#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q3s n ILE 11 N 0.00 1.04 -3.70 1.55 0.00 -1.26 -5.00 119.36 111.99 1q3s n ILE 11 Ca 0.00 0.29 -0.16 0.00 0.00 0.00 0.00 62.75 62.88 1q3s n ILE 11 Cb 0.00 -2.14 -0.15 0.00 0.00 0.00 0.00 39.64 37.34 1q3s n ILE 11 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1q3s s LEU 12 N -7.19 0.25 0.06 9.51 0.20 -1.26 -5.13 118.68 115.11 1q3s s LEU 12 Ca -0.12 0.31 -0.14 0.00 0.69 0.00 0.00 54.13 54.87 1q3s s LEU 12 Cb 0.02 0.30 -0.08 0.00 -0.43 0.00 0.00 46.19 46.00 1q3s s LEU 12 CO 0.18 -0.21 0.31 -2.65 -0.29 0.00 0.00 176.35 173.70 1q3s n PRO 13 N 4.88 0.00 -1.91 0.98 -0.02 -1.26 -4.95 135.00 132.73 1q3s n PRO 13 Ca -0.13 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.05 1q3s n PRO 13 Cb 0.50 -0.51 0.06 0.00 -0.02 0.00 0.00 33.50 33.53 1q3s n PRO 13 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1q3s s GLU 14 N -0.28 2.56 -1.43 -0.52 4.04 -1.26 -3.70 118.70 118.12 1q3s s GLU 14 Ca 0.32 0.33 0.00 0.00 0.04 0.00 0.00 54.97 55.66 1q3s s GLU 14 Cb -0.46 -2.01 0.00 0.00 0.02 0.00 0.00 34.13 31.69 1q3s s GLU 14 CO 0.25 -1.21 0.00 0.41 -1.84 0.00 0.00 175.26 172.86 1q3s n GLY 15 N -3.10 0.58 3.06 -3.83 0.00 -1.26 -4.60 105.19 96.04 1q3s n GLY 15 Ca 0.07 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 1q3s n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q3s s THR 16 N -2.66 1.84 0.40 2.61 2.01 -1.24 -2.78 115.64 115.81 1q3s s THR 16 Ca 0.00 -0.94 0.03 0.00 0.31 0.00 0.00 61.69 61.09 1q3s s THR 16 Cb 0.00 -1.76 -0.01 0.00 0.01 0.00 0.00 72.50 70.74 1q3s s THR 16 CO 0.00 0.37 0.59 -1.10 -0.69 0.00 0.00 174.62 173.79 1q3s s GLN 17 N 1.35 3.12 -0.16 4.92 1.11 0.09 -4.96 119.66 125.12 1q3s s GLN 17 Ca 0.02 -0.66 -0.26 0.00 0.01 0.00 0.00 55.36 54.47 1q3s s GLN 17 Cb -0.14 -2.66 0.07 0.00 -1.01 0.00 0.00 33.01 29.26 1q3s s GLN 17 CO -0.10 -0.11 0.67 0.50 0.01 0.00 0.00 175.29 176.25 1q3s s ARG 18 N -4.40 0.90 0.04 2.91 3.52 -1.26 -1.93 118.95 118.73 1q3s s ARG 18 Ca 0.46 0.62 0.01 0.00 -0.13 0.00 0.00 55.73 56.68 1q3s s ARG 18 Cb -0.10 0.43 -0.03 0.00 -1.56 0.00 0.00 34.95 33.70 1q3s s ARG 18 CO 0.35 -0.20 -0.05 0.71 -0.81 0.00 0.00 175.30 175.31 1q3s s TYR 19 N -0.35 0.49 0.06 5.12 1.51 -0.98 -4.97 117.35 118.23 1q3s s TYR 19 Ca -0.05 -0.61 -0.01 0.00 -1.01 0.00 0.00 57.07 55.39 1q3s s TYR 19 Cb -0.03 -0.32 -0.04 0.00 -0.11 0.00 0.00 41.96 41.47 1q3s s TYR 19 CO 0.05 -0.17 -0.03 0.08 -1.11 0.00 0.00 175.55 174.37 1q3s s VAL 20 N -1.90 0.29 0.00 0.71 1.01 -1.26 -1.70 120.40 117.56 1q3s s VAL 20 Ca -0.09 -1.84 0.00 0.00 0.00 0.00 0.00 61.98 60.05 1q3s s VAL 20 Cb -0.07 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.73 1q3s s VAL 20 CO -0.02 -0.94 0.00 0.61 0.00 0.00 0.00 175.10 174.75 1q3s n GLY 21 N 0.07 1.93 0.06 4.51 0.00 -0.91 -1.91 105.19 108.94 1q3s n GLY 21 Ca -0.13 0.32 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 1q3s n GLY 21 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1q3s h ARG 22 N 0.00 -0.02 -0.32 1.61 2.43 -1.99 -1.19 114.38 114.90 1q3s h ARG 22 Ca 0.00 0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1q3s h ARG 22 Cb 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.51 1q3s h ARG 22 CO 0.00 -0.01 -0.25 -0.44 -1.51 0.00 0.00 179.97 177.76 1q3s h ASP 23 N -0.02 -0.87 -0.32 -3.80 5.19 -1.78 0.50 116.42 115.31 1q3s h ASP 23 Ca 0.02 0.12 0.03 0.00 -0.62 0.00 0.00 57.03 56.59 1q3s h ASP 23 Cb 0.07 0.37 -0.05 0.00 0.18 0.00 0.00 39.33 39.90 1q3s h ASP 23 CO -0.12 -0.13 -0.33 0.00 -3.12 0.00 0.00 179.24 175.54 1q3s h ALA 24 N -0.53 -0.52 -0.97 3.45 0.00 -1.25 0.65 119.26 120.10 1q3s h ALA 24 Ca 0.05 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.01 1q3s h ALA 24 Cb 0.21 1.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 1q3s h ALA 24 CO -0.34 -0.69 0.64 1.96 0.00 0.00 0.00 179.25 180.81 1q3s h GLN 25 N -0.18 1.21 0.22 0.00 4.20 -0.98 -1.44 115.11 118.15 1q3s h GLN 25 Ca 0.05 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 1q3s h GLN 25 Cb 0.32 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1q3s h GLN 25 CO -0.40 0.80 -0.11 -0.09 -0.67 0.00 0.00 178.83 178.36 1q3s h ARG 26 N 1.24 -0.29 0.03 1.46 9.65 0.80 -0.55 114.38 126.72 1q3s h ARG 26 Ca 0.38 0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 59.28 1q3s h ARG 26 Cb -0.02 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.62 1q3s h ARG 26 CO -0.11 -0.19 -0.01 -0.07 2.80 0.00 0.00 179.97 182.38 1q3s h LEU 27 N -0.30 -0.03 -0.13 3.80 3.38 -0.75 -1.32 115.31 119.96 1q3s h LEU 27 Ca -0.03 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 57.84 1q3s h LEU 27 Cb 0.23 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1q3s h LEU 27 CO 0.05 0.13 -0.26 0.78 0.09 0.00 0.00 178.44 179.23 1q3s h ASN 28 N -0.19 -0.79 -0.91 -0.43 -0.26 -1.23 0.45 115.58 112.21 1q3s h ASN 28 Ca -0.00 0.13 0.03 0.00 -0.56 0.00 0.00 56.30 55.89 1q3s h ASN 28 Cb 0.18 0.35 -0.05 0.00 -1.06 0.00 0.00 38.32 37.74 1q3s h ASN 28 CO 0.01 -0.30 0.60 0.40 -1.06 0.00 0.00 177.43 177.07 1q3s h ILE 29 N -0.32 1.17 0.28 2.81 2.04 -1.04 -0.83 117.51 121.62 1q3s h ILE 29 Ca 0.10 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 1q3s h ILE 29 Cb 0.47 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.46 1q3s h ILE 29 CO -0.32 0.21 -0.13 0.25 0.00 0.00 0.00 178.15 178.16 1q3s h LEU 30 N 1.16 -0.32 -0.64 1.44 5.85 -0.20 0.39 115.31 123.00 1q3s h LEU 30 Ca 0.36 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 59.08 1q3s h LEU 30 Cb -0.02 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.03 1q3s h LEU 30 CO -0.10 -0.12 0.30 0.00 -0.34 0.00 0.00 178.44 178.18 1q3s h ALA 31 N 0.18 0.86 0.34 1.25 0.00 -0.70 0.59 119.26 121.78 1q3s h ALA 31 Ca -0.04 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1q3s h ALA 31 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1q3s h ALA 31 CO 0.06 -0.09 -0.18 0.00 0.00 0.00 0.00 179.25 179.04 1q3s h ALA 32 N 1.39 -0.48 -0.90 0.00 0.00 -0.98 -2.67 119.26 115.62 1q3s h ALA 32 Ca 0.31 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.21 1q3s h ALA 32 Cb 0.32 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.25 1q3s h ALA 32 CO -0.26 -0.77 0.59 0.00 0.00 0.00 0.00 179.25 178.81 1q3s h ARG 33 N -0.48 0.93 0.26 0.00 3.08 -0.30 -1.91 114.38 115.95 1q3s h ARG 33 Ca -0.04 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.95 1q3s h ARG 33 Cb 0.38 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1q3s h ARG 33 CO 0.06 0.61 -0.19 0.82 -1.07 0.00 0.00 179.97 180.21 1q3s h ILE 34 N 0.95 0.60 -0.26 2.04 2.04 -0.68 -1.30 117.51 120.90 1q3s h ILE 34 Ca 0.41 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.30 1q3s h ILE 34 Cb 0.32 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1q3s h ILE 34 CO -0.17 0.00 0.05 0.40 0.00 0.00 0.00 178.15 178.43 1q3s h ILE 35 N -0.45 0.87 -0.80 -0.67 1.08 -1.18 -1.55 117.51 114.82 1q3s h ILE 35 Ca -0.02 -0.05 0.09 0.00 -0.39 0.00 0.00 64.86 64.49 1q3s h ILE 35 Cb 0.39 0.71 -0.07 0.00 -3.07 0.00 0.00 36.82 34.78 1q3s h ILE 35 CO -0.00 0.03 0.45 0.00 -0.69 0.00 0.00 178.15 177.94 1q3s h ALA 36 N 1.19 1.12 0.00 1.87 0.00 -1.17 -0.96 119.26 121.32 1q3s h ALA 36 Ca 0.12 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1q3s h ALA 36 Cb 0.13 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1q3s h ALA 36 CO -0.16 0.09 0.00 0.93 0.00 0.00 0.00 179.25 180.11 1q3s h GLU 37 N 0.78 0.00 -0.01 0.00 5.08 -0.80 -2.39 114.58 117.23 1q3s h GLU 37 Ca 0.38 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.62 1q3s h GLU 37 Cb 0.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1q3s h GLU 37 CO -0.23 0.00 -0.53 1.15 -1.00 0.00 0.00 179.01 178.39 1q3s h THR 38 N 0.00 1.38 0.00 1.13 2.02 -0.16 -3.30 112.91 113.98 1q3s h THR 38 Ca 0.00 -1.82 -0.04 0.00 0.77 0.00 0.00 66.41 65.32 1q3s h THR 38 Cb 0.67 1.97 -0.01 0.00 -1.74 0.00 0.00 68.15 69.04 1q3s h THR 38 CO 0.00 0.52 -1.99 1.33 0.37 0.00 0.00 175.52 175.75 1q3s n VAL 39 N -3.91 0.13 0.29 3.16 0.24 -1.10 -4.42 118.33 112.72 1q3s n VAL 39 Ca -0.01 -0.51 0.19 0.00 -2.04 0.00 0.00 64.34 61.97 1q3s n VAL 39 Cb 0.54 -0.03 1.03 0.00 -1.47 0.00 0.00 33.84 33.92 1q3s n VAL 39 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 1q3s h ARG 40 N 0.00 0.00 0.00 7.34 0.11 -1.51 0.22 114.38 120.54 1q3s h ARG 40 Ca -0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.03 1q3s h ARG 40 Cb 1.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.16 1q3s h ARG 40 CO 0.00 0.00 0.00 0.25 0.10 0.00 0.00 179.97 180.32 1q3s n THR 41 N -2.83 0.34 0.23 0.08 -2.24 -1.26 -2.60 114.28 105.99 1q3s n THR 41 Ca -0.02 0.08 0.03 0.00 -2.27 0.00 0.00 64.05 61.87 1q3s n THR 41 Cb 0.06 -0.78 0.03 0.00 -2.10 0.00 0.00 70.33 67.55 1q3s n THR 41 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1q3s n THR 42 N -1.22 0.09 -2.29 4.28 -2.24 0.06 0.11 114.28 113.08 1q3s n THR 42 Ca 0.10 -0.54 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 1q3s n THR 42 Cb 0.13 1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 69.40 1q3s n THR 42 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1q3s s LEU 43 N -0.56 4.39 0.00 3.22 2.96 -1.07 -4.34 118.68 123.29 1q3s s LEU 43 Ca 0.08 2.24 0.00 0.00 -0.22 0.00 0.00 54.13 56.22 1q3s s LEU 43 Cb 0.05 -3.59 0.00 0.00 0.50 0.00 0.00 46.19 43.15 1q3s s LEU 43 CO 0.08 -0.53 0.00 0.61 -1.32 0.00 0.00 176.35 175.19 1q3s n GLY 44 N 2.97 -0.63 0.25 7.98 0.00 -1.26 -3.49 105.19 111.01 1q3s n GLY 44 Ca 0.08 -1.75 0.06 0.00 0.00 0.00 0.00 46.02 44.41 1q3s n GLY 44 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1q3s h PRO 45 N 0.00 0.11 -0.02 1.61 0.11 -1.77 -2.69 132.00 129.34 1q3s h PRO 45 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 1q3s h PRO 45 Cb 0.00 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.09 1q3s h PRO 45 CO 0.00 0.16 -0.14 1.63 -0.21 0.00 0.00 178.00 179.44 1q3s n LYS 46 N -4.43 1.87 -0.91 1.05 4.76 -1.26 -4.75 118.16 114.48 1q3s n LYS 46 Ca -0.02 -1.48 -0.33 0.00 -2.87 0.00 0.00 58.31 53.62 1q3s n LYS 46 Cb 0.15 -1.47 0.14 0.00 -1.84 0.00 0.00 35.03 32.01 1q3s n LYS 46 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q3s n GLY 47 N 1.34 -0.52 3.99 0.72 0.00 -1.02 -4.73 105.19 104.98 1q3s n GLY 47 Ca 0.13 -0.60 -0.25 0.00 0.00 0.00 0.00 46.02 45.31 1q3s n GLY 47 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1q3s s MET 48 N -4.15 1.35 0.36 1.61 -1.94 0.12 -4.86 119.30 111.78 1q3s s MET 48 Ca 0.68 -1.16 0.08 0.00 -1.71 0.00 0.00 55.69 53.59 1q3s s MET 48 Cb -0.26 -2.26 -0.05 0.00 2.01 0.00 0.00 34.83 34.27 1q3s s MET 48 CO 0.56 -1.72 0.08 -0.51 -0.01 0.00 0.00 175.02 173.43 1q3s s ASP 49 N -4.83 4.36 0.02 3.03 1.01 -1.26 -4.39 116.67 114.61 1q3s s ASP 49 Ca 0.69 -0.96 0.05 0.00 0.71 0.00 0.00 52.55 53.04 1q3s s ASP 49 Cb -0.04 -0.57 -0.02 0.00 1.01 0.00 0.00 42.92 43.30 1q3s s ASP 49 CO 0.46 -0.32 -0.14 -0.54 0.21 0.00 0.00 175.17 174.84 1q3s s LYS 50 N -3.79 0.99 -0.34 8.23 1.02 -0.74 -4.98 119.74 120.13 1q3s s LYS 50 Ca 0.37 -0.67 -0.08 0.00 0.02 0.00 0.00 55.97 55.61 1q3s s LYS 50 Cb 0.00 -0.99 0.03 0.00 -0.52 0.00 0.00 37.83 36.36 1q3s s LYS 50 CO 0.21 0.25 0.13 1.41 -0.92 0.00 0.00 175.35 176.43 1q3s s MET 51 N -0.88 2.73 -0.35 1.68 -2.45 -1.26 -2.15 119.30 116.63 1q3s s MET 51 Ca 0.03 -1.11 -0.12 0.00 -1.25 0.00 0.00 55.69 53.23 1q3s s MET 51 Cb -0.07 -3.52 -0.01 0.00 1.25 0.00 0.00 34.83 32.48 1q3s s MET 51 CO 0.01 -0.65 0.23 -0.51 1.05 0.00 0.00 175.02 175.15 1q3s s LEU 52 N 1.45 4.54 -0.54 4.11 1.43 0.27 -4.96 118.68 124.98 1q3s s LEU 52 Ca -0.00 -0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 52.42 1q3s s LEU 52 Cb -0.19 -2.11 0.13 0.00 0.03 0.00 0.00 46.19 44.05 1q3s s LEU 52 CO 0.04 -0.26 0.48 -0.69 0.23 0.00 0.00 176.35 176.15 1q3s s VAL 53 N 1.69 5.05 0.48 -1.59 1.01 -1.26 -1.65 120.40 124.14 1q3s s VAL 53 Ca 0.05 -1.57 -0.23 0.00 0.00 0.00 0.00 61.98 60.23 1q3s s VAL 53 Cb -0.18 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 31.87 1q3s s VAL 53 CO 0.10 -0.86 1.11 -0.67 0.00 0.00 0.00 175.10 174.78 1q3s n ASP 54 N 5.16 1.66 0.02 3.32 4.64 0.11 -4.86 116.55 126.60 1q3s n ASP 54 Ca -0.12 0.99 0.20 0.00 -1.38 0.00 0.00 54.79 54.48 1q3s n ASP 54 Cb 0.40 -1.43 0.71 0.00 -1.04 0.00 0.00 41.12 39.77 1q3s n ASP 54 CO 0.00 0.00 0.00 0.77 -0.82 0.00 0.00 177.20 177.15 1q3s h SER 55 N 1.40 0.00 -0.11 1.67 4.64 -1.97 0.31 113.55 119.49 1q3s h SER 55 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1q3s h SER 55 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1q3s h SER 55 CO 0.56 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.70 1q3s n LEU 56 N -4.22 0.75 0.00 5.97 4.77 -1.26 -4.87 117.00 118.15 1q3s n LEU 56 Ca 0.09 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 1q3s n LEU 56 Cb 0.60 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1q3s n LEU 56 CO 0.35 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1q3s n GLY 57 N 0.61 1.62 3.73 -0.72 0.00 0.11 -5.03 105.19 105.51 1q3s n GLY 57 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1q3s n GLY 57 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1q3s n ASP 58 N 0.00 3.36 -4.15 1.61 -0.08 -1.22 -4.72 116.55 111.35 1q3s n ASP 58 Ca 0.00 1.18 -0.33 0.00 -1.51 0.00 0.00 54.79 54.13 1q3s n ASP 58 Cb 0.00 -1.54 -0.16 0.00 2.34 0.00 0.00 41.12 41.76 1q3s n ASP 58 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 1q3s s ILE 59 N -0.53 2.06 -0.16 5.18 1.09 -1.26 0.05 121.20 127.63 1q3s s ILE 59 Ca 0.60 -0.96 0.00 0.00 -1.10 0.00 0.00 60.65 59.19 1q3s s ILE 59 Cb -0.54 -1.83 0.02 0.00 -1.06 0.00 0.00 42.46 39.05 1q3s s ILE 59 CO 0.55 0.55 -0.14 -0.69 -0.10 0.00 0.00 174.94 175.11 1q3s s VAL 60 N 0.99 1.61 -0.32 2.92 1.01 -0.66 -4.99 120.40 120.96 1q3s s VAL 60 Ca -0.03 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.22 1q3s s VAL 60 Cb -0.15 -1.53 0.05 0.00 0.00 0.00 0.00 36.38 34.75 1q3s s VAL 60 CO -0.06 0.42 0.04 -0.69 0.00 0.00 0.00 175.10 174.82 1q3s s VAL 61 N 1.46 3.25 0.17 2.92 1.01 -1.26 -0.57 120.40 127.39 1q3s s VAL 61 Ca 0.04 -1.34 -0.06 0.00 0.00 0.00 0.00 61.98 60.62 1q3s s VAL 61 Cb -0.13 -2.88 -0.02 0.00 0.00 0.00 0.00 36.38 33.35 1q3s s VAL 61 CO -0.11 -0.16 0.22 0.28 0.00 0.00 0.00 175.10 175.33 1q3s s THR 62 N 1.29 0.06 -0.65 3.92 -1.32 -0.91 -4.89 115.64 113.13 1q3s s THR 62 Ca -0.03 -1.63 0.14 0.00 -1.21 0.00 0.00 61.69 58.96 1q3s s THR 62 Cb -0.20 -2.04 -0.15 0.00 -1.51 0.00 0.00 72.50 68.60 1q3s s THR 62 CO -0.00 -0.26 0.59 -3.20 -2.21 0.00 0.00 174.62 169.54 1q3s n ASN 63 N -0.21 0.68 -4.66 8.08 5.15 -1.26 -1.79 115.26 121.24 1q3s n ASN 63 Ca -0.05 -0.82 -0.43 0.00 -0.60 0.00 0.00 54.58 52.69 1q3s n ASN 63 Cb 0.64 1.01 -0.02 0.00 -0.53 0.00 0.00 39.78 40.87 1q3s n ASN 63 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1q3s s ASP 64 N -2.34 6.85 0.08 1.20 2.15 -1.26 -4.94 116.67 118.41 1q3s s ASP 64 Ca 0.05 1.82 -0.22 0.00 0.43 0.00 0.00 52.55 54.62 1q3s s ASP 64 Cb 0.11 -2.54 -0.14 0.00 -0.30 0.00 0.00 42.92 40.05 1q3s s ASP 64 CO 0.58 -0.83 1.65 0.00 -0.17 0.00 0.00 175.17 176.39 1q3s h ALA 66 N 0.91 0.90 -0.41 0.00 0.00 -1.92 0.84 119.26 119.59 1q3s h ALA 66 Ca 0.02 0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1q3s h ALA 66 Cb 0.11 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1q3s h ALA 66 CO -0.00 -0.19 -0.34 1.15 0.00 0.00 0.00 179.25 179.87 1q3s h THR 67 N 0.44 1.27 0.44 0.00 2.02 -1.94 -2.49 112.91 112.66 1q3s h THR 67 Ca 0.35 -1.51 -0.02 0.00 0.77 0.00 0.00 66.41 66.00 1q3s h THR 67 Cb 0.47 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1q3s h THR 67 CO -0.34 0.51 -0.21 0.40 0.37 0.00 0.00 175.52 176.24 1q3s h ILE 68 N 0.79 0.46 -0.58 3.11 2.04 -0.35 -0.46 117.51 122.51 1q3s h ILE 68 Ca 0.07 -0.47 0.13 0.00 1.00 0.00 0.00 64.86 65.60 1q3s h ILE 68 Cb 0.93 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1q3s h ILE 68 CO 0.09 0.07 0.40 -0.07 0.00 0.00 0.00 178.15 178.64 1q3s h LEU 69 N -0.91 0.19 0.11 1.44 3.38 -0.96 -0.38 115.31 118.19 1q3s h LEU 69 Ca -0.06 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1q3s h LEU 69 Cb 0.57 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1q3s h LEU 69 CO 0.10 0.11 -0.05 -0.78 0.09 0.00 0.00 178.44 177.90 1q3s h ASP 70 N 0.21 -0.13 -0.53 -0.43 1.82 -1.34 -3.36 116.42 112.67 1q3s h ASP 70 Ca 0.28 -0.45 -0.06 0.00 -0.39 0.00 0.00 57.03 56.41 1q3s h ASP 70 Cb 0.81 0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.83 1q3s h ASP 70 CO -0.05 0.47 0.08 0.11 -1.61 0.00 0.00 179.24 178.25 1q3s h LYS 71 N -0.83 0.87 -6.73 0.28 1.79 -0.70 -3.43 116.57 107.82 1q3s h LYS 71 Ca -0.02 -0.23 -0.53 0.00 -2.18 0.00 0.00 60.65 57.69 1q3s h LYS 71 Cb 0.56 -0.10 0.07 0.00 -1.58 0.00 0.00 32.23 31.18 1q3s h LYS 71 CO 0.02 0.85 0.95 0.42 -1.08 0.00 0.00 179.45 180.62 1q3s s ILE 72 N -5.20 2.05 -0.83 1.86 1.01 -0.18 -4.90 121.20 115.02 1q3s s ILE 72 Ca -0.13 0.