77 0.00 4.20 8.00 -1.26 -4.88 116.55 120.39 1b8j n ASP 394 Ca -0.02 0.45 0.00 0.00 0.71 0.00 0.00 54.79 55.93 1b8j n ASP 394 Cb 0.09 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 1b8j n ASP 394 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b8j n GLY 395 N 1.32 0.82 3.50 0.44 0.00 0.34 -5.05 105.19 106.55 1b8j n GLY 395 Ca 0.05 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.32 1b8j n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8j s ALA 396 N -2.00 2.61 -0.13 4.61 0.00 -1.26 -4.91 121.76 120.68 1b8j s ALA 396 Ca 0.00 -2.09 -0.06 0.00 0.00 0.00 0.00 51.96 49.81 1b8j s ALA 396 Cb 0.00 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 1b8j s ALA 396 CO 0.00 -0.17 0.09 0.14 0.00 0.00 0.00 175.76 175.82 1b8j s VAL 397 N -3.02 5.09 -0.06 0.00 -7.23 -1.26 -1.08 120.40 112.84 1b8j s VAL 397 Ca 0.34 0.06 0.06 0.00 -1.81 0.00 0.00 61.98 60.62 1b8j s VAL 397 Cb 0.07 -3.22 -0.01 0.00 0.56 0.00 0.00 36.38 33.78 1b8j s VAL 397 CO 0.15 0.57 -0.23 -0.32 -0.31 0.00 0.00 175.10 174.96 1b8j s MET 398 N -0.63 2.57 -0.17 4.82 0.00 -0.30 -4.87 119.30 120.72 1b8j s MET 398 Ca 0.12 -0.87 -0.06 0.00 0.00 0.00 0.00 55.69 54.88 1b8j s MET 398 Cb -0.12 -2.21 -0.04 0.00 0.00 0.00 0.00 34.83 32.47 1b8j s MET 398 CO 0.02 0.41 0.02 0.08 0.00 0.00 0.00 175.02 175.56 1b8j s VAL 399 N -0.23 4.43 0.06 10.11 1.01 -1.25 -0.06 120.40 134.48 1b8j s VAL 399 Ca -0.01 -0.16 0.05 0.00 0.00 0.00 0.00 61.98 61.85 1b8j s VAL 399 Cb -0.13 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1b8j s VAL 399 CO 0.03 0.48 -0.07 -0.04 0.00 0.00 0.00 175.10 175.50 1b8j s MET 400 N 0.29 2.35 -0.00 2.72 -1.94 -0.39 -1.70 119.30 120.63 1b8j s MET 400 Ca 0.01 -0.88 0.03 0.00 -1.71 0.00 0.00 55.69 53.14 1b8j s MET 400 Cb -0.13 -2.41 -0.01 0.00 2.01 0.00 0.00 34.83 34.29 1b8j s MET 400 CO 0.01 0.55 -0.08 0.45 -0.01 0.00 0.00 175.02 175.94 1b8j s SER 401 N -1.90 0.97 -0.27 3.03 0.15 0.60 -1.86 113.70 114.42 1b8j s SER 401 Ca 0.20 -0.18 0.01 0.00 0.70 0.00 0.00 55.95 56.68 1b8j s SER 401 Cb -0.11 -0.10 0.08 0.00 -1.71 0.00 0.00 66.02 64.18 1b8j s SER 401 CO 0.12 0.08 0.01 -0.31 1.20 0.00 0.00 173.24 174.34 1b8j s TYR 402 N -0.28 2.39 -0.04 3.44 1.51 0.10 -0.84 117.35 123.63 1b8j s TYR 402 Ca 0.02 -1.94 0.13 0.00 -1.01 0.00 0.00 57.07 54.28 1b8j s TYR 402 Cb -0.04 -1.84 0.25 0.00 -0.11 0.00 0.00 41.96 40.22 1b8j s TYR 402 CO -0.00 -0.83 1.11 0.41 -1.11 0.00 0.00 175.55 175.13 1b8j n GLY 403 N 4.66 1.84 1.12 0.71 0.00 -1.26 -1.51 105.19 110.75 1b8j n GLY 403 Ca -0.06 -0.62 0.08 0.00 0.00 0.00 0.00 46.02 45.42 1b8j n GLY 403 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1b8j n ASN 404 N -0.15 4.05 -3.64 1.61 0.23 -1.26 -4.85 115.26 111.25 1b8j n ASN 404 Ca 0.07 -2.56 -0.10 0.00 -0.53 0.00 0.00 54.58 51.46 1b8j n ASN 404 Cb 0.85 -0.48 -0.07 0.00 -2.08 0.00 0.00 39.78 38.00 1b8j n ASN 404 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1b8j s SER 405 N -1.28 -0.86 0.00 0.53 0.15 -1.26 -4.61 113.70 106.37 1b8j s SER 405 Ca 0.41 1.47 0.25 0.00 0.70 0.00 0.00 55.95 