#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 0.53 -3.47 1.55 0.00 -1.26 -5.03 119.36 111.69 1q3s n ILE 11 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 62.75 62.49 1q3s n ILE 11 Cb 0.00 -0.82 -0.04 0.00 0.00 0.00 0.00 39.64 38.78 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 -5.04 -0.63 -0.08 9.51 0.20 -1.26 -5.13 118.68 116.24 1q3s s LEU 12 Ca -0.08 0.89 -0.28 0.00 0.69 0.00 0.00 54.13 55.34 1q3s s LEU 12 Cb 0.03 1.75 -0.14 0.00 -0.43 0.00 0.00 46.19 47.40 1q3s s LEU 12 CO 0.27 -0.13 0.82 -2.65 -0.29 0.00 0.00 176.35 174.37 1q3s n PRO 13 N 4.81 0.00 -1.51 0.98 -0.02 -1.26 -4.90 135.00 133.10 1q3s n PRO 13 Ca -0.11 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.04 1q3s n PRO 13 Cb 0.53 -1.02 0.07 0.00 -0.02 0.00 0.00 33.50 33.06 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 0.49 2.45 -0.07 -0.52 4.04 -1.26 -2.85 118.70 120.98 1q3s s GLU 14 Ca 0.64 1.39 0.00 0.00 0.04 0.00 0.00 54.97 57.04 1q3s s GLU 14 Cb -0.90 -1.91 0.00 0.00 0.02 0.00 0.00 34.13 31.34 1q3s s GLU 14 CO 0.43 -1.52 0.00 0.41 -1.84 0.00 0.00 175.26 172.74 1q3s n GLY 15 N -0.54 0.42 2.98 -3.83 0.00 -1.26 -5.00 105.19 97.96 1q3s n GLY 15 Ca 0.10 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.77 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 -2.02 2.65 0.51 2.61 2.01 -1.13 -4.26 115.64 116.01 1q3s s THR 16 Ca 0.00 -3.12 -0.20 0.00 0.31 0.00 0.00 61.69 58.68 1q3s s THR 16 Cb 0.00 -2.85 -0.07 0.00 0.01 0.00 0.00 72.50 69.60 1q3s s THR 16 CO 0.00 -0.77 1.12 -1.10 -0.69 0.00 0.00 174.62 173.17 1q3s s GLN 17 N -0.06 3.53 -0.06 4.92 1.11 -0.87 -4.83 119.66 123.39 1q3s s GLN 17 Ca 0.16 1.59 -0.07 0.00 0.01 0.00 0.00 55.36 57.05 1q3s s GLN 17 Cb -0.24 -2.10 0.02 0.00 -1.01 0.00 0.00 33.01 29.67 1q3s s GLN 17 CO -0.02 -0.70 0.19 0.50 0.01 0.00 0.00 175.29 175.27 1q3s s ARG 18 N -3.15 0.25 0.07 2.91 3.52 -1.26 -2.17 118.95 119.12 1q3s s ARG 18 Ca 0.70 0.20 0.04 0.00 -0.13 0.00 0.00 55.73 56.53 1q3s s ARG 18 Cb -0.23 0.12 -0.03 0.00 -1.56 0.00 0.00 34.95 33.25 1q3s s ARG 18 CO 0.27 -0.04 -0.11 0.71 -0.81 0.00 0.00 175.30 175.32 1q3s s TYR 19 N -0.06 1.02 0.07 5.12 1.51 -1.01 -4.98 117.35 119.02 1q3s s TYR 19 Ca -0.02 -0.52 0.01 0.00 -1.01 0.00 0.00 57.07 55.54 1q3s s TYR 19 Cb -0.02 -0.58 -0.04 0.00 -0.11 0.00 0.00 41.96 41.22 1q3s s TYR 19 CO 0.00 0.00 -0.06 0.08 -1.11 0.00 0.00 175.55 174.46 1q3s s VAL 20 N -1.58 0.55 0.00 0.71 1.01 -1.26 -1.95 120.40 117.88 1q3s s VAL 20 Ca -0.03 -1.61 0.00 0.00 0.00 0.00 0.00 61.98 60.34 1q3s s VAL 20 Cb -0.08 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 35.03 1q3s s VAL 20 CO 0.01 -0.72 0.00 0.61 0.00 0.00 0.00 175.10 175.00 1q3s n GLY 21 N 0.51 1.89 0.20 4.51 0.00 -0.65 -1.75 105.19 109.90 1q3s n GLY 21 Ca -0.16 0.45 -0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.14 -0.40 1.61 2.43 -1.98 -1.05 114.38 114.85 1q3s h ARG 22 Ca 0.00 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1q3s h ARG 22 Cb 0.00 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.53 1q3s h ARG 22 CO 0.00 -0.09 -0.32 -0.44 -1.51 0.00 0.00 179.97 177.61 1q3s h ASP 23 N -0.15 -1.13 -0.06 -3.80 5.19 -1.74 0.81 116.42 115.55 1q3s h ASP 23 Ca 0.04 0.16 0.01 0.00 -0.62 0.00 0.00 57.03 56.62 1q3s h ASP 23 Cb 0.25 0.48 -0.01 0.00 0.18 0.00 0.00 39.33 40.23 1q3s h ASP 23 CO -0.29 -0.17 -0.11 0.00 -3.12 0.00 0.00 179.24 175.55 1q3s h ALA 24 N -0.37 -0.46 -0.97 3.45 0.00 -1.30 0.52 119.26 120.13 1q3s h ALA 24 Ca 0.07 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.11 1q3s h ALA 24 Cb 0.28 0.73 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 1q3s h ALA 24 CO -0.43 -0.50 0.59 1.96 0.00 0.00 0.00 179.25 180.87 1q3s h GLN 25 N -0.10 0.85 0.09 0.00 4.20 -0.99 0.31 115.11 119.48 1q3s h GLN 25 Ca 0.01 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.68 1q3s h GLN 25 Cb 0.13 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1q3s h GLN 25 CO -0.10 0.56 -0.11 -0.09 -0.67 0.00 0.00 178.83 178.42 1q3s h ARG 26 N 0.88 -0.22 -0.27 1.46 9.65 0.12 0.53 114.38 126.53 1q3s h ARG 26 Ca 0.50 0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 59.34 1q3s h ARG 26 Cb 0.59 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.21 1q3s h ARG 26 CO -0.30 -0.15 -0.07 -0.07 2.80 0.00 0.00 179.97 182.18 1q3s h LEU 27 N -0.23 0.52 -0.13 3.80 3.38 -0.35 -1.33 115.31 120.97 1q3s h LEU 27 Ca 0.01 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.64 1q3s h LEU 27 Cb 0.23 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1q3s h LEU 27 CO -0.05 0.77 -0.03 0.78 0.09 0.00 0.00 178.44 180.00 1q3s h ASN 28 N 0.27 -0.12 0.10 -0.43 -0.26 -0.89 0.41 115.58 114.66 1q3s h ASN 28 Ca 0.07 0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 55.82 1q3s h ASN 28 Cb 0.54 0.08 -0.00 0.00 -1.06 0.00 0.00 38.32 37.88 1q3s h ASN 28 CO 0.03 -0.04 -0.10 0.40 -1.06 0.00 0.00 177.43 176.65 1q3s h ILE 29 N 0.00 1.07 0.22 2.81 2.04 -0.82 0.60 117.51 123.42 1q3s h ILE 29 Ca 0.06 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1q3s h ILE 29 Cb 0.10 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1q3s h ILE 29 CO -0.13 0.10 -0.10 0.25 0.00 0.00 0.00 178.15 178.26 1q3s h LEU 30 N 0.00 -0.25 -1.05 1.44 5.85 -0.22 -1.60 115.31 119.48 1q3s h LEU 30 Ca -0.00 -0.27 0.09 0.00 0.84 0.00 0.00 57.88 58.54 1q3s h LEU 30 Cb 0.18 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 1q3s h LEU 30 CO 0.01 0.26 0.63 0.00 -0.34 0.00 0.00 178.44 179.00 1q3s h ALA 31 N -0.39 1.50 0.30 1.25 0.00 -0.77 0.15 119.26 121.30 1q3s h ALA 31 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1q3s h ALA 31 Cb 0.51 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1q3s h ALA 31 CO 0.05 0.31 -0.15 0.00 0.00 0.00 0.00 179.25 179.46 1q3s h ALA 32 N 1.51 -0.41 -0.77 0.00 0.00 -0.88 -2.75 119.26 115.96 1q3s h ALA 32 Ca 0.46 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1q3s h ALA 32 Cb 0.35 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1q3s h ALA 32 CO -0.21 -0.70 0.42 0.00 0.00 0.00 0.00 179.25 178.76 1q3s h ARG 33 N -0.48 1.07 -0.00 0.00 3.08 -0.51 -2.14 114.38 115.41 1q3s h ARG 33 Ca -0.04 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 59.90 1q3s h ARG 33 Cb 0.36 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 1q3s h ARG 33 CO 0.07 0.79 -0.10 0.82 -1.07 0.00 0.00 179.97 180.48 1q3s h ILE 34 N 1.08 0.76 -0.51 2.04 2.04 -0.67 0.68 117.51 122.93 1q3s h ILE 34 Ca 0.27 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.18 1q3s h ILE 34 Cb 0.03 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 1q3s h ILE 34 CO -0.04 0.00 0.26 0.40 0.00 0.00 0.00 178.15 178.77 1q3s h ILE 35 N -0.16 0.96 -0.34 -0.67 1.08 -1.26 -2.04 117.51 115.09 1q3s h ILE 35 Ca 0.04 -0.17 0.02 0.00 -0.39 0.00 0.00 64.86 64.35 1q3s h ILE 35 Cb 0.21 0.41 -0.03 0.00 -3.07 0.00 0.00 36.82 34.35 1q3s h ILE 35 CO -0.10 0.09 0.18 0.00 -0.69 0.00 0.00 178.15 177.63 1q3s h ALA 36 N 1.27 0.42 0.00 1.87 0.00 -0.92 -2.39 119.26 119.51 1q3s h ALA 36 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1q3s h ALA 36 Cb 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1q3s h ALA 36 CO -0.15 -0.19 -0.18 0.93 0.00 0.00 0.00 179.25 179.66 1q3s h GLU 37 N 0.37 0.00 -0.67 0.00 5.08 -0.52 -2.25 114.58 116.59 1q3s h GLU 37 Ca 0.14 