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.33 1q3s s ILE 72 Cb 0.12 -3.03 0.06 0.00 0.01 0.00 0.00 42.46 39.62 1q3s s ILE 72 CO 0.81 0.00 1.23 -0.62 0.00 0.00 0.00 174.94 176.37 1q3s s ASP 73 N 0.85 6.32 0.10 3.58 3.68 -1.26 -4.91 116.67 125.03 1q3s s ASP 73 Ca 0.69 -1.08 -0.26 0.00 2.13 0.00 0.00 52.55 54.04 1q3s s ASP 73 Cb -0.49 -2.51 -0.06 0.00 -1.45 0.00 0.00 42.92 38.41 1q3s s ASP 73 CO 0.40 -1.55 0.80 -0.76 0.13 0.00 0.00 175.17 174.19 1q3s s LEU 74 N 4.71 4.51 -0.16 -1.34 1.43 -1.26 -4.99 118.68 121.58 1q3s s LEU 74 Ca 0.35 1.57 -0.14 0.00 -1.03 0.00 0.00 54.13 54.88 1q3s s LEU 74 Cb -0.07 -3.31 -0.06 0.00 0.03 0.00 0.00 46.19 42.77 1q3s s LEU 74 CO 0.03 0.07 -0.30 0.00 0.23 0.00 0.00 176.35 176.39 1q3s n GLN 75 N 2.38 0.46 -1.68 1.70 1.13 -1.26 -4.93 117.38 115.18 1q3s n GLN 75 Ca -0.03 0.19 -0.46 0.00 -1.94 0.00 0.00 57.00 54.76 1q3s n GLN 75 Cb 0.49 -1.30 -0.04 0.00 0.11 0.00 0.00 30.24 29.51 1q3s n GLN 75 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 1q3s n HIS 76 N -4.24 2.36 -0.14 1.08 -0.00 -1.26 -4.87 115.22 108.15 1q3s n HIS 76 Ca -0.21 0.18 -0.04 0.00 0.46 0.00 0.00 57.72 58.11 1q3s n HIS 76 Cb 0.55 -2.59 0.04 0.00 -0.12 0.00 0.00 29.99 27.87 1q3s n HIS 76 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1q3s h PRO 77 N 6.62 0.28 -0.04 1.57 0.11 -1.99 -1.60 132.00 136.94 1q3s h PRO 77 Ca -0.45 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.65 1q3s h PRO 77 Cb 1.25 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 1q3s h PRO 77 CO 0.91 0.18 0.03 0.00 -0.21 0.00 0.00 178.00 178.91 1q3s h ALA 78 N 1.31 2.01 0.01 -0.75 0.00 -1.89 -1.22 119.26 118.73 1q3s h ALA 78 Ca 0.21 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.90 1q3s h ALA 78 Cb 0.23 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1q3s h ALA 78 CO -0.24 -0.05 -0.95 0.00 0.00 0.00 0.00 179.25 178.01 1q3s h ALA 79 N 1.98 0.38 -0.00 0.00 0.00 -1.56 -3.11 119.26 116.95 1q3s h ALA 79 Ca 0.02 -0.73 -0.07 0.00 0.00 0.00 0.00 54.91 54.13 1q3s h ALA 79 Cb 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1q3s h ALA 79 CO -0.00 0.85 -0.34 0.87 0.00 0.00 0.00 179.25 180.63 1q3s h LYS 80 N 0.19 0.01 0.00 0.00 1.57 -0.70 -1.49 116.57 116.15 1q3s h LYS 80 Ca -0.07 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.65 1q3s h LYS 80 Cb 1.59 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.89 1q3s h LYS 80 CO 0.16 0.35 -0.25 0.52 -0.57 0.00 0.00 179.45 179.66 1q3s h MET 81 N 0.01 0.00 0.00 3.15 2.86 -1.28 -0.73 114.93 118.94 1q3s h MET 81 Ca -0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1q3s h MET 81 Cb 0.60 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.26 1q3s h MET 81 CO 0.04 0.25 -0.06 0.52 1.06 0.00 0.00 176.91 178.72 1q3s h MET 82 N 0.00 0.00 -0.38 1.72 2.86 -1.27 -2.07 114.93 115.80 1q3s h MET 82 Ca -0.00 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 1q3s h MET 82 Cb 0.53 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1q3s h MET 82 CO 0.03 0.06 -0.32 0.28 1.06 0.00 0.00 176.91 178.03 1q3s h VAL 83 N 0.00 1.28 -0.06 -2.22 2.07 -1.12 -2.54 116.25 113.66 1q3s h VAL 83 Ca -0.00 -1.49 0.02 0.00 0.82 0.00 0.00 66.70 66.05 1q3s h VAL 83 Cb 0.53 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1q3s h VAL 83 CO 0.01 0.49 0.05 -0.33 0.02 0.00 0.00 177.57 177.81 1q3s h GLU 84 N 0.69 0.00 0.51 1.57 5.08 -1.32 0.54 114.58 121.65 1q3s h GLU 84 Ca 0.07 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1q3s h GLU 84 Cb 0.90 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.16 1q3s h GLU 84 CO 0.08 0.00 -0.25 0.28 -1.00 0.00 0.00 179.01 178.13 1q3s h VAL 85 N 0.00 0.44 -0.24 3.13 2.07 -1.35 -0.49 116.25 119.80 1q3s h VAL 85 Ca 0.03 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1q3s h VAL 85 Cb 0.13 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1q3s h VAL 85 CO -0.00 0.04 -0.00 0.00 0.02 0.00 0.00 177.57 177.63 1q3s h ALA 86 N -0.50 1.55 -0.65 1.67 0.00 -1.44 -1.06 119.26 118.83 1q3s h ALA 86 Ca -0.07 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1q3s h ALA 86 Cb 0.60 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1q3s h ALA 86 CO 0.12 0.33 0.29 -0.22 0.00 0.00 0.00 179.25 179.76 1q3s h LYS 87 N 0.35 0.96 0.02 0.00 1.63 -0.72 0.09 116.57 118.90 1q3s h LYS 87 Ca 0.08 -0.16 -0.22 0.00 -0.85 0.00 0.00 60.65 59.50 1q3s h LYS 87 Cb 0.24 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.70 1q3s h LYS 87 CO 0.01 0.79 -0.95 1.15 -3.45 0.00 0.00 179.45 177.00 1q3s h THR 88 N 0.91 1.48 -0.38 1.00 2.02 -0.56 -2.85 112.91 114.53 1q3s h THR 88 Ca 0.22 -2.66 -0.16 0.00 0.77 0.00 0.00 66.41 64.59 1q3s h THR 88 Cb 0.16 2.53 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 1q3s h THR 88 CO -0.02 0.78 -0.38 -0.61 0.37 0.00 0.00 175.52 175.66 1q3s h GLN 89 N 0.13 0.92 0.00 6.66 5.75 -1.04 -2.69 115.11 124.84 1q3s h GLN 89 Ca -0.06 -0.48 -0.08 0.00 -0.15 0.00 0.00 58.65 57.88 1q3s h GLN 89 Cb 1.59 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 30.15 1q3s h GLN 89 CO 0.15 1.13 -0.37 0.22 -2.65 0.00 0.00 178.83 177.31 1q3s h ASP 90 N 0.75 0.00 -0.25 -0.69 3.58 -1.00 -0.58 116.42 118.23 1q3s h ASP 90 Ca 0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1q3s h ASP 90 Cb 0.97 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.02 1q3s h ASP 90 CO 0.09 0.37 0.00 1.17 -2.88 0.00 0.00 179.24 178.00 1q3s n LYS 91 N -3.87 2.02 0.00 0.28 4.81 -1.08 -3.16 118.16 117.16 1q3s n LYS 91 Ca -0.01 -1.53 0.00 0.00 -0.87 0.00 0.00 58.31 55.89 1q3s n LYS 91 Cb 0.44 -1.43 0.00 0.00 0.02 0.00 0.00 35.03 34.05 1q3s n LYS 91 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1q3s n GLU 92 N 0.76 2.21 0.00 1.64 -0.58 -1.02 -4.88 120.64 118.78 1q3s n GLU 92 Ca 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 1q3s n GLU 92 Cb 0.43 -0.68 0.00 0.00 -0.57 0.00 0.00 31.44 30.62 1q3s n GLU 92 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1q3s n ALA 93 N -0.89 0.66 0.00 0.62 0.00 -0.30 -4.97 120.51 115.63 1q3s n ALA 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1q3s n ALA 93 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1q3s n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3s n GLY 94 N 0.47 1.26 3.88 0.00 0.00 -0.75 -4.36 105.19 105.69 1q3s n GLY 94 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1q3s n GLY 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1q3s s ASP 95 N 0.00 4.98 -0.26 1.61 3.68 -1.26 -4.62 116.67 120.80 1q3s s ASP 95 Ca 0.00 -0.81 -0.00 0.00 2.13 0.00 0.00 52.55 53.86 1q3s s ASP 95 Cb 0.00 -0.44 0.00 0.00 -1.45 0.00 0.00 42.92 41.03 1q3s s ASP 95 CO 0.00 -0.71 0.03 0.61 0.13 0.00 0.00 175.17 175.22 1q3s n GLY 96 N -1.58 0.31 0.20 2.66 0.00 -1.26 -4.80 105.19 100.72 1q3s n GLY 96 Ca 0.03 -0.72 -0.15 0.00 0.00 0.00 0.00 46.02 45.18 1q3s n GLY 96 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1q3s h THR 97 N -0.06 1.33 0.09 2.61 1.35 -1.91 -2.40 112.91 113.93 1q3s h THR 97 Ca -0.08 -2.11 -0.00 0.00 -0.55 0.00 0.00 66.41 63.67 1q3s h THR 97 Cb 1.06 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.59 1q3s h THR 97 CO 0.09 0.65 -0.04 0.74 -0.25 0.00 0.00 175.52 176.71 1q3s h THR 98 N 0.40 1.03 -0.49 6.82 2.02 -1.95 -2.76 112.91 117.98 1q3s h THR 98 Ca -0.06 -0.44 0.10 0.00 0.77 0.00 0.00 66.41 66.79 1q3s h THR 98 Cb 1.42 1.31 -0.10 0.00 -1.74 0.00 0.00 68.15 69.04 1q3s h THR 98 CO 0.15 0.11 -0.22 0.74 0.37 0.00 0.00 175.52 176.67 1q3s h THR 99 N -0.32 0.34 -0.67 3.16 2.02 -1.97 0.16 112.91 115.63 1q3s h THR 99 Ca -0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.20 1q3s h THR 99 Cb 0.27 0.34 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 1q3s h THR 99 CO 0.02 0.00 0.42 0.00 0.37 0.00 0.00 175.52 176.33 1q3s h ALA 100 N 1.21 0.87 -0.19 6.16 0.00 -1.39 -0.58 119.26 125.35 1q3s h ALA 100 Ca 0.23 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.92 1q3s h ALA 100 Cb 0.47 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1q3s h ALA 100 CO -0.57 0.18 -0.67 0.28 0.00 0.00 0.00 179.25 178.47 1q3s h VAL 101 N 0.81 1.30 -0.13 0.00 2.07 -1.11 -1.60 116.25 117.59 1q3s h VAL 101 Ca 0.27 -1.89 -0.01 0.00 0.82 0.00 0.00 66.70 65.89 1q3s h VAL 101 Cb 0.02 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1q3s h VAL 101 CO -0.11 0.60 0.06 0.58 0.02 0.00 0.00 177.57 178.72 1q3s h VAL 102 N 0.53 1.13 0.00 2.57 2.07 -0.49 -1.70 116.25 120.36 1q3s h VAL 102 Ca -0.02 -0.39 -0.05 0.00 0.82 0.00 0.00 66.70 67.06 1q3s h VAL 102 Cb 1.27 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 1q3s h VAL 102 CO 0.14 0.12 -0.22 0.40 0.02 0.00 0.00 177.57 178.03 1q3s h ILE 103 N 0.07 1.11 -0.34 4.57 2.04 -1.10 -1.71 117.51 122.15 1q3s h ILE 103 Ca 0.04 -0.76 -0.13 0.00 1.00 0.00 0.00 64.86 65.01 1q3s h ILE 103 Cb 0.14 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1q3s h ILE 103 CO -0.00 0.21 -0.31 0.00 0.00 0.00 0.00 178.15 178.05 1q3s h ALA 104 N 1.78 0.50 -0.48 1.87 0.00 -1.00 -0.84 119.26 121.09 1q3s h ALA 104 Ca -0.00 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1q3s h ALA 104 Cb 0.40 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1q3s h ALA 104 CO 0.03 0.54 0.12 0.78 0.00 0.00 0.00 179.25 180.71 1q3s h GLY 105 N 0.59 0.83 0.93 0.00 0.00 -0.85 -2.19 103.07 102.39 1q3s h GLY 105 Ca 0.06 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 1q3s h GLY 105 CO 0.08 0.48 0.14 0.83 0.00 0.00 0.00 176.54 178.08 1q3s h GLU 106 N 0.65 0.45 -0.89 4.80 4.39 -1.24 -1.15 114.58 121.60 1q3s h GLU 106 Ca 0.15 -0.07 0.12 0.00 0.34 0.00 0.00 59.36 59.90 1q3s h GLU 106 Cb 0.33 -0.08 -0.07 0.00 -0.10 0.00 0.00 28.75 28.83 1q3s h GLU 106 CO 0.00 0.43 0.57 -0.07 -1.16 0.00 0.00 179.01 178.78 1q3s h LEU 107 N 0.36 0.73 -0.58 1.33 4.07 -1.06 -0.18 115.31 119.98 1q3s h LEU 107 Ca 0.11 0.03 -0.15 0.00 0.08 0.00 0.00 57.88 57.95 1q3s h LEU 107 Cb 0.13 -0.12 -0.02 0.00 1.08 0.00 0.00 40.66 41.73 1q3s h LEU 107 CO -0.01 0.41 -0.70 -0.07 -1.08 0.00 0.00 178.44 176.98 1q3s h LEU 108 N 0.80 0.00 0.08 1.67 3.38 -0.73 -1.39 115.31 119.11 1q3s h LEU 108 Ca 0.43 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.39 1q3s h LEU 108 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1q3s h LEU 108 CO -0.19 0.70 -0.04 -0.09 0.09 0.00 0.00 178.44 178.91 1q3s h ARG 109 N 0.00 -0.10 0.00 1.13 2.43 0.01 -1.55 114.38 116.30 1q3s h ARG 109 Ca -0.01 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 1q3s h ARG 109 Cb 1.25 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.82 1q3s h ARG 109 CO 0.09 0.41 -0.12 0.87 -1.51 0.00 0.00 179.97 179.71 1q3s h LYS 110 N -0.70 0.00 -0.06 0.20 1.79 -1.14 -2.36 116.57 114.30 1q3s h LYS 110 Ca -0.01 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.29 1q3s h LYS 110 Cb 0.56 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.22 1q3s h LYS 110 CO 0.02 0.12 -0.62 0.00 -1.08 0.00 0.00 179.45 177.88 1q3s h ALA 111 N 1.88 0.16 -0.08 3.86 0.00 -1.18 -3.05 119.26 120.85 1q3s h ALA 111 Ca -0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 1q3s h ALA 111 Cb 0.32 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1q3s h ALA 111 CO 0.01 0.43 -0.10 1.49 0.00 0.00 0.00 179.25 181.09 1q3s h GLU 112 N 0.12 0.12 -0.52 0.00 4.81 -0.78 -1.44 114.58 116.90 1q3s h GLU 112 Ca -0.06 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1q3s h GLU 112 Cb 1.29 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.61 1q3s h GLU 112 CO 0.13 0.23 0.31 0.93 -0.73 0.00 0.00 179.01 179.88 1q3s h GLU 113 N 0.12 0.59 0.00 1.92 5.08 -1.36 0.44 114.58 121.38 1q3s h GLU 113 Ca 0.03 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 1q3s h GLU 113 Cb 0.26 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1q3s h GLU 113 CO 0.02 0.39 -0.22 -0.07 -1.00 0.00 0.00 179.01 178.12 1q3s h LEU 114 N 0.61 0.00 -0.09 1.33 3.38 -1.20 -2.22 115.31 117.12 1q3s h LEU 114 Ca 0.21 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.00 1q3s h LEU 114 Cb 0.03 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.79 1q3s h LEU 114 CO -0.10 0.22 -0.63 -0.07 0.09 0.00 0.00 178.44 177.96 1q3s h LEU 115 N 0.00 0.71 -1.83 1.67 3.38 -0.50 -2.14 115.31 116.61 1q3s h LEU 115 Ca -0.00 -0.66 -0.02 0.00 0.09 0.00 0.00 57.88 57.29 1q3s h LEU 115 Cb 0.56 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1q3s h LEU 115 CO 0.03 1.27 -0.09 0.44 0.09 0.00 0.00 178.44 180.18 1q3s h ASP 116 N 0.22 0.00 0.00 -0.43 3.45 -0.65 0.23 116.42 119.23 1q3s h ASP 116 Ca -0.05 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.41 1q3s h ASP 116 Cb 1.28 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.05 1q3s h ASP 116 CO 0.13 0.09 0.00 1.67 -1.57 0.00 0.00 179.24 179.56 1q3s n GLN 117 N -4.43 0.77 -0.93 3.56 7.27 -0.86 -4.84 117.38 117.92 1q3s n GLN 117 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.04 1q3s n GLN 117 Cb 0.17 -1.43 0.00 0.00 2.41 0.00 0.00 30.24 31.39 1q3s n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1q3s n ASN 118 N -0.93 -2.11 -4.72 1.69 5.03 0.80 -5.02 115.26 110.00 1q3s n ASN 118 Ca 0.16 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.19 1q3s n ASN 118 Cb 0.07 -0.35 -0.03 0.00 -1.02 0.00 0.00 39.78 38.45 1q3s n ASN 118 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1q3s s ILE 119 N -2.45 3.65 0.26 2.41 1.01 -0.82 -4.96 121.20 120.30 1q3s s ILE 119 Ca 0.00 1.19 -0.31 0.00 0.00 0.00 0.00 60.65 61.53 1q3s s ILE 119 Cb 0.00 -3.76 -0.12 0.00 0.01 0.00 0.00 42.46 38.59 1q3s s ILE 119 CO 0.00 0.10 1.60 1.57 0.00 0.00 0.00 174.94 178.21 1q3s n HIS 120 N 3.88 2.69 -0.33 3.97 -0.00 -1.26 -4.46 115.22 119.71 1q3s n HIS 120 Ca 0.10 0.23 0.17 0.00 -0.00 0.00 0.00 57.72 58.22 1q3s n HIS 120 Cb 0.44 -2.59 0.38 0.00 -0.00 0.00 0.00 29.99 28.22 1q3s n HIS 120 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1q3s h PRO 121 N 5.26 0.49 -1.01 1.57 0.13 -1.92 0.25 132.00 136.77 1q3s h PRO 121 Ca -0.46 -0.03 0.23 0.00 -0.87 0.00 0.00 66.00 64.88 1q3s h PRO 121 Cb 1.23 -0.11 -0.12 0.00 0.13 0.00 0.00 31.00 32.13 1q3s h PRO 121 CO 0.83 0.33 0.60 1.03 -0.23 0.00 0.00 178.00 180.56 1q3s h SER 122 N 0.51 0.70 -0.13 1.44 0.87 -1.89 -0.27 113.55 114.77 1q3s h SER 122 Ca 0.64 0.13 -0.12 0.00 -1.23 0.00 0.00 61.79 61.21 1q3s h SER 122 Cb 1.25 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1q3s h SER 122 CO -0.51 0.14 -0.38 0.40 -0.53 0.00 0.00 176.83 175.95 1q3s h ILE 123 N 0.62 1.37 0.06 2.23 1.08 -0.86 -2.68 117.51 119.33 1q3s h ILE 123 Ca 0.63 -1.69 -0.00 0.00 -0.39 0.00 0.00 64.86 63.41 1q3s h ILE 123 Cb 1.16 2.10 0.00 0.00 -3.07 0.00 0.00 36.82 37.01 1q3s h ILE 123 CO -0.45 0.50 -0.03 0.40 -0.69 0.00 0.00 178.15 177.88 1q3s h ILE 124 N 0.08 0.97 0.15 -0.67 2.04 -1.15 -0.25 117.51 118.68 1q3s h ILE 124 Ca -0.01 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.78 1q3s h ILE 124 Cb 1.01 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 1q3s h ILE 124 CO 0.08 0.02 -0.51 0.40 0.00 0.00 0.00 178.15 178.15 1q3s h ILE 125 N -0.12 0.03 -0.94 -0.67 2.04 -1.16 0.63 117.51 117.33 1q3s h ILE 125 Ca -0.01 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.98 1q3s h ILE 125 Cb 0.09 0.03 -0.08 0.00 -0.74 0.00 0.00 36.82 36.13 1q3s h ILE 125 CO 0.01 0.00 0.60 0.11 0.00 0.00 0.00 178.15 178.87 1q3s h LYS 126 N -0.76 0.83 0.00 2.37 1.79 -1.37 0.62 116.57 120.05 1q3s h LYS 126 Ca -0.00 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.31 1q3s h LYS 126 Cb 0.76 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 31.21 1q3s h LYS 126 CO -0.27 0.55 -0.51 0.78 -1.08 0.00 0.00 179.45 178.92 1q3s h GLY 127 N 0.85 0.00 1.10 3.86 0.00 -0.57 -2.38 103.07 105.93 1q3s h GLY 127 Ca 0.47 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.57 1q3s h GLY 127 CO -0.23 0.00 -0.82 -0.97 0.00 0.00 0.00 176.54 174.52 1q3s h TYR 128 N 0.00 0.96 -0.66 5.60 0.99 0.85 -2.43 116.97 122.28 1q3s h TYR 128 Ca -0.01 -0.47 -0.03 0.00 2.00 0.00 0.00 58.73 60.23 1q3s h TYR 128 Cb 1.07 -0.13 -0.03 0.00 1.00 0.00 0.00 36.73 38.64 1q3s h TYR 128 CO 0.00 1.30 0.31 0.00 -0.00 0.00 0.00 178.16 179.77 1q3s h ALA 129 N 0.45 0.85 -0.68 3.88 0.00 -0.89 0.20 119.26 123.07 1q3s h ALA 129 Ca -0.08 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1q3s h ALA 129 Cb 1.47 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1q3s h ALA 129 CO 0.17 0.42 0.21 -0.07 0.00 0.00 0.00 179.25 179.97 1q3s h LEU 130 N 0.91 0.98 -0.26 0.00 3.38 -1.44 0.59 115.31 119.48 1q3s h LEU 130 Ca 0.23 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1q3s h LEU 130 Cb 0.13 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1q3s h LEU 130 CO -0.03 0.92 -0.19 0.00 0.09 0.00 0.00 178.44 179.24 1q3s h ALA 131 N 1.21 0.38 -0.07 1.53 0.00 -0.99 -1.19 119.26 120.13 1q3s h ALA 131 Ca 0.22 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1q3s h ALA 131 Cb 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1q3s h ALA 131 CO -0.01 0.30 0.04 0.00 0.00 0.00 0.00 179.25 179.58 1q3s h ALA 132 N 0.71 0.09 -0.63 0.00 0.00 -0.34 -1.46 119.26 117.63 1q3s h ALA 132 Ca 0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1q3s h ALA 132 Cb 0.72 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 1q3s h ALA 132 CO 0.05 -0.37 0.17 0.93 0.00 0.00 0.00 179.25 180.03 1q3s h GLU 133 N 0.02 0.98 0.00 0.00 4.39 -0.90 -2.45 114.58 116.62 1q3s h GLU 133 Ca 0.02 -0.21 0.00 0.00 0.34 0.00 0.00 59.36 59.51 1q3s h GLU 133 Cb 0.08 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 1q3s h GLU 133 CO -0.00 0.86 0.00 1.17 -1.16 0.00 0.00 179.01 179.88 1q3s n LYS 134 N -4.26 0.23 0.09 2.33 3.00 -0.45 -2.95 118.16 116.15 1q3s n LYS 134 Ca 0.05 0.30 -0.22 0.00 -0.00 0.00 0.00 58.31 58.44 1q3s n LYS 134 Cb 0.23 -1.83 -0.15 0.00 0.00 0.00 0.00 35.03 33.28 1q3s n LYS 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1q3s h ALA 135 N 2.42 -0.10 -0.28 3.14 0.00 -0.79 -2.48 119.26 121.17 1q3s h ALA 135 Ca 0.00 -0.79 0.06 0.00 0.00 0.00 0.00 54.91 54.19 1q3s h ALA 135 Cb 0.57 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 1q3s h ALA 135 CO 0.00 0.53 -0.11 1.96 0.00 0.00 0.00 179.25 181.63 1q3s h GLN 136 N -0.16 -0.06 -0.33 0.00 1.08 -1.45 0.91 115.11 115.10 1q3s h GLN 136 Ca -0.20 0.00 0.07 0.00 -1.45 0.00 0.00 58.65 57.08 1q3s h GLN 136 Cb 1.86 0.01 -0.08 0.00 -0.05 0.00 0.00 27.48 29.22 1q3s h GLN 136 CO 0.20 -0.04 -0.29 1.49 -0.95 0.00 0.00 178.83 179.24 1q3s h GLU 137 N -0.06 -0.24 -0.53 1.46 4.81 -1.56 0.14 114.58 118.59 1q3s h GLU 137 Ca 0.14 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1q3s h GLU 137 Cb 0.28 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 1q3s h GLU 137 CO -0.32 -0.16 0.27 0.82 -0.73 0.00 0.00 179.01 178.88 1q3s h ILE 138 N -0.25 1.17 -0.09 2.32 2.04 -0.85 -2.04 117.51 119.80 1q3s h ILE 138 Ca 0.16 -0.46 -0.07 0.00 1.00 0.00 0.00 64.86 65.49 1q3s h ILE 138 Cb 0.51 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1q3s h ILE 138 CO -0.47 0.20 -0.22 -0.07 0.00 0.00 0.00 178.15 177.58 1q3s h LEU 139 N 0.74 0.36 -1.66 1.44 3.38 0.13 0.45 115.31 120.14 1q3s h LEU 139 Ca 0.19 -0.58 0.11 0.00 0.09 0.00 0.00 57.88 57.68 1q3s h LEU 139 Cb 0.05 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1q3s h LEU 139 CO -0.03 0.87 0.40 0.44 0.09 0.00 0.00 178.44 180.22 1q3s h ASP 140 N -0.14 0.34 0.14 -0.43 3.32 -0.60 -0.39 116.42 118.66 1q3s h ASP 140 Ca -0.00 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.05 1q3s h ASP 140 Cb 0.82 