58.78 1b8j s SER 405 Cb 0.28 1.40 0.47 0.00 -1.71 0.00 0.00 66.02 66.46 1b8j s SER 405 CO 0.16 -0.24 1.39 -0.62 1.20 0.00 0.00 173.24 175.13 1b8j n GLU 406 N 3.68 0.96 0.00 5.44 1.02 -1.26 -4.87 120.64 125.62 1b8j n GLU 406 Ca -0.18 -0.67 0.00 0.00 -0.02 0.00 0.00 57.16 56.29 1b8j n GLU 406 Cb 0.57 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.51 1b8j n GLU 406 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1b8j n GLU 407 N -0.44 2.07 -0.08 3.49 -0.58 -1.26 -5.01 120.64 118.83 1b8j n GLU 407 Ca 0.11 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.71 1b8j n GLU 407 Cb 0.39 0.00 -0.14 0.00 -0.57 0.00 0.00 31.44 31.12 1b8j n GLU 407 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1b8j n ASP 408 N 0.00 1.14 -4.82 1.62 8.00 -1.26 -4.91 116.55 116.31 1b8j n ASP 408 Ca 0.00 0.04 -0.37 0.00 0.71 0.00 0.00 54.79 55.16 1b8j n ASP 408 Cb 0.00 0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 41.12 1b8j n ASP 408 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1b8j s SER 409 N -6.17 6.61 0.26 -2.24 0.15 -1.26 -4.85 113.70 106.20 1b8j s SER 409 Ca -0.20 0.73 -0.23 0.00 0.70 0.00 0.00 55.95 56.95 1b8j s SER 409 Cb 0.07 -2.19 -0.09 0.00 -1.71 0.00 0.00 66.02 62.11 1b8j s SER 409 CO 0.74 0.30 0.82 -1.10 1.20 0.00 0.00 173.24 175.19 1b8j s GLN 410 N -0.72 4.41 0.40 5.44 -1.52 -0.65 -4.76 119.66 122.25 1b8j s GLN 410 Ca 0.20 1.08 0.02 0.00 -1.95 0.00 0.00 55.36 54.71 1b8j s GLN 410 Cb -0.15 -2.87 -0.01 0.00 -0.22 0.00 0.00 33.01 29.76 1b8j s GLN 410 CO 0.09 0.36 0.58 -1.21 -0.25 0.00 0.00 175.29 174.86 1b8j s GLU 411 N -1.95 3.15 0.88 2.91 2.02 -1.26 -4.45 118.70 119.99 1b8j s GLU 411 Ca 0.45 -0.63 -0.12 0.00 0.02 0.00 0.00 54.97 54.70 1b8j s GLU 411 Cb -0.18 -2.66 0.12 0.00 0.10 0.00 0.00 34.13 31.51 1b8j s GLU 411 CO 0.22 -0.09 1.09 -1.01 0.02 0.00 0.00 175.26 175.49 1b8j s HIS 412 N -2.39 2.39 0.18 1.61 3.76 -1.26 -2.86 115.29 116.72 1b8j s HIS 412 Ca 0.46 1.24 0.00 0.00 -0.15 0.00 0.00 55.06 56.61 1b8j s HIS 412 Cb -0.10 -3.16 -0.04 0.00 1.11 0.00 0.00 32.58 30.39 1b8j s HIS 412 CO 0.35 -2.30 0.06 0.95 -0.85 0.00 0.00 174.74 172.95 1b8j s THR 413 N -2.97 0.34 -2.10 1.30 -4.23 -0.90 -4.84 115.64 102.24 1b8j s THR 413 Ca 0.63 -1.96 0.23 0.00 -1.18 0.00 0.00 61.69 59.41 1b8j s THR 413 Cb -0.17 -2.24 0.61 0.00 1.34 0.00 0.00 72.50 72.03 1b8j s THR 413 CO 0.56 -0.31 1.52 0.61 -0.54 0.00 0.00 174.62 176.46 1b8j n GLY 414 N -0.23 2.34 3.70 3.99 0.00 -1.26 -3.18 105.19 110.55 1b8j n GLY 414 Ca -0.04 -0.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.76 1b8j n GLY 414 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1b8j n SER 415 N 1.65 2.95 -4.67 1.61 2.88 -1.26 -4.83 113.62 111.96 1b8j n SER 415 Ca 0.24 1.18 -0.31 0.00 -1.33 0.00 0.00 58.87 58.65 1b8j n SER 415 Cb 0.63 -1.49 0.17 0.00 -0.75 0.00 0.00 64.21 62.76 1b8j n SER 415 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1b8j s GLN 416 N -1.30 0.97 0.23 -1.46 -2.07 -1.26 -4.45 119.66 110.32 1b8j s GLN 416 Ca 0.60 1.41 -0.10 0.00 -1.82 0.00 0.00 55.36 55.45 