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 1q3s h GLU 37 Cb 0.03 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1q3s h GLU 37 CO -0.08 0.18 0.21 1.15 -1.00 0.00 0.00 179.01 179.46 1q3s h THR 38 N 0.00 1.25 0.00 1.13 2.02 -0.84 -3.18 112.91 113.29 1q3s h THR 38 Ca -0.00 -0.86 0.00 0.00 0.77 0.00 0.00 66.41 66.32 1q3s h THR 38 Cb 0.36 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1q3s h THR 38 CO 0.02 0.33 -1.34 1.33 0.37 0.00 0.00 175.52 176.24 1q3s n VAL 39 N -4.26 0.38 0.16 3.16 0.24 -1.07 -4.29 118.33 112.65 1q3s n VAL 39 Ca 0.05 -0.51 0.11 0.00 -2.04 0.00 0.00 64.34 61.95 1q3s n VAL 39 Cb 0.22 -0.18 0.59 0.00 -1.47 0.00 0.00 33.84 33.00 1q3s n VAL 39 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1q3s n ARG 40 N -2.48 0.14 0.00 7.34 1.85 -0.87 -0.97 116.66 121.66 1q3s n ARG 40 Ca -0.01 0.64 0.14 0.00 -1.00 0.00 0.00 57.85 57.62 1q3s n ARG 40 Cb 0.55 -1.96 0.73 0.00 -1.05 0.00 0.00 32.46 30.72 1q3s n ARG 40 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1q3s n THR 41 N -2.26 0.07 0.35 8.89 -2.24 -1.26 -2.71 114.28 115.13 1q3s n THR 41 Ca -0.01 0.02 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1q3s n THR 41 Cb 0.04 -0.56 0.11 0.00 -2.10 0.00 0.00 70.33 67.82 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 -1.24 0.33 -2.33 4.28 -2.24 -0.15 -0.63 114.28 112.30 1q3s n THR 42 Ca 0.15 -0.66 -0.41 0.00 -2.27 0.00 0.00 64.05 60.86 1q3s n THR 42 Cb 0.20 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.45 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 -1.19 4.49 0.04 3.22 2.96 -1.10 -4.45 118.68 122.65 1q3s s LEU 43 Ca 0.22 2.41 0.00 0.00 -0.22 0.00 0.00 54.13 56.55 1q3s s LEU 43 Cb 0.14 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 43.20 1q3s s LEU 43 CO 0.20 -0.33 0.00 0.61 -1.32 0.00 0.00 176.35 175.51 1q3s n GLY 44 N 1.27 -1.34 0.20 7.98 0.00 -1.26 -3.11 105.19 108.93 1q3s n GLY 44 Ca 0.00 -1.50 0.01 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.15 0.16 -0.18 1.61 0.11 -1.82 -2.76 132.00 128.97 1q3s h PRO 45 Ca 0.00 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1q3s h PRO 45 Cb 0.15 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.25 1q3s h PRO 45 CO 0.00 0.47 0.00 1.63 -0.21 0.00 0.00 178.00 179.89 1q3s n LYS 46 N -4.11 1.79 -1.00 1.05 4.76 -1.26 -4.64 118.16 114.75 1q3s n LYS 46 Ca -0.01 -1.18 -0.32 0.00 -2.87 0.00 0.00 58.31 53.93 1q3s n LYS 46 Cb 0.40 -1.40 0.13 0.00 -1.84 0.00 0.00 35.03 32.32 1q3s n LYS 46 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1q3s s GLY 47 N -1.58 1.82 0.47 0.72 0.00 -1.04 -4.61 107.32 103.10 1q3s s GLY 47 Ca 0.33 0.57 0.06 0.00 0.00 0.00 0.00 44.72 45.68 1q3s s GLY 47 CO 0.27 0.97 0.64 1.06 0.00 0.00 0.00 173.10 176.03 1q3s s MET 48 N -4.55 2.71 0.28 2.90 -1.94 0.19 -4.90 119.30 113.99 1q3s s MET 48 Ca 0.67 -1.14 0.08 0.00 -1.71 0.00 0.00 55.69 53.59 1q3s s MET 48 Cb -0.23 -2.68 -0.04 0.00 2.01 0.00 0.00 34.83 33.90 1q3s s MET 48 CO 0.55 -0.43 0.19 -0.51 -0.01 0.00 0.00 175.02 174.80 1q3s s ASP 49 N -4.39 5.24 0.07 3.03 1.01 -1.26 -4.26 116.67 116.11 1q3s s ASP 49 Ca 0.56 -0.42 0.09 0.00 0.71 0.00 0.00 52.55 53.50 1q3s s ASP 49 Cb -0.10 -1.15 -0.03 0.00 1.01 0.00 0.00 42.92 42.65 1q3s s ASP 49 CO 0.35 -0.13 -0.25 -0.54 0.21 0.00 0.00 175.17 174.80 1q3s s LYS 50 N -3.86 1.58 -0.25 8.23 1.02 -0.23 -4.93 119.74 121.30 1q3s s LYS 50 Ca 0.35 -1.14 -0.07 0.00 0.02 0.00 0.00 55.97 55.12 1q3s s LYS 50 Cb -0.07 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1q3s s LYS 50 CO 0.24 0.46 0.07 1.41 -0.92 0.00 0.00 175.35 176.61 1q3s s MET 51 N -1.48 3.66 -0.23 1.68 -2.45 -1.26 -2.07 119.30 117.15 1q3s s MET 51 Ca 0.11 -0.48 -0.06 0.00 -1.25 0.00 0.00 55.69 54.02 1q3s s MET 51 Cb -0.10 -3.32 -0.02 0.00 1.25 0.00 0.00 34.83 32.64 1q3s s MET 51 CO 0.03 -0.18 0.02 -0.51 1.05 0.00 0.00 175.02 175.42 1q3s s LEU 52 N 1.60 3.18 -0.33 4.11 1.43 0.83 -4.97 118.68 124.54 1q3s s LEU 52 Ca 0.06 -0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 52.84 1q3s s LEU 52 Cb -0.15 -1.84 0.06 0.00 0.03 0.00 0.00 46.19 44.29 1q3s s LEU 52 CO 0.04 -0.02 0.06 -0.69 0.23 0.00 0.00 176.35 175.96 1q3s s VAL 53 N 1.53 3.20 0.74 -1.59 1.01 -1.26 -1.40 120.40 122.62 1q3s s VAL 53 Ca 0.06 -1.47 -0.11 0.00 0.00 0.00 0.00 61.98 60.46 1q3s s VAL 53 Cb -0.15 -2.91 0.03 0.00 0.00 0.00 0.00 36.38 33.36 1q3s s VAL 53 CO 0.00 -0.24 1.07 1.51 0.00 0.00 0.00 175.10 177.45 1q3s s ASP 54 N 1.39 4.99 0.62 3.32 -4.77 -1.04 -4.90 116.67 116.28 1q3s s ASP 54 Ca -0.02 1.57 0.30 0.00 -3.30 0.00 0.00 52.55 51.10 1q3s s ASP 54 Cb -0.20 -2.39 1.61 0.00 -1.09 0.00 0.00 42.92 40.85 1q3s s ASP 54 CO -0.01 -1.69 1.97 0.77 0.70 0.00 0.00 175.17 176.91 1q3s h SER 55 N -0.89 0.00 -0.02 2.11 4.64 -1.99 0.41 113.55 117.81 1q3s h SER 55 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1q3s h SER 55 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 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 -3.42 0.86 0.00 5.97 4.77 -1.26 -4.94 117.00 118.98 1q3s n LEU 56 Ca 0.03 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.71 1q3s n LEU 56 Cb 0.47 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1q3s n LEU 56 CO 0.22 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1q3s n GLY 57 N 1.08 3.09 1.38 -0.72 0.00 0.14 -5.06 105.19 105.10 1q3s n GLY 57 Ca 0.20 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 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 1.16 -0.24 -4.37 1.61 -0.08 -1.26 -4.41 116.55 108.96 1q3s n ASP 58 Ca 0.00 0.46 -0.33 0.00 -1.51 0.00 0.00 54.79 53.41 1q3s n ASP 58 Cb 0.00 -0.37 -0.14 0.00 2.34 0.00 0.00 41.12 42.94 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 -0.19 2.97 -0.12 5.18 1.09 -1.26 -2.51 121.20 126.36 1q3s s ILE 59 Ca 0.31 -0.70 0.00 0.00 -1.10 0.00 0.00 60.65 59.17 1q3s s ILE 59 Cb -0.44 -2.23 0.02 0.00 -1.06 0.00 0.00 42.46 38.75 1q3s s ILE 59 CO 0.23 0.54 -0.12 -0.69 -0.10 0.00 0.00 174.94 174.80 1q3s s VAL 60 N 0.21 1.31 -0.20 2.92 1.01 -0.50 -4.98 120.40 120.17 1q3s s VAL 60 Ca -0.09 -0.49 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 1q3s s VAL 60 Cb -0.15 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 34.97 1q3s s VAL 60 CO 0.05 0.41 -0.10 -0.69 0.00 0.00 0.00 175.10 174.77 1q3s s VAL 61 N 1.44 2.92 0.36 2.92 1.01 -1.26 -0.12 120.40 127.67 1q3s s VAL 61 Ca 0.02 -0.65 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 1q3s s VAL 61 Cb -0.13 -2.29 0.01 0.00 0.00 0.00 0.00 36.38 33.97 1q3s s VAL 61 CO -0.07 0.47 0.54 0.28 0.00 0.00 0.00 175.10 176.31 1q3s s THR 62 N 1.31 0.00 0.00 3.92 -1.32 -0.88 -4.89 115.64 113.78 1q3s s THR 62 Ca 0.04 -1.49 0.00 0.00 -1.21 0.00 0.00 61.69 59.03 1q3s s THR 62 Cb -0.14 -2.70 0.00 0.00 -1.51 0.00 0.00 72.50 68.15 1q3s s THR 62 CO -0.05 0.00 0.03 -3.20 -2.21 0.00 0.00 174.62 169.19 1q3s n ASN 63 N -1.45 0.06 -4.61 8.08 5.15 -1.26 -1.07 115.26 120.17 1q3s n ASN 63 Ca -0.01 -0.40 -0.43 0.00 -0.60 0.00 0.00 54.58 53.14 1q3s n ASN 63 Cb 0.61 0.63 -0.02 0.00 -0.53 0.00 0.00 39.78 40.47 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 -0.63 6.47 0.16 1.20 2.15 -1.26 -4.91 116.67 119.84 1q3s s ASP 64 Ca 0.00 0.86 -0.18 0.00 0.43 0.00 0.00 52.55 53.66 1q3s s ASP 64 Cb 0.00 -2.54 0.07 0.00 -0.30 0.00 0.00 42.92 40.15 