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.31 1q3s h ASP 140 CO 0.05 0.20 -0.07 -0.08 -1.72 0.00 0.00 179.24 177.62 1q3s h GLU 141 N 0.38 -0.18 0.00 3.56 4.81 -1.20 -3.33 114.58 118.62 1q3s h GLU 141 Ca 0.28 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1q3s h GLU 141 Cb 0.60 0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.02 1q3s h GLU 141 CO -0.07 0.10 0.00 0.44 -0.73 0.00 0.00 179.01 178.75 1q3s n ILE 142 N -4.88 1.05 -1.70 2.32 -5.35 0.13 -4.84 119.36 106.09 1q3s n ILE 142 Ca -0.05 0.32 -0.43 0.00 -0.27 0.00 0.00 62.75 62.32 1q3s n ILE 142 Cb 0.18 -1.19 -0.02 0.00 -1.74 0.00 0.00 39.64 36.87 1q3s n ILE 142 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1q3s n ALA 143 N -1.63 1.55 -2.86 -1.28 0.00 -0.17 -4.93 120.51 111.18 1q3s n ALA 143 Ca 0.02 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.42 1q3s n ALA 143 Cb 0.16 -2.32 -0.04 0.00 0.00 0.00 0.00 19.45 17.26 1q3s n ALA 143 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1q3s s ILE 144 N -0.35 4.39 -0.17 0.00 1.01 0.55 -4.88 121.20 121.75 1q3s s ILE 144 Ca 0.63 -0.62 -0.29 0.00 0.00 0.00 0.00 60.65 60.37 1q3s s ILE 144 Cb -0.59 -4.72 -0.05 0.00 0.01 0.00 0.00 42.46 37.12 1q3s s ILE 144 CO 0.53 -1.49 1.95 -0.13 0.00 0.00 0.00 174.94 175.81 1q3s s ARG 145 N 3.82 3.58 0.42 2.79 1.81 -1.26 -1.46 118.95 128.64 1q3s s ARG 145 Ca 0.25 2.01 0.07 0.00 -1.72 0.00 0.00 55.73 56.35 1q3s s ARG 145 Cb -0.14 -4.21 -0.03 0.00 -0.45 0.00 0.00 34.95 30.12 1q3s s ARG 145 CO 0.05 -1.58 0.29 0.54 -0.68 0.00 0.00 175.30 173.93 1q3s s VAL 146 N 6.37 2.50 -0.44 3.52 0.11 -0.07 -4.95 120.40 127.44 1q3s s VAL 146 Ca 0.87 -1.50 -0.26 0.00 -2.93 0.00 0.00 61.98 58.16 1q3s s VAL 146 Cb -0.32 -3.00 0.02 0.00 -1.53 0.00 0.00 36.38 31.56 1q3s s VAL 146 CO 0.35 0.00 0.95 -0.62 -3.33 0.00 0.00 175.10 172.45 1q3s s ASP 147 N -4.03 6.57 0.09 3.54 3.68 -1.26 -4.51 116.67 120.75 1q3s s ASP 147 Ca 0.45 0.29 0.08 0.00 2.13 0.00 0.00 52.55 55.50 1q3s s ASP 147 Cb 0.00 -2.47 0.29 0.00 -1.45 0.00 0.00 42.92 39.30 1q3s s ASP 147 CO 0.25 -1.02 0.28 -2.65 0.13 0.00 0.00 175.17 172.17 1q3s n PRO 148 N 7.14 -0.00 0.00 4.34 -0.02 -1.26 0.16 135.00 145.36 1q3s n PRO 148 Ca 0.07 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1q3s n PRO 148 Cb 0.48 -0.45 0.00 0.00 -0.02 0.00 0.00 33.50 33.51 1q3s n PRO 148 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1q3s n ASP 149 N -2.66 1.12 -4.54 2.55 3.85 -1.26 -4.22 116.55 111.39 1q3s n ASP 149 Ca 0.08 -1.52 -0.28 0.00 -0.71 0.00 0.00 54.79 52.36 1q3s n ASP 149 Cb 0.33 0.00 -0.10 0.00 -1.35 0.00 0.00 41.12 40.00 1q3s n ASP 149 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 1q3s n ASP 150 N -0.26 1.21 0.04 -1.12 4.64 0.43 -4.72 116.55 116.76 1q3s n ASP 150 Ca 0.00 -0.70 0.22 0.00 -1.38 0.00 0.00 54.79 52.93 1q3s n ASP 150 Cb 0.32 -1.33 0.73 0.00 -1.04 0.00 0.00 41.12 39.80 1q3s n ASP 150 CO 0.00 0.00 0.00 -0.08 -0.82 0.00 0.00 177.20 176.30 1q3s h GLU 151 N 14.81 0.00 0.06 -0.67 4.81 -1.93 -2.51 114.58 129.15 1q3s h GLU 151 Ca -0.09 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1q3s h GLU 151 Cb 1.17 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.55 1q3s h GLU 151 CO 1.23 0.00 -0.07 1.49 -0.73 0.00 0.00 179.01 180.93 1q3s h GLU 152 N 0.00 -0.13 0.00 1.92 4.57 -1.97 -1.51 114.58 117.46 1q3s h GLU 152 Ca 0.24 0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.39 1q3s h GLU 152 Cb 1.19 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.81 1q3s h GLU 152 CO -0.00 -0.08 -0.18 1.79 -1.18 0.00 0.00 179.01 179.36 1q3s h THR 153 N -0.13 0.71 0.00 0.32 1.35 -1.92 -1.57 112.91 111.67 1q3s h THR 153 Ca -0.01 -0.73 -0.07 0.00 -0.55 0.00 0.00 66.41 65.05 1q3s h THR 153 Cb 0.11 1.45 -0.01 0.00 -1.73 0.00 0.00 68.15 67.98 1q3s h THR 153 CO -0.01 0.17 -0.33 0.25 -0.25 0.00 0.00 175.52 175.35 1q3s h LEU 154 N 0.00 0.00 -0.11 3.87 5.85 -1.35 -0.34 115.31 123.23 1q3s h LEU 154 Ca -0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.51 1q3s h LEU 154 Cb 0.44 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 1q3s h LEU 154 CO 0.02 0.33 -0.97 -0.07 -0.34 0.00 0.00 178.44 177.42 1q3s h LEU 155 N 0.00 0.08 0.17 2.25 -0.00 -0.25 -3.06 115.31 114.50 1q3s h LEU 155 Ca -0.00 -0.08 -0.01 0.00 -0.00 0.00 0.00 57.88 57.79 1q3s h LEU 155 Cb 0.62 -0.03 0.00 0.00 -0.00 0.00 0.00 40.66 41.25 1q3s h LEU 155 CO 0.04 0.99 -0.08 0.11 -0.00 0.00 0.00 178.44 179.51 1q3s h LYS 156 N 0.02 -0.22 -0.42 1.13 1.57 -1.08 -2.34 116.57 115.24 1q3s h LYS 156 Ca -0.03 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.85 1q3s h LYS 156 Cb 1.68 0.05 -0.09 0.00 0.08 0.00 0.00 32.23 33.94 1q3s h LYS 156 CO 0.13 0.21 -0.32 0.82 -0.57 0.00 0.00 179.45 179.72 1q3s h ILE 157 N -0.77 0.23 -0.98 1.86 1.08 -1.18 0.23 117.51 117.98 1q3s h ILE 157 Ca -0.02 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.51 1q3s h ILE 157 Cb 0.52 0.23 -0.07 0.00 -3.07 0.00 0.00 36.82 34.44 1q3s h ILE 157 CO 0.04 0.00 0.63 0.00 -0.69 0.00 0.00 178.15 178.13 1q3s h ALA 158 N 0.81 1.35 -0.08 1.87 0.00 -1.59 -2.24 119.26 119.38 1q3s h ALA 158 Ca 0.18 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1q3s h ALA 158 Cb 0.53 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1q3s h ALA 158 CO -0.55 0.44 -0.10 0.00 0.00 0.00 0.00 179.25 179.04 1q3s h ALA 159 N 1.44 0.12 -0.84 0.00 0.00 -0.62 -2.86 119.26 116.50 1q3s h ALA 159 Ca 0.42 -0.31 0.13 0.00 0.00 0.00 0.00 54.91 55.15 1q3s h ALA 159 Cb 0.14 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1q3s h ALA 159 CO -0.17 -0.04 0.55 1.15 0.00 0.00 0.00 179.25 180.75 1q3s h THR 160 N -0.23 0.87 -0.13 0.00 2.02 -0.39 -1.00 112.91 114.05 1q3s h THR 160 Ca 0.01 -0.23 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 1q3s h THR 160 Cb 0.63 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1q3s h THR 160 CO 0.02 0.12 0.01 -1.28 0.37 0.00 0.00 175.52 174.77 1q3s h SER 161 N 0.68 0.22 0.03 4.18 0.87 -1.36 -3.06 113.55 115.11 1q3s h SER 161 Ca 0.41 -0.29 -0.06 0.00 -1.23 0.00 0.00 61.79 60.63 1q3s h SER 161 Cb 0.63 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 1q3s h SER 161 CO -0.17 0.45 -0.16 0.40 -0.53 0.00 0.00 176.83 176.82 1q3s h ILE 162 N -0.02 1.20 -0.90 2.23 2.04 -1.12 -3.29 117.51 117.64 1q3s h ILE 162 Ca 0.04 -0.89 -0.69 0.00 1.00 0.00 0.00 64.86 64.32 1q3s h ILE 162 Cb 0.33 1.25 -0.09 0.00 -0.74 0.00 0.00 36.82 37.58 1q3s h ILE 162 CO 0.00 0.28 2.21 0.41 0.00 0.00 0.00 178.15 181.05 1q3s n THR 163 N -4.24 3.94 -0.22 -0.27 -1.04 -0.45 -2.28 114.28 109.72 1q3s n THR 163 Ca -0.01 -4.08 0.00 0.00 -2.04 0.00 0.00 64.05 57.92 1q3s n THR 163 Cb 0.30 -2.38 0.00 0.00 -1.82 0.00 0.00 70.33 66.43 1q3s n THR 163 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1q3s n GLY 164 N 5.18 0.18 2.18 3.41 0.00 -1.24 -4.40 105.19 110.50 1q3s n GLY 164 Ca 0.48 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.33 1q3s n GLY 164 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1q3s n LYS 165 N 0.00 0.84 0.08 1.61 5.02 -0.97 -4.43 118.16 120.32 1q3s n LYS 165 Ca 0.00 -2.24 -0.12 0.00 -2.02 0.00 0.00 58.31 53.93 1q3s n LYS 165 Cb 0.01 1.05 -0.06 0.00 -0.02 0.00 0.00 35.03 36.01 1q3s n LYS 165 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 1q3s h ASN 166 N 0.97 -0.28 0.00 4.39 -0.00 -1.94 -3.18 115.58 115.54 1q3s h ASN 166 Ca -0.22 0.03 0.00 0.00 -0.00 0.00 0.00 56.30 56.11 1q3s h ASN 166 Cb 0.78 0.11 0.00 0.00 -0.00 0.00 0.00 38.32 39.21 1q3s h ASN 166 CO 0.35 -0.16 0.00 0.00 -0.00 0.00 0.00 177.43 177.63 1q3s n ALA 167 N -2.31 1.74 0.00 1.57 0.00 -1.26 -3.97 120.51 116.28 1q3s n ALA 167 Ca -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1q3s n ALA 167 Cb 0.15 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1q3s n ALA 167 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1q3s n GLU 168 N -0.54 0.00 -0.23 0.00 0.28 -1.20 -2.41 120.64 116.54 1q3s n GLU 168 Ca 0.00 0.39 0.09 0.00 -0.16 0.00 0.00 57.16 57.48 1q3s n GLU 168 Cb 0.00 -1.53 0.35 0.00 1.43 0.00 0.00 31.44 31.70 1q3s n GLU 168 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1q3s h SER 169 N 0.00 0.68 -1.65 -1.84 4.64 -1.89 -2.77 113.55 110.72 1q3s h SER 169 Ca 0.00 0.02 -0.53 0.00 -0.47 0.00 0.00 61.79 60.81 1q3s h SER 169 Cb 0.06 -0.12 -0.41 0.00 -0.31 0.00 0.00 62.40 61.61 1q3s h SER 169 CO 0.00 0.40 -0.86 1.41 -0.87 0.00 0.00 176.83 176.91 1q3s n HIS 170 N -4.51 2.72 0.24 4.77 8.25 -1.01 -4.83 115.22 120.85 1q3s n HIS 170 Ca 0.14 -3.34 0.09 0.00 -0.26 0.00 0.00 57.72 54.34 1q3s n HIS 170 Cb 0.33 -0.28 0.62 0.00 1.12 0.00 0.00 29.99 31.78 1q3s n HIS 170 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1q3s h LYS 171 N 2.81 0.00 0.77 -0.41 2.10 -1.63 -2.75 116.57 117.46 1q3s h LYS 171 Ca 0.15 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.76 1q3s h LYS 171 Cb 0.88 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 32.22 1q3s h LYS 171 CO 0.73 0.14 -0.37 1.49 -2.00 0.00 0.00 179.45 179.43 1q3s h GLU 172 N 0.00 -0.99 0.73 0.07 4.57 -1.88 -2.19 114.58 114.89 1q3s h GLU 172 Ca -0.00 0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.21 1q3s h GLU 172 Cb 0.27 0.23 -0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1q3s h GLU 172 CO 0.02 -0.66 -0.43 1.25 -1.18 0.00 0.00 179.01 178.01 1q3s h LEU 173 N -1.05 -1.06 -1.23 1.64 5.85 -1.95 -2.83 115.31 114.67 1q3s h LEU 173 Ca -0.11 0.05 0.21 0.00 0.84 0.00 0.00 57.88 58.88 1q3s h LEU 173 Cb 0.79 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 42.03 1q3s h LEU 173 CO 0.17 -0.67 0.62 -0.07 -0.34 0.00 0.00 178.44 178.15 1q3s h LEU 174 N -1.08 0.60 -0.23 2.25 3.38 -1.61 0.03 115.31 118.64 1q3s h LEU 174 Ca -0.10 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1q3s h LEU 174 Cb 0.85 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1q3s h LEU 174 CO 0.12 0.20 0.06 0.00 0.09 0.00 0.00 178.44 178.90 1q3s h ALA 175 N 1.63 0.31 -0.51 1.53 0.00 -1.35 -2.00 119.26 118.86 1q3s h ALA 175 Ca 0.55 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.31 1q3s h ALA 175 Cb 1.12 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1q3s h ALA 175 CO -0.31 -0.04 0.34 -0.22 0.00 0.00 0.00 179.25 179.02 1q3s h LYS 176 N 0.20 0.67 -0.26 0.00 3.64 -0.81 -1.39 116.57 118.61 1q3s h LYS 176 Ca 0.07 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 1q3s h LYS 176 Cb 0.28 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1q3s h LYS 176 CO 0.00 0.44 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.55 1q3s h LEU 177 N 0.69 0.36 -0.18 5.20 3.38 -1.00 -1.39 115.31 122.36 1q3s h LEU 177 Ca 0.19 -0.06 -0.22 0.00 0.09 0.00 0.00 57.88 57.88 1q3s h LEU 177 Cb -0.07 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 1q3s h LEU 177 CO -0.05 0.42 -0.95 0.00 0.09 0.00 0.00 178.44 177.96 1q3s h ALA 178 N 1.63 0.39 0.01 1.53 0.00 -0.78 -0.84 119.26 121.19 1q3s h ALA 178 Ca 0.09 -0.73 -0.21 0.00 0.00 0.00 0.00 54.91 54.05 1q3s h ALA 178 Cb 0.26 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1q3s h ALA 178 CO 0.01 0.87 -0.92 0.28 0.00 0.00 0.00 179.25 179.48 1q3s h VAL 179 N 0.17 1.45 -0.14 0.00 2.07 -1.05 -2.50 116.25 116.25 1q3s h VAL 179 Ca -0.07 -2.57 -0.09 0.00 0.82 0.00 0.00 66.70 64.79 1q3s h VAL 179 Cb 1.59 2.47 0.00 0.00 -1.52 0.00 0.00 31.29 33.83 1q3s h VAL 179 CO 0.16 0.76 -0.27 -0.08 0.02 0.00 0.00 177.57 178.16 1q3s h GLU 180 N 0.16 0.43 -0.36 1.57 4.81 -1.28 -1.67 114.58 118.23 1q3s h GLU 180 Ca -0.06 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 1q3s h GLU 180 Cb 1.56 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.95 1q3s h GLU 180 CO 0.15 0.87 0.24 0.00 -0.73 0.00 0.00 179.01 179.54 1q3s h ALA 181 N 0.55 0.46 -0.29 2.92 0.00 -1.19 -2.46 119.26 119.26 1q3s h ALA 181 Ca 0.01 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 1q3s h ALA 181 Cb 0.85 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1q3s h ALA 181 CO 0.06 -0.08 -0.30 0.28 0.00 0.00 0.00 179.25 179.21 1q3s h VAL 182 N 0.49 1.30 -0.28 0.00 2.07 -1.47 -2.99 116.25 115.37 1q3s h VAL 182 Ca 0.13 -1.47 0.04 0.00 0.82 0.00 0.00 66.70 66.22 1q3s h VAL 182 Cb -0.06 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1q3s h VAL 182 CO -0.03 0.47 0.19 0.11 0.02 0.00 0.00 177.57 178.33 1q3s h LYS 183 N 0.45 0.20 0.31 1.57 1.57 -1.20 0.33 116.57 119.80 1q3s h LYS 183 Ca 0.04 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1q3s h LYS 183 Cb 0.88 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1q3s h LYS 183 CO 0.07 0.13 -0.15 0.37 -0.57 0.00 0.00 179.45 179.31 1q3s h GLN 184 N 0.21 -0.40 0.00 3.15 5.75 -1.35 -3.31 115.11 119.16 1q3s h GLN 184 Ca 0.12 0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.65 1q3s h GLN 184 Cb 0.21 0.09 0.00 0.00 1.07 0.00 0.00 27.48 28.85 1q3s h GLN 184 CO -0.02 -0.17 0.00 -0.39 -2.65 0.00 0.00 178.83 175.60 1q3s h VAL 185 N -1.06 0.00 -2.88 2.39 -1.51 -1.44 -3.46 116.25 108.29 1q3s h VAL 185 Ca -0.04 -0.52 -0.59 0.00 -1.23 0.00 0.00 66.70 64.32 1q3s h VAL 185 Cb 0.42 1.52 0.17 0.00 -2.13 0.00 0.00 31.29 31.26 1q3s h VAL 185 CO 0.07 0.00 -0.36 0.00 -1.23 0.00 0.00 177.57 176.05 1q3s n ALA 186 N -2.08 -1.10 -2.67 5.19 0.00 0.10 -4.78 120.51 115.16 1q3s n ALA 186 Ca 0.01 0.02 -0.19 0.00 0.00 0.00 0.00 53.44 53.27 1q3s n ALA 186 Cb 0.31 -1.84 -0.13 0.00 0.00 0.00 0.00 19.45 17.80 1q3s n ALA 186 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1q3s s GLU 187 N -2.01 0.89 -0.28 0.00 2.56 -1.02 -4.99 118.70 113.85 1q3s s GLU 187 Ca 0.68 -0.85 -0.01 0.00 0.00 0.00 0.00 54.97 54.79 1q3s s GLU 187 Cb -0.47 -0.91 0.17 0.00 2.00 0.00 0.00 34.13 34.92 1q3s s GLU 187 CO 0.55 0.21 0.50 0.21 -0.56 0.00 0.00 175.26 176.18 1q3s s LYS 188 N -1.41 0.48 0.00 4.30 2.20 -1.26 0.12 119.74 124.17 1q3s s LYS 188 Ca 0.00 0.75 0.00 0.00 -0.36 0.00 0.00 55.97 56.36 1q3s s LYS 188 Cb -0.09 0.09 0.00 0.00 -1.51 0.00 0.00 37.83 36.33 1q3s s LYS 188 CO 0.02 -0.68 0.27 0.36 -0.36 0.00 0.00 175.35 174.95 1q3s n LYS 189 N 5.40 0.06 0.00 4.03 -0.00 -1.26 -4.82 118.16 121.58 1q3s n LYS 189 Ca -0.02 -0.30 0.00 0.00 -0.00 0.00 0.00 58.31 58.00 1q3s n LYS 189 Cb 0.51 -0.60 0.00 0.00 -0.00 0.00 0.00 35.03 34.94 1q3s n LYS 189 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1q3s n ASP 190 N -0.03 0.65 0.00 -5.58 5.75 -1.26 -5.02 116.55 111.06 1q3s n ASP 190 Ca 0.00 -0.89 0.00 0.00 -0.01 0.00 0.00 54.79 53.89 1q3s n ASP 190 Cb 0.28 0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 1q3s n ASP 190 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1q3s n GLY 191 N 0.14 3.45 3.58 6.12 0.00 -1.26 -5.08 105.19 112.14 1q3s n GLY 191 Ca 0.00 -1.04 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 1q3s n GLY 191 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q3s s LYS 192 N 0.00 1.97 0.67 1.61 1.02 -1.26 -5.10 119.74 118.65 1q3s s LYS 192 Ca 0.00 -1.74 -0.11 0.00 0.02 0.00 0.00 55.97 54.14 1q3s s LYS 192 Cb 0.00 -1.89 -0.01 0.00 -0.52 0.00 0.00 37.83 35.42 1q3s s LYS 192 CO 0.00 0.22 1.05 0.71 -0.92 0.00 0.00 175.35 176.41 1q3s s TYR 193 N -2.50 3.33 -0.24 3.18 1.51 -1.26 -4.35 117.35 117.01 1q3s s TYR 193 Ca 0.33 1.31 -0.03 0.00 -1.01 0.00 0.00 57.07 57.67 1q3s s TYR 193 Cb -0.02 -2.85 0.13 0.00 -0.11 0.00 0.00 41.96 39.11 1q3s s TYR 193 CO 0.18 -1.04 0.37 0.08 -1.11 0.00 0.00 175.55 174.02 1q3s s VAL 194 N -3.14 -0.59 -0.25 0.71 1.01 0.12 -4.65 120.40 113.61 1q3s s VAL 194 Ca 0.57 -0.08 -0.08 0.00 0.00 0.00 0.00 61.98 62.40 1q3s s VAL 194 Cb -0.12 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 1q3s s VAL 194 CO 0.54 -0.13 0.09 -0.69 0.00 0.00 0.00 175.10 174.91 1q3s s VAL 195 N 2.53 4.50 -0.68 2.92 1.01 -1.26 -2.45 120.40 126.97 1q3s s VAL 195 Ca 0.12 -0.11 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 1q3s s VAL 195 Cb -0.15 -3.10 0.16 0.00 0.00 0.00 0.00 36.38 33.29 1q3s s VAL 195 CO -0.16 0.34 0.66 -0.62 0.00 0.00 0.00 175.10 175.32 1q3s s ASP 196 N 1.48 6.45 0.00 3.32 -1.08 -1.26 -4.92 116.67 120.67 1q3s s ASP 196 Ca 0.06 -2.14 0.01 0.00 -0.52 0.00 0.00 52.55 49.96 1q3s s ASP 196 Cb -0.15 -2.23 0.07 0.00 -1.46 0.00 0.00 42.92 39.15 1q3s s ASP 196 CO 0.04 -0.78 0.86 0.18 0.52 0.00 0.00 175.17 176.00 1q3s n LEU 197 N 4.88 0.00 0.07 -1.34 4.77 -1.26 -1.27 117.00 122.86 1q3s n LEU 197 Ca -0.00 0.30 0.10 0.00 -0.03 0.00 0.00 56.01 56.38 1q3s n LEU 197 Cb 0.44 -0.30 0.42 0.00 -2.33 0.00 0.00 43.42 41.65 1q3s n LEU 197 CO 0.46 -0.29 0.81 0.47 -1.33 0.00 0.00 177.39 177.51 1q3s n ASP 198 N -1.30 0.37 -0.67 -1.43 8.00 -1.26 -2.30 116.55 117.95 1q3s n ASP 198 Ca 0.01 0.58 0.04 0.00 0.71 0.00 0.00 54.79 56.13 1q3s n ASP 198 Cb 0.01 -0.66 0.13 0.00 -0.02 0.00 0.00 41.12 40.58 1q3s n ASP 198 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1q3s n ASN 199 N -1.90 1.89 -3.73 -2.24 3.02 -0.39 -4.52 115.26 107.38 1q3s n ASN 199 Ca 0.03 -2.12 -0.30 0.00 -0.03 0.00 0.00 54.58 52.17 1q3s n ASN 199 Cb 0.22 -0.31 -0.13 0.00 -0.61 0.00 0.00 39.78 38.95 1q3s n ASN 199 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1q3s s ILE 200 N -1.64 1.39 0.47 2.41 1.01 -0.97 -1.31 121.20 122.56 1q3s s ILE 200 Ca 0.19 -2.40 -0.21 0.00 0.00 0.00 0.00 60.65 58.23 1q3s s ILE 200 Cb 0.11 -1.99 -0.09 0.00 0.01 0.00 0.00 42.46 40.51 1q3s s ILE 200 CO 0.10 -0.85 1.03 -0.75 0.00 0.00 0.00 174.94 174.47 1q3s s LYS 201 N 0.53 3.90 -0.10 2.79 2.20 -0.35 -4.92 119.74 123.79 1q3s s LYS 201 Ca 0.16 1.34 0.03 0.00 -0.36 0.00 0.00 55.97 57.14 1q3s s LYS 201 Cb -0.23 -2.15 -0.01 0.00 -1.51 0.00 0.00 37.83 33.93 1q3s s LYS 201 CO -0.03 -0.35 -0.21 -0.06 -0.36 0.00 0.00 175.35 174.34 1q3s s PHE 202 N -1.98 2.61 -0.23 4.03 0.40 -1.26 -1.11 117.98 120.44 1q3s s PHE 202 Ca 0.66 -0.85 0.01 0.00 -0.60 0.00 0.00 56.93 56.15 1q3s s PHE 202 Cb -0.16 -1.72 0.04 0.00 0.51 0.00 0.00 43.02 41.69 1q3s s PHE 202 CO 0.19 -0.30 -0.12 -2.00 0.70 0.00 0.00 175.22 173.69 1q3s s GLU 203 N 0.21 2.65 -0.33 0.44 2.56 0.13 -4.92 118.70 119.44 1q3s s GLU 203 Ca -0.13 -1.08 -0.11 0.00 0.00 0.00 0.00 54.97 53.65 1q3s s GLU 203 Cb -0.16 -2.83 -0.01 0.00 2.00 0.00 0.00 34.13 33.13 1q3s s GLU 203 CO 0.07 -0.41 0.20 0.15 -0.56 0.00 0.00 175.26 174.71 1q3s s LYS 204 N 1.23 3.34 -0.10 4.30 