1b8j s GLN 416 Cb -0.58 -1.73 -0.01 0.00 -1.09 0.00 0.00 33.01 29.60 1b8j s GLN 416 CO 0.57 -2.62 0.39 -0.48 -1.32 0.00 0.00 175.29 171.83 1b8j s LEU 417 N -6.58 0.55 0.39 2.60 0.05 -0.99 -4.90 118.68 109.81 1b8j s LEU 417 Ca 0.66 -1.02 -0.27 0.00 0.05 0.00 0.00 54.13 53.55 1b8j s LEU 417 Cb -0.22 1.42 -0.10 0.00 -2.05 0.00 0.00 46.19 45.24 1b8j s LEU 417 CO 0.58 -1.05 1.40 -0.60 -0.55 0.00 0.00 176.35 176.13 1b8j s ARG 418 N -4.04 4.05 -0.01 1.48 3.52 -1.26 -1.40 118.95 121.29 1b8j s ARG 418 Ca 0.25 2.39 0.03 0.00 -0.13 0.00 0.00 55.73 58.26 1b8j s ARG 418 Cb 0.01 -2.89 -0.01 0.00 -1.56 0.00 0.00 34.95 30.51 1b8j s ARG 418 CO 0.09 -0.51 -0.08 -1.50 -0.81 0.00 0.00 175.30 172.49 1b8j s ILE 419 N -1.17 0.67 -0.00 4.11 2.07 -0.75 -4.32 121.20 121.80 1b8j s ILE 419 Ca 0.54 -0.36 -0.03 0.00 -1.41 0.00 0.00 60.65 59.40 1b8j s ILE 419 Cb -0.43 -0.56 -0.00 0.00 0.13 0.00 0.00 42.46 41.59 1b8j s ILE 419 CO 0.57 0.19 0.06 0.00 -1.91 0.00 0.00 174.94 173.85 1b8j s ALA 420 N -0.16 -0.13 0.20 1.50 0.00 -0.91 -0.61 121.76 121.65 1b8j s ALA 420 Ca 0.03 -0.15 -0.09 0.00 0.00 0.00 0.00 51.96 51.74 1b8j s ALA 420 Cb -0.04 0.04 -0.01 0.00 0.00 0.00 0.00 23.12 23.11 1b8j s ALA 420 CO -0.00 -0.13 0.34 0.00 0.00 0.00 0.00 175.76 175.96 1b8j s ALA 421 N -0.90 0.09 -0.10 0.00 0.00 -0.22 -0.63 121.76 120.01 1b8j s ALA 421 Ca -0.10 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 50.77 1b8j s ALA 421 Cb -0.06 1.04 0.03 0.00 0.00 0.00 0.00 23.12 24.13 1b8j s ALA 421 CO 0.00 -0.72 0.25 -0.47 0.00 0.00 0.00 175.76 174.82 1b8j s TYR 422 N -4.02 -0.30 0.00 0.00 5.04 0.30 -2.99 117.35 115.39 1b8j s TYR 422 Ca 0.23 0.71 0.00 0.00 -2.44 0.00 0.00 57.07 55.57 1b8j s TYR 422 Cb 0.02 0.08 0.00 0.00 0.35 0.00 0.00 41.96 42.41 1b8j s TYR 422 CO 0.06 -0.17 0.00 0.41 -1.34 0.00 0.00 175.55 174.51 1b8j n GLY 423 N 3.38 -0.42 3.69 8.97 0.00 -1.26 -0.30 105.19 119.24 1b8j n GLY 423 Ca -0.17 -2.26 -0.44 0.00 0.00 0.00 0.00 46.02 43.15 1b8j n GLY 423 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b8j n PRO 424 N -0.39 2.18 -0.98 1.61 -0.04 -1.26 -2.51 135.00 133.61 1b8j n PRO 424 Ca 0.00 0.78 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 1b8j n PRO 424 Cb 0.00 -2.47 0.00 0.00 -0.04 0.00 0.00 33.50 30.99 1b8j n PRO 424 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1b8j n HIS 425 N 2.09 0.00 0.35 0.54 8.25 0.08 -4.59 115.22 121.93 1b8j n HIS 425 Ca 0.11 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.71 1b8j n HIS 425 Cb 0.32 -0.69 0.57 0.00 1.12 0.00 0.00 29.99 31.31 1b8j n HIS 425 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1b8j h ALA 426 N 0.00 1.00 -0.02 -1.41 0.00 -1.74 -2.39 119.26 114.70 1b8j h ALA 426 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1b8j h ALA 426 Cb 0.31 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1b8j h ALA 426 CO 0.00 0.00 0.02 0.00 0.00 0.00 0.00 179.25 179.27 1b8j h ALA 427 N 2.18 1.53 0.00 0.00 0.00 -1.89 -2.59 119.26 118.48 1b8j h ALA 427 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b8j h