1q3s s ASP 64 CO 0.00 -1.32 1.67 0.00 -0.17 0.00 0.00 175.17 175.35 1q3s h ALA 66 N 1.30 0.91 -0.31 0.00 0.00 -1.91 0.86 119.26 120.10 1q3s h ALA 66 Ca 0.17 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 55.10 1q3s h ALA 66 Cb 0.30 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1q3s h ALA 66 CO -0.39 -0.20 -0.16 1.15 0.00 0.00 0.00 179.25 179.65 1q3s h THR 67 N 0.42 1.29 0.10 0.00 2.02 -1.79 -2.25 112.91 112.70 1q3s h THR 67 Ca 0.36 -1.27 -0.00 0.00 0.77 0.00 0.00 66.41 66.27 1q3s h THR 67 Cb 0.50 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 1q3s h THR 67 CO -0.36 0.41 -0.05 0.40 0.37 0.00 0.00 175.52 176.29 1q3s h ILE 68 N 0.42 1.01 -0.64 3.11 2.04 -0.52 0.39 117.51 123.32 1q3s h ILE 68 Ca 0.07 -0.41 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1q3s h ILE 68 Cb 0.69 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 1q3s h ILE 68 CO 0.05 0.10 0.43 -0.07 0.00 0.00 0.00 178.15 178.65 1q3s h LEU 69 N -0.32 0.74 -0.13 1.44 3.38 -0.92 0.54 115.31 120.03 1q3s h LEU 69 Ca -0.01 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 1q3s h LEU 69 Cb 0.27 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.84 1q3s h LEU 69 CO 0.02 0.53 -0.60 -0.78 0.09 0.00 0.00 178.44 177.71 1q3s h ASP 70 N 0.87 0.75 -0.14 -0.43 1.82 -1.19 -3.33 116.42 114.79 1q3s h ASP 70 Ca 0.24 -0.63 -0.06 0.00 -0.39 0.00 0.00 57.03 56.19 1q3s h ASP 70 Cb -0.10 -0.22 -0.00 0.00 0.68 0.00 0.00 39.33 39.68 1q3s h ASP 70 CO -0.05 1.26 -0.16 0.11 -1.61 0.00 0.00 179.24 178.79 1q3s h LYS 71 N 0.30 0.35 -7.09 0.28 1.79 0.16 -3.44 116.57 108.91 1q3s h LYS 71 Ca -0.04 -0.19 -0.54 0.00 -2.18 0.00 0.00 60.65 57.70 1q3s h LYS 71 Cb 1.23 0.01 0.18 0.00 -1.58 0.00 0.00 32.23 32.07 1q3s h LYS 71 CO 0.12 0.75 0.24 -0.89 -1.08 0.00 0.00 179.45 178.60 1q3s n ILE 72 N -4.55 2.52 -3.17 1.86 5.41 0.15 -4.92 119.36 116.66 1q3s n ILE 72 Ca -0.06 -0.29 -0.41 0.00 1.00 0.00 0.00 62.75 62.99 1q3s n ILE 72 Cb 0.37 -1.18 -0.01 0.00 -0.71 0.00 0.00 39.64 38.12 1q3s n ILE 72 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1q3s n ASP 73 N -2.53 5.73 -4.73 4.38 4.64 -1.26 -4.92 116.55 117.86 1q3s n ASP 73 Ca 0.13 -3.33 -0.42 0.00 -1.38 0.00 0.00 54.79 49.80 1q3s n ASP 73 Cb 0.50 -1.19 0.00 0.00 -1.04 0.00 0.00 41.12 39.39 1q3s n ASP 73 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1q3s n LEU 74 N 1.57 4.12 -0.04 -2.67 4.77 -1.26 -4.90 117.00 118.60 1q3s n LEU 74 Ca 0.26 1.19 -0.04 0.00 -0.03 0.00 0.00 56.01 57.38 1q3s n LEU 74 Cb 0.35 -1.54 -0.05 0.00 -2.33 0.00 0.00 43.42 39.86 1q3s n LEU 74 CO 0.61 -0.31 -0.74 0.00 -1.33 0.00 0.00 177.39 175.63 1q3s n GLN 75 N 0.36 1.88 -2.31 3.23 1.13 -1.26 -4.91 117.38 115.49 1q3s n GLN 75 Ca 0.04 0.02 -0.41 0.00 -1.94 0.00 0.00 57.00 54.70 1q3s n GLN 75 Cb 0.38 -1.17 -0.03 0.00 0.11 0.00 0.00 30.24 29.53 1q3s n GLN 75 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 1q3s s HIS 76 N -2.16 3.36 0.15 1.08 2.46 -1.26 -4.93 115.29 113.99 1q3s s HIS 76 Ca -0.06 1.29 -0.22 0.00 0.47 0.00 0.00 55.06 56.54 1q3s s HIS 76 Cb 0.02 -3.51 0.04 0.00 -0.13 0.00 0.00 32.58 29.01 1q3s s HIS 76 CO 0.24 -1.55 1.63 -1.35 -2.47 0.00 0.00 174.74 171.24 1q3s h PRO 77 N 5.75 -0.21 0.00 2.88 0.11 -1.99 -0.99 132.00 137.54 1q3s h PRO 77 Ca -0.44 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 1q3s h PRO 77 Cb 1.21 0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 1q3s h PRO 77 CO 0.78 -0.14 -0.03 0.00 -0.21 0.00 0.00 178.00 178.40 1q3s h ALA 78 N 0.88 1.26 0.18 -0.75 0.00 -1.92 -2.09 119.26 116.82 1q3s h ALA 78 Ca 0.15 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.79 1q3s h ALA 78 Cb 0.45 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.26 1q3s h ALA 78 CO -0.40 0.03 -1.13 0.00 0.00 0.00 0.00 179.25 177.75 1q3s h ALA 79 N 1.97 -0.07 -0.38 0.00 0.00 -1.47 -3.28 119.26 116.04 1q3s h ALA 79 Ca -0.00 -0.81 0.03 0.00 0.00 0.00 0.00 54.91 54.13 1q3s h ALA 79 Cb 0.11 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1q3s h ALA 79 CO 0.00 0.55 0.25 0.87 0.00 0.00 0.00 179.25 180.93 1q3s h LYS 80 N -0.19 0.40 0.00 0.00 1.57 -0.64 0.98 116.57 118.70 1q3s h LYS 80 Ca -0.20 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.55 1q3s h LYS 80 Cb 1.84 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 34.06 1q3s h LYS 80 CO 0.18 0.27 -0.02 0.52 -0.57 0.00 0.00 179.45 179.83 1q3s h MET 81 N 0.42 0.00 0.00 3.15 2.86 -1.46 -0.95 114.93 118.95 1q3s h MET 81 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1q3s h MET 81 Cb 0.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.76 1q3s h MET 81 CO -0.04 0.02 0.00 0.52 1.06 0.00 0.00 176.91 178.48 1q3s h MET 82 N 0.00 0.00 -0.04 1.72 2.86 -0.86 -2.96 114.93 115.64 1q3s h MET 82 Ca -0.00 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.44 1q3s h MET 82 Cb 0.33 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.99 1q3s h MET 82 CO 0.00 0.00 -0.83 0.28 1.06 0.00 0.00 176.91 177.42 1q3s h VAL 83 N 0.00 1.39 -0.16 -2.22 2.07 -1.15 -2.94 116.25 113.24 1q3s h VAL 83 Ca 0.00 -2.30 -0.01 0.00 0.82 0.00 0.00 66.70 65.20 1q3s h VAL 83 Cb 0.86 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 1q3s h VAL 83 CO 0.00 0.69 0.03 -0.33 0.02 0.00 0.00 177.57 177.98 1q3s h GLU 84 N 0.25 0.22 0.39 1.57 5.08 -1.49 -1.43 114.58 119.16 1q3s h GLU 84 Ca -0.05 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1q3s h GLU 84 Cb 1.44 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.65 1q3s h GLU 84 CO 0.14 0.22 -0.19 0.28 -1.00 0.00 0.00 179.01 178.47 1q3s h VAL 85 N 0.22 0.63 -0.66 3.13 2.07 -1.52 -1.71 116.25 118.40 1q3s h VAL 85 Ca 0.06 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.41 1q3s h VAL 85 Cb 0.10 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 1q3s h VAL 85 CO -0.00 0.04 0.44 0.00 0.02 0.00 0.00 177.57 178.07 1q3s h ALA 86 N -0.05 1.59 0.45 1.67 0.00 -1.48 -1.39 119.26 120.05 1q3s h ALA 86 Ca -0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1q3s h ALA 86 Cb 0.46 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1q3s h ALA 86 CO 0.09 0.36 -0.22 -0.22 0.00 0.00 0.00 179.25 179.26 1q3s h LYS 87 N 0.84 -0.58 -0.84 0.00 1.63 -1.06 0.10 116.57 116.65 1q3s h LYS 87 Ca 0.26 0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 60.07 1q3s h LYS 87 Cb 0.00 0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.72 1q3s h LYS 87 CO -0.07 -0.36 0.42 1.15 -3.45 0.00 0.00 179.45 177.14 1q3s h THR 88 N -0.65 1.26 0.02 1.00 2.02 -1.09 -1.25 112.91 114.22 1q3s h THR 88 Ca -0.06 -0.70 -0.00 0.00 0.77 0.00 0.00 66.41 66.42 1q3s h THR 88 Cb 0.49 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1q3s h THR 88 CO 0.10 0.30 -0.01 -0.61 0.37 0.00 0.00 175.52 175.67 1q3s h GLN 89 N 1.19 -0.03 0.00 6.66 5.75 -1.14 -1.68 115.11 125.87 1q3s h GLN 89 Ca 0.29 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.79 1q3s h GLN 89 Cb 0.10 0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.65 1q3s h GLN 89 CO -0.04 0.08 0.00 0.22 -2.65 0.00 0.00 178.83 176.44 1q3s h ASP 90 N -0.13 0.00 -0.02 -0.69 3.58 -0.64 -0.57 116.42 117.94 1q3s h ASP 90 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1q3s h ASP 90 Cb 0.12 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.17 1q3s h ASP 90 CO 0.01 0.00 -0.30 1.17 -2.88 0.00 0.00 