1.02 -1.26 0.76 119.74 129.03 1q3s s LYS 204 Ca -0.02 -0.74 -0.00 0.00 0.02 0.00 0.00 55.97 55.23 1q3s s LYS 204 Cb -0.17 -3.71 0.02 0.00 -0.52 0.00 0.00 37.83 33.46 1q3s s LYS 204 CO -0.07 -0.47 -0.07 0.15 -0.92 0.00 0.00 175.35 173.96 1q3s s LYS 205 N 1.66 1.38 0.68 1.68 -0.14 -0.39 -4.98 119.74 119.63 1q3s s LYS 205 Ca 0.05 -0.22 -0.15 0.00 -1.36 0.00 0.00 55.97 54.29 1q3s s LYS 205 Cb -0.17 -1.43 0.01 0.00 -1.68 0.00 0.00 37.83 34.56 1q3s s LYS 205 CO 0.08 -0.21 1.16 0.00 -0.76 0.00 0.00 175.35 175.62 1q3s s ALA 206 N 1.53 2.33 0.00 5.17 0.00 -1.26 -3.75 121.76 125.78 1q3s s ALA 206 Ca 0.01 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.70 1q3s s ALA 206 Cb -0.13 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.60 1q3s s ALA 206 CO -0.05 -1.50 0.00 0.41 0.00 0.00 0.00 175.76 174.61 1q3s n GLY 207 N -0.04 2.41 7.00 0.00 0.00 0.10 -4.80 105.19 109.87 1q3s n GLY 207 Ca 0.12 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1q3s n GLY 207 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q3s n GLU 208 N 0.55 0.00 -4.48 1.61 -0.58 -1.26 -1.47 120.64 115.02 1q3s n GLU 208 Ca 0.00 0.00 -0.26 0.00 -0.42 0.00 0.00 57.16 56.48 1q3s n GLU 208 Cb 0.00 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 30.77 1q3s n GLU 208 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1q3s s GLY 209 N -4.40 2.24 0.00 0.62 0.00 -1.26 -2.38 107.32 102.13 1q3s s GLY 209 Ca 0.00 -2.10 0.03 0.00 0.00 0.00 0.00 44.72 42.64 1q3s s GLY 209 CO 0.00 -2.00 1.03 -0.62 0.00 0.00 0.00 173.10 171.50 1q3s n VAL 210 N -0.90 1.61 0.05 1.40 0.31 -0.92 -1.43 118.33 118.46 1q3s n VAL 210 Ca -0.05 0.40 -0.04 0.00 -0.01 0.00 0.00 64.34 64.65 1q3s n VAL 210 Cb 0.64 -1.36 0.18 0.00 -0.91 0.00 0.00 33.84 32.39 1q3s n VAL 210 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1q3s h GLU 211 N 0.00 0.37 -0.24 5.55 4.39 -1.94 -3.06 114.58 119.65 1q3s h GLU 211 Ca 0.00 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.52 1q3s h GLU 211 Cb 0.04 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1q3s h GLU 211 CO 0.00 0.71 0.00 0.39 -1.16 0.00 0.00 179.01 178.95 1q3s n GLU 212 N -4.03 1.41 -2.49 2.33 -0.58 -0.51 -4.87 120.64 111.90 1q3s n GLU 212 Ca -0.01 -0.57 -0.38 0.00 -0.42 0.00 0.00 57.16 55.78 1q3s n GLU 212 Cb 0.49 -1.18 -0.04 0.00 -0.57 0.00 0.00 31.44 30.14 1q3s n GLU 212 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1q3s s SER 213 N -0.91 6.92 0.15 1.62 0.01 -1.16 -4.71 113.70 115.62 1q3s s SER 213 Ca 0.10 2.16 -0.11 0.00 1.31 0.00 0.00 55.95 59.41 1q3s s SER 213 Cb 0.06 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1q3s s SER 213 CO 0.07 -0.38 0.32 -1.83 0.41 0.00 0.00 173.24 171.83 1q3s s GLU 214 N -2.07 1.12 -0.23 12.44 -1.05 -0.65 -5.01 118.70 123.25 1q3s s GLU 214 Ca 0.53 -1.02 -0.16 0.00 -0.15 0.00 0.00 54.97 54.17 1q3s s GLU 214 Cb -0.27 0.41 -0.04 0.00 -0.44 0.00 0.00 34.13 33.79 1q3s s GLU 214 CO 0.34 -0.42 0.41 -1.17 0.95 0.00 0.00 175.26 175.36 1q3s s LEU 215 N -2.91 4.10 -0.63 1.83 2.96 -1.26 -1.02 118.68 121.75 1q3s s LEU 215 Ca 0.11 0.44 -0.10 0.00 -0.22 0.00 0.00 54.13 54.36 1q3s s LEU 215 Cb 0.03 -2.50 0.16 0.00 0.50 0.00 0.00 46.19 44.37 1q3s s LEU 215 CO -0.04 -0.14 0.53 -0.69 -1.32 0.00 0.00 176.35 174.69 1q3s s VAL 216 N 1.69 4.72 -0.45 1.68 1.01 0.17 -4.95 120.40 124.26 1q3s s VAL 216 Ca 0.18 -2.22 -0.17 0.00 0.00 0.00 0.00 61.98 59.77 1q3s s VAL 216 Cb -0.15 -4.01 -0.17 0.00 0.00 0.00 0.00 36.38 32.05 1q3s s VAL 216 CO 0.09 -0.89 1.70 0.54 0.00 0.00 0.00 175.10 176.53 1q3s n ARG 217 N 4.35 0.95 0.00 2.72 1.74 -1.26 -2.17 116.66 122.99 1q3s n ARG 217 Ca 0.02 -1.29 0.00 0.00 -0.77 0.00 0.00 57.85 55.81 1q3s n ARG 217 Cb 0.42 -2.54 0.00 0.00 -1.02 0.00 0.00 32.46 29.32 1q3s n ARG 217 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1q3s n GLY 218 N 4.40 0.93 3.33 -0.13 0.00 -1.26 -1.85 105.19 110.61 1q3s n GLY 218 Ca 0.39 0.24 -0.14 0.00 0.00 0.00 0.00 46.02 46.50 1q3s n GLY 218 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q3s s VAL 219 N 1.61 0.04 -0.10 1.61 1.01 0.50 -3.30 120.40 121.77 1q3s s VAL 219 Ca 0.00 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.65 1q3s s VAL 219 Cb 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 36.38 35.54 1q3s s VAL 219 CO 0.00 -0.20 -0.21 -0.69 0.00 0.00 0.00 175.10 173.99 1q3s s VAL 220 N -1.84 1.88 -0.05 2.92 1.01 -1.26 -0.68 120.40 122.37 1q3s s VAL 220 Ca -0.09 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.04 1q3s s VAL 220 Cb -0.02 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.70 1q3s s VAL 220 CO 0.02 0.52 -0.23 -0.63 0.00 0.00 0.00 175.10 174.78 1q3s s ILE 221 N 0.49 1.89 -1.27 2.22 1.01 -0.24 -4.96 121.20 120.34 1q3s s ILE 221 Ca -0.16 -0.98 -0.09 0.00 0.00 0.00 0.00 60.65 59.41 1q3s s ILE 221 Cb -0.17 -1.61 0.17 0.00 0.01 0.00 0.00 42.46 40.87 1q3s s ILE 221 CO 0.06 0.53 1.83 0.47 0.00 0.00 0.00 174.94 177.84 1q3s n ASP 222 N 2.97 5.16 -4.05 3.58 9.92 -1.26 0.37 116.55 133.23 1q3s n ASP 222 Ca -0.17 -3.12 -0.12 0.00 -0.53 0.00 0.00 54.79 50.85 1q3s n ASP 222 Cb 0.52 -1.47 -0.08 0.00 -0.64 0.00 0.00 41.12 39.45 1q3s n ASP 222 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1q3s s LYS 223 N 0.30 1.37 0.45 -1.24 -0.14 -1.26 -5.00 119.74 114.23 1q3s s LYS 223 Ca 0.39 -1.54 0.05 0.00 -1.36 0.00 0.00 55.97 53.52 1q3s s LYS 223 Cb 0.09 0.34 -0.04 0.00 -1.68 0.00 0.00 37.83 36.54 1q3s s LYS 223 CO 0.01 -0.50 0.11 -1.21 -0.76 0.00 0.00 175.35 173.00 1q3s s GLU 224 N -4.02 2.14 -0.12 1.68 2.02 -1.26 -3.67 118.70 115.48 1q3s s GLU 224 Ca 0.34 -2.09 -0.30 0.00 0.02 0.00 0.00 54.97 52.95 1q3s s GLU 224 Cb 0.04 -1.78 -0.02 0.00 0.10 0.00 0.00 34.13 32.47 1q3s s GLU 224 CO 0.12 -0.22 1.15 0.08 0.02 0.00 0.00 175.26 176.42 1q3s s VAL 225 N -2.72 4.43 0.60 2.63 1.01 -1.26 -4.63 120.40 120.46 1q3s s VAL 225 Ca 0.29 1.73 0.31 0.00 0.00 0.00 0.00 61.98 64.32 1q3s s VAL 225 Cb 0.04 -4.12 0.36 0.00 0.00 0.00 0.00 36.38 32.67 1q3s s VAL 225 CO 0.16 -0.06 2.24 1.62 0.00 0.00 0.00 175.10 179.06 1q3s h VAL 226 N 5.20 0.46 -4.22 2.92 3.04 -1.38 -3.43 116.25 118.84 1q3s h VAL 226 Ca -0.29 0.00 -0.60 0.00 -1.01 0.00 0.00 66.70 64.80 1q3s h VAL 226 Cb 1.13 0.97 -0.26 0.00 -2.01 0.00 0.00 31.29 31.11 1q3s h VAL 226 CO 0.91 0.00 -0.85 -2.28 -1.01 0.00 0.00 177.57 174.34 1q3s s HIS 227 N -4.58 1.88 0.25 3.17 2.46 -1.26 -5.04 115.29 112.17 1q3s s HIS 227 Ca -0.05 -0.38 -0.04 0.00 0.47 0.00 0.00 55.06 55.07 1q3s s HIS 227 Cb 0.15 -1.13 0.37 0.00 -0.13 0.00 0.00 32.58 31.83 1q3s s HIS 227 CO 0.53 0.08 1.87 -1.35 -2.47 0.00 0.00 174.74 173.40 1q3s h PRO 228 N 4.96 1.04 -0.17 2.88 0.11 -1.99 -2.80 132.00 136.03 1q3s h PRO 228 Ca -0.43 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1q3s h PRO 228 Cb 1.15 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1q3s h PRO 228 CO 0.44 0.69 0.00 0.54 -0.21 0.00 0.00 178.00 179.46 1q3s n ARG 229 N -4.56 1.40 -3.32 1.05 5.12 -1.26 -4.90 116.66 110.18 1q3s n ARG 229 Ca 0.14 -0.62 -0.29 0.00 -1.93 0.00 0.00 57.85 55.15 1q3s n ARG 229 Cb 0.18 -1.14 -0.03 0.00 -1.16 0.00 0.00 32.46 30.31 1q3s n ARG 229 CO 0.00 0.00 0.00 -1.64 -1.93 0.00 0.00 177.63 174.06 1q3s s MET 230 N -1.77 3.64 0.23 5.56 -1.94 -1.06 -4.90 119.30 119.06 1q3s s MET 230 Ca 0.12 0.03 -0.32 0.00 -1.71 0.00 0.00 55.69 53.81 1q3s s MET 230 Cb 0.06 -2.64 -0.13 0.00 2.01 0.00 0.00 34.83 34.14 1q3s s MET 230 CO 0.08 0.21 1.54 -2.30 -0.01 0.00 0.00 175.02 174.54 1q3s n PRO 231 N -0.92 2.33 -0.22 2.03 -0.02 -1.26 -4.85 135.00 132.10 1q3s n PRO 231 Ca -0.01 0.83 0.08 0.00 -2.02 0.00 0.00 63.50 62.37 1q3s n PRO 231 Cb 0.54 -2.58 0.21 0.00 -0.02 0.00 0.00 33.50 31.65 1q3s n PRO 231 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1q3s n LYS 232 N 2.66 2.03 -3.64 -0.52 4.76 -1.26 -4.76 118.16 117.42 1q3s n LYS 232 Ca 0.13 -1.59 -0.06 0.00 -2.87 0.00 0.00 58.31 53.92 1q3s n LYS 232 Cb 0.33 -1.36 -0.07 0.00 -1.84 0.00 0.00 35.03 32.09 1q3s n LYS 232 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1q3s s ARG 233 N -1.43 0.43 -0.04 1.97 3.52 -1.26 -1.32 118.95 120.82 1q3s s ARG 233 Ca 0.30 0.60 0.04 0.00 -0.13 0.00 0.00 55.73 56.54 1q3s s ARG 233 Cb 0.16 0.16 -0.00 0.00 -1.56 0.00 0.00 34.95 33.70 1q3s s ARG 233 CO 0.21 -0.07 -0.15 0.08 -0.81 0.00 0.00 175.30 174.57 1q3s s VAL 234 N 0.74 1.24 0.00 7.11 1.01 -0.35 -5.00 120.40 125.14 1q3s s VAL 234 Ca -0.02 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.35 1q3s s VAL 234 Cb -0.04 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.26 1q3s s VAL 234 CO -0.11 0.37 0.00 -0.62 0.00 0.00 0.00 175.10 174.74 1q3s n GLU 235 N 3.24 0.00 -3.03 2.72 -0.58 -1.26 -1.92 120.64 119.80 1q3s n GLU 235 Ca -0.18 0.00 -0.45 0.00 -0.42 0.00 0.00 57.16 56.11 1q3s n GLU 235 Cb 0.53 -0.15 -0.02 0.00 -0.57 0.00 0.00 31.44 31.23 1q3s n GLU 235 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1q3s s ASN 236 N -1.35 6.70 0.25 1.62 0.01 -1.26 -2.86 114.94 118.04 1q3s s ASN 236 Ca 0.00 -2.28 -0.30 0.00 -0.71 0.00 0.00 52.86 49.57 1q3s s ASN 236 Cb 0.00 -2.35 -0.09 0.00 0.41 0.00 0.00 41.25 39.22 1q3s s ASN 236 CO 0.00 -0.91 1.18 0.00 -1.51 0.00 0.00 177.10 175.86 1q3s s ALA 237 N 1.94 3.44 -0.46 0.60 0.00 -0.73 -4.95 121.76 121.60 1q3s s ALA 237 Ca 0.30 0.98 -0.03 0.00 0.00 0.00 0.00 51.96 53.21 1q3s s ALA 237 Cb -0.06 -3.39 0.12 0.00 0.00 0.00 0.00 23.12 19.79 1q3s s ALA 237 CO -0.09 -0.33 0.26 0.15 0.00 0.00 0.00 175.76 175.75 1q3s s LYS 238 N -0.98 2.15 0.05 0.00 1.02 -1.26 -2.65 119.74 118.07 1q3s s LYS 238 Ca 0.49 -1.96 -0.23 0.00 0.02 0.00 0.00 55.97 54.29 1q3s s LYS 238 Cb -0.34 -3.64 -0.06 0.00 -0.52 0.00 0.00 37.83 33.27 1q3s s LYS 238 CO 0.41 -1.10 0.69 0.42 -0.92 0.00 0.00 175.35 174.85 1q3s s ILE 239 N 0.92 4.73 -0.16 2.17 1.01 0.21 -2.30 121.20 127.79 1q3s s ILE 239 Ca 0.10 1.47 0.01 0.00 0.00 0.00 0.00 60.65 62.24 1q3s s ILE 239 Cb -0.23 -4.04 0.01 0.00 0.01 0.00 0.00 42.46 38.22 1q3s s ILE 239 CO -0.04 0.43 -0.20 0.00 0.00 0.00 0.00 174.94 175.14 1q3s s ALA 240 N -0.39 2.34 -0.64 9.38 0.00 0.13 0.87 121.76 133.45 1q3s s ALA 240 Ca 0.35 -1.12 -0.12 0.00 0.00 0.00 0.00 51.96 51.07 1q3s s ALA 240 Cb -0.20 -1.11 0.16 0.00 0.00 0.00 0.00 23.12 21.97 1q3s s ALA 240 CO 0.21 -0.12 0.55 -0.51 0.00 0.00 0.00 175.76 175.89 1q3s s LEU 241 N 0.95 6.17 -0.25 0.00 1.02 -1.26 -0.27 118.68 125.04 1q3s s LEU 241 Ca -0.03 -2.27 -0.11 0.00 0.02 0.00 0.00 54.13 51.74 1q3s s LEU 241 Cb -0.15 -2.12 -0.05 0.00 0.02 0.00 0.00 46.19 43.89 1q3s s LEU 241 CO -0.04 -0.66 0.17 -0.63 0.02 0.00 0.00 176.35 175.21 1q3s s ILE 242 N 0.83 5.35 -0.80 -0.59 -1.09 -0.27 -1.39 121.20 123.24 1q3s s ILE 242 Ca 0.11 0.18 0.02 0.00 -2.23 0.00 0.00 60.65 58.73 1q3s s ILE 242 Cb -0.21 -3.51 0.31 0.00 -1.58 0.00 0.00 42.46 37.48 1q3s s ILE 242 CO -0.03 0.32 1.26 -3.20 -1.23 0.00 0.00 174.94 172.06 1q3s n ASN 243 N 4.49 5.52 -3.75 3.58 5.15 0.94 -1.13 115.26 130.06 1q3s n ASN 243 Ca -0.15 -3.61 -0.14 0.00 -0.60 0.00 0.00 54.58 50.09 1q3s n ASN 243 Cb 0.52 -0.87 -0.09 0.00 -0.53 0.00 0.00 39.78 38.82 1q3s n ASN 243 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1q3s s GLU 244 N -3.47 0.67 -0.27 1.20 2.12 -1.26 -4.54 118.70 113.14 1q3s s GLU 244 Ca 0.42 -0.12 -0.26 0.00 0.36 0.00 0.00 54.97 55.37 1q3s s GLU 244 Cb 0.20 0.30 0.00 0.00 0.26 0.00 0.00 34.13 34.89 1q3s s GLU 244 CO -0.08 -0.18 0.91 0.00 -0.54 0.00 0.00 175.26 175.37 1q3s s ALA 245 N -1.20 3.60 -1.20 6.30 0.00 -1.26 -4.34 121.76 123.64 1q3s s ALA 245 Ca -0.12 -0.13 -0.16 0.00 0.00 0.00 0.00 51.96 51.55 1q3s s ALA 245 Cb -0.05 -3.42 -0.05 0.00 0.00 0.00 0.00 23.12 19.61 1q3s s ALA 245 CO 0.04 -1.13 2.20 1.28 0.00 0.00 0.00 175.76 178.15 1q3s n LEU 246 N 6.29 5.99 -3.86 0.00 4.32 -0.87 -4.80 117.00 124.07 1q3s n LEU 246 Ca 0.08 -3.65 -0.10 0.00 -0.02 0.00 0.00 56.01 52.32 1q3s n LEU 246 Cb 0.47 -1.42 -0.06 0.00 -1.62 0.00 0.00 43.42 40.79 1q3s n LEU 246 CO 0.51 0.68 0.07 -1.83 -1.22 0.00 0.00 177.39 175.60 1q3s s GLU 247 N 3.71 1.18 -0.80 3.23 -1.05 -1.26 -0.99 118.70 122.71 1q3s s GLU 247 Ca 0.52 -1.03 -0.22 0.00 -0.15 0.00 0.00 54.97 54.09 1q3s s GLU 247 Cb 0.14 0.42 -0.18 0.00 -0.44 0.00 0.00 34.13 34.07 1q3s s GLU 247 CO -0.01 -0.45 2.38 0.28 0.95 0.00 0.00 175.26 178.40 1q3s n VAL 248 N -0.23 -0.01 -1.58 1.83 0.31 -1.26 -4.92 118.33 112.46 1q3s n VAL 248 Ca -0.10 -0.52 -0.39 0.00 -0.01 0.00 0.00 64.34 63.33 1q3s n VAL 248 Cb 0.63 -1.57 0.03 0.00 -0.91 0.00 0.00 33.84 32.02 1q3s n VAL 248 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1q3s n LYS 249 N 8.07 0.97 -4.31 5.55 5.02 -1.26 -5.03 118.16 127.16 1q3s n LYS 249 Ca 0.52 0.36 -0.19 0.00 -2.02 0.00 0.00 58.31 56.98 1q3s n LYS 249 Cb 0.36 -2.02 -0.11 0.00 -0.02 0.00 0.00 35.03 33.24 1q3s n LYS 249 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1q3s s LYS 250 N -2.34 1.23 0.35 1.97 1.02 -1.26 -5.14 119.74 115.57 1q3s s LYS 250 Ca 0.70 -1.44 -0.26 0.00 0.02 0.00 0.00 55.97 55.00 1q3s s LYS 250 Cb -0.47 -1.12 -0.10 0.00 -0.52 0.00 0.00 37.83 35.62 1q3s s LYS 250 CO 0.52 0.21 0.99 0.95 -0.92 0.00 0.00 175.35 177.10 1q3s s THR 251 N -2.46 4.01 0.48 2.17 -4.23 -1.26 -4.93 115.64 109.42 1q3s s THR 251 Ca 0.17 1.63 0.18 0.00 -1.18 0.00 0.00 61.69 62.49 1q3s s THR 251 Cb -0.03 -3.89 0.24 0.00 1.34 0.00 0.00 72.50 70.16 1q3s s THR 251 CO 0.06 0.10 2.08 -0.08 -0.54 0.00 0.00 174.62 176.23 1q3s h GLU 252 N 2.97 0.00 -6.13 3.99 4.57 -2.03 -3.40 114.58 114.54 1q3s h GLU 252 Ca -0.47 0.00 -0.56 0.00 -1.18 0.00 0.00 59.36 57.14 1q3s h GLU 252 Cb 1.20 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.74 1q3s h GLU 252 CO 0.64 0.11 0.45 0.99 -1.18 0.00 0.00 179.01 180.02 1q3s s THR 253 N -4.69 4.84 0.05 0.32 2.01 -1.26 -4.95 115.64 111.97 1q3s s THR 253 Ca -0.04 1.85 -0.37 0.00 0.31 0.00 0.00 61.69 63.43 1q3s s THR 253 Cb 0.16 -4.23 -0.19 0.00 0.01 0.00 0.00 72.50 68.25 1q3s s THR 253 CO 0.66 0.04 0.97 -0.67 -0.69 0.00 0.00 174.62 174.92 1q3s n ASP 254 N 4.93 -0.20 -3.77 3.53 4.64 -1.26 -4.94 116.55 119.48 1q3s n ASP 254 Ca 0.06 1.15 -0.13 0.00 -1.38 0.00 0.00 54.79 54.49 1q3s n ASP 254 Cb 0.49 -0.94 -0.10 0.00 -1.04 0.00 0.00 41.12 39.53 1q3s n ASP 254 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1q3s s ALA 255 N -0.20 -0.77 -0.05 -1.67 0.00 -1.26 -5.08 121.76 112.73 1q3s s ALA 255 Ca 0.85 0.55 -0.13 0.00 0.00 0.00 0.00 51.96 53.23 1q3s s ALA 255 Cb -1.18 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 21.78 1q3s s ALA 255 CO 0.56 -0.21 0.30 0.21 0.00 0.00 0.00 175.76 176.62 1q3s s LYS 256 N -0.68 0.56 -0.05 0.00 2.20 -1.26 -5.05 119.74 115.45 1q3s s LYS 256 Ca -0.08 -0.01 -0.20 0.00 -0.36 0.00 0.00 55.97 55.33 1q3s s LYS 256 Cb -0.04 0.25 -0.05 0.00 -1.51 0.00 0.00 37.83 36.48 1q3s s LYS 256 CO 0.02 -0.13 0.55 0.42 -0.36 0.00 0.00 175.35 175.86 1q3s s ILE 257 N -0.85 5.02 -0.60 5.43 1.01 -1.26 -5.04 121.20 124.91 1q3s s ILE 257 Ca -0.09 1.14 -0.03 0.00 0.00 0.00 0.00 60.65 61.67 1q3s s ILE 257 Cb -0.04 -3.89 0.15 0.00 0.01 0.00 0.00 42.46 38.69 1q3s s ILE 257 CO 0.03 0.38 0.41 0.20 0.00 0.00 0.00 174.94 175.96 1q3s s ASN 258 N 0.10 5.25 0.05 3.58 0.01 -1.26 -5.06 114.94 117.61 1q3s s ASN 258 Ca 0.30 -2.74 -0.31 0.00 -0.71 0.00 0.00 52.86 49.40 1q3s s ASN 258 Cb -0.17 -1.85 -0.07 0.00 0.41 0.00 0.00 41.25 39.56 1q3s s ASN 258 CO 0.15 -0.40 1.51 -0.63 -1.51 0.00 0.00 177.10 176.22 1q3s s ILE 259 N 0.10 3.36 -0.02 0.60 1.09 -1.26 -4.88 121.20 120.19 1q3s s ILE 259 Ca 0.16 0.81 0.05 0.00 -1.10 0.00 0.00 60.65 60.57 1q3s s ILE 259 Cb -0.21 -3.52 -0.08 0.00 -1.06 0.00 0.00 42.46 37.59 1q3s s ILE 259 CO -0.03 0.01 0.10 0.35 -0.10 0.00 0.00 174.94 175.26 1q3s n THR 260 N 4.59 0.09 -3.80 2.92 -2.24 -1.26 -5.04 114.28 109.54 1q3s n THR 260 Ca 0.14 -0.15 -0.12 0.00 -2.27 0.00 0.00 64.05 61.64 1q3s n THR 260 Cb 0.42 0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.61 1q3s n THR 260 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1q3s s SER 261 N -2.90 -0.18 0.15 3.42 1.04 -1.26 -5.10 113.70 108.87 1q3s s SER 261 Ca -0.02 0.27 -0.20 0.00 0.48 0.00 0.00 55.95 56.47 1q3s s SER 261 Cb 0.03 0.40 0.04 0.00 0.10 0.00 0.00 66.02 66.59 1q3s s SER 261 CO 0.23 -0.22 1.22 -2.65 0.98 0.00 0.00 173.24 172.80 1q3s n PRO 262 N 2.31 -0.28 0.32 4.02 -0.02 -1.26 -1.47 135.00 138.61 1q3s n PRO 262 Ca -0.17 1.20 0.07 0.00 -2.02 0.00 0.00 63.50 62.58 1q3s n PRO 262 Cb 0.57 -1.77 0.34 0.00 -0.02 0.00 0.00 33.50 32.62 1q3s n PRO 262 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1q3s h ASP 263 N 0.00 0.00 0.16 2.55 3.04 -2.03 -0.77 116.42 119.37 1q3s h ASP 263 Ca 0.18 0.00 -0.18 0.00 -3.24 0.00 0.00 57.03 53.79 1q3s h ASP 263 Cb 0.38 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.67 1q3s h ASP 263 CO -0.76 0.00 -0.68 1.56 -2.04 0.00 0.00 179.24 177.32 1q3s h GLN 264 N 0.00 0.47 -0.72 4.15 4.20 -1.69 -2.68 115.11 118.84 1q3s h GLN 264 Ca 0.01 -0.36 0.16 0.00 0.06 0.00 0.00 58.65 58.52 1q3s h GLN 264 Cb 1.48 0.07 -0.11 0.00 0.30 0.00 0.00 27.48 29.22 1q3s h GLN 264 CO -0.00 0.98 0.13 -0.07 -0.67 0.00 0.00 178.83 179.20 1q3s h LEU 265 N 0.34 -0.08 0.30 1.46 3.38 -1.33 -2.07 115.31 117.31 1q3s h LEU 265 Ca -0.02 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1q3s h LEU 265 Cb 1.25 0.23 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1q3s h LEU 265 CO 0.12 -0.07 -0.14 0.24 0.09 0.00 0.00 178.44 178.68 1q3s h MET 266 N 0.22 -0.39 -1.01 1.13 2.86 -1.71 -3.20 114.93 112.84 1q3s h MET 266 Ca 0.40 0.03 0.30 0.00 -2.06 0.00 0.00 59.70 58.37 1q3s h MET 266 Cb 0.70 0.09 -0.14 0.00 0.06 0.00 0.00 31.60 32.30 1q3s h MET 266 CO -0.54 -0.08 0.58 0.66 1.06 0.00 0.00 176.91 178.60 1q3s h SER 267 N -0.97 0.55 0.18 1.22 4.64 -1.22 -0.93 113.55 117.02 1q3s h SER 267 Ca -0.04 0.17 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1q3s h SER 267 Cb 0.49 0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1q3s h SER 267 CO 0.07 -0.07 -0.09 -0.26 -0.87 0.00 0.00 176.83 175.61 1q3s h PHE 268 N 0.39 -0.23 -0.77 4.77 -1.00 -1.50 -1.14 116.94 117.46 1q3s h PHE 268 Ca 0.71 -0.01 0.15 0.00 2.81 0.00 0.00 57.97 61.63 1q3s h PHE 268 Cb 1.57 0.08 -0.10 0.00 3.61 0.00 0.00 35.95 41.11 1q3s h