ALA 427 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1b8j h ALA 427 CO 0.00 -0.03 0.00 0.09 0.00 0.00 0.00 179.25 179.31 1b8j n ASN 428 N -3.81 0.00 -0.16 0.00 3.02 -0.90 -2.54 115.26 110.88 1b8j n ASN 428 Ca -0.03 -1.12 0.06 0.00 -0.03 0.00 0.00 54.58 53.47 1b8j n ASN 428 Cb 0.11 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.25 1b8j n ASN 428 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1b8j n VAL 429 N -0.74 0.00 -2.77 2.41 0.24 -0.98 -5.00 118.33 111.50 1b8j n VAL 429 Ca 0.09 -0.30 -0.37 0.00 -2.04 0.00 0.00 64.34 61.71 1b8j n VAL 429 Cb 0.04 1.08 -0.06 0.00 -1.47 0.00 0.00 33.84 33.43 1b8j n VAL 429 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1b8j s VAL 430 N -1.82 4.18 0.00 3.34 1.01 -1.05 -3.25 120.40 122.81 1b8j s VAL 430 Ca 0.08 1.79 0.00 0.00 0.00 0.00 0.00 61.98 63.85 1b8j s VAL 430 Cb 0.10 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.49 1b8j s VAL 430 CO 0.39 0.13 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1b8j n GLY 431 N 0.53 -1.70 3.74 4.51 0.00 -1.25 -4.78 105.19 106.23 1b8j n GLY 431 Ca 0.02 -1.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 1b8j n GLY 431 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1b8j s LEU 432 N 0.00 4.32 0.27 0.99 2.96 -1.26 -2.19 118.68 123.77 1b8j s LEU 432 Ca 0.00 0.85 0.02 0.00 -0.22 0.00 0.00 54.13 54.78 1b8j s LEU 432 Cb 0.00 -2.68 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 1b8j s LEU 432 CO 0.00 0.07 0.17 0.42 -1.32 0.00 0.00 176.35 175.68 1b8j s THR 433 N 0.28 0.18 0.23 3.68 -4.23 -0.87 -5.00 115.64 109.89 1b8j s THR 433 Ca 0.25 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.84 1b8j s THR 433 Cb -0.15 -2.52 -0.04 0.00 1.34 0.00 0.00 72.50 71.13 1b8j s THR 433 CO 0.11 0.00 0.06 -0.62 -0.54 0.00 0.00 174.62 173.63 1b8j s ASP 434 N -3.30 4.94 0.49 3.99 2.15 -1.26 -1.50 116.67 122.18 1b8j s ASP 434 Ca 0.38 -0.43 0.19 0.00 0.43 0.00 0.00 52.55 53.12 1b8j s ASP 434 Cb 0.05 -1.09 1.23 0.00 -0.30 0.00 0.00 42.92 42.81 1b8j s ASP 434 CO 0.17 0.02 2.03 -0.61 -0.17 0.00 0.00 175.17 176.61 1b8j h GLN 435 N 2.07 0.15 0.00 4.34 4.15 -1.38 -0.16 115.11 124.28 1b8j h GLN 435 Ca -0.46 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1b8j h GLN 435 Cb 1.23 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.88 1b8j h GLN 435 CO 0.60 0.10 0.00 1.79 -1.93 0.00 0.00 178.83 179.39 1b8j h THR 436 N 0.16 0.00 0.00 2.39 1.35 -1.85 -1.62 112.91 113.34 1b8j h THR 436 Ca 0.20 -0.58 -0.04 0.00 -0.55 0.00 0.00 66.41 65.43 1b8j h THR 436 Cb 0.58 1.53 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 1b8j h THR 436 CO -0.03 0.00 -0.21 0.44 -0.25 0.00 0.00 175.52 175.47 1b8j h ASP 437 N 0.00 0.00 -0.97 5.36 3.32 -1.34 -2.77 116.42 120.02 1b8j h ASP 437 Ca 0.00 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.06 1b8j h ASP 437 Cb 0.65 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.15 1b8j h ASP 437 CO 0.00 0.21 0.64 0.25 -1.72 0.00 0.00 179.24 178.62 1b8j h LEU 438 N 0.00 1.10 0.12 1.55 5.85 -1.33 0.83 115.31 123.43 1b8j