179.24 177.23 1q3s n LYS 91 N -3.07 1.57 -0.00 0.28 4.81 -0.50 -2.87 118.16 118.38 1q3s n LYS 91 Ca -0.02 -1.22 0.00 0.00 -0.87 0.00 0.00 58.31 56.21 1q3s n LYS 91 Cb 0.16 -1.42 -0.01 0.00 0.02 0.00 0.00 35.03 33.78 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 0.35 1.40 0.00 1.64 -0.58 -0.67 -4.81 120.64 117.98 1q3s n GLU 92 Ca 0.10 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1q3s n GLU 92 Cb 0.47 -1.03 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 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 -1.72 0.00 0.00 0.62 0.00 -0.28 -4.96 120.51 114.17 1q3s n ALA 93 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1q3s n ALA 93 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 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 0.00 0.87 3.30 0.00 0.00 -0.84 -4.39 105.19 104.13 1q3s n GLY 94 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.49 2.20 0.00 1.61 3.68 -1.26 -4.68 116.67 117.73 1q3s s ASP 95 Ca 0.00 -0.99 0.00 0.00 2.13 0.00 0.00 52.55 53.69 1q3s s ASP 95 Cb 0.00 -0.08 0.00 0.00 -1.45 0.00 0.00 42.92 41.39 1q3s s ASP 95 CO 0.00 -0.23 0.00 0.61 0.13 0.00 0.00 175.17 175.68 1q3s n GLY 96 N -0.21 0.79 0.34 2.66 0.00 -1.26 -4.81 105.19 102.70 1q3s n GLY 96 Ca -0.10 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.32 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 0.00 1.26 0.03 2.61 1.35 -1.89 -2.05 112.91 114.22 1q3s h THR 97 Ca 0.00 -0.82 -0.00 0.00 -0.55 0.00 0.00 66.41 65.04 1q3s h THR 97 Cb 0.13 0.35 0.00 0.00 -1.73 0.00 0.00 68.15 66.90 1q3s h THR 97 CO 0.00 0.33 -0.01 0.74 -0.25 0.00 0.00 175.52 176.33 1q3s h THR 98 N 1.12 1.26 -0.79 6.82 2.02 -1.95 -2.89 112.91 118.49 1q3s h THR 98 Ca 0.25 -0.92 0.19 0.00 0.77 0.00 0.00 66.41 66.71 1q3s h THR 98 Cb 0.23 1.87 -0.13 0.00 -1.74 0.00 0.00 68.15 68.38 1q3s h THR 98 CO -0.02 0.23 0.14 0.74 0.37 0.00 0.00 175.52 176.99 1q3s h THR 99 N -0.44 0.39 -0.33 3.16 2.02 -1.91 0.07 112.91 115.88 1q3s h THR 99 Ca -0.00 -0.07 -0.11 0.00 0.77 0.00 0.00 66.41 66.99 1q3s h THR 99 Cb 0.41 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 1q3s h THR 99 CO 0.01 0.04 -0.24 0.00 0.37 0.00 0.00 175.52 175.69 1q3s h ALA 100 N 1.70 0.47 -0.53 6.16 0.00 -1.39 -1.60 119.26 124.08 1q3s h ALA 100 Ca 0.46 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1q3s h ALA 100 Cb 0.86 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1q3s h ALA 100 CO -0.61 0.45 -0.03 0.28 0.00 0.00 0.00 179.25 179.34 1q3s h VAL 101 N 0.51 1.26 0.31 0.00 2.07 -1.12 -1.70 116.25 117.57 1q3s h VAL 101 Ca 0.06 -1.11 -0.02 0.00 0.82 0.00 0.00 66.70 66.46 1q3s h VAL 101 Cb 0.80 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1q3s h VAL 101 CO 0.06 0.39 -0.15 0.58 0.02 0.00 0.00 177.57 178.48 1q3s h VAL 102 N 0.84 0.69 -0.04 2.57 2.07 -0.97 -2.27 116.25 119.15 1q3s h VAL 102 Ca 0.15 -0.59 0.01 0.00 0.82 0.00 0.00 66.70 67.10 1q3s h VAL 102 Cb 0.53 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1q3s h VAL 102 CO 0.03 0.11 0.11 0.40 0.02 0.00 0.00 177.57 178.24 1q3s h ILE 103 N -0.75 0.16 0.04 4.57 2.04 -1.27 -0.53 117.51 121.78 1q3s h ILE 103 Ca -0.04 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 1q3s h ILE 103 Cb 0.50 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1q3s h ILE 103 CO 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 178.20 1q3s h ALA 104 N 1.82 -0.06 -0.69 1.87 0.00 -1.12 -1.47 119.26 119.61 1q3s h ALA 104 Ca 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1q3s h ALA 104 Cb 0.23 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1q3s h ALA 104 CO -0.00 -0.11 0.41 0.78 0.00 0.00 0.00 179.25 180.33 1q3s h GLY 105 N -0.90 1.00 0.93 0.00 0.00 -0.86 -1.09 103.07 102.15 1q3s h GLY 105 Ca -0.01 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.88 1q3s h GLY 105 CO 0.01 0.40 0.12 -2.09 0.00 0.00 0.00 176.54 174.98 1q3s h GLU 106 N 0.95 0.61 -0.96 4.80 4.57 -1.17 -1.00 114.58 122.38 1q3s h GLU 106 Ca 0.25 -0.13 0.02 0.00 -1.18 0.00 0.00 59.36 58.31 1q3s h GLU 106 Cb -0.03 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.42 1q3s h GLU 106 CO -0.05 0.61 0.63 1.25 -1.18 0.00 0.00 179.01 180.28 1q3s h LEU 107 N 0.48 1.08 -1.19 1.64 5.85 -0.74 -1.44 115.31 120.99 1q3s h LEU 107 Ca 0.13 -0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.74 1q3s h LEU 107 Cb 0.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1q3s h LEU 107 CO -0.00 0.77 -0.37 -0.07 -0.34 0.00 0.00 178.44 178.42 1q3s h LEU 108 N 1.27 0.05 0.44 2.25 3.38 -0.69 -0.69 115.31 121.32 1q3s h LEU 108 Ca 0.36 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 1q3s h LEU 108 Cb -0.11 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1q3s h LEU 108 CO -0.09 0.42 -0.21 -0.09 0.09 0.00 0.00 178.44 178.57 1q3s h ARG 109 N 0.04 -0.56 -0.11 1.13 2.43 -0.19 -2.15 114.38 114.96 1q3s h ARG 109 Ca 0.00 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1q3s h ARG 109 Cb 0.69 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.36 1q3s h ARG 109 CO 0.05 -0.26 0.07 0.87 -1.51 0.00 0.00 179.97 179.19 1q3s h LYS 110 N -0.99 0.15 -0.31 0.20 1.79 -1.33 -1.46 116.57 114.61 1q3s h LYS 110 Ca -0.06 -0.01 -0.08 0.00 -2.18 0.00 0.00 60.65 58.32 1q3s h LYS 110 Cb 0.56 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.16 1q3s h LYS 110 CO 0.10 0.10 -0.14 0.00 -1.08 0.00 0.00 179.45 178.43 1q3s h ALA 111 N 1.92 1.18 -0.02 3.86 0.00 -1.03 -2.48 119.26 122.68 1q3s h ALA 111 Ca 0.04 -0.29 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 1q3s h ALA 111 Cb -0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1q3s h ALA 111 CO -0.01 0.53 -0.79 1.49 0.00 0.00 0.00 179.25 180.46 1q3s h GLU 112 N 0.50 0.24 -0.69 0.00 4.81 -0.60 -1.93 114.58 116.90 1q3s h GLU 112 Ca 0.09 -0.22 0.09 0.00 -0.13 0.00 0.00 59.36 59.18 1q3s h GLU 112 Cb 0.54 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.91 1q3s h GLU 112 CO 0.03 0.91 0.35 0.93 -0.73 0.00 0.00 179.01 180.50 1q3s h GLU 113 N 0.15 0.59 0.00 1.92 5.08 -1.01 0.18 114.58 121.49 1q3s h GLU 113 Ca -0.03 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1q3s h GLU 113 Cb 1.38 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1q3s h GLU 113 CO 0.12 0.39 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.27 1q3s h LEU 114 N 0.60 0.00 -0.01 1.33 3.38 -1.17 -2.56 115.31 116.88 1q3s h LEU 114 Ca 0.34 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.08 1q3s h LEU 114 Cb 0.34 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.10 1q3s h LEU 114 CO -0.25 0.18 -0.87 -0.07 0.09 0.00 0.00 178.44 177.51 1q3s h LEU 115 N 0.00 0.79 -1.64 1.67 3.38 0.02 -2.22 115.31 117.31 1q3s h LEU 115 Ca -0.00 -0.74 -0.04 0.00 0.09 0.00 0.00 57.88 57.19 1q3s h LEU 115 Cb 0.68 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1q3s h LEU 115 CO 0.02 1.42 -0.20 0.44 0.09 0.00 0.00 178.44 180.22 1q3s h ASP 116 N 0.24 0.00 0.00 -0.43 3.45 -0.63 0.13 116.42 119.19 1q3s h ASP 116 Ca -0.11 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.35 1q3s h ASP 116 Cb 1.54 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.31 1q3s h ASP 116 CO 0.17 0.20 0.00 1.67 -1.57 0.00 0.00 179.24 179.71 1q3s n GLN 117 N -4.16 0.82 -1.05 3.56 7.27 -0.98 -4.85 117.38 117.99 1q3s n GLN 117 Ca -0.02 