PHE 268 CO -0.01 0.17 0.32 -0.07 -1.61 0.00 0.00 178.31 177.11 1q3s h LEU 269 N -0.74 0.30 -1.18 1.54 4.07 -1.36 0.40 115.31 118.32 1q3s h LEU 269 Ca -0.03 0.11 -0.06 0.00 0.08 0.00 0.00 57.88 57.99 1q3s h LEU 269 Cb 0.51 0.09 -0.02 0.00 1.08 0.00 0.00 40.66 42.32 1q3s h LEU 269 CO 0.04 0.10 -0.04 -0.33 -1.08 0.00 0.00 178.44 177.14 1q3s h GLU 270 N 0.45 0.52 -0.74 1.13 5.08 -1.17 -1.04 114.58 118.81 1q3s h GLU 270 Ca 0.43 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.63 1q3s h GLU 270 Cb 0.66 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1q3s h GLU 270 CO -0.41 0.58 0.33 0.37 -1.00 0.00 0.00 179.01 178.87 1q3s h GLN 271 N 0.50 1.08 -0.11 2.33 5.75 0.11 -1.19 115.11 123.57 1q3s h GLN 271 Ca 0.10 -0.17 -0.23 0.00 -0.15 0.00 0.00 58.65 58.20 1q3s h GLN 271 Cb 0.38 -0.19 0.01 0.00 1.07 0.00 0.00 27.48 28.75 1q3s h GLN 271 CO 0.02 0.85 -0.84 0.93 -2.65 0.00 0.00 178.83 177.13 1q3s h GLU 272 N 1.06 0.76 -0.70 1.69 5.08 -0.57 -2.25 114.58 119.65 1q3s h GLU 272 Ca 0.25 -0.67 0.09 0.00 -1.00 0.00 0.00 59.36 58.02 1q3s h GLU 272 Cb 0.15 0.16 -0.07 0.00 0.50 0.00 0.00 28.75 29.49 1q3s h GLU 272 CO -0.03 1.27 0.35 0.93 -1.00 0.00 0.00 179.01 180.54 1q3s h GLU 273 N 0.47 0.60 0.03 2.33 5.08 -0.92 0.29 114.58 122.47 1q3s h GLU 273 Ca -0.08 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1q3s h GLU 273 Cb 1.48 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.58 1q3s h GLU 273 CO 0.17 0.40 -0.10 -0.22 -1.00 0.00 0.00 179.01 178.26 1q3s h LYS 274 N 0.62 -0.18 -0.60 2.33 3.64 -1.14 0.82 116.57 122.06 1q3s h LYS 274 Ca 0.34 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.78 1q3s h LYS 274 Cb 0.33 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 1q3s h LYS 274 CO -0.25 -0.12 0.33 0.52 -2.27 0.00 0.00 179.45 177.66 1q3s h MET 275 N -0.19 0.61 0.47 1.90 2.86 -0.65 0.26 114.93 120.19 1q3s h MET 275 Ca 0.03 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1q3s h MET 275 Cb 0.21 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 31.74 1q3s h MET 275 CO -0.08 0.40 -0.23 1.25 1.06 0.00 0.00 176.91 179.32 1q3s h LEU 276 N 0.63 -0.54 -1.70 1.22 5.85 0.15 -2.63 115.31 118.28 1q3s h LEU 276 Ca 0.26 0.01 0.01 0.00 0.84 0.00 0.00 57.88 59.00 1q3s h LEU 276 Cb 0.13 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1q3s h LEU 276 CO -0.16 -0.38 0.21 0.50 -0.34 0.00 0.00 178.44 178.27 1q3s h LYS 277 N -0.64 0.39 -0.36 1.25 3.64 0.12 -1.71 116.57 119.26 1q3s h LYS 277 Ca -0.06 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.22 1q3s h LYS 277 Cb 0.49 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 1q3s h LYS 277 CO 0.11 0.26 -0.10 -0.44 -2.27 0.00 0.00 179.45 177.01 1q3s h ASP 278 N 0.41 0.59 -0.19 4.20 3.32 -0.26 0.95 116.42 125.44 1q3s h ASP 278 Ca 0.12 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 1q3s h ASP 278 Cb -0.03 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1q3s h ASP 278 CO -0.03 0.73 0.01 0.24 -1.72 0.00 0.00 179.24 178.47 1q3s h MET 279 N 0.56 0.33 -0.12 3.56 2.86 -0.96 -2.11 114.93 119.05 1q3s h MET 279 Ca 0.10 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1q3s h MET 279 Cb 0.50 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 1q3s h MET 279 CO 0.03 0.52 0.07 0.28 1.06 0.00 0.00 176.91 178.87 1q3s h VAL 280 N 0.10 1.05 -0.92 -2.22 2.07 -1.21 -2.26 116.25 112.86 1q3s h VAL 280 Ca 0.06 -0.12 0.18 0.00 0.82 0.00 0.00 66.70 67.63 1q3s h VAL 280 Cb 0.36 0.92 -0.10 0.00 -1.52 0.00 0.00 31.29 30.95 1q3s h VAL 280 CO 0.01 0.05 0.51 0.44 0.02 0.00 0.00 177.57 178.59 1q3s h ASP 281 N 0.13 0.61 -0.61 0.57 3.32 -0.72 0.21 116.42 119.94 1q3s h ASP 281 Ca 0.04 0.10 0.03 0.00 0.02 0.00 0.00 57.03 57.23 1q3s h ASP 281 Cb 0.01 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1q3s h ASP 281 CO -0.01 0.21 0.40 0.45 -1.72 0.00 0.00 179.24 178.57 1q3s h HIS 282 N 0.65 0.69 0.02 4.55 3.86 -0.79 -1.50 115.15 122.63 1q3s h HIS 282 Ca 0.53 0.02 -0.25 0.00 -1.16 0.00 0.00 60.37 59.50 1q3s h HIS 282 Cb 0.82 -0.23 0.02 0.00 1.06 0.00 0.00 27.41 29.09 1q3s h HIS 282 CO -0.06 0.40 -1.00 0.82 0.86 0.00 0.00 177.93 178.96 1q3s h ILE 283 N 0.72 1.30 -0.05 2.45 2.04 -0.36 -3.34 117.51 120.26 1q3s h ILE 283 Ca 0.24 -2.24 -0.00 0.00 1.00 0.00 0.00 64.86 63.86 1q3s h ILE 283 Cb 0.08 2.46 -0.00 0.00 -0.74 0.00 0.00 36.82 38.62 1q3s h ILE 283 CO -0.07 0.69 0.02 0.00 0.00 0.00 0.00 178.15 178.79 1q3s h ALA 284 N 0.37 0.07 0.00 1.87 0.00 -0.82 -3.03 119.26 117.72 1q3s h ALA 284 Ca -0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1q3s h ALA 284 Cb 1.66 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1q3s h ALA 284 CO 0.20 -0.34 0.45 1.96 0.00 0.00 0.00 179.25 181.52 1q3s h GLN 285 N -0.09 0.00 0.00 0.00 4.20 -1.41 1.36 115.11 119.18 1q3s h GLN 285 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1q3s h GLN 285 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 1q3s h GLN 285 CO -0.00 0.00 -0.71 0.25 -0.67 0.00 0.00 178.83 177.70 1q3s n THR 286 N -2.05 0.26 -0.37 -0.54 -2.24 -1.14 -4.94 114.28 103.25 1q3s n THR 286 Ca -0.01 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 1q3s n THR 286 Cb 0.47 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 1q3s n THR 286 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1q3s n GLY 287 N 1.37 0.81 3.69 3.38 0.00 0.47 -4.49 105.19 110.41 1q3s n GLY 287 Ca 0.03 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1q3s n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3s s ALA 288 N -2.00 3.43 -0.83 4.61 0.00 -1.25 -4.76 121.76 120.97 1q3s s ALA 288 Ca 0.00 0.58 0.16 0.00 0.00 0.00 0.00 51.96 52.69 1q3s s ALA 288 Cb 0.00 -3.47 -0.15 0.00 0.00 0.00 0.00 23.12 19.50 1q3s s ALA 288 CO 0.00 -0.64 0.68 0.27 0.00 0.00 0.00 175.76 176.07 1q3s n ASN 289 N 4.91 0.85 -3.93 0.00 0.23 -0.97 -4.70 115.26 111.64 1q3s n ASN 289 Ca 0.10 -0.92 -0.24 0.00 -0.53 0.00 0.00 54.58 52.99 1q3s n ASN 289 Cb 0.47 0.93 -0.17 0.00 -2.08 0.00 0.00 39.78 38.94 1q3s n ASN 289 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1q3s s VAL 290 N -2.40 0.85 -0.07 3.53 1.01 -1.16 0.63 120.40 122.80 1q3s s VAL 290 Ca 0.07 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1q3s s VAL 290 Cb 0.12 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.67 1q3s s VAL 290 CO 0.61 0.31 -0.07 -0.69 0.00 0.00 0.00 175.10 175.26 1q3s s VAL 291 N 1.16 0.85 -0.31 2.92 1.01 0.10 0.18 120.40 126.32 1q3s s VAL 291 Ca -0.06 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.60 1q3s s VAL 291 Cb -0.14 -0.85 0.02 0.00 0.00 0.00 0.00 36.38 35.41 1q3s s VAL 291 CO -0.02 0.31 0.08 -0.36 0.00 0.00 0.00 175.10 175.12 1q3s s PHE 292 N 1.17 3.18 -0.15 5.22 0.40 0.63 -1.52 117.98 126.90 1q3s s PHE 292 Ca -0.06 -1.18 -0.08 0.00 -0.60 0.00 0.00 56.93 55.02 1q3s s PHE 292 Cb -0.14 -2.25 -0.04 0.00 0.51 0.00 0.00 43.02 41.09 1q3s s PHE 292 CO -0.02 -0.64 0.11 0.08 0.70 0.00 0.00 175.22 175.45 1q3s s VAL 293 N 1.45 5.25 -0.02 -0.44 1.01 -0.25 -1.11 120.40 126.30 1q3s s VAL 293 Ca 0.01 0.12 -0.20 0.00 0.00 0.00 0.00 61.98 61.91 1q3s s VAL 293 Cb -0.18 -3.33 -0.33 0.00 0.00 0.00 0.00 36.38 32.54 1q3s s VAL 293 CO 0.02 0.54 0.94 -0.61 0.00 0.00 0.00 175.10 175.99 1q3s h GLN 294 N 5.81 0.40 0.00 2.72 4.15 -1.39 -2.56 115.11 124.24 1q3s h GLN 294 Ca -0.47 -0.67 0.00 0.00 0.77 0.00 0.00 58.65 58.28 1q3s h GLN 294 Cb 1.19 0.25 0.00 0.00 0.21 0.00 0.00 27.48 29.13 1q3s h GLN 294 CO 0.65 1.32 0.00 1.63 -1.93 0.00 0.00 178.83 180.50 1q3s n LYS 295 N -3.98 2.11 -2.08 1.69 4.76 -1.26 -3.04 118.16 116.37 1q3s n LYS 295 Ca -0.15 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.01 1q3s n LYS 295 Cb 0.92 0.00 0.18 0.00 -1.84 0.00 0.00 35.03 34.30 1q3s n LYS 295 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q3s n GLY 296 N 5.00 -0.94 2.77 0.72 0.00 -1.26 -2.09 105.19 109.38 1q3s n GLY 296 Ca 0.00 -1.79 -0.17 0.00 0.00 0.00 0.00 46.02 44.06 1q3s n GLY 296 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q3s s ILE 297 N -3.70 -0.37 1.03 -0.61 1.01 -1.26 -2.06 121.20 115.25 1q3s s ILE 297 Ca 0.73 -0.19 -0.16 0.00 0.00 0.00 0.00 60.65 61.03 1q3s s ILE 297 Cb -0.02 -0.76 0.06 0.00 0.01 0.00 0.00 42.46 41.75 1q3s s ILE 297 CO 0.51 -0.25 0.17 0.47 0.00 0.00 0.00 174.94 175.83 1q3s n ASP 298 N 5.32 -2.32 -0.03 3.58 9.92 -0.16 -4.75 116.55 128.11 1q3s n ASP 298 Ca -0.05 0.11 -0.14 0.00 -0.53 0.00 0.00 54.79 54.18 1q3s n ASP 298 Cb 0.49 -1.07 -0.02 0.00 -0.64 0.00 0.00 41.12 39.87 1q3s n ASP 298 CO 0.00 0.00 0.00 0.44 0.13 0.00 0.00 177.20 177.77 1q3s h ASP 299 N -1.78 0.85 -0.26 -2.24 3.32 -1.99 -2.24 116.42 112.08 1q3s h ASP 299 Ca -0.48 -0.50 -0.04 0.00 0.02 0.00 0.00 57.03 56.03 1q3s h ASP 299 Cb 1.32 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.61 1q3s h ASP 299 CO 0.36 1.28 0.02 -0.07 -1.72 0.00 0.00 179.24 179.10 1q3s h LEU 300 N 0.54 0.44 -2.22 1.55 3.38 -1.96 -0.63 115.31 116.41 1q3s h LEU 300 Ca -0.01 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1q3s h LEU 300 Cb 1.24 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1q3s h LEU 300 CO 0.13 0.62 0.00 0.00 0.09 0.00 0.00 178.44 179.29 1q3s h ALA 301 N 0.83 1.78 -0.28 1.53 0.00 -1.87 0.27 119.26 121.52 1q3s h ALA 301 Ca 0.08 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 1q3s h ALA 301 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1q3s h ALA 301 CO 0.01 -0.01 -0.50 1.96 0.00 0.00 0.00 179.25 180.71 1q3s h GLN 302 N 0.00 0.83 -0.17 0.00 4.20 -0.75 -2.33 115.11 116.89 1q3s h GLN 302 Ca 0.00 -0.52 -0.03 0.00 0.06 0.00 0.00 58.65 58.16 1q3s h GLN 302 Cb 0.01 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1q3s h GLN 302 CO -0.00 1.15 -0.01 1.25 -0.67 0.00 0.00 178.83 180.55 1q3s h HIS 303 N 0.60 0.34 -0.33 2.96 2.76 0.90 -1.13 115.15 121.24 1q3s h HIS 303 Ca 0.02 -0.06 -0.02 0.00 -2.20 0.00 0.00 60.37 58.11 1q3s h HIS 303 Cb 1.11 -0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.97 1q3s h HIS 303 CO 0.08 0.54 0.15 1.88 -1.30 0.00 0.00 177.93 179.27 1q3s h TYR 304 N 0.04 0.49 -0.64 5.26 0.05 -0.68 -0.62 116.97 120.87 1q3s h TYR 304 Ca 0.05 -0.03 0.05 0.00 0.05 0.00 0.00 58.73 58.85 1q3s h TYR 304 Cb 0.41 -0.15 -0.04 0.00 1.01 0.00 0.00 36.73 37.97 1q3s h TYR 304 CO 0.04 0.45 0.42 -0.07 -1.05 0.00 0.00 178.16 177.95 1q3s h LEU 305 N 0.40 0.58 -0.22 3.88 3.38 -1.38 -2.06 115.31 119.89 1q3s h LEU 305 Ca 0.11 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 1q3s h LEU 305 Cb 0.15 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1q3s h LEU 305 CO -0.01 0.39 -0.11 0.00 0.09 0.00 0.00 178.44 178.79 1q3s h ALA 306 N 1.65 0.31 0.00 1.53 0.00 -0.61 -1.86 119.26 120.27 1q3s h ALA 306 Ca 0.27 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1q3s h ALA 306 Cb 0.22 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1q3s h ALA 306 CO -0.08 0.15 -0.01 0.87 0.00 0.00 0.00 179.25 180.18 1q3s h LYS 307 N 0.17 0.00 -0.10 0.00 1.57 -0.46 0.71 116.57 118.45 1q3s h LYS 307 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1q3s h LYS 307 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1q3s h LYS 307 CO 0.03 0.01 0.00 0.66 -0.57 0.00 0.00 179.45 179.59 1q3s n TYR 308 N -4.13 0.13 -2.49 -1.35 4.02 -0.89 -4.90 117.16 107.55 1q3s n TYR 308 Ca -0.03 -0.06 -0.13 0.00 -0.01 0.00 0.00 57.90 57.67 1q3s n TYR 308 Cb 0.10 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.43 1q3s n TYR 308 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1q3s n GLY 309 N 1.06 -0.10 3.66 2.72 0.00 0.24 -5.01 105.19 107.76 1q3s n GLY 309 Ca 0.16 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 1q3s n GLY 309 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q3s s ILE 310 N -2.78 5.07 -0.14 -0.61 1.01 -0.71 -4.77 121.20 118.27 1q3s s ILE 310 Ca 0.09 0.07 -0.25 0.00 0.00 0.00 0.00 60.65 60.57 1q3s s ILE 310 Cb -0.04 -3.32 -0.02 0.00 0.01 0.00 0.00 42.46 39.09 1q3s s ILE 310 CO 0.12 0.42 0.81 -0.32 0.00 0.00 0.00 174.94 175.96 1q3s s MET 311 N 0.62 4.34 0.01 2.79 -2.45 0.21 -4.36 119.30 120.46 1q3s s MET 311 Ca 0.06 1.00 0.05 0.00 -1.25 0.00 0.00 55.69 55.55 1q3s s MET 311 Cb -0.12 -3.54 -0.02 0.00 1.25 0.00 0.00 34.83 32.40 1q3s s MET 311 CO 0.01 -0.23 -0.16 0.00 1.05 0.00 0.00 175.02 175.69 1q3s s ALA 312 N 1.80 1.36 -0.04 4.11 0.00 -1.26 0.02 121.76 127.75 1q3s s ALA 312 Ca 0.39 -0.79 0.04 0.00 0.00 0.00 0.00 51.96 51.60 1q3s s ALA 312 Cb -0.17 -0.29 -0.00 0.00 0.00 0.00 0.00 23.12 22.65 1q3s s ALA 312 CO 0.15 0.31 -0.16 0.08 0.00 0.00 0.00 175.76 176.13 1q3s s VAL 313 N -0.58 1.37 0.42 0.00 1.01 -0.58 -0.87 120.40 121.17 1q3s s VAL 313 Ca 0.05 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.42 1q3s s VAL 313 Cb -0.07 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1q3s s VAL 313 CO 0.00 0.40 0.21 0.00 0.00 0.00 0.00 175.10 175.71 1q3s s ARG 314 N 0.08 2.27 -1.19 2.72 1.70 -1.26 -1.09 118.95 122.18 1q3s s ARG 314 Ca -0.04 -1.82 -0.19 0.00 -0.47 0.00 0.00 55.73 53.21 1q3s s ARG 314 Cb -0.11 -2.03 -0.00 0.00 -0.57 0.00 0.00 34.95 32.23 1q3s s ARG 314 CO 0.02 -0.15 0.72 0.54 -1.08 0.00 0.00 175.30 175.35 1q3s n ARG 315 N -1.30 -1.48 -3.25 3.89 3.00 -0.89 -4.91 116.66 111.72 1q3s n ARG 315 Ca -0.01 0.40 -0.39 0.00 -0.01 0.00 0.00 57.85 57.85 1q3s n ARG 315 Cb 0.64 -4.01 -0.06 0.00 0.00 0.00 0.00 32.46 29.04 1q3s n ARG 315 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1q3s s VAL 316 N -3.56 4.96 0.31 1.55 1.01 -0.99 -5.00 120.40 118.69 1q3s s VAL 316 Ca 0.40 1.15 -0.29 0.00 0.00 0.00 0.00 61.98 63.24 1q3s s VAL 316 Cb -0.15 -3.89 -0.12 0.00 0.00 0.00 0.00 36.38 32.21 1q3s s VAL 316 CO 0.88 0.42 1.36 0.29 0.00 0.00 0.00 175.10 178.05 1q3s n LYS 317 N 2.77 2.18 0.04 2.72 5.02 -1.26 -4.65 118.16 124.99 1q3s n LYS 317 Ca -0.08 0.77 0.11 0.00 -2.02 0.00 0.00 58.31 57.09 1q3s n LYS 317 Cb 0.51 -2.39 0.56 0.00 -0.02 0.00 0.00 35.03 33.69 1q3s n LYS 317 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 1q3s h LYS 318 N 3.19 0.24 -0.10 1.97 3.64 -1.95 0.15 116.57 123.71 1q3s h LYS 318 Ca -0.46 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 58.80 1q3s h LYS 318 Cb 1.27 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1q3s h LYS 318 CO 0.67 0.16 -0.42 0.66 -2.27 0.00 0.00 179.45 178.25 1q3s h SER 319 N 0.24 0.23 -0.16 4.20 4.64 -2.00 -2.60 113.55 118.09 1q3s h SER 319 Ca 0.17 -0.09 -0.14 0.00 -0.47 0.00 0.00 61.79 61.25 1q3s h SER 319 Cb 0.37 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1q3s h SER 319 CO -0.03 0.62 -0.45 0.44 -0.87 0.00 0.00 176.83 176.54 1q3s h ASP 320 N 0.18 0.68 -0.61 4.97 3.45 -1.12 -2.70 116.42 121.27 1q3s h ASP 320 Ca 0.02 -0.58 0.07 0.00 0.43 0.00 0.00 57.03 56.96 1q3s h ASP 320 Cb 0.82 -0.20 -0.06 0.00 -0.56 0.00 0.00 39.33 39.33 1q3s h ASP 320 CO 0.06 1.14 0.31 0.24 -1.57 0.00 0.00 179.24 179.42 1q3s h MET 321 N 0.25 0.55 -0.12 3.56 2.86 -0.99 0.16 114.93 121.20 1q3s h MET 321 Ca -0.01 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.49 1q3s h MET 321 Cb 1.07 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 1q3s h MET 321 CO 0.10 0.36 -0.39 0.93 1.06 0.00 0.00 176.91 178.97 1q3s h GLU 322 N 0.56 0.25 -0.36 1.72 5.08 -1.47 0.12 114.58 120.49 1q3s h GLU 322 Ca 0.28 -0.12 -0.17 0.00 -1.00 0.00 0.00 59.36 58.36 1q3s h GLU 322 Cb 0.23 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1q3s h GLU 322 CO -0.21 0.61 -0.43 0.87 -1.00 0.00 0.00 179.01 178.85 1q3s h LYS 323 N 0.22 0.91 -0.63 2.33 1.57 -0.98 -1.27 116.57 118.72 1q3s h LYS 323 Ca 0.02 -0.51 -0.05 0.00 -1.87 0.00 0.00 60.65 58.25 1q3s h LYS 323 Cb 0.79 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 1q3s h LYS 323 CO 0.06 1.16 0.21 -0.07 -0.57 0.00 0.00 179.45 180.23 1q3s h LEU 324 N 0.73 0.89 -0.30 2.94 3.38 -0.39 -0.52 115.31 122.05 1q3s h LEU 324 Ca 0.05 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1q3s h LEU 324 Cb 1.03 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1q3s h LEU 324 CO 0.10 0.83 -0.01 0.00 0.09 0.00 0.00 178.44 179.45 1q3s h ALA 325 N 1.29 0.40 0.00 1.53 0.00 -0.69 -0.60 119.26 121.19 1q3s h ALA 325 Ca 0.21 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1q3s h ALA 325 Cb 0.25 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1q3s h ALA 325 CO -0.01 0.16 -0.32 0.87 0.00 0.00 0.00 179.25 179.95 1q3s h LYS 326 N 0.32 0.00 0.07 0.00 1.57 -0.99 -1.99 116.57 115.55 1q3s h LYS 326 Ca 0.08 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.64 1q3s h LYS 326 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1q3s h LYS 326 CO 0.02 0.32 -1.15 0.00 -0.57 0.00 0.00 179.45 178.07 1q3s h ALA 327 N 1.68 0.16 0.00 3.86 0.00 -0.97 0.80 119.26 124.79 1q3s h ALA 327 Ca -0.00 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 53.89 1q3s h ALA 327 Cb 0.87 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1q3s h ALA 327 CO 0.04 0.66 -0.73 0.25 0.00 0.00 0.00 179.25 179.48 1q3s n THR 328 N -4.14 0.29 -0.79 0.00 -2.24 -0.24 -3.92 114.28 103.23 1q3s n THR 328 Ca -0.24 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1q3s n THR 328 Cb 0.79 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 1q3s n THR 328 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1q3s n GLY 329 N 1.35 0.83 3.77 3.38 0.00 -0.75 -1.05 105.19 112.73 1q3s n GLY 329 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1q3s n GLY 329 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3s s ALA 330 N -3.25 2.16 -0.13 4.61 0.00 -1.23 -4.62 121.76 119.29 1q3s s ALA 330 Ca 0.00 0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.06 1q3s s ALA 330 Cb 0.00 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 1q3s s ALA 330 CO 0.00 -1.80 -0.17 0.15 0.00 0.00 0.00 175.76 173.94 1q3s s LYS 331 N -4.97 3.22 0.25 0.00 1.02 0.97 -4.66 119.74 115.56 1q3s s LYS 331 Ca 0.61 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 55.54 1q3s s LYS 331 Cb -0.16 -2.53 -0.09 0.00 -0.52 0.00 0.00 37.83 34.52 1q3s s LYS 331 CO 0.56 0.13 1.33 0.42 -0.92 0.00 0.00 175.35 176.87 1q3s s ILE 332 N 0.52 2.96 -0.03 2.17 1.01 -1.26 -4.43 121.20 122.13 1q3s s ILE 332 Ca -0.11 0.84 0.06 0.00 0.00 0.00 0.00 60.65 61.44 1q3s s ILE 332 Cb -0.16 -3.54 