h LEU 438 Ca -0.00 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1b8j h LEU 438 Cb 0.56 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1b8j h LEU 438 CO 0.03 0.79 -0.06 0.15 -0.34 0.00 0.00 178.44 179.01 1b8j h PHE 439 N 1.30 -0.15 -0.79 1.25 3.57 -1.50 -1.61 116.94 119.01 1b8j h PHE 439 Ca 0.36 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.82 1b8j h PHE 439 Cb -0.13 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 38.63 1b8j h PHE 439 CO -0.00 -0.05 0.35 1.88 -2.23 0.00 0.00 178.31 178.26 1b8j h TYR 440 N -0.21 1.15 -0.42 0.41 0.05 -1.43 0.01 116.97 116.53 1b8j h TYR 440 Ca -0.02 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.69 1b8j h TYR 440 Cb 0.16 -0.35 -0.02 0.00 1.01 0.00 0.00 36.73 37.53 1b8j h TYR 440 CO -0.06 0.85 0.22 1.15 -1.05 0.00 0.00 178.16 179.27 1b8j h THR 441 N 1.13 1.17 -0.21 -2.88 2.02 -0.61 -1.00 112.91 112.53 1b8j h THR 441 Ca 0.27 -0.46 -0.15 0.00 0.77 0.00 0.00 66.41 66.83 1b8j h THR 441 Cb 0.15 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 1b8j h THR 441 CO -0.03 0.18 -0.51 0.24 0.37 0.00 0.00 175.52 175.77 1b8j h MET 442 N 0.55 0.57 -0.40 6.66 2.86 -1.07 -0.37 114.93 123.73 1b8j h MET 442 Ca 0.15 -0.34 -0.05 0.00 -2.06 0.00 0.00 59.70 57.40 1b8j h MET 442 Cb 0.09 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 1b8j h MET 442 CO -0.02 0.95 0.06 -0.22 1.06 0.00 0.00 176.91 178.74 1b8j h LYS 443 N 0.45 0.67 -0.31 1.72 3.64 -0.91 -2.11 116.57 119.72 1b8j h LYS 443 Ca 0.02 -0.18 -0.09 0.00 -1.27 0.00 0.00 60.65 59.13 1b8j h LYS 443 Cb 1.05 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1b8j h LYS 443 CO 0.10 0.72 -0.14 0.00 -2.27 0.00 0.00 179.45 177.86 1b8j h ALA 444 N 0.92 0.44 -0.78 5.00 0.00 -1.09 -1.20 119.26 122.56 1b8j h ALA 444 Ca 0.12 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1b8j h ALA 444 Cb 0.38 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1b8j h ALA 444 CO 0.01 0.33 0.50 0.00 0.00 0.00 0.00 179.25 180.09 1b8j h ALA 445 N 0.77 1.01 0.00 0.00 0.00 -1.00 -0.58 119.26 119.46 1b8j h ALA 445 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1b8j h ALA 445 Cb 0.66 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1b8j h ALA 445 CO 0.04 0.34 0.00 1.28 0.00 0.00 0.00 179.25 180.91 1b8j n LEU 446 N -4.58 0.03 -0.59 0.00 4.77 -0.80 -1.20 117.00 114.63 1b8j n LEU 446 Ca 0.08 0.50 -0.06 0.00 -0.03 0.00 0.00 56.01 56.51 1b8j n LEU 446 Cb 0.06 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 40.64 1b8j n LEU 446 CO 0.34 -0.01 -0.07 0.61 -1.33 0.00 0.00 177.39 176.94 1b8j n GLY 447 N 1.49 0.52 3.81 -0.72 0.00 -0.23 -4.90 105.19 105.16 1b8j n GLY 447 Ca 0.07 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 1b8j n GLY 447 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b8j s LEU 448 N -1.60 3.49 0.00 0.99 1.43 -0.54 -5.01 118.68 117.45 1b8j s LEU 448 Ca 0.00 1.75 0.17 0.00 -1.03 0.00 0.00 54.13 55.02 1b8j s LEU 448 Cb 0.00 -4.52 0.14 0.00 0.03 0.00 0.00 46.19 41.83 1b8j s LEU 448 CO 0.00 -1.07 1.04 0.29 0.23 0.00 0.00 176.35 176.84