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.03 1q3s n GLN 117 Cb 0.26 -1.32 -0.01 0.00 2.41 0.00 0.00 30.24 31.58 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 -0.82 -3.82 -4.71 1.69 5.03 0.47 -5.01 115.26 108.08 1q3s n ASN 118 Ca 0.13 0.04 -0.42 0.00 0.87 0.00 0.00 54.58 55.20 1q3s n ASN 118 Cb 0.06 -1.46 -0.03 0.00 -1.02 0.00 0.00 39.78 37.33 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 -1.85 3.50 0.20 2.41 1.01 -0.84 -4.94 121.20 120.69 1q3s s ILE 119 Ca 0.00 1.06 -0.33 0.00 0.00 0.00 0.00 60.65 61.39 1q3s s ILE 119 Cb 0.00 -3.68 -0.13 0.00 0.01 0.00 0.00 42.46 38.66 1q3s s ILE 119 CO 0.00 0.08 1.55 1.57 0.00 0.00 0.00 174.94 178.13 1q3s n HIS 120 N 4.07 2.34 -0.34 3.97 -0.00 -1.26 -4.52 115.22 119.47 1q3s n HIS 120 Ca 0.11 0.29 0.25 0.00 -0.00 0.00 0.00 57.72 58.37 1q3s n HIS 120 Cb 0.43 -2.54 0.49 0.00 -0.00 0.00 0.00 29.99 28.37 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 5.45 0.31 -0.40 1.57 0.13 -1.92 0.11 132.00 137.26 1q3s h PRO 121 Ca -0.45 -0.02 0.08 0.00 -0.87 0.00 0.00 66.00 64.74 1q3s h PRO 121 Cb 1.25 -0.07 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 1q3s h PRO 121 CO 0.85 0.21 -0.31 1.03 -0.23 0.00 0.00 178.00 179.54 1q3s h SER 122 N 0.32 -1.04 -0.48 1.44 0.87 -1.91 0.58 113.55 113.33 1q3s h SER 122 Ca 0.73 0.19 0.01 0.00 -1.23 0.00 0.00 61.79 61.49 1q3s h SER 122 Cb 1.72 0.49 -0.03 0.00 -0.44 0.00 0.00 62.40 64.15 1q3s h SER 122 CO -0.57 -0.31 0.31 0.40 -0.53 0.00 0.00 176.83 176.13 1q3s h ILE 123 N -0.24 1.11 -0.71 2.23 1.08 -1.13 -0.64 117.51 119.20 1q3s h ILE 123 Ca 0.18 -0.22 -0.01 0.00 -0.39 0.00 0.00 64.86 64.42 1q3s h ILE 123 Cb 0.53 0.42 -0.03 0.00 -3.07 0.00 0.00 36.82 34.67 1q3s h ILE 123 CO -0.53 0.11 0.40 0.40 -0.69 0.00 0.00 178.15 177.84 1q3s h ILE 124 N 0.63 1.21 0.02 -0.67 2.04 -1.09 -0.05 117.51 119.61 1q3s h ILE 124 Ca 0.18 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.51 1q3s h ILE 124 Cb -0.06 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1q3s h ILE 124 CO -0.05 0.23 -0.01 0.40 0.00 0.00 0.00 178.15 178.72 1q3s h ILE 125 N 0.97 1.10 -0.02 -0.67 2.04 -0.51 -0.94 117.51 119.49 1q3s h ILE 125 Ca 0.25 -0.39 -0.05 0.00 1.00 0.00 0.00 64.86 65.66 1q3s h ILE 125 Cb 0.02 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1q3s h ILE 125 CO -0.04 0.10 -0.24 0.11 0.00 0.00 0.00 178.15 178.07 1q3s h LYS 126 N -0.20 0.03 0.02 2.37 1.79 -0.94 -0.97 116.57 118.67 1q3s h LYS 126 Ca -0.00 -0.01 -0.21 0.00 -2.18 0.00 0.00 60.65 58.25 1q3s h LYS 126 Cb 0.19 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 1q3s h LYS 126 CO 0.01 0.27 -0.96 0.78 -1.08 0.00 0.00 179.45 178.47 1q3s h GLY 127 N 0.77 0.20 1.69 3.86 0.00 -0.85 -2.75 103.07 105.98 1q3s h GLY 127 Ca 0.00 -0.39 -0.16 0.00 0.00 0.00 0.00 47.33 46.78 1q3s h GLY 127 CO 0.03 0.34 -0.63 -0.97 0.00 0.00 0.00 176.54 175.32 1q3s h TYR 128 N 0.08 0.41 -0.42 5.60 0.99 -0.70 -1.72 116.97 121.21 1q3s h TYR 128 Ca -0.05 -0.16 -0.11 0.00 2.00 0.00 0.00 58.73 60.40 1q3s h TYR 128 Cb 1.62 -0.07 -0.01 0.00 1.00 0.00 0.00 36.73 39.27 1q3s h TYR 128 CO 0.03 0.86 -0.17 0.00 -0.00 0.00 0.00 178.16 178.88 1q3s h ALA 129 N 1.10 0.58 -0.63 3.88 0.00 -1.18 0.53 119.26 123.55 1q3s h ALA 129 Ca -0.01 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 1q3s h ALA 129 Cb 1.16 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 1q3s h ALA 129 CO 0.10 0.52 0.09 -0.07 0.00 0.00 0.00 179.25 179.90 1q3s h LEU 130 N 0.67 0.98 -0.47 0.00 3.38 -1.40 0.23 115.31 118.70 1q3s h LEU 130 Ca 0.10 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 1q3s h LEU 130 Cb 0.72 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1q3s h LEU 130 CO 0.05 0.98 -0.18 0.00 0.09 0.00 0.00 178.44 179.39 1q3s h ALA 131 N 1.13 0.65 -0.10 1.53 0.00 -1.16 -0.77 119.26 120.55 1q3s h ALA 131 Ca 0.19 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1q3s h ALA 131 Cb 0.43 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1q3s h ALA 131 CO 0.01 0.61 0.04 0.00 0.00 0.00 0.00 179.25 179.91 1q3s h ALA 132 N 0.86 0.13 0.03 0.00 0.00 -0.55 -1.39 119.26 118.35 1q3s h ALA 132 Ca 0.11 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1q3s h ALA 132 Cb 0.74 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1q3s h ALA 132 CO 0.06 -0.27 -0.02 0.93 0.00 0.00 0.00 179.25 179.95 1q3s h GLU 133 N -0.01 -0.04 -0.01 0.00 4.39 -0.51 -2.46 114.58 115.94 1q3s h GLU 133 Ca 0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1q3s h GLU 133 Cb 0.19 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1q3s h GLU 133 CO -0.00 0.08 0.01 -0.22 -1.16 0.00 0.00 179.01 177.72 1q3s h LYS 134 N -0.16 0.00 0.05 2.33 1.63 -1.13 -2.75 116.57 116.54 1q3s h LYS 134 Ca -0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1q3s h LYS 134 Cb 0.15 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.78 1q3s h LYS 134 CO 0.01 0.00 -0.02 0.00 -3.45 0.00 0.00 179.45 175.99 1q3s h ALA 135 N 1.99 -0.06 0.15 5.00 0.00 -0.76 -0.85 119.26 124.72 1q3s h ALA 135 Ca 0.01 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1q3s h ALA 135 Cb 0.03 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1q3s h ALA 135 CO -0.00 -0.48 -0.25 1.96 0.00 0.00 0.00 179.25 180.48 1q3s h GLN 136 N -0.17 -0.45 -0.60 0.00 1.08 -1.34 0.03 115.11 113.66 1q3s h GLN 136 Ca -0.01 0.03 0.12 0.00 -1.45 0.00 0.00 58.65 57.34 1q3s h GLN 136 Cb 0.15 0.10 -0.11 0.00 -0.05 0.00 0.00 27.48 27.57 1q3s h GLN 136 CO 0.01 -0.30 -0.17 1.49 -0.95 0.00 0.00 178.83 178.91 1q3s h GLU 137 N -0.47 -0.02 0.00 1.46 4.81 -1.45 0.26 114.58 119.16 1q3s h GLU 137 Ca 0.02 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 1q3s h GLU 137 Cb 0.48 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 1q3s h GLU 137 CO -0.12 -0.02 -0.28 0.82 -0.73 0.00 0.00 179.01 178.69 1q3s h ILE 138 N -0.02 1.12 0.03 2.32 2.04 -0.66 -2.26 117.51 120.08 1q3s h ILE 138 Ca 0.28 -0.97 -0.27 0.00 1.00 0.00 0.00 64.86 64.91 1q3s h ILE 138 Cb 0.46 1.53 0.02 0.00 -0.74 0.00 0.00 36.82 38.09 1q3s h ILE 138 CO -0.63 0.27 -1.07 -0.07 0.00 0.00 0.00 178.15 176.65 1q3s h LEU 139 N 0.00 0.81 -0.77 1.44 3.38 0.11 -2.72 115.31 117.56 1q3s h LEU 139 Ca -0.00 -0.68 -0.08 0.00 0.09 0.00 0.00 57.88 57.21 1q3s h LEU 139 Cb 0.51 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1q3s h LEU 139 CO 0.04 1.48 0.03 0.44 0.09 0.00 0.00 178.44 180.51 1q3s h ASP 140 N 0.32 0.93 0.32 -0.43 3.32 -0.36 -1.57 116.42 118.95 1q3s h ASP 140 Ca -0.13 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.67 1q3s h ASP 140 Cb 1.73 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 41.04 1q3s h ASP 140 CO 0.20 0.97 -0.15 -0.08 -1.72 0.00 0.00 179.24 178.46 1q3s h GLU 141 N 0.89 -0.41 0.00 3.56 4.81 -1.45 -3.24 114.58 118.74 1q3s h GLU 141 Ca 0.17 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1q3s h GLU 141 Cb 0.48 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1q3s h GLU 141 CO 0.02 -0.09 0.00 -0.84 -0.73 0.00 0.00 179.01 177.37 1q3s h ILE 142 N -0.79 0.00 -2.20 2.32 3.07 -1.53 -3.46 117.51 114.92 1q3s h ILE 142 Ca -0.04 -0.38 -0.59 0.00 1.55 0.00 0.00 64.86 65.39 1q3s h ILE 142 Cb 0.51 1.24 0.06 0.00 -0.27 0.00 0.00 36.82 38.36 1q3s h ILE 142 CO 0.07 0.00 0.75 0.00 -1.05 0.00 0.00 178.15 177.93 1q3s n ALA 143 N -1.85 1.08 -2.62 0.16 0.00 -0.59 -4.90 