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1q3s s ILE 332 CO 0.04 0.15 -0.21 -0.69 0.00 0.00 0.00 174.94 174.24 1q3s s VAL 333 N -0.27 1.67 -0.16 2.92 1.01 -0.48 -4.97 120.40 120.11 1q3s s VAL 333 Ca 0.55 -0.88 0.20 0.00 0.00 0.00 0.00 61.98 61.85 1q3s s VAL 333 Cb -0.38 -1.40 -0.12 0.00 0.00 0.00 0.00 36.38 34.47 1q3s s VAL 333 CO 0.43 0.47 0.81 0.41 0.00 0.00 0.00 175.10 177.22 1q3s n THR 334 N 2.79 0.78 -3.92 3.92 -1.04 -1.26 -0.04 114.28 115.51 1q3s n THR 334 Ca -0.16 -0.61 -0.28 0.00 -2.04 0.00 0.00 64.05 60.95 1q3s n THR 334 Cb 0.53 -0.44 -0.16 0.00 -1.82 0.00 0.00 70.33 68.43 1q3s n THR 334 CO 0.00 0.00 0.00 0.21 -0.64 0.00 0.00 175.07 174.64 1q3s s ASN 335 N -5.39 2.75 0.33 8.00 3.84 -1.26 -4.51 114.94 118.70 1q3s s ASN 335 Ca -0.03 -0.60 0.02 0.00 0.21 0.00 0.00 52.86 52.45 1q3s s ASN 335 Cb 0.10 -0.96 0.58 0.00 -0.55 0.00 0.00 41.25 40.41 1q3s s ASN 335 CO 0.82 -0.15 1.96 -0.37 -2.79 0.00 0.00 177.10 176.56 1q3s h VAL 336 N 6.31 1.18 -0.91 -5.21 -1.51 -1.95 -2.45 116.25 111.71 1q3s h VAL 336 Ca -0.27 -0.45 0.25 0.00 -1.23 0.00 0.00 66.70 65.00 1q3s h VAL 336 Cb 1.12 0.39 -0.04 0.00 -2.13 0.00 0.00 31.29 30.62 1q3s h VAL 336 CO 0.42 0.20 0.64 0.11 -1.23 0.00 0.00 177.57 177.72 1q3s h LYS 337 N 0.82 0.07 -0.61 5.19 1.57 -1.93 0.28 116.57 121.96 1q3s h LYS 337 Ca 0.21 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1q3s h LYS 337 Cb 0.03 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1q3s h LYS 337 CO -0.03 0.05 0.00 -0.25 -0.57 0.00 0.00 179.45 178.64 1q3s n ASP 338 N -4.31 3.69 -4.74 0.86 9.92 -0.92 -4.97 116.55 116.07 1q3s n ASP 338 Ca 0.19 -1.99 -0.41 0.00 -0.53 0.00 0.00 54.79 52.05 1q3s n ASP 338 Cb 0.93 -0.40 -0.03 0.00 -0.64 0.00 0.00 41.12 40.98 1q3s n ASP 338 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1q3s s LEU 339 N -1.08 4.42 0.27 0.64 2.96 0.09 -5.03 118.68 120.94 1q3s s LEU 339 Ca 0.43 2.44 0.03 0.00 -0.22 0.00 0.00 54.13 56.81 1q3s s LEU 339 Cb 0.23 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 43.25 1q3s s LEU 339 CO 0.30 -0.54 0.04 0.42 -1.32 0.00 0.00 176.35 175.25 1q3s s THR 340 N 0.02 0.95 0.56 3.68 -4.23 -1.26 -4.91 115.64 110.44 1q3s s THR 340 Ca 0.56 -2.01 0.29 0.00 -1.18 0.00 0.00 61.69 59.35 1q3s s THR 340 Cb -0.37 -2.56 0.34 0.00 1.34 0.00 0.00 72.50 71.24 1q3s s THR 340 CO 0.40 -0.14 2.22 -0.65 -0.54 0.00 0.00 174.62 175.91 1q3s h PRO 341 N 2.34 0.00 0.00 3.99 0.11 -1.93 -1.51 132.00 135.00 1q3s h PRO 341 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1q3s h PRO 341 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1q3s h PRO 341 CO 0.65 0.02 0.00 0.93 -0.21 0.00 0.00 178.00 179.39 1q3s h GLU 342 N 0.00 0.00 0.00 1.05 3.07 -1.96 -2.48 114.58 114.27 1q3s h GLU 342 Ca -0.00 0.00 -0.23 0.00 -0.50 0.00 0.00 59.36 58.63 1q3s h GLU 342 Cb 0.06 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 27.93 1q3s h GLU 342 CO 0.00 0.00 -1.15 -0.44 -1.40 0.00 0.00 179.01 176.02 1q3s h ASP 343 N 0.00 0.00 -4.04 1.42 3.45 -1.63 -3.45 116.42 112.17 1q3s h ASP 343 Ca 0.00 0.00 -0.54 0.00 0.43 0.00 0.00 57.03 56.92 1q3s h ASP 343 Cb 0.42 0.00 0.12 0.00 -0.56 0.00 0.00 39.33 39.31 1q3s h ASP 343 CO 0.00 0.99 0.58 -0.76 -1.57 0.00 0.00 179.24 178.48 1q3s s LEU 344 N -6.56 3.89 0.45 1.55 1.43 -0.93 -0.02 118.68 118.49 1q3s s LEU 344 Ca -0.00 2.65 0.07 0.00 -1.03 0.00 0.00 54.13 55.81 1q3s s LEU 344 Cb 0.09 -4.26 -0.02 0.00 0.03 0.00 0.00 46.19 42.03 1q3s s LEU 344 CO 0.82 -1.40 0.29 -0.83 0.23 0.00 0.00 176.35 175.46 1q3s s GLY 345 N -1.06 2.32 -0.00 -3.19 0.00 0.25 -4.47 107.32 101.17 1q3s s GLY 345 Ca 0.69 -1.78 0.07 0.00 0.00 0.00 0.00 44.72 43.71 1q3s s GLY 345 CO 0.44 -1.87 -0.22 -0.47 0.00 0.00 0.00 173.10 170.99 1q3s s TYR 346 N -2.62 1.95 -0.02 1.90 5.04 -0.21 0.66 117.35 124.04 1q3s s TYR 346 Ca 0.40 -0.37 -0.00 0.00 -2.44 0.00 0.00 57.07 54.66 1q3s s TYR 346 Cb 0.00 -1.23 0.03 0.00 0.35 0.00 0.00 41.96 41.11 1q3s s TYR 346 CO 0.23 -0.00 0.04 0.00 -1.34 0.00 0.00 175.55 174.48 1q3s s ALA 347 N -0.57 0.08 0.55 3.97 0.00 -1.08 -4.00 121.76 120.70 1q3s s ALA 347 Ca 0.08 0.32 0.36 0.00 0.00 0.00 0.00 51.96 52.72 1q3s s ALA 347 Cb -0.09 -0.30 1.98 0.00 0.00 0.00 0.00 23.12 24.71 1q3s s ALA 347 CO -0.00 -0.15 2.25 1.49 0.00 0.00 0.00 175.76 179.35 1q3s h GLU 348 N 7.41 0.00 -1.75 0.00 4.81 -0.71 -1.94 114.58 122.41 1q3s h GLU 348 Ca -0.43 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 58.87 1q3s h GLU 348 Cb 1.12 0.00 -0.24 0.00 0.63 0.00 0.00 28.75 30.26 1q3s h GLU 348 CO 0.44 0.02 0.23 0.08 -0.73 0.00 0.00 179.01 179.06 1q3s s VAL 349 N -4.28 0.00 -0.28 0.32 1.01 -1.08 -4.17 120.40 111.92 1q3s s VAL 349 Ca -0.04 0.00 0.01 0.00 0.00 0.00 0.00 61.98 61.95 1q3s s VAL 349 Cb 0.13 -1.00 0.08 0.00 0.00 0.00 0.00 36.38 35.60 1q3s s VAL 349 CO 0.50 0.00 0.02 -0.69 0.00 0.00 0.00 175.10 174.93 1q3s s VAL 350 N 1.36 1.49 0.06 2.92 1.01 -0.81 -1.96 120.40 124.48 1q3s s VAL 350 Ca -0.08 -1.55 0.05 0.00 0.00 0.00 0.00 61.98 60.40 1q3s s VAL 350 Cb -0.04 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1q3s s VAL 350 CO -0.16 -0.42 -0.15 -0.70 0.00 0.00 0.00 175.10 173.68 1q3s s GLU 351 N 1.35 0.88 -0.44 2.72 2.12 -0.80 -1.22 118.70 123.31 1q3s s GLU 351 Ca 0.04 -0.91 -0.17 0.00 0.36 0.00 0.00 54.97 54.29 1q3s s GLU 351 Cb -0.18 -0.91 0.03 0.00 0.26 0.00 0.00 34.13 33.34 1q3s s GLU 351 CO -0.13 0.21 0.45 -2.00 -0.54 0.00 0.00 175.26 173.26 1q3s s GLU 352 N -1.56 3.08 0.06 4.30 2.12 -0.43 -0.50 118.70 125.76 1q3s s GLU 352 Ca -0.00 -0.87 0.06 0.00 0.36 0.00 0.00 54.97 54.51 1q3s s GLU 352 Cb -0.09 -4.01 -0.04 0.00 0.26 0.00 0.00 34.13 30.25 1q3s s GLU 352 CO 0.02 -0.93 -0.09 1.03 -0.54 0.00 0.00 175.26 174.75 1q3s s ARG 353 N 2.12 2.29 -0.83 4.30 0.52 -0.77 -4.93 118.95 121.65 1q3s s ARG 353 Ca 0.11 -0.91 -0.15 0.00 -0.52 0.00 0.00 55.73 54.26 1q3s s ARG 353 Cb -0.18 -2.37 0.20 0.00 0.52 0.00 0.00 34.95 33.11 1q3s s ARG 353 CO 0.12 0.55 0.83 0.21 0.02 0.00 0.00 175.30 177.02 1q3s s LYS 354 N -1.84 3.56 -0.39 3.54 2.20 -1.26 -1.33 119.74 124.22 1q3s s LYS 354 Ca 0.19 -2.26 -0.19 0.00 -0.36 0.00 0.00 55.97 53.35 1q3s s LYS 354 Cb -0.11 -4.51 0.01 0.00 -1.51 0.00 0.00 37.83 31.71 1q3s s LYS 354 CO 0.11 -1.39 0.56 -1.17 -0.36 0.00 0.00 175.35 173.09 1q3s s LEU 355 N 0.79 4.48 -1.19 5.43 2.96 0.14 -4.25 118.68 127.03 1q3s s LEU 355 Ca 0.20 -0.23 -0.01 0.00 -0.22 0.00 0.00 54.13 53.88 1q3s s LEU 355 Cb -0.10 -2.62 -0.01 0.00 0.50 0.00 0.00 46.19 43.95 1q3s s LEU 355 CO -0.08 -0.61 0.97 0.00 -1.32 0.00 0.00 176.35 175.30 1q3s n ALA 356 N 5.94 -2.08 0.00 5.97 0.00 -1.26 -2.22 120.51 126.85 1q3s n ALA 356 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1q3s n ALA 356 Cb 0.48 -2.81 0.00 0.00 0.00 0.00 0.00 19.45 17.12 1q3s n ALA 356 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3s n GLY 357 N -1.18 2.26 3.84 0.00 0.00 -1.26 -4.97 105.19 103.88 1q3s n GLY 357 Ca -0.26 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 1q3s n GLY 357 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q3s s GLU 358 N 0.00 3.92 -0.00 1.61 8.01 -0.94 -5.01 118.70 126.28 1q3s s GLU 358 Ca 0.00 0.41 -0.19 0.00 0.01 0.00 0.00 54.97 55.20 1q3s s GLU 358 Cb 0.00 -3.15 -0.06 0.00 -4.31 0.00 0.00 34.13 26.62 1q3s s GLU 358 CO 0.00 0.64 0.53 -0.80 0.01 0.00 0.00 175.26 175.64 1q3s s ASN 359 N -1.28 6.92 0.09 -0.19 0.01 -1.26 0.27 114.94 119.49 1q3s s ASN 359 Ca 0.27 1.09 -0.03 0.00 -0.71 0.00 0.00 52.86 53.48 1q3s s ASN 359 Cb -0.16 -2.33 -0.03 0.00 0.41 0.00 0.00 41.25 39.14 1q3s s ASN 359 CO 0.15 0.17 0.06 -0.04 -1.51 0.00 0.00 177.10 175.93 1q3s s MET 360 N -0.44 0.78 -0.22 -0.60 -1.94 -0.44 -4.13 119.30 112.31 1q3s s MET 360 Ca 0.28 -1.22 -0.03 0.00 -1.71 0.00 0.00 55.69 53.02 1q3s s MET 360 Cb -0.18 0.26 0.00 0.00 2.01 0.00 0.00 34.83 36.92 1q3s s MET 360 CO 0.16 -0.21 -0.06 0.42 -0.01 0.00 0.00 175.02 175.32 1q3s s ILE 361 N -3.94 3.17 -0.38 2.53 1.01 0.16 -1.84 121.20 121.90 1q3s s ILE 361 Ca 0.12 -0.63 -0.16 0.00 0.00 0.00 0.00 60.65 59.97 1q3s s ILE 361 Cb 0.07 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 40.08 1q3s s ILE 361 CO -0.06 0.39 0.39 -0.36 0.00 0.00 0.00 174.94 175.29 1q3s s PHE 362 N 1.44 3.20 -0.89 3.97 0.40 0.34 -1.08 117.98 125.35 1q3s s PHE 362 Ca 0.05 -0.21 -0.09 0.00 -0.60 0.00 0.00 56.93 56.08 1q3s s PHE 362 Cb -0.15 -2.76 0.23 0.00 0.51 0.00 0.00 43.02 40.86 1q3s s PHE 362 CO -0.04 -0.55 0.82 0.08 0.70 0.00 0.00 175.22 176.22 1q3s s VAL 363 N 2.04 5.22 0.47 -0.44 1.01 0.14 -1.90 120.40 126.94 1q3s s VAL 363 Ca 0.11 -3.07 0.07 0.00 0.00 0.00 0.00 61.98 59.09 1q3s s VAL 363 Cb -0.17 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 31.99 1q3s s VAL 363 CO 0.12 -1.06 0.33 -1.83 0.00 0.00 0.00 175.10 172.66 1q3s s GLU 364 N -0.56 2.33 -0.99 2.72 -1.05 -0.83 -0.37 118.70 119.95 1q3s s GLU 364 Ca 0.23 -1.83 -0.05 0.00 -0.15 0.00 0.00 54.97 53.17 1q3s s GLU 364 Cb -0.11 -2.14 0.01 0.00 -0.44 0.00 0.00 34.13 31.44 1q3s s GLU 364 CO -0.08 -0.35 0.71 0.41 0.95 0.00 0.00 175.26 176.89 1q3s n GLY 365 N -1.55 -0.11 3.81 -3.83 0.00 -1.17 -2.59 105.19 99.74 1q3s n GLY 365 Ca -0.00 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1q3s n GLY 365 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3s n LYS 367 N -2.72 0.00 -3.21 0.00 4.81 -1.26 -4.42 118.16 111.36 1q3s n LYS 367 Ca 0.08 0.00 -0.24 0.00 -0.87 0.00 0.00 58.31 57.28 1q3s n LYS 367 Cb 0.53 -0.27 -0.06 0.00 0.02 0.00 0.00 35.03 35.25 1q3s n LYS 367 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1q3s n ASN 368 N 0.00 1.67 -4.51 3.14 5.15 -1.26 -5.09 115.26 114.37 1q3s n ASN 368 Ca 0.00 -3.06 -0.48 0.00 -0.60 0.00 0.00 54.58 50.44 1q3s n ASN 368 Cb 0.00 -0.63 -0.03 0.00 -0.53 0.00 0.00 39.78 38.58 1q3s n ASN 368 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1q3s n PRO 369 N 0.83 0.65 0.00 1.20 -0.04 -1.25 -4.89 135.00 131.50 1q3s n PRO 369 Ca 0.25 0.23 0.09 0.00 -0.04 0.00 0.00 63.50 64.03 1q3s n PRO 369 Cb 0.51 -1.51 0.01 0.00 -0.04 0.00 0.00 33.50 32.48 1q3s n PRO 369 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1q3s n LYS 370 N 1.17 1.55 -3.81 0.54 3.00 0.27 -4.53 118.16 116.35 1q3s n LYS 370 Ca 0.15 -1.04 -0.14 0.00 -0.00 0.00 0.00 58.31 57.28 1q3s n LYS 370 Cb 0.25 -1.35 -0.15 0.00 0.00 0.00 0.00 35.03 33.77 1q3s n LYS 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1q3s s ALA 371 N -2.01 0.05 0.27 3.14 0.00 -1.23 -4.64 121.76 117.34 1q3s s ALA 371 Ca 0.17 0.20 0.02 0.00 0.00 0.00 0.00 51.96 52.34 1q3s s ALA 371 Cb 0.15 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 23.06 1q3s s ALA 371 CO 0.42 -0.07 0.08 0.54 0.00 0.00 0.00 175.76 176.74 1q3s s VAL 372 N 0.67 0.72 0.00 0.00 0.11 -0.43 -4.32 120.40 117.16 1q3s s VAL 372 Ca -0.06 -2.00 0.04 0.00 -2.93 0.00 0.00 61.98 57.03 1q3s s VAL 372 Cb -0.08 -2.67 -0.01 0.00 -1.53 0.00 0.00 36.38 32.09 1q3s s VAL 372 CO -0.02 -0.01 -0.12 -0.89 -3.33 0.00 0.00 175.10 170.73 1q3s s THR 373 N -3.64 0.94 -0.28 5.04 2.01 -0.92 -1.21 115.64 117.58 1q3s s THR 373 Ca 0.37 -0.61 -0.02 0.00 0.31 0.00 0.00 61.69 61.74 1q3s s THR 373 Cb 0.08 -0.80 0.03 0.00 0.01 0.00 0.00 72.50 71.82 1q3s s THR 373 CO 0.14 0.18 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.61 1q3s s ILE 374 N -0.42 3.06 -0.25 1.82 1.01 -0.27 0.42 121.20 126.58 1q3s s ILE 374 Ca 0.03 -1.14 -0.26 0.00 0.00 0.00 0.00 60.65 59.28 1q3s s ILE 374 Cb -0.05 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.77 1q3s s ILE 374 CO -0.00 0.05 0.89 -0.22 0.00 0.00 0.00 174.94 175.65 1q3s s LEU 375 N 1.32 4.08 -0.20 2.97 2.96 -0.19 -0.70 118.68 128.91 1q3s s LEU 375 Ca -0.02 1.07 -0.08 0.00 -0.22 0.00 0.00 54.13 54.88 1q3s s LEU 375 Cb -0.18 -3.27 -0.04 0.00 0.50 0.00 0.00 46.19 43.19 1q3s s LEU 375 CO -0.02 -0.58 0.09 -0.63 -1.32 0.00 0.00 176.35 173.89 1q3s s ILE 376 N 2.98 4.94 0.04 6.68 1.01 0.23 -1.64 121.20 135.45 1q3s s ILE 376 Ca 0.37 0.03 0.09 0.00 0.00 0.00 0.00 60.65 61.14 1q3s s ILE 376 Cb -0.15 -3.26 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 1q3s s ILE 376 CO 0.08 0.42 -0.25 -0.13 0.00 0.00 0.00 174.94 175.06 1q3s s ARG 377 N 0.66 1.72 -0.17 2.79 1.81 -1.26 -1.26 118.95 123.23 1q3s s ARG 377 Ca 0.05 -1.08 -0.35 0.00 -1.72 0.00 0.00 55.73 52.64 1q3s s ARG 377 Cb -0.13 -1.88 0.14 0.00 -0.45 0.00 0.00 34.95 32.62 1q3s s ARG 377 CO 0.01 0.49 1.20 0.20 -0.68 0.00 0.00 175.30 176.52 1q3s s GLY 378 N -1.22 -0.31 0.13 -3.53 0.00 -0.54 -2.16 107.32 99.69 1q3s s GLY 378 Ca 0.11 1.53 -0.21 0.00 0.00 0.00 0.00 44.72 46.15 1q3s s GLY 378 CO 0.02 0.50 1.69 -1.33 0.00 0.00 0.00 173.10 173.99 1q3s h GLY 379 N 2.00 0.05 -2.15 0.20 0.00 -1.66 0.29 103.07 101.81 1q3s h GLY 379 Ca -0.11 0.10 -0.53 0.00 0.00 0.00 0.00 47.33 46.79 1q3s h GLY 379 CO 0.23 -0.10 -0.68 -1.08 0.00 0.00 0.00 176.54 174.92 1q3s s THR 380 N -6.18 1.83 0.23 4.70 -1.32 -1.26 -4.18 115.64 109.45 1q3s s THR 380 Ca -0.14 -2.15 -0.07 0.00 -1.21 0.00 0.00 61.69 58.12 1q3s s THR 380 Cb 0.10 -2.50 0.18 0.00 -1.51 0.00 0.00 72.50 68.77 1q3s s THR 380 CO 0.68 -0.28 1.74 -0.08 -2.21 0.00 0.00 174.62 174.47 1q3s h GLU 381 N 2.21 0.43 0.12 7.08 4.57 -2.00 -1.90 114.58 125.09 1q3s h GLU 381 Ca -0.40 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 57.75 1q3s h GLU 381 Cb 1.24 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.73 1q3s h GLU 381 CO 0.68 0.29 -0.09 0.45 -1.18 0.00 0.00 179.01 179.16 1q3s h HIS 382 N 0.45 -0.22 -0.85 0.92 3.86 -1.97 0.39 115.15 117.73 1q3s h HIS 382 Ca 0.36 -0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.69 1q3s h HIS 382 Cb 0.48 0.08 -0.08 0.00 1.06 0.00 0.00 27.41 28.94 1q3s h HIS 382 CO -0.16 -0.14 0.47 0.28 0.86 0.00 0.00 177.93 179.24 1q3s h VAL 383 N -0.21 0.82 0.72 2.45 2.07 -1.77 -1.96 116.25 118.37 1q3s h VAL 383 Ca -0.01 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 67.23 1q3s h VAL 383 Cb 0.19 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.00 1q3s h VAL 383 CO -0.00 0.13 -0.35 0.40 0.02 0.00 0.00 177.57 177.77 1q3s h ILE 384 N 0.72 0.00 -0.91 4.57 2.04 -0.83 -2.22 117.51 120.88 1q3s h ILE 384 Ca 0.44 -0.10 0.22 0.00 1.00 0.00 0.00 64.86 66.42 1q3s h ILE 384 Cb 0.52 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.48 1q3s h ILE 384 CO -0.31 0.00 0.42 0.44 0.00 0.00 0.00 178.15 178.71 1q3s h ASP 385 N -1.07 0.38 0.21 1.72 3.32 -0.71 0.18 116.42 120.46 1q3s h ASP 385 Ca -0.10 0.15 -0.14 0.00 0.02 0.00 0.00 57.03 56.97 1q3s h ASP 385 Cb 0.74 0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 1q3s h ASP 385 CO 0.16 0.01 -0.52 -0.08 -1.72 0.00 0.00 179.24 177.10 1q3s h GLU 386 N 0.43 0.34 -0.33 3.56 4.57 -1.36 -2.19 114.58 119.60 1q3s h GLU 386 Ca 0.57 -0.20 -0.14 0.00 -1.18 0.00 0.00 59.36 58.41 1q3s h GLU 386 Cb 1.09 0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.69 1q3s h GLU 386 CO -0.52 0.78 -0.36 0.28 -1.18 0.00 0.00 179.01 178.01 1q3s h VAL 387 N 0.27 1.28 -0.45 0.32 2.07 -0.39 0.92 116.25 120.27 1q3s h VAL 387 Ca 0.01 -1.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.00 1q3s h VAL 387 Cb 1.00 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1q3s h VAL 387 CO 0.09 0.50 0.27 -0.08 0.02 0.00 0.00 177.57 178.36 1q3s h GLU 388 N 0.63 0.61 -0.07 1.57 4.81 -0.92 0.23 114.58 121.44 1q3s h GLU 388 Ca 0.06 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1q3s h GLU 388 Cb 0.90 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 1q3s h GLU 388 CO 0.08 0.45 0.02 0.00 -0.73 0.00 0.00 179.01 178.84 1q3s h ARG 389 N 0.60 0.06 -0.45 1.92 3.08 -1.08 0.40 114.38 118.90 1q3s h ARG 389 Ca 0.16 -0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.28 1q3s h ARG 389 Cb 0.00 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 29.97 1q3s h ARG 389 CO -0.03 0.04 0.09 0.00 -1.07 0.00 0.00 179.97 179.00 1q3s h ALA 390 N 1.04 0.50 -0.75 0.04 0.00 -0.46 -2.45 119.26 117.19 1q3s h ALA 390 Ca 0.03 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1q3s h ALA 390 Cb 0.01 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1q3s h ALA 390 CO -0.03 -0.31 0.31 -0.07 0.00 0.00 0.00 179.25 179.15 1q3s h LEU 391 N 0.23 1.02 -1.35 0.00 3.38 -0.48 -0.18 115.31 117.94 1q3s h LEU 391 Ca 0.22 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1q3s h LEU 391 Cb 0.29 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1q3s h LEU 391 CO -0.29 0.91 0.22 -0.33 0.09 0.00 0.00 178.44 179.04 1q3s h GLU 392 N 1.08 0.67 -0.02 1.13 5.08 -0.50 0.71 114.58 122.73 1q3s h GLU 392 Ca 0.25 -0.08 -0.21 0.00 -1.00 0.00 0.00 59.36 58.32 1q3s h GLU 392 Cb 0.20 -0.13 0.02 0.00 0.50 0.00 0.00 28.75 29.33 1q3s h GLU 392 CO -0.02 0.53 -0.80 -0.44 -1.00 0.00 0.00 179.01 177.27 1q3s h ASP 393 N 0.67 0.74 -0.81 1.42 3.32 -1.12 -1.52 116.42 119.11 1q3s h ASP 393 Ca 0.17 -0.73 0.04 0.00 0.02 0.00 0.00 57.03 56.52 1q3s h ASP 393 Cb 0.08 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.36 1q3s h ASP 393 CO -0.02 1.37 0.51 0.00 -1.72 0.00 0.00 179.24 179.38 1q3s h ALA 394 N 0.38 1.08 -0.29 3.45 0.00 -0.02 -0.60 119.26 123.26 1q3s h ALA 394 Ca -0.10 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1q3s h ALA 394 Cb 1.48 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1q3s h ALA 394 CO 0.16 0.30 -0.24 0.28 0.00 0.00 0.00 179.25 179.75 1q3s h VAL 395 N 0.98 1.30 -0.21 0.00 2.07 0.40 -2.94 116.25 117.84 1q3s h VAL 395 Ca 0.33 -1.39 -0.05 0.00 0.82 0.00 0.00 66.70 66.41 1q3s h VAL 395 Cb 0.06 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 1q3s h VAL 395 CO -0.13 0.45 -0.09 0.11 0.02 0.00 0.00 177.57 177.92 1q3s h LYS 396 N 0.43 0.33 -0.01 1.57 1.57 -0.69 -1.13 116.57 118.64 1q3s h LYS 396 Ca 0.05 -0.08 -0.21 0.00 -1.87 0.00 0.00 60.65 58.55 1q3s h LYS 396 Cb 0.80 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.06 1q3s h LYS 396 CO 0.06 0.44 -0.90 -0.39 -0.57 0.00 0.00 179.45 178.09 1q3s h VAL 397 N 0.32 1.43 -0.70 0.50 -1.51 -1.13 -2.63 116.25 112.52 1q3s h VAL 397 Ca 0.07 -2.47 -0.07 0.00 -1.23 0.00 0.00 66.70 62.99 1q3s h VAL 397 Cb 0.37 2.40 -0.03 0.00 -2.13 0.00 0.00 31.29 31.90 1q3s h VAL 397 CO 0.02 0.73 0.15 0.58 -1.23 0.00 0.00 177.57 177.82 1q3s h VAL 398 N 0.20 1.26 -0.96 7.19 2.07 -1.29 -1.99 116.25 122.72 1q3s h VAL 398 Ca -0.06 -1.00 0.03 0.00 0.82 0.00 0.00 66.70 66.49 1q3s h VAL 398 Cb 1.53 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 31.81 1q3s h VAL 398 CO 0.15 0.38 0.63 0.50 0.02 0.00 0.00 177.57 179.26 1q3s h LYS 399 N 1.06 1.21 0.13 1.57 3.64 -1.11 -2.13 116.57 120.93 1q3s h LYS 399 Ca 0.22 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1q3s h LYS 399 Cb 0.40 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1q3s h LYS 399 CO 0.01 0.80 -0.06 -0.44 -2.27 0.00 0.00 179.45 177.48 1q3s h ASP 400 N 1.24 -0.14 0.15 4.20 3.32 -1.01 -2.52 116.42 121.66 1q3s h ASP 400 Ca 0.37 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 1q3s h ASP 400 Cb -0.04 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.54 1q3s h ASP 400 CO -0.11 0.10 -0.14 0.58 -1.72 0.00 0.00 179.24 177.95 1q3s h VAL 401 N -0.39 1.06 0.00 -1.35 2.07 -1.21 0.33 116.25 116.76 1q3s h VAL 401 Ca -0.02 -0.49 -0.19 0.00 0.82 0.00 0.00 66.70 66.82 1q3s h VAL 401 Cb 0.32 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1q3s h VAL 401 CO 0.03 0.14 -0.86 0.24 0.02 0.00 0.00 177.57 177.14 1q3s h MET 402 N 0.00 0.17 0.07 1.57 2.86 -1.31 0.11 114.93 118.39 1q3s h MET 402 Ca -0.00 -0.18 -0.31 0.00 -2.06 0.00 0.00 59.70 57.15 1q3s h MET 402 Cb 0.25 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 1q3s h MET 402 CO 0.02 0.93 -1.66 0.93 1.06 0.00 0.00 176.91 178.18 1q3s h GLU 403 N 0.09 0.15 0.03 1.72 5.08 -1.00 -3.38 114.58 117.27 1q3s h GLU 403 Ca -0.04 -0.26 -0.26 0.00 -1.00 0.00 0.00 59.36 57.81 1q3s h GLU 403 Cb 1.48 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.80 1q3s h GLU 403 CO 0.13 0.92 -1.40 -0.44 -1.00 0.00 0.00 179.01 177.22 1q3s h ASP 404 N 0.04 0.09 -0.92 1.42 3.45 -0.44 -3.45 116.42 116.60 1q3s h ASP 404 Ca -0.28 -0.60 -0.08 0.00 0.43 0.00 0.00 57.03 56.49 1q3s h ASP 404 Cb 2.00 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 40.75 1q3s h ASP 404 CO 0.11 1.56 -0.12 0.61 -1.57 0.00 0.00 179.24 179.84 1q3s n GLY 405 N 1.54 0.30 3.10 2.75 0.00 0.37 -4.99 105.19 108.26 1q3s n GLY 405 Ca -0.32 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1q3s n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3s s ALA 406 N -2.41 -0.51 0.27 4.61 0.00 -1.26 -0.89 121.76 121.57 1q3s s ALA 406 Ca 0.03 0.51 0.02 0.00 0.00 0.00 0.00 51.96 52.52 1q3s s ALA 406 Cb -0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 1q3s s ALA 406 CO 0.03 -0.12 0.17 0.14 0.00 0.00 0.00 175.76 175.98 1q3s s VAL 407 N -0.11 0.18 0.09 0.00 -7.23 -0.53 -2.65 120.40 110.15 1q3s s VAL 407 Ca -0.02 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.09 1q3s s VAL 407 Cb -0.02 -2.52 -0.01 0.00 0.56 0.00 0.00 36.38 34.39 1q3s s VAL 407 CO 0.01 0.00 0.13 -0.76 -0.31 0.00 0.00 175.10 174.17 1q3s s LEU 408 N -3.30 1.69 0.69 1.32 1.43 -0.29 -0.33 118.68 119.89 1q3s s LEU 408 Ca 0.38 -0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 52.56 1q3s s LEU 408 Cb 0.05 0.78 0.01 0.00 0.03 0.00 0.00 46.19 47.06 1q3s s LEU 408 CO 0.17 -0.71 1.07 -2.16 0.23 0.00 0.00 176.35 174.95 1q3s s PRO 409 N -3.90 2.86 0.00 1.29 0.04 -1.26 -0.88 135.00 133.15 1q3s s PRO 409 Ca 0.08 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.21 1q3s s PRO 409 Cb 0.06 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.62 1q3s s PRO 409 CO -0.09 -1.17 0.00 0.00 0.04 0.00 0.00 177.00 175.78 1q3s n ALA 410 N -2.93 0.00 -3.88 8.56 0.00 -0.91 -4.30 120.51 117.05 1q3s n ALA 410 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.25 1q3s n ALA 410 Cb 0.53 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.99 1q3s n ALA 410 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3s n GLY 411 N 5.00 -0.36 3.02 0.00 0.00 -1.26 -1.58 105.19 110.01 1q3s n GLY 411 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1q3s n GLY 411 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3s n GLY 412 N -1.68 0.33 0.37 -0.02 0.00 -1.26 -0.75 105.19 102.17 1q3s n GLY 412 Ca -0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.90 1q3s n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q3s h ALA 413 N 0.00 1.44 -0.17 4.61 0.00 -1.50 -1.42 119.26 122.22 1q3s h ALA 413 Ca 0.00 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.67 1q3s h ALA 413 Cb 0.30 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.79 1q3s h ALA 413 CO 0.00 0.44 -0.72 -1.35 0.00 0.00 0.00 179.25 177.61 1q3s h PRO 414 N 1.13 0.79 -0.03 0.00 0.11 -1.82 -2.36 132.00 129.81 1q3s h PRO 414 Ca 0.40 -0.62 -0.09 0.00 0.11 0.00 0.00 66.00 65.80 1q3s h PRO 414 Cb 0.12 0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.35 1q3s h PRO 414 CO -0.14 1.23 -0.39 1.05 -0.21 0.00 0.00 178.00 179.54 1q3s h GLU 415 N 0.52 0.07 -0.17 1.05 9.09 -1.83 0.11 114.58 123.43 1q3s h GLU 415 Ca -0.04 -0.03 -0.15 0.00 0.05 0.00 0.00 59.36 59.19 1q3s h GLU 415 Cb 1.35 -0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.44 1q3s h GLU 415 CO 0.15 0.45 -0.52 0.82 0.05 0.00 0.00 179.01 179.96 1q3s h ILE 416 N 0.06 1.33 -0.15 -1.06 2.04 -1.23 0.23 117.51 118.72 1q3s h ILE 416 Ca 0.00 -1.77 -0.04 0.00 1.00 0.00 0.00 64.86 64.05 1q3s h ILE 416 Cb 0.71 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.56 1q3s h ILE 416 CO 0.05 0.54 -0.07 -0.08 0.00 0.00 0.00 178.15 178.59 1q3s h GLU 417 N 0.36 0.32 -0.69 2.37 4.57 -0.85 -2.14 114.58 118.52 1q3s h GLU 417 Ca 0.01 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 1q3s h GLU 417 Cb 1.04 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.58 1q3s h GLU 417 CO 0.09 0.64 0.41 -0.07 -1.18 0.00 0.00 179.01 178.90 1q3s h LEU 418 N -0.01 0.83 0.13 1.64 3.38 -0.56 -0.78 115.31 119.94 1q3s h LEU 418 Ca 0.03 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1q3s h LEU 418 Cb 0.54 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1q3s h LEU 418 CO 0.02 0.64 -0.06 0.00 0.09 0.00 0.00 178.44 179.14 1q3s h ALA 419 N 1.50 -0.77 -0.96 1.53 0.00 -0.49 0.48 119.26 120.55 1q3s h ALA 419 Ca 0.25 -0.04 0.30 0.00 0.00 0.00 0.00 54.91 55.43 1q3s h ALA 419 Cb -0.02 0.07 -0.16 0.00 0.00 0.00 0.00 17.79 17.67 1q3s h ALA 419 CO -0.05 -0.76 0.30 0.82 0.00 0.00 0.00 179.25 179.57 1q3s h ILE 420 N -0.22 0.15 0.01 0.00 2.04 -1.37 -2.05 117.51 116.07 1q3s h ILE 420 Ca -0.02 -0.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 1q3s h ILE 420 Cb 0.13 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1q3s h ILE 420 CO 0.03 0.02 -0.00 -0.09 0.00 0.00 0.00 178.15 178.11 1q3s h ARG 421 N 0.12 -0.01 0.00 2.37 9.65 -1.16 -3.32 114.38 122.03 1q3s h ARG 421 Ca 0.67 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.55 1q3s h ARG 421 Cb 1.52 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.10 1q3s h ARG 421 CO -0.75 0.79 0.03 1.28 2.80 0.00 0.00 179.97 184.12 1q3s n LEU 422 N -4.66 0.00 0.06 3.80 4.77 0.17 -0.17 117.00 120.97 1q3s n LEU 422 Ca -0.08 0.20 0.04 0.00 -0.03 0.00 0.00 56.01 56.14 1q3s n LEU 422 Cb 0.39 -0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 1q3s n LEU 422 CO 0.28 -0.20 -0.16 -0.78 -1.33 0.00 0.00 177.39 175.20 1q3s h ASP 423 N 0.00 0.00 0.03 -1.43 1.82 -1.55 -2.93 116.42 112.36 1q3s h ASP 423 Ca 0.00 0.00 -0.19 0.00 -0.39 0.00 0.00 57.03 56.45 1q3s h ASP 423 Cb 0.06 0.00 0.02 0.00 0.68 0.00 0.00 39.33 40.09 1q3s h ASP 423 CO 0.00 0.38 -0.76 -0.33 -1.61 0.00 0.00 179.24 176.91 1q3s h GLU 424 N 0.00 0.47 -0.65 0.28 4.39 -0.72 -2.69 114.58 115.65 1q3s h GLU 424 Ca -0.10 -0.54 0.07 0.00 0.34 0.00 0.00 59.36 59.12 1q3s h GLU 424 Cb 1.38 0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 30.15 1q3s h GLU 424 CO 0.03 1.19 0.43 -0.92 -1.16 0.00 0.00 179.01 178.58 1q3s h TYR 425 N -0.02 0.65 0.54 4.33 3.20 -1.61 -1.52 116.97 122.54 1q3s h TYR 425 Ca -0.10 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 1q3s h TYR 425 Cb 1.48 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 39.54 1q3s h TYR 425 CO 0.14 0.34 -0.28 0.00 -1.64 0.00 0.00 178.16 176.72 1q3s h ALA 426 N 1.65 -0.76 -0.38 1.82 0.00 -1.34 -1.25 119.26 119.00 1q3s h ALA 426 Ca 0.28 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.11 1q3s h ALA 426 Cb 0.29 0.32 -0.09 0.00 0.00 0.00 0.00 17.79 18.31 1q3s h ALA 426 CO -0.09 -0.93 -0.32 0.87 0.00 0.00 0.00 179.25 178.78 1q3s h LYS 427 N -0.76 -0.25 -0.46 0.00 1.79 -0.98 0.12 116.57 116.04 1q3s h LYS 427 Ca -0.07 0.02 0.09 0.00 -2.18 0.00 0.00 60.65 58.51 1q3s h LYS 427 Cb 0.59 0.06 -0.09 0.00 -1.58 0.00 0.00 32.23 31.21 1q3s h LYS 427 CO 0.11 -0.16 -0.10 1.96 -1.08 0.00 0.00 179.45 180.17 1q3s h GLN 428 N -0.26 0.01 -0.07 3.15 4.20 -1.16 -1.95 115.11 119.03 1q3s h GLN 428 Ca 0.17 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1q3s h GLN 428 Cb 0.53 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 1q3s h GLN 428 CO -0.52 0.01 0.05 0.28 -0.67 0.00 0.00 178.83 177.97 1q3s h VAL 429 N 0.01 1.04 -3.10 -0.54 2.07 -0.07 -3.49 116.25 112.18 1q3s h VAL 429 Ca 0.22 -0.10 0.31 0.00 0.82 0.00 0.00 66.70 67.95 1q3s h VAL 429 Cb 0.34 0.98 -0.16 0.00 -1.52 0.00 0.00 31.29 30.92 1q3s h VAL 429 CO -0.46 0.04 -1.09 0.61 0.02 0.00 0.00 177.57 176.69 1q3s n GLY 430 N -1.04 -3.20 4.88 2.17 0.00 0.32 -4.83 105.19 103.51 1q3s n GLY 430 Ca -0.06 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.86 1q3s n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q3s n GLY 431 N -4.09 -0.97 0.34 -0.02 0.00 -1.26 -3.52 105.19 95.66 1q3s n GLY 431 Ca -0.08 -1.43 -0.05 0.00 0.00 0.00 0.00 46.02 44.46 1q3s n GLY 431 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1q3s h LYS 432 N 0.00 1.17 -0.45 1.61 1.79 -1.99 -2.80 116.57 115.90 1q3s h LYS 432 Ca 0.00 -0.18 0.05 0.00 -2.18 0.00 0.00 60.65 58.33 1q3s h LYS 432 Cb 0.00 -0.21 -0.04 0.00 -1.58 0.00 0.00 32.23 30.40 1q3s h LYS 432 CO 0.00 0.91 0.20 0.93 -1.08 0.00 0.00 179.45 180.42 1q3s h GLU 433 N 1.15 0.40 -0.76 3.15 3.07 -1.85 -1.47 114.58 118.27 1q3s h GLU 433 Ca 0.28 -0.02 0.22 0.00 -0.50 0.00 0.00 59.36 59.33 1q3s h GLU 433 Cb 0.14 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 27.93 1q3s h GLU 433 CO -0.03 0.26 0.56 0.00 -1.40 0.00 0.00 179.01 178.40 1q3s h ALA 434 N 1.26 2.71 -0.31 3.43 0.00 -1.54 0.84 119.26 125.66 1q3s h ALA 434 Ca 0.20 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1q3s h ALA 434 Cb 0.15 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1q3s h ALA 434 CO -0.17 -0.95 -0.09 -0.07 0.00 0.00 0.00 179.25 177.97 1q3s h LEU 435 N 0.00 0.61 -0.32 0.00 4.07 -1.27 -0.30 115.31 118.10 1q3s h LEU 435 Ca 0.36 -0.38 -0.07 0.00 0.08 0.00 0.00 57.88 57.87 1q3s h LEU 435 Cb 1.48 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 43.04 1q3s h LEU 435 CO -0.00 0.85 -0.08 0.00 -1.08 0.00 0.00 178.44 178.12 1q3s h ALA 436 N 0.78 0.45 -0.74 1.53 0.00 -0.89 -1.82 119.26 118.57 1q3s h ALA 436 Ca 0.08 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1q3s h ALA 436 Cb 0.59 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1q3s h ALA 436 CO 0.03 0.29 0.45 0.82 0.00 0.00 0.00 179.25 180.83 1q3s h ILE 437 N 0.41 1.21 -0.37 0.00 2.04 -0.92 0.68 117.51 120.55 1q3s h ILE 437 Ca 0.08 -0.46 -0.13 0.00 1.00 0.00 0.00 64.86 65.35 1q3s h ILE 437 Cb 0.58 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1q3s h ILE 437 CO 0.03 0.22 -0.30 -0.33 0.00 0.00 0.00 178.15 177.77 1q3s h GLU 438 N 1.01 0.79 -0.35 2.37 5.08 -1.00 -1.92 114.58 120.55 1q3s h GLU 438 Ca 0.26 -0.36 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 1q3s h GLU 438 Cb -0.04 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1q3s h GLU 438 CO -0.05 0.99 -0.15 -0.91 -1.00 0.00 0.00 179.01 177.89 1q3s h ASN 439 N 0.67 0.62 -0.34 1.42 4.21 -0.86 -1.65 115.58 119.66 1q3s h ASN 439 Ca 0.08 -0.19 -0.03 0.00 1.21 0.00 0.00 56.30 57.37 1q3s h ASN 439 Cb 0.84 -0.17 -0.01 0.00 -1.12 0.00 0.00 38.32 37.86 1q3s h ASN 439 CO 0.07 0.79 0.09 0.15 -1.29 0.00 0.00 177.43 177.24 1q3s h PHE 440 N 0.57 0.56 0.00 1.19 3.57 -0.65 0.52 116.94 122.71 1q3s h PHE 440 Ca 0.10 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1q3s h PHE 440 Cb 0.58 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.16 1q3s h PHE 440 CO 0.02 0.57 -0.19 0.00 -2.23 0.00 0.00 178.31 176.48 1q3s h ALA 441 N 0.93 1.68 0.19 2.41 0.00 -1.09 -2.53 119.26 120.85 1q3s h ALA 441 Ca 0.11 -0.18 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 1q3s h ALA 441 Cb 0.29 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.07 1q3s h ALA 441 CO -0.00 0.24 -1.17 0.22 0.00 0.00 0.00 179.25 178.54 1q3s h ASP 442 N 0.00 0.63 -0.78 0.00 1.82 -0.90 -3.28 116.42 113.90 1q3s h ASP 442 Ca -0.00 -0.93 0.16 0.00 -0.39 0.00 0.00 57.03 55.86 1q3s h ASP 442 Cb 0.34 -0.20 -0.10 0.00 0.68 0.00 0.00 39.33 40.05 1q3s h ASP 442 CO 0.03 1.56 0.31 0.00 -1.61 0.00 0.00 179.24 179.52 1q3s h ALA 443 N 0.10 1.12 0.00 -0.78 0.00 -0.59 0.61 119.26 119.72 1q3s h ALA 443 Ca -0.21 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1q3s h ALA 443 Cb 1.89 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1q3s h ALA 443 CO 0.20 -0.24 0.17 1.28 0.00 0.00 0.00 179.25 180.66 1q3s n LEU 444 N -5.02 0.00 -0.37 0.00 4.77 -0.98 -1.93 117.00 113.46 1q3s n LEU 444 Ca 0.16 0.29 0.14 0.00 -0.03 0.00 0.00 56.01 56.57 1q3s n LEU 444 Cb 0.46 -0.29 0.62 0.00 -2.33 0.00 0.00 43.42 41.88 1q3s n LEU 444 CO 0.17 -0.29 0.92 0.29 -1.33 0.00 0.00 177.39 177.15 1q3s n LYS 445 N -1.27 1.52 0.19 3.23 5.02 0.21 -3.84 118.16 123.21 1q3s n LYS 445 Ca 0.00 -0.75 0.14 0.00 -2.02 0.00 0.00 58.31 55.68 1q3s n LYS 445 Cb 0.17 -1.48 0.56 0.00 -0.02 0.00 0.00 35.03 34.26 1q3s n LYS 445 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 1q3s h ILE 446 N 1.83 0.00 0.35 -0.18 -0.00 -1.60 -0.56 117.51 117.36 1q3s h ILE 446 Ca 0.00 -0.37 -0.02 0.00 -0.00 0.00 0.00 64.86 64.47 1q3s h ILE 446 Cb 0.39 1.23 0.00 0.00 -0.00 0.00 0.00 36.82 38.44 1q3s h ILE 446 CO 0.00 0.00 -0.17 0.40 -0.00 0.00 0.00 178.15 178.38 1q3s h ILE 447 N 0.00 0.10 -0.97 0.16 1.08 -1.84 0.61 117.51 116.66 1q3s h ILE 447 Ca 0.00 -0.68 0.02 0.00 -0.39 0.00 0.00 64.86 63.81 1q3s h ILE 447 Cb 0.45 0.17 -0.05 0.00 -3.07 0.00 0.00 36.82 34.32 1q3s h ILE 447 CO 0.00 0.03 0.64 -0.65 -0.69 0.00 0.00 178.15 177.47 1q3s h PRO 448 N -1.10 1.23 0.22 2.37 0.11 -1.80 -1.15 132.00 131.89 1q3s h PRO 448 Ca -0.05 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 1q3s h PRO 448 Cb 0.41 -0.28 -0.00 0.00 0.11 0.00 0.00 31.00 31.24 1q3s h PRO 448 CO 0.08 0.81 -0.13 -0.22 -0.21 0.00 0.00 178.00 178.33 1q3s h LYS 449 N 1.27 -0.32 0.00 1.05 3.64 -1.12 -2.28 116.57 118.80 1q3s h LYS 449 Ca 0.37 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 1q3s h LYS 449 Cb -0.07 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1q3s h LYS 449 CO -0.10 -0.21 0.00 0.25 -2.27 0.00 0.00 179.45 177.12 1q3s n THR 450 N -3.01 1.29 -0.04 1.00 -2.24 0.21 -1.33 114.28 110.16 1q3s n THR 450 Ca -0.04 0.34 -0.14 0.00 -2.27 0.00 0.00 64.05 61.94 1q3s n THR 450 Cb 0.14 -1.19 -0.12 0.00 -2.10 0.00 0.00 70.33 67.06 1q3s n THR 450 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1q3s h LEU 451 N 0.00 0.06 -1.24 3.22 3.38 -1.06 -2.04 115.31 117.62 1q3s h LEU 451 Ca 0.00 -0.77 -0.07 0.00 0.09 0.00 0.00 57.88 57.13 1q3s h LEU 451 Cb 0.17 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1q3s h LEU 451 CO 0.00 0.81 -0.35 0.00 0.09 0.00 0.00 178.44 178.99 1q3s h ALA 452 N 0.24 1.24 0.28 1.53 0.00 -0.79 -2.78 119.26 118.98 1q3s h ALA 452 Ca -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1q3s h ALA 452 Cb 0.82 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1q3s h ALA 452 CO 0.01 0.44 -0.13 1.49 0.00 0.00 0.00 179.25 181.06 1q3s h GLU 453 N 0.00 -0.36 -0.02 0.00 4.81 -1.23 -0.75 114.58 117.03 1q3s h GLU 453 Ca -0.00 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1q3s h GLU 453 Cb 0.70 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.16 1q3s h GLU 453 CO 0.05 -0.01 0.09 -0.91 -0.73 0.00 0.00 179.01 177.50 1q3s h ASN 454 N -0.88 0.00 0.28 1.04 2.35 -1.36 0.19 115.58 117.21 1q3s h ASN 454 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1q3s h ASN 454 Cb 0.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1q3s h ASN 454 CO 0.06 0.00 -0.09 0.00 -1.65 0.00 0.00 177.43 175.75 1q3s n ALA 455 N -2.10 2.75 -0.67 -0.83 0.00 -1.05 -4.60 120.51 114.00 1q3s n ALA 455 Ca -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1q3s n ALA 455 Cb 0.17 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1q3s n ALA 455 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1q3s n GLY 456 N 1.25 1.28 3.20 0.00 0.00 0.67 -5.03 105.19 106.55 1q3s n GLY 456 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 1q3s n GLY 456 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1q3s n LEU 457 N 0.00 0.00 -4.41 0.99 4.77 -0.30 -4.96 117.00 113.09 1q3s n LEU 457 Ca 0.00 -1.07 -0.44 0.00 -0.03 0.00 0.00 56.01 54.47 1q3s n LEU 457 Cb 0.00 -0.91 -0.04 0.00 -2.33 0.00 0.00 43.42 40.14 1q3s n LEU 457 CO 0.00 -2.02 0.59 -0.62 -1.33 0.00 0.00 177.39 174.01 1q3s s ASP 458 N -4.26 6.24 0.06 -1.43 3.68 -1.26 -4.65 116.67 115.05 1q3s s ASP 458 Ca 0.65 -1.37 -0.14 0.00 2.13 0.00 0.00 52.55 53.81 1q3s s ASP 458 Cb -0.06 -2.35 -0.05 0.00 -1.45 0.00 0.00 42.92 39.01 1q3s s ASP 458 CO 0.49 -1.21 1.24 0.74 0.13 0.00 0.00 175.17 176.56 1q3s h THR 459 N 5.90 0.00 -0.10 1.71 2.02 -1.91 0.15 112.91 120.68 1q3s h THR 459 Ca -0.24 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.96 1q3s h THR 459 Cb 1.07 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.45 1q3s h THR 459 CO 1.12 0.00 -0.31 0.58 0.37 0.00 0.00 175.52 177.28 1q3s h VAL 460 N -0.15 0.00 -0.47 3.16 2.07 -1.97 -1.01 116.25 117.88 1q3s h VAL 460 Ca 0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 1q3s h VAL 460 Cb 0.25 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 1q3s h VAL 460 CO -0.29 0.00 0.28 -0.08 0.02 0.00 0.00 177.57 177.50 1q3s h GLU 461 N -0.32 0.63 -0.51 1.57 4.81 -1.99 -3.02 114.58 115.76 1q3s h GLU 461 Ca 0.02 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1q3s h GLU 461 Cb 0.38 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.59 1q3s h GLU 461 CO -0.27 0.46 0.29 1.98 -0.73 0.00 0.00 179.01 180.75 1q3s h MET 462 N 0.62 0.55 0.00 1.92 4.05 -0.60 -1.52 114.93 119.95 1q3s h MET 462 Ca 0.17 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.55 1q3s h MET 462 Cb -0.01 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 30.67 1q3s h MET 462 CO -0.03 0.37 0.00 -0.11 0.23 0.00 0.00 176.91 177.36 1q3s n LEU 463 N -4.83 0.41 0.05 3.39 7.94 -0.39 -1.98 117.00 121.59 1q3s n LEU 463 Ca 0.04 0.64 -0.22 0.00 -1.11 0.00 0.00 56.01 55.36 1q3s n LEU 463 Cb 0.09 -0.64 -0.14 0.00 0.53 0.00 0.00 43.42 43.26 1q3s n LEU 463 CO 0.31 -0.63 -0.57 0.58 -1.11 0.00 0.00 177.39 175.97 1q3s h VAL 464 N 0.00 0.89 -0.52 1.96 2.07 -1.23 -3.24 116.25 116.18 1q3s h VAL 464 Ca 0.00 -2.45 -0.06 0.00 0.82 0.00 0.00 66.70 65.01 1q3s h VAL 464 Cb 0.16 2.