120.51 111.79 1q3s n ALA 143 Ca 0.03 0.45 -0.42 0.00 0.00 0.00 0.00 53.44 53.51 1q3s n ALA 143 Cb 0.31 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.41 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 0.85 4.00 0.11 0.00 1.01 -0.27 -4.89 121.20 122.01 1q3s s ILE 144 Ca 0.79 -0.54 -0.34 0.00 0.00 0.00 0.00 60.65 60.57 1q3s s ILE 144 Cb -0.71 -4.96 -0.13 0.00 0.01 0.00 0.00 42.46 36.66 1q3s s ILE 144 CO 0.39 -1.83 1.66 0.54 0.00 0.00 0.00 174.94 175.70 1q3s n ARG 145 N 8.63 2.21 -4.43 2.79 5.12 -1.26 -2.08 116.66 127.64 1q3s n ARG 145 Ca 0.22 0.80 -0.21 0.00 -1.93 0.00 0.00 57.85 56.73 1q3s n ARG 145 Cb 0.50 -2.60 -0.10 0.00 -1.16 0.00 0.00 32.46 29.10 1q3s n ARG 145 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1q3s s VAL 146 N 1.72 1.41 -0.58 1.55 0.11 0.10 -4.94 120.40 119.78 1q3s s VAL 146 Ca 0.82 -2.06 -0.28 0.00 -2.93 0.00 0.00 61.98 57.53 1q3s s VAL 146 Cb -0.67 -2.60 0.02 0.00 -1.53 0.00 0.00 36.38 31.61 1q3s s VAL 146 CO 0.41 -0.17 1.30 -0.62 -3.33 0.00 0.00 175.10 172.68 1q3s s ASP 147 N -3.46 6.29 0.13 3.54 3.68 -1.26 -4.51 116.67 121.07 1q3s s ASP 147 Ca 0.32 0.18 0.08 0.00 2.13 0.00 0.00 52.55 55.26 1q3s s ASP 147 Cb 0.06 -2.55 0.28 0.00 -1.45 0.00 0.00 42.92 39.26 1q3s s ASP 147 CO 0.13 -1.60 0.31 -2.65 0.13 0.00 0.00 175.17 171.49 1q3s n PRO 148 N 8.58 0.00 -0.04 4.34 -0.02 -1.26 0.17 135.00 146.77 1q3s n PRO 148 Ca 0.10 0.23 0.01 0.00 -2.02 0.00 0.00 63.50 61.81 1q3s n PRO 148 Cb 0.49 -0.54 0.01 0.00 -0.02 0.00 0.00 33.50 33.44 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 -2.03 1.16 -4.53 2.55 3.85 -1.26 -3.99 116.55 112.29 1q3s n ASP 149 Ca 0.07 -1.71 -0.39 0.00 -0.71 0.00 0.00 54.79 52.05 1q3s n ASP 149 Cb 0.38 -0.05 -0.07 0.00 -1.35 0.00 0.00 41.12 40.04 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 -0.36 1.76 -0.33 -1.12 4.64 0.45 -4.79 116.55 116.81 1q3s n ASP 150 Ca 0.01 -0.20 0.31 0.00 -1.38 0.00 0.00 54.79 53.53 1q3s n ASP 150 Cb 0.40 -1.36 0.65 0.00 -1.04 0.00 0.00 41.12 39.77 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 16.58 0.15 0.00 -0.67 4.57 -1.96 -2.00 114.58 131.26 1q3s h GLU 151 Ca -0.20 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 1q3s h GLU 151 Cb 1.29 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.84 1q3s h GLU 151 CO 1.20 0.10 0.00 -1.91 -1.18 0.00 0.00 179.01 177.22 1q3s n GLU 152 N -4.39 0.00 0.13 1.92 4.07 -1.26 -1.76 120.64 119.35 1q3s n GLU 152 Ca 0.26 0.14 0.19 0.00 -0.06 0.00 0.00 57.16 57.69 1q3s n GLU 152 Cb 1.12 -1.08 0.76 0.00 -0.06 0.00 0.00 31.44 32.19 1q3s n GLU 152 CO 0.00 0.00 0.00 1.79 -0.06 0.00 0.00 177.13 178.86 1q3s h THR 153 N 0.00 0.36 -0.11 6.31 1.35 -1.96 0.30 112.91 119.16 1q3s h THR 153 Ca 0.00 0.00 -0.17 0.00 -0.55 0.00 0.00 66.41 65.69 1q3s h THR 153 Cb 0.00 0.68 -0.01 0.00 -1.73 0.00 0.00 68.15 67.09 1q3s h THR 153 CO 0.00 0.00 -0.63 0.25 -0.25 0.00 0.00 175.52 174.89 1q3s h LEU 154 N 0.00 0.48 -0.73 3.87 5.85 -1.38 -2.31 115.31 121.09 1q3s h LEU 154 Ca 0.16 -0.29 -0.13 0.00 0.84 0.00 0.00 57.88 58.47 1q3s h LEU 154 Cb 0.96 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1q3s h LEU 154 CO -0.00 0.99 -0.63 -0.07 -0.34 0.00 0.00 178.44 178.39 1q3s h LEU 155 N 0.31 0.00 0.04 2.25 -0.00 0.43 -3.09 115.31 115.25 1q3s h LEU 155 Ca -0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1q3s h LEU 155 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.84 1q3s h LEU 155 CO 0.11 0.63 -0.02 0.11 -0.00 0.00 0.00 178.44 179.27 1q3s h LYS 156 N 0.00 -0.05 -0.49 1.13 1.57 -1.36 -2.95 116.57 114.41 1q3s h LYS 156 Ca -0.01 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.87 1q3s h LYS 156 Cb 1.12 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 33.35 1q3s h LYS 156 CO 0.08 -0.04 -0.13 -0.89 -0.57 0.00 0.00 179.45 177.91 1q3s n ILE 157 N -2.23 -0.21 -0.24 1.86 2.08 -0.88 0.11 119.36 119.85 1q3s n ILE 157 Ca -0.01 1.13 -0.07 0.00 0.56 0.00 0.00 62.75 64.35 1q3s n ILE 157 Cb 0.02 -1.55 0.05 0.00 -0.75 0.00 0.00 39.64 37.41 1q3s n ILE 157 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1q3s h ALA 158 N 0.95 0.93 -0.06 -1.39 0.00 -1.60 -2.28 119.26 115.81 1q3s h ALA 158 Ca 0.23 -0.27 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 1q3s h ALA 158 Cb 0.35 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1q3s h ALA 158 CO -0.50 0.67 -0.80 0.00 0.00 0.00 0.00 179.25 178.61 1q3s h ALA 159 N 1.08 0.17 -0.81 0.00 0.00 0.90 -1.77 119.26 118.83 1q3s h ALA 159 Ca 0.21 -0.62 0.11 0.00 0.00 0.00 0.00 54.91 54.61 1q3s h ALA 159 Cb 0.43 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1q3s h ALA 159 CO 0.01 0.57 0.53 1.15 0.00 0.00 0.00 179.25 181.51 1q3s h THR 160 N 0.29 0.91 -0.04 0.00 2.02 -1.01 0.94 112.91 116.01 1q3s h THR 160 Ca -0.08 -0.24 -0.08 0.00 0.77 0.00 0.00 66.41 66.78 1q3s h THR 160 Cb 1.46 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1q3s h THR 160 CO 0.16 0.13 -0.27 -1.28 0.37 0.00 0.00 175.52 174.63 1q3s h SER 161 N 0.70 0.31 0.17 4.18 0.87 -1.32 -3.17 113.55 115.30 1q3s h SER 161 Ca 0.38 -0.68 -0.01 0.00 -1.23 0.00 0.00 61.79 60.26 1q3s h SER 161 Cb 0.54 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1q3s h SER 161 CO -0.15 0.94 -0.07 0.40 -0.53 0.00 0.00 176.83 177.42 1q3s h ILE 162 N -0.29 0.61 -2.28 2.23 2.04 -0.52 -3.32 117.51 115.98 1q3s h ILE 162 Ca -0.02 -0.28 -0.66 0.00 1.00 0.00 0.00 64.86 64.90 1q3s h ILE 162 Cb 0.94 1.18 -0.16 0.00 -0.74 0.00 0.00 36.82 38.04 1q3s h ILE 162 CO 0.06 0.07 0.86 -0.89 0.00 0.00 0.00 178.15 178.24 1q3s s THR 163 N -4.46 4.49 0.00 -0.27 2.01 0.25 -2.98 115.64 114.69 1q3s s THR 163 Ca -0.04 -1.11 0.00 0.00 0.31 0.00 0.00 61.69 60.85 1q3s s THR 163 Cb 0.14 -4.80 0.00 0.00 0.01 0.00 0.00 72.50 67.86 1q3s s THR 163 CO 0.58 -1.56 0.00 0.61 -0.69 0.00 0.00 174.62 173.56 1q3s n GLY 164 N 5.65 0.00 3.30 4.40 0.00 -1.25 -4.39 105.19 112.89 1q3s n GLY 164 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 1q3s n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1q3s s LYS 165 N 0.00 1.66 0.04 1.61 1.02 -1.16 -4.63 119.74 118.29 1q3s s LYS 165 Ca 0.00 -1.90 -0.15 0.00 0.02 0.00 0.00 55.97 53.94 1q3s s LYS 165 Cb 0.00 0.33 -0.07 0.00 -0.52 0.00 0.00 37.83 37.57 1q3s s LYS 165 CO 0.00 -0.62 1.24 -0.97 -0.92 0.00 0.00 175.35 174.08 1q3s h ASN 166 N 2.23 -0.66 0.00 2.83 -0.00 -1.92 -3.20 115.58 114.86 1q3s h ASN 166 Ca -0.28 0.06 0.00 0.00 -0.00 0.00 0.00 56.30 56.09 1q3s h ASN 166 Cb 1.24 0.23 0.00 0.00 -0.00 0.00 0.00 38.32 39.79 1q3s h ASN 166 CO 0.40 -0.26 0.00 0.00 -0.00 0.00 0.00 177.43 177.57 1q3s n ALA 167 N -2.60 1.28 0.62 1.57 0.00 -1.26 -4.00 120.51 116.12 1q3s n ALA 167 Ca -0.04 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.46 1q3s n ALA 167 Cb 0.19 -1.00 0.33 0.00 0.00 0.00 0.00 19.45 18.97 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 0.56 0.17 0.27 0.00 0.28 -1.21 -2.04 120.64 118.67 1q3s n GLU 168 Ca 0.00 0.17 0.18 0.00 -0.16 0.00 0.00 57.16 57.35 1q3s n GLU 168 Cb 0.04 -1.50 0.88 0.00 1.43 0.00 0.00 31.44 32.28 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 0.00 -0.67 -1.84 4.64 -1.89 -2.42 113.55 111.37 1q3s h SER 169 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1q3s h SER 169 Cb 0.14 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 61.82 1q3s h