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.61 1q3s h VAL 464 CO 0.00 0.84 0.10 0.11 0.02 0.00 0.00 177.57 178.64 1q3s h LYS 465 N 0.02 0.86 -0.63 1.57 1.57 -1.15 -1.74 116.57 117.07 1q3s h LYS 465 Ca -0.35 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.19 1q3s h LYS 465 Cb 2.02 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 34.20 1q3s h LYS 465 CO 0.14 0.83 0.35 0.28 -0.57 0.00 0.00 179.45 180.48 1q3s h VAL 466 N 0.74 1.20 0.00 0.50 2.07 -1.56 0.53 116.25 119.73 1q3s h VAL 466 Ca 0.16 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 67.13 1q3s h VAL 466 Cb 0.38 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1q3s h VAL 466 CO 0.01 0.21 -0.33 0.40 0.02 0.00 0.00 177.57 177.88 1q3s h ILE 467 N 0.85 0.75 0.26 4.57 2.04 -1.57 -1.66 117.51 122.77 1q3s h ILE 467 Ca 0.22 -1.45 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 1q3s h ILE 467 Cb 0.03 1.93 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 1q3s h ILE 467 CO -0.04 0.33 -0.13 -1.28 0.00 0.00 0.00 178.15 177.03 1q3s h SER 468 N 0.00 -0.30 -0.14 1.72 0.87 -0.34 -1.99 113.55 113.37 1q3s h SER 468 Ca -0.00 0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.61 1q3s h SER 468 Cb 0.90 0.08 -0.07 0.00 -0.44 0.00 0.00 62.40 62.87 1q3s h SER 468 CO 0.04 -0.16 -0.38 -0.33 -0.53 0.00 0.00 176.83 175.47 1q3s h GLU 469 N -0.46 -0.43 -0.85 2.24 4.39 -0.98 -1.38 114.58 117.11 1q3s h GLU 469 Ca -0.04 0.03 0.18 0.00 0.34 0.00 0.00 59.36 59.88 1q3s h GLU 469 Cb 0.27 0.10 -0.11 0.00 -0.10 0.00 0.00 28.75 28.91 1q3s h GLU 469 CO 0.06 -0.29 0.38 1.25 -1.16 0.00 0.00 179.01 179.25 1q3s h HIS 470 N -0.45 0.64 -0.54 4.33 2.76 -1.40 1.40 115.15 121.90 1q3s h HIS 470 Ca 0.09 0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.27 1q3s h HIS 470 Cb 0.59 -0.15 -0.03 0.00 1.55 0.00 0.00 27.41 29.38 1q3s h HIS 470 CO -0.46 0.03 0.20 0.87 -1.30 0.00 0.00 177.93 177.28 1q3s h LYS 471 N 0.46 0.78 0.00 5.26 1.57 -0.49 -2.16 116.57 121.99 1q3s h LYS 471 Ca 0.50 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1q3s h LYS 471 Cb 0.86 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.03 1q3s h LYS 471 CO -0.46 0.65 0.00 0.09 -0.57 0.00 0.00 179.45 179.16 1q3s n ASN 472 N -4.33 0.00 -0.07 0.86 3.02 0.15 -4.67 115.26 110.22 1q3s n ASN 472 Ca 0.04 0.01 -0.07 0.00 -0.03 0.00 0.00 54.58 54.53 1q3s n ASN 472 Cb 0.17 -0.02 -0.01 0.00 -0.61 0.00 0.00 39.78 39.31 1q3s n ASN 472 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1q3s h ARG 473 N 0.00 -0.19 0.00 3.52 3.08 0.15 -3.49 114.38 117.45 1q3s h ARG 473 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1q3s h ARG 473 Cb 0.00 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.09 1q3s h ARG 473 CO 0.00 -0.13 0.00 0.41 -1.07 0.00 0.00 179.97 179.18 1q3s n GLY 474 N -1.37 1.23 0.52 0.04 0.00 -0.81 -4.89 105.19 99.93 1q3s n GLY 474 Ca -0.00 -2.06 0.40 0.00 0.00 0.00 0.00 46.02 44.36 1q3s n GLY 474 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1q3s n LEU 475 N 0.00 0.03 -0.02 0.99 7.94 -1.26 -0.22 117.00 124.45 1q3s n LEU 475 Ca 0.00 0.82 0.15 0.00 -1.11 0.00 0.00 56.01 55.87 1q3s n LEU 475 Cb 0.00 -0.41 0.77 0.00 0.53 0.00 0.00 43.42 44.31 1q3s n LEU 475 CO 0.00 -0.84 1.01 0.61 -1.11 0.00 0.00 177.39 177.06 1q3s n GLY 476 N -1.67 -1.17 3.67 -3.96 0.00 -1.26 -4.70 105.19 96.11 1q3s n GLY 476 Ca 0.34 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1q3s n GLY 476 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q3s s ILE 477 N -2.45 4.85 0.00 -0.61 -1.09 0.69 -0.11 121.20 122.49 1q3s s ILE 477 Ca 0.32 1.73 0.00 0.00 -2.23 0.00 0.00 60.65 60.48 1q3s s ILE 477 Cb 0.21 -4.18 0.00 0.00 -1.58 0.00 0.00 42.46 36.91 1q3s s ILE 477 CO 0.45 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.78 1q3s n GLY 478 N 3.37 4.56 3.59 6.18 0.00 -0.78 -4.41 105.19 117.69 1q3s n GLY 478 Ca 0.06 -1.26 -0.33 0.00 0.00 0.00 0.00 46.02 44.49 1q3s n GLY 478 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q3s s ILE 479 N -1.56 3.68 -0.32 -0.61 1.01 0.07 -1.83 121.20 121.64 1q3s s ILE 479 Ca 0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 1q3s s ILE 479 Cb 0.00 -2.56 0.07 0.00 0.01 0.00 0.00 42.46 39.98 1q3s s ILE 479 CO 0.00 0.49 0.03 -0.62 0.00 0.00 0.00 174.94 174.84 1q3s s ASP 480 N -1.14 4.89 0.55 3.58 3.68 -1.00 -4.35 116.67 122.88 1q3s s ASP 480 Ca 0.15 -1.54 0.24 0.00 2.13 0.00 0.00 52.55 53.54 1q3s s ASP 480 Cb -0.11 -1.70 1.48 0.00 -1.45 0.00 0.00 42.92 41.14 1q3s s ASP 480 CO 0.05 -0.32 2.09 -0.37 0.13 0.00 0.00 175.17 176.75 1q3s h VAL 481 N 6.51 0.69 0.00 1.11 -1.51 -1.92 0.27 116.25 121.40 1q3s h VAL 481 Ca -0.17 0.00 -0.18 0.00 -1.23 0.00 0.00 66.70 65.11 1q3s h VAL 481 Cb 1.05 0.86 -0.02 0.00 -2.13 0.00 0.00 31.29 31.05 1q3s h VAL 481 CO 0.55 0.00 -0.85 -0.26 -1.23 0.00 0.00 177.57 175.78 1q3s h PHE 482 N 0.00 0.13 0.03 5.19 0.04 -1.95 -3.26 116.94 117.13 1q3s h PHE 482 Ca 0.11 -0.07 -0.27 0.00 2.80 0.00 0.00 57.97 60.54 1q3s h PHE 482 Cb 0.50 -0.01 -0.03 0.00 2.20 0.00 0.00 35.95 38.60 1q3s h PHE 482 CO 0.00 0.89 -1.44 1.49 -0.60 0.00 0.00 178.31 178.66 1q3s h GLU 483 N 0.05 0.07 0.00 1.51 4.57 -1.47 -3.48 114.58 115.84 1q3s h GLU 483 Ca -0.03 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1q3s h GLU 483 Cb 1.49 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 30.12 1q3s h GLU 483 CO 0.12 0.84 0.00 0.41 -1.18 0.00 0.00 179.01 179.20 1q3s n GLY 484 N 1.53 0.48 3.49 1.92 0.00 0.76 -4.99 105.19 108.38 1q3s n GLY 484 Ca -0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.79 1q3s n GLY 484 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1q3s s LYS 485 N -0.14 1.62 0.66 1.61 -2.85 -1.24 -5.01 119.74 114.41 1q3s s LYS 485 Ca 0.00 -1.50 -0.14 0.00 -1.00 0.00 0.00 55.97 53.33 1q3s s LYS 485 Cb 0.00 0.43 -0.00 0.00 -2.06 0.00 0.00 37.83 36.20 1q3s s LYS 485 CO 0.00 -0.66 1.08 -2.14 0.10 0.00 0.00 175.35 173.74 1q3s s PRO 486 N -3.68 2.88 0.25 1.78 0.02 -1.26 -2.38 135.00 132.61 1q3s s PRO 486 Ca 0.28 1.24 -0.21 0.00 0.02 0.00 0.00 61.00 62.33 1q3s s PRO 486 Cb 0.01 -1.97 0.03 0.00 0.02 0.00 0.00 34.50 32.59 1q3s s PRO 486 CO 0.14 -1.17 0.69 0.00 -0.33 0.00 0.00 177.00 176.33 1q3s s ALA 487 N -2.56 -1.31 -0.57 -1.55 0.00 -0.76 -4.86 121.76 110.15 1q3s s ALA 487 Ca 0.64 -0.13 -0.23 0.00 0.00 0.00 0.00 51.96 52.24 1q3s s ALA 487 Cb -0.18 0.86 0.05 0.00 0.00 0.00 0.00 23.12 23.85 1q3s s ALA 487 CO 0.44 -0.98 0.91 0.34 0.00 0.00 0.00 175.76 176.47 1q3s s ASP 488 N -2.88 6.29 0.53 0.00 -1.08 -1.26 -1.87 116.67 116.38 1q3s s ASP 488 Ca 0.09 -0.57 0.18 0.00 -0.52 0.00 0.00 52.55 51.73 1q3s s ASP 488 Cb -0.05 -2.41 1.32 0.00 -1.46 0.00 0.00 42.92 40.31 1q3s s ASP 488 CO 0.02 -1.23 2.14 0.24 0.52 0.00 0.00 175.17 176.86 1q3s h MET 489 N 9.33 0.00 -0.29 4.34 2.86 -0.83 -2.66 114.93 127.68 1q3s h MET 489 Ca -0.27 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.29 1q3s h MET 489 Cb 1.08 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.73 1q3s h MET 489 CO 1.09 0.00 -0.14 -0.07 1.06 0.00 0.00 176.91 178.85 1q3s h LEU 490 N 0.00 0.63 -1.82 1.22 4.07 -1.80 -0.98 115.31 116.63 1q3s h LEU 490 Ca 0.03 -0.41 -0.01 0.00 0.08 0.00 0.00 57.88 57.57 1q3s h LEU 490 Cb 0.11 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 41.67 1q3s h LEU 490 CO -0.00 0.90 -0.07 -0.33 -1.08 0.00 0.00 178.44 177.86 1q3s h GLU 491 N 0.36 0.00 -0.02 1.13 5.08 -1.86 -1.56 114.58 117.71 1q3s h GLU 491 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1q3s h GLU 491 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 1q3s h GLU 491 CO 0.04 0.07 -0.03 1.63 -1.00 0.00 0.00 179.01 179.72 1q3s n LYS 492 N -3.28 1.98 -1.07 2.33 4.76 -1.08 -4.94 118.16 116.86 1q3s n LYS 492 Ca -0.01 -1.47 -0.02 0.00 -2.87 0.00 0.00 58.31 53.94 1q3s n LYS 492 Cb 0.26 -1.47 -0.01 0.00 -1.84 0.00 0.00 35.03 31.97 1q3s n LYS 492 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1q3s n GLY 493 N 1.28 0.33 3.49 0.72 0.00 -0.59 -4.92 105.19 105.50 1q3s n GLY 493 Ca 0.16 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1q3s n GLY 493 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q3s s ILE 494 N -1.40 4.19 0.23 -0.61 1.01 -0.47 -4.75 121.20 119.41 1q3s s ILE 494 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.20 1q3s s ILE 494 Cb 0.00 -4.81 -0.05 0.00 0.01 0.00 0.00 42.46 37.61 1q3s s ILE 494 CO 0.00 -1.64 0.12 0.27 0.00 0.00 0.00 174.94 173.69 1q3s s ILE 495 N 4.35 0.29 0.07 2.92 -4.36 -1.26 -2.15 121.20 121.06 1q3s s ILE 495 Ca 0.31 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.67 1q3s s ILE 495 Cb -0.10 -2.57 -0.03 0.00 1.25 0.00 0.00 42.46 41.01 1q3s s ILE 495 CO 0.05 0.00 0.02 -1.83 0.24 0.00 0.00 174.94 173.42 1q3s s GLU 496 N -4.08 0.69 0.37 0.37 -1.05 -0.06 -4.52 118.70 110.43 1q3s s GLU 496 Ca 0.38 -1.21 -0.28 0.00 -0.15 0.00 0.00 54.97 53.71 1q3s s GLU 496 Cb 0.07 0.24 -0.11 0.00 -0.44 0.00 0.00 34.13 33.89 1q3s s GLU 496 CO 0.13 -0.16 1.47 -2.30 0.95 0.00 0.00 175.26 175.36 1q3s n PRO 497 N 0.05 2.62 0.28 -4.83 -0.02 -1.26 -1.14 135.00 130.70 1q3s n PRO 497 Ca -0.13 0.92 0.16 0.00 -2.02 0.00 0.00 63.50 62.43 1q3s n PRO 497 Cb 0.62 -2.64 0.79 0.00 -0.02 0.00 0.00 33.50 32.25 1q3s n PRO 497 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1q3s h LEU 498 N 2.94 0.00 -0.22 2.45 7.12 -1.78 -2.37 115.31 123.45 1q3s h LEU 498 Ca -0.50 0.00 -0.21 0.00 0.13 0.00 0.00 57.88 57.30 1q3s h LEU 498 Cb 1.25 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.37 1q3s h LEU 498 CO 0.64 0.08 -0.92 -0.09 -0.13 0.00 0.00 178.44 178.02 1q3s h ARG 499 N 0.00 0.19 -0.52 1.25 2.43 -1.90 -2.84 114.38 113.00 1q3s h ARG 499 Ca -0.00 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 58.93 1q3s h ARG 499 Cb 0.35 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1q3s h ARG 499 CO 0.01 0.98 0.28 0.28 -1.51 0.00 0.00 179.97 180.02 1q3s h VAL 500 N 0.10 1.18 0.09 0.20 2.07 -1.74 -0.48 116.25 117.67 1q3s h VAL 500 Ca -0.05 -0.45 -0.00 0.00 0.82 0.00 0.00 66.70 67.02 1q3s h VAL 500 Cb 1.57 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1q3s h VAL 500 CO 0.14 0.19 -0.04 0.11 0.02 0.00 0.00 177.57 177.99 1q3s h LYS 501 N 0.69 -0.11 -1.00 1.57 1.79 -1.63 -1.91 116.57 115.96 1q3s h LYS 501 Ca 0.18 0.01 0.20 0.00 -2.18 0.00 0.00 60.65 58.86 1q3s h LYS 501 Cb 0.05 0.03 -0.11 0.00 -1.58 0.00 0.00 32.23 30.62 1q3s h LYS 501 CO -0.03 0.35 0.61 0.87 -1.08 0.00 0.00 179.45 180.18 1q3s h LYS 502 N -0.64 0.69 0.04 3.15 1.57 -1.47 -1.58 116.57 118.33 1q3s h LYS 502 Ca -0.01 -0.04 -0.22 0.00 -1.87 0.00 0.00 60.65 58.51 1q3s h LYS 502 Cb 0.52 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1q3s h LYS 502 CO 0.02 0.46 -1.00 0.37 -0.57 0.00 0.00 179.45 178.73 1q3s h GLN 503 N 0.71 0.18 -0.11 3.15 5.75 -1.05 -2.78 115.11 120.95 1q3s h GLN 503 Ca 0.58 -0.24 -0.01 0.00 -0.15 0.00 0.00 58.65 58.84 1q3s h GLN 503 Cb 0.98 0.08 -0.01 0.00 1.07 0.00 0.00 27.48 29.61 1q3s h GLN 503 CO -0.38 1.03 0.05 0.00 -2.65 0.00 0.00 178.83 176.88 1q3s h ALA 504 N 0.87 0.15 -0.68 3.38 0.00 -0.47 -0.13 119.26 122.39 1q3s h ALA 504 Ca -0.06 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.83 1q3s h ALA 504 Cb 1.68 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.37 1q3s h ALA 504 CO 0.15 -0.28 0.37 0.82 0.00 0.00 0.00 179.25 180.31 1q3s h ILE 505 N 0.05 0.96 0.80 0.00 1.08 -1.43 0.42 117.51 119.38 1q3s h ILE 505 Ca 0.04 -0.23 -0.04 0.00 -0.39 0.00 0.00 64.86 64.24 1q3s h ILE 505 Cb 0.14 0.21 0.01 0.00 -3.07 0.00 0.00 36.82 34.11 1q3s h ILE 505 CO -0.00 0.12 -0.38 0.11 -0.69 0.00 0.00 178.15 177.31 1q3s h LYS 506 N 0.68 -1.04 -0.49 2.37 1.57 -1.19 -1.95 116.57 116.53 1q3s h LYS 506 Ca 0.31 0.07 0.10 0.00 -1.87 0.00 0.00 60.65 59.25 1q3s h LYS 506 Cb 0.21 0.24 -0.09 0.00 0.08 0.00 0.00 32.23 32.67 1q3s h LYS 506 CO -0.19 -0.68 -0.04 0.77 -0.57 0.00 0.00 179.45 178.74 1q3s h SER 507 N -1.15 -0.29 0.28 0.86 0.02 -0.73 -1.81 113.55 110.72 1q3s h SER 507 Ca -0.11 0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1q3s h SER 507 Cb 0.84 0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.62 1q3s h SER 507 CO 0.18 -0.10 -0.13 0.00 -1.14 0.00 0.00 176.83 175.63 1q3s h ALA 508 N 1.46 -0.37 -0.21 3.77 0.00 -0.95 -2.20 119.26 120.75 1q3s h ALA 508 Ca 0.24 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1q3s h ALA 508 Cb 0.37 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1q3s h ALA 508 CO -0.44 -0.53 0.15 0.66 0.00 0.00 0.00 179.25 179.08 1q3s h SER 509 N -0.72 0.04 0.76 0.00 4.64 -1.28 0.22 113.55 117.21 1q3s h SER 509 Ca -0.04 -0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.04 1q3s h SER 509 Cb 0.49 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 1q3s h SER 509 CO 0.06 0.03 -1.12 -0.33 -0.87 0.00 0.00 176.83 174.60 1q3s h GLU 510 N 0.05 0.17 -0.30 4.77 5.08 -1.32 -1.18 114.58 121.84 1q3s h GLU 510 Ca 0.10 -0.27 -0.17 0.00 -1.00 0.00 0.00 59.36 58.02 1q3s h GLU 510 Cb 0.33 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 1q3s h GLU 510 CO -0.01 1.12 -0.48 0.00 -1.00 0.00 0.00 179.01 178.64 1q3s h ALA 511 N 0.77 0.59 0.43 3.43 0.00 -0.58 -0.57 119.26 123.32 1q3s h ALA 511 Ca -0.08 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.32 1q3s h ALA 511 Cb 1.86 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.55 1q3s h ALA 511 CO 0.17 0.68 -0.21 0.00 0.00 0.00 0.00 179.25 179.89 1q3s h ALA 512 N 0.81 -0.58 -0.09 0.00 0.00 -0.62 -2.73 119.26 116.06 1q3s h ALA 512 Ca 0.03 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1q3s h ALA 512 Cb 1.06 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1q3s h ALA 512 CO 0.11 -0.72 0.05 0.82 0.00 0.00 0.00 179.25 179.50 1q3s h ILE 513 N -0.78 1.03 0.00 0.00 2.04 -1.21 -0.10 117.51 118.49 1q3s h ILE 513 Ca -0.06 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 65.62 1q3s h ILE 513 Cb 0.54 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.52 1q3s h ILE 513 CO 0.10 0.03 -0.45 -0.03 0.00 0.00 0.00 178.15 177.81 1q3s h MET 514 N 0.12 0.00 0.18 2.37 4.05 -0.96 -2.80 114.93 117.89 1q3s h MET 514 Ca 0.03 0.00 -0.35 0.00 -0.28 0.00 0.00 59.70 59.10 1q3s h MET 514 Cb 0.01 0.00 0.01 0.00 -0.80 0.00 0.00 31.60 30.82 1q3s h MET 514 CO -0.01 0.45 -1.72 0.82 0.23 0.00 0.00 176.91 176.68 1q3s h ILE 515 N 0.00 0.97 0.00 1.77 2.04 -1.01 -3.23 117.51 118.06 1q3s h ILE 515 Ca -0.00 -2.55 0.00 0.00 1.00 0.00 0.00 64.86 63.30 1q3s h ILE 515 Cb 0.83 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 1q3s h ILE 515 CO 0.06 0.85 0.00 0.18 0.00 0.00 0.00 178.15 179.24 1q3s n LEU 516 N -3.58 0.00 -0.00 1.44 4.77 -0.14 -1.38 117.00 118.11 1q3s n LEU 516 Ca -0.23 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.79 1q3s n LEU 516 Cb 1.08 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.11 1q3s n LEU 516 CO 0.52 0.00 -0.16 0.54 -1.33 0.00 0.00 177.39 176.96 1q3s n ARG 517 N -0.89 3.27 -3.07 3.23 1.74 -1.07 -4.85 116.66 115.02 1q3s n ARG 517 Ca 0.06 -0.02 -0.42 0.00 -0.77 0.00 0.00 57.85 56.69 1q3s n ARG 517 Cb 0.03 -0.97 -0.06 0.00 -1.02 0.00 0.00 32.46 30.43 1q3s n ARG 517 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1q3s s ILE 518 N -1.99 4.80 -2.13 0.55 1.01 -0.48 -4.88 121.20 118.09 1q3s s ILE 518 Ca 0.02 0.41 0.19 0.00 0.00 0.00 0.00 60.65 61.27 1q3s s ILE 518 Cb 0.06 -4.18 0.32 0.00 0.01 0.00 0.00 42.46 38.67 1q3s s ILE 518 CO 0.35 -0.51 1.27 -0.90 0.00 0.00 0.00 174.94 175.15 1q3s n ASP 519 N 6.29 3.08 -3.66 3.58 5.75 -1.26 -4.37 116.55 125.96 1q3s n ASP 519 Ca -0.00 -1.90 -0.09 0.00 -0.01 0.00 0.00 54.79 52.79 1q3s n ASP 519 Cb 0.48 -0.18 -0.08 0.00 -1.03 0.00 0.00 41.12 40.32 1q3s n ASP 519 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1q3s s ASP 520 N -1.37 -0.81 -0.16 -1.12 2.15 -1.26 -2.15 116.67 111.95 1q3s s ASP 520 Ca 0.31 1.33 0.01 0.00 0.43 0.00 0.00 52.55 54.64 1q3s s ASP 520 Cb 0.19 1.22 0.02 0.00 -0.30 0.00 0.00 42.92 44.05 1q3s s ASP 520 CO 0.26 -0.23 -0.20 -0.69 -0.17 0.00 0.00 175.17 174.15 1q3s s VAL 521 N 1.44 1.99 -0.32 1.11 1.01 -0.69 -4.97 120.40 119.96 1q3s s VAL 521 Ca -0.09 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.01 1q3s s VAL 521 Cb -0.06 -1.79 0.09 0.00 0.00 0.00 0.00 36.38 34.63 1q3s s VAL 521 CO -0.16 0.53 0.02 -0.63 0.00 0.00 0.00 175.10 174.87 1q3s s ILE 522 N 1.14 2.09 -0.24 2.22 1.01 -1.26 -2.33 121.20 123.83 1q3s s ILE 522 Ca 0.00 -2.09 -0.05 0.00 0.00 0.00 0.00 60.65 58.51 1q3s s ILE 522 Cb -0.14 -2.48 -0.01 0.00 0.01 0.00 0.00 42.46 39.84 1q3s s ILE 522 CO -0.09 -0.49 0.01 0.00 0.00 0.00 0.00 174.94 174.38 1q3s s ALA 523 N 1.03 2.97 1.00 9.38 0.00 -0.81 -5.02 121.76 130.30 1q3s s ALA 523 Ca 0.07 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1q3s s ALA 523 Cb -0.19 -1.90 0.00 0.00 0.00 0.00 0.00 23.12 21.03 1q3s s ALA 523 CO -0.09 -0.51 0.00 0.00 0.00 0.00 0.00 175.76 175.16 1q3s n ALA 524 N 4.85 0.00 -2.48 0.00 0.00 -1.26 -0.74 120.51 120.89 1q3s n ALA 524 Ca -0.17 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 52.89 1q3s n ALA 524 Cb 0.51 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.90 1q3s n ALA 524 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1q3s s LYS 525 N -0.83 4.09 0.00 0.00 2.20 -1.12 -4.52 119.74 119.56 1q3s s LYS 525 Ca 0.00 0.52 0.30 0.00 -0.36 0.00 0.00 55.97 56.43 1q3s s LYS 525 Cb 0.00 -3.27 1.54 0.00 -1.51 0.00 0.00 37.83 34.59 1q3s s LYS 525 CO 0.00 0.57 2.02 0.00 -0.36 0.00 0.00 175.35 177.58