SER 169 CO 0.00 0.00 -1.01 1.41 -0.87 0.00 0.00 176.83 176.36 1q3s n HIS 170 N -2.83 1.85 0.19 4.77 8.25 -0.86 -4.82 115.22 121.77 1q3s n HIS 170 Ca -0.01 -2.30 0.14 0.00 -0.26 0.00 0.00 57.72 55.29 1q3s n HIS 170 Cb 0.14 -0.27 0.74 0.00 1.12 0.00 0.00 29.99 31.72 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 2.52 0.00 0.15 -0.41 2.10 -1.54 -2.74 116.57 116.65 1q3s h LYS 171 Ca 0.05 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.69 1q3s h LYS 171 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1q3s h LYS 171 CO 0.44 0.00 -0.07 1.49 -2.00 0.00 0.00 179.45 179.31 1q3s h GLU 172 N 0.00 -0.19 0.03 0.07 4.57 -1.87 -2.40 114.58 114.78 1q3s h GLU 172 Ca 0.08 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.28 1q3s h GLU 172 Cb 0.37 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 1q3s h GLU 172 CO -0.00 -0.13 -0.26 1.25 -1.18 0.00 0.00 179.01 178.69 1q3s h LEU 173 N -0.21 -0.79 -1.10 1.64 5.85 -1.92 -2.87 115.31 115.91 1q3s h LEU 173 Ca -0.02 0.09 0.23 0.00 0.84 0.00 0.00 57.88 59.01 1q3s h LEU 173 Cb 0.15 0.30 -0.11 0.00 0.37 0.00 0.00 40.66 41.37 1q3s h LEU 173 CO 0.03 -0.26 0.62 -0.07 -0.34 0.00 0.00 178.44 178.42 1q3s h LEU 174 N -0.34 0.66 -0.70 2.25 3.38 -1.63 -0.56 115.31 118.35 1q3s h LEU 174 Ca 0.00 0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1q3s h LEU 174 Cb 0.36 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1q3s h LEU 174 CO -0.16 0.16 0.23 0.00 0.09 0.00 0.00 178.44 178.76 1q3s h ALA 175 N 1.67 0.92 0.37 1.53 0.00 -1.28 -1.68 119.26 120.79 1q3s h ALA 175 Ca 0.60 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 1q3s h ALA 175 Cb 1.17 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1q3s h ALA 175 CO -0.39 0.59 -0.18 -0.22 0.00 0.00 0.00 179.25 179.05 1q3s h LYS 176 N 1.03 -0.47 -0.99 0.00 3.64 -0.91 -1.72 116.57 117.15 1q3s h LYS 176 Ca 0.23 0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.82 1q3s h LYS 176 Cb 0.29 0.11 -0.10 0.00 -0.41 0.00 0.00 32.23 32.12 1q3s h LYS 176 CO -0.01 -0.24 0.61 -0.07 -2.27 0.00 0.00 179.45 177.47 1q3s h LEU 177 N -0.61 0.76 -0.06 5.20 3.38 -1.26 -0.74 115.31 121.97 1q3s h LEU 177 Ca -0.05 0.08 -0.22 0.00 0.09 0.00 0.00 57.88 57.78 1q3s h LEU 177 Cb 0.45 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.15 1q3s h LEU 177 CO 0.08 0.31 -0.82 0.00 0.09 0.00 0.00 178.44 178.10 1q3s h ALA 178 N 1.62 0.19 -0.47 1.53 0.00 -1.12 -0.53 119.26 120.47 1q3s h ALA 178 Ca 0.55 -0.62 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1q3s h ALA 178 Cb 0.85 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1q3s h ALA 178 CO -0.33 0.60 -0.20 0.28 0.00 0.00 0.00 179.25 179.60 1q3s h VAL 179 N 0.34 1.27 0.70 0.00 2.07 -0.95 -2.49 116.25 117.19 1q3s h VAL 179 Ca -0.08 -1.36 -0.03 0.00 0.82 0.00 0.00 66.70 66.04 1q3s h VAL 179 Cb 1.48 1.12 0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1q3s h VAL 179 CO 0.17 0.47 -0.33 -0.08 0.02 0.00 0.00 177.57 177.81 1q3s h GLU 180 N 0.82 -0.90 -1.07 1.57 4.81 -1.18 -1.19 114.58 117.43 1q3s h GLU 180 Ca 0.11 0.06 0.29 0.00 -0.13 0.00 0.00 59.36 59.69 1q3s h GLU 180 Cb 0.77 0.21 -0.08 0.00 0.63 0.00 0.00 28.75 30.27 1q3s h GLU 180 CO 0.06 -0.60 0.71 0.00 -0.73 0.00 0.00 179.01 178.45 1q3s h ALA 181 N -1.48 2.46 0.00 2.92 0.00 -1.11 0.64 119.26 122.69 1q3s h ALA 181 Ca -0.10 0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.62 1q3s h ALA 181 Cb 0.72 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1q3s h ALA 181 CO 0.16 -0.85 -1.21 0.28 0.00 0.00 0.00 179.25 177.62 1q3s h VAL 182 N 0.29 1.41 -0.15 0.00 2.07 -1.38 -3.06 116.25 115.44 1q3s h VAL 182 Ca 0.59 -3.16 -0.12 0.00 0.82 0.00 0.00 66.70 64.83 1q3s h VAL 182 Cb 1.71 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 34.16 1q3s h VAL 182 CO -0.23 0.81 -0.43 0.11 0.02 0.00 0.00 177.57 177.84 1q3s h LYS 183 N 0.00 0.34 0.00 1.57 1.57 0.35 -1.89 116.57 118.52 1q3s h LYS 183 Ca -0.10 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1q3s h LYS 183 Cb 1.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.15 1q3s h LYS 183 CO 0.11 0.72 0.00 0.94 -0.57 0.00 0.00 179.45 180.65 1q3s n GLN 184 N -4.01 0.00 0.25 3.15 -0.06 -0.39 -3.71 117.38 112.61 1q3s n GLN 184 Ca -0.02 0.09 0.17 0.00 -2.00 0.00 0.00 57.00 55.24 1q3s n GLN 184 Cb 0.51 -0.96 0.76 0.00 -4.06 0.00 0.00 30.24 26.49 1q3s n GLN 184 CO 0.00 0.00 0.00 -0.39 -0.20 0.00 0.00 177.06 176.47 1q3s h VAL 185 N 0.00 0.12 -2.89 1.69 -1.51 -1.66 -3.44 116.25 108.56 1q3s h VAL 185 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 66.70 64.88 1q3s h VAL 185 Cb 0.00 0.62 0.16 0.00 -2.13 0.00 0.00 31.29 29.95 1q3s h VAL 185 CO 0.00 0.00 -0.34 0.00 -1.23 0.00 0.00 177.57 176.00 1q3s n ALA 186 N -2.03 -1.06 -2.76 5.19 0.00 -0.71 -4.81 120.51 114.35 1q3s n ALA 186 Ca 0.02 0.03 -0.16 0.00 0.00 0.00 0.00 53.44 53.32 1q3s n ALA 186 Cb 0.50 -1.85 -0.14 0.00 0.00 0.00 0.00 19.45 17.97 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 -2.02 0.54 -0.30 0.00 2.56 -1.08 -5.03 118.70 113.37 1q3s s GLU 187 Ca 0.68 -0.36 -0.01 0.00 0.00 0.00 0.00 54.97 55.28 1q3s s GLU 187 Cb -0.48 -0.48 0.19 0.00 2.00 0.00 0.00 34.13 35.37 1q3s s GLU 187 CO 0.55 0.12 0.64 0.21 -0.56 0.00 0.00 175.26 176.22 1q3s s LYS 188 N -0.49 0.53 0.00 4.30 2.20 -1.26 -0.13 119.74 124.89 1q3s s LYS 188 Ca -0.00 0.88 0.00 0.00 -0.36 0.00 0.00 55.97 56.48 1q3s s LYS 188 Cb -0.04 0.48 0.00 0.00 -1.51 0.00 0.00 37.83 36.75 1q3s s LYS 188 CO -0.00 -0.65 0.00 0.36 -0.36 0.00 0.00 175.35 174.70 1q3s n LYS 189 N 5.43 3.35 -0.38 4.03 -0.00 -1.26 -4.71 118.16 124.61 1q3s n LYS 189 Ca -0.00 0.00 0.08 0.00 -0.00 0.00 0.00 58.31 58.39 1q3s n LYS 189 Cb 0.52 -0.40 0.26 0.00 -0.00 0.00 0.00 35.03 35.41 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 -0.58 3.41 0.00 -5.58 5.75 -1.26 -4.95 116.55 113.34 1q3s n ASP 190 Ca 0.00 -2.17 0.00 0.00 -0.01 0.00 0.00 54.79 52.61 1q3s n ASP 190 Cb 0.00 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.65 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 1.18 2.64 3.96 6.12 0.00 -1.26 -5.03 105.19 112.81 1q3s n GLY 191 Ca 0.19 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 45.28 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 3.35 0.72 1.61 1.02 -1.26 -5.03 119.74 120.15 1q3s s LYS 192 Ca 0.00 -0.60 -0.11 0.00 0.02 0.00 0.00 55.97 55.28 1q3s s LYS 192 Cb 0.00 -2.75 0.03 0.00 -0.52 0.00 0.00 37.83 34.59 1q3s s LYS 192 CO 0.00 0.16 1.07 0.71 -0.92 0.00 0.00 175.35 176.37 1q3s s TYR 193 N -2.22 2.92 -0.26 3.18 1.51 -1.26 -4.36 117.35 116.85 1q3s s TYR 193 Ca 0.40 1.47 -0.02 0.00 -1.01 0.00 0.00 57.07 57.91 1q3s s TYR 193 Cb -0.09 -2.94 0.15 0.00 -0.11 0.00 0.00 41.96 38.97 1q3s s TYR 193 CO 0.33 -1.44 0.45 0.08 -1.11 0.00 0.00 175.55 173.86 1q3s s VAL 194 N -3.00 -0.73 -0.11 0.71 1.01 0.82 -4.66 120.40 114.45 1q3s s VAL 194 Ca 0.59 -0.06 -0.06 0.00 0.00 0.00 0.00 61.98 62.46 1q3s s VAL 194 Cb -0.15 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 1q3s s VAL 194 CO 0.55 -0.09 0.11 -0.69 0.00 0.00 0.00 175.10 174.98 1q3s s VAL 195 N 2.64 5.24 -0.50 2.92 1.01 -1.26 -2.65 120.40 127.81 1q3s s VAL 195 Ca 0.15 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.26 1q3s s VAL 195 Cb -0.15 -3.27 0.13 0.00 0.00 0.00 0.00 36.38 33.08 1q3s s VAL 195 CO -0.18 0.61 0.24 -0.62 0.00 0.00 0.00 175.10 175.15 1q3s s ASP 196 N -1.03 4.25 0.00 3.32 -1.08 -1.26 -4.96 116.67 115.92 1q3s s ASP 196 Ca 0.15 -2.91 0.00 0.00 -0.52 0.00 0.00 52.55 49.27 1q3s s ASP 196 Cb -0.12 -1.56 0.00 0.00 -1.46 0.00 0.00 42.92 39.78 1q3s s ASP 196 CO 0.04 -0.24 0.84 0.18 0.52 0.00 0.00 175.17 176.51 1q3s n LEU 197 N 3.23 0.00 0.12 -1.34 4.77 -1.26 -1.24 117.00 121.29 1q3s n LEU 197 Ca 0.05 0.35 0.11 0.00 -0.03 0.00 0.00 56.01 56.50 1q3s n LEU 197 Cb 0.33 -0.35 0.48 0.00 -2.33 0.00 0.00 43.42 41.54 1q3s n LEU 197 CO 0.32 -0.35 0.84 0.47 -1.33 0.00 0.00 177.39 177.34 1q3s n ASP 198 N -1.34 0.61 -0.62 -1.43 8.00 -1.26 -1.91 116.55 118.61 1q3s n ASP 198 Ca 0.00 0.65 0.04 0.00 0.71 0.00 0.00 54.79 56.19 1q3s n ASP 198 Cb 0.08 -0.78 0.13 0.00 -0.02 0.00 0.00 41.12 40.52 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 -2.18 1.74 -3.88 -2.24 3.02 -0.37 -4.59 115.26 106.76 1q3s n ASN 199 Ca 0.02 -2.08 -0.30 0.00 -0.03 0.00 0.00 54.58 52.19 1q3s n ASN 199 Cb 0.22 -0.27 -0.15 0.00 -0.61 0.00 0.00 39.78 38.98 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 1.70 0.23 2.41 1.01 -0.80 -1.22 121.20 122.89 1q3s s ILE 200 Ca 0.19 -2.07 -0.20 0.00 0.00 0.00 0.00 60.65 58.56 1q3s s ILE 200 Cb 0.11 -2.26 -0.08 0.00 0.01 0.00 0.00 42.46 40.24 1q3s s ILE 200 CO 0.11 -0.67 0.75 -0.75 0.00 0.00 0.00 174.94 174.38 1q3s s LYS 201 N 1.05 4.29 -0.15 2.79 2.20 -0.83 -4.94 119.74 124.15 1q3s s LYS 201 Ca 0.11 0.92 -0.03 0.00 -0.36 0.00 0.00 55.97 56.62 1q3s s LYS 201 Cb -0.19 -2.89 -0.02 0.00 -1.51 0.00 0.00 37.83 33.22 1q3s s LYS 201 CO -0.13 0.39 -0.06 -0.06 -0.36 0.00 0.00 175.35 175.12 1q3s s PHE 202 N -1.52 2.96 -0.20 4.03 0.40 -1.26 -0.70 117.98 121.69 1q3s s PHE 202 Ca 0.43 -0.41 -0.01 0.00 -0.60 0.00 0.00 56.93 56.34 1q3s s PHE 202 Cb -0.17 -1.93 0.01 0.00 0.51 0.00 0.00 43.02 41.44 1q3s s PHE 202 CO 0.21 -0.10 -0.13 -2.00 0.70 0.00 0.00 175.22 173.91 1q3s s GLU 203 N 0.38 3.09 -0.13 0.44 2.56 0.15 -4.94 118.70 120.26 1q3s s GLU 203 Ca -0.06 -0.79 -0.01 0.00 0.00 0.00 0.00 54.97 54.12 1q3s s GLU 203 Cb -0.15 -2.77 -0.02 0.00 2.00 0.00 0.00 34.13 33.19 1q3s s GLU 203 CO 0.04 -0.23 -0.10 0.15 -0.56 0.00 0.00 175.26 174.55 1q3s s LYS 204 N 1.36 3.36 -0.09 4.30 1.02 -1.26 0.93 119.74 129.35 1q3s s LYS 204 Ca 0.04 -0.64 -0.04 0.00 0.02 0.00 0.00 55.97 55.36 1q3s s LYS 204 Cb -0.14 -2.68 0.05 0.00 -0.52 0.00 0.00 37.83 34.53 1q3s s LYS 204 CO -0.09 0.28 0.20 0.15 -0.92 0.00 0.00 175.35 174.97 1q3s s LYS 205 N 0.21 0.13 0.63 1.68 -0.14 -0.72 -4.97 119.74 116.56 1q3s s LYS 205 Ca -0.06 0.50 -0.16 0.00 -1.36 0.00 0.00 55.97 54.89 1q3s s LYS 205 Cb -0.15 -0.16 -0.01 0.00 -1.68 0.00 0.00 37.83 35.83 1q3s s LYS 205 CO 0.04 -0.20 1.11 0.00 -0.76 0.00 0.00 175.35 175.54 1q3s s ALA 206 N 1.51 2.54 0.00 5.17 0.00 -1.26 -3.81 121.76 125.91 1q3s s ALA 206 Ca -0.06 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1q3s s ALA 206 Cb -0.11 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.69 1q3s s ALA 206 CO -0.07 -1.13 0.00 0.41 0.00 0.00 0.00 175.76 174.96 1q3s n GLY 207 N -0.47 2.82 7.00 0.00 0.00 0.15 -4.71 105.19 109.99 1q3s n GLY 207 Ca 0.10 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 44.23 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 0.32 0.00 -4.49 1.61 -0.58 -1.26 -1.24 120.64 115.01 1q3s n GLU 208 Ca 0.00 0.00 -0.27 0.00 -0.42 0.00 0.00 57.16 56.47 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 -3.43 2.40 0.00 0.62 0.00 -1.26 -2.25 107.32 103.40 1q3s s GLY 209 Ca 0.00 -2.22 0.07 0.00 0.00 0.00 0.00 44.72 42.57 1q3s s GLY 209 CO 0.00 -2.04 0.80 -0.62 0.00 0.00 0.00 173.10 171.24 1q3s n VAL 210 N -1.00 0.00 0.08 1.40 0.31 -1.18 -2.12 118.33 115.83 1q3s n VAL 210 Ca -0.04 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.18 1q3s n VAL 210 Cb 0.66 -0.73 -0.07 0.00 -0.91 0.00 0.00 33.84 32.78 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 0.17 -0.08 5.55 4.39 -1.93 -3.20 114.58 119.48 1q3s h GLU 211 Ca 0.00 -0.24 0.00 0.00 0.34 0.00 0.00 59.36 59.46 1q3s h GLU 211 Cb 0.00 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1q3s h GLU 211 CO 0.00 1.04 0.00 0.39 -1.16 0.00 0.00 179.01 179.28 1q3s n GLU 212 N -3.55 1.22 -2.15 2.33 -0.58 -0.90 -4.83 120.64 112.18 1q3s n GLU 212 Ca -0.04 -0.33 -0.42 0.00 -0.42 0.00 0.00 57.16 55.95 1q3s n GLU 212 Cb 0.90 -1.17 -0.03 0.00 -0.57 0.00 0.00 31.44 30.58 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 -1.21 6.79 0.16 1.62 0.01 -1.21 -4.73 113.70 115.14 1q3s s SER 213 Ca 0.15 2.27 0.03 0.00 1.31 0.00 0.00 55.95 59.71 1q3s s SER 213 Cb 0.07 -2.57 -0.05 0.00 0.21 0.00 0.00 66.02 63.68 1q3s s SER 213 CO 0.11 -0.72 -0.04 -1.83 0.41 0.00 0.00 173.24 171.18 1q3s s GLU 214 N 1.86 1.09 -0.66 12.44 -1.05 -0.95 -5.00 118.70 126.44 1q3s s GLU 214 Ca 0.66 -1.51 -0.09 0.00 -0.15 0.00 0.00 54.97 53.88 1q3s s GLU 214 Cb -0.35 -0.41 0.17 0.00 -0.44 0.00 0.00 34.13 33.10 1q3s s GLU 214 CO 0.29 -0.06 0.54 -1.17 0.95 0.00 0.00 175.26 175.82 1q3s s LEU 215 N -3.17 5.99 -0.29 1.83 2.96 -1.26 -0.89 118.68 123.84 1q3s s LEU 215 Ca 0.21 -2.49 -0.28 0.00 -0.22 0.00 0.00 54.13 51.34 1q3s s LEU 215 Cb 0.05 -2.05 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 1q3s s LEU 215 CO 0.03 -0.56 1.88 -0.69 -1.32 0.00 0.00 176.35 175.69 1q3s s VAL 216 N 0.48 3.38 -1.48 1.68 1.01 0.91 -4.85 120.40 121.53 1q3s s VAL 216 Ca 0.14 0.39 -0.13 0.00 0.00 0.00 0.00 61.98 62.37 1q3s s VAL 216 Cb -0.19 -3.50 0.01 0.00 0.00 0.00 0.00 36.38 32.70 1q3s s VAL 216 CO -0.04 -0.31 2.39 0.54 0.00 0.00 0.00 175.10 177.68 1q3s n ARG 217 N 8.45 3.02 0.00 2.72 1.74 -1.26 -1.74 116.66 129.58 1q3s n ARG 217 Ca 0.24 -2.49 0.00 0.00 -0.77 0.00 0.00 57.85 54.83 1q3s n ARG 217 Cb 0.46 -3.17 0.00 0.00 -1.02 0.00 0.00 32.46 28.73 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 3.99 -0.49 3.34 -0.13 0.00 -1.25 -2.73 105.19 107.90 1q3s n GLY 218 Ca 0.58 0.36 -0.13 0.00 0.00 0.00 0.00 46.02 46.82 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 0.00 0.01 -0.16 1.61 1.01 -0.50 -2.42 120.40 119.95 1q3s s VAL 219 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.91 1q3s s VAL 219 Cb 0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 36.38 35.72 1q3s s VAL 219 CO 0.00 -0.02 -0.05 -0.69 0.00 0.00 0.00 175.10 174.33 1q3s s VAL 220 N 0.04 3.69 -0.07 2.92 1.01 -1.26 -1.24 120.40 125.50 1q3s s VAL 220 Ca -0.02 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.59 1q3s s VAL 220 Cb -0.03 -2.61 -0.01 0.00 0.00 0.00 0.00 36.38 33.72 1q3s s VAL 220 CO 0.01 0.49 -0.24 -0.63 0.00 0.00 0.00 175.10 174.74 1q3s s ILE 221 N 0.45 2.18 -1.12 2.22 1.01 0.08 -4.97 121.20 121.05 1q3s s ILE 221 Ca -0.05 -1.02 -0.05 0.00 0.00 0.00 0.00 60.65 59.53 1q3s s ILE 221 Cb -0.15 -1.80 0.09 0.00 0.01 0.00 0.00 42.46 40.61 1q3s s ILE 221 CO 0.03 0.57 2.52 0.47 0.00 0.00 0.00 174.94 178.53 1q3s n ASP 222 N 3.00 7.68 -3.82 3.58 9.92 -1.26 -0.87 116.55 134.78 1q3s n ASP 222 Ca -0.18 -3.12 -0.23 0.00 -0.53 0.00 0.00 54.79 50.74 1q3s n ASP 222 Cb 0.52 -1.34 -0.08 0.00 -0.64 0.00 0.00 41.12 39.58 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 -1.09 1.86 0.24 -1.24 -0.14 -1.26 -4.99 119.74 113.11 1q3s s LYS 223 Ca 0.56 -2.11 0.01 0.00 -1.36 0.00 0.00 55.97 53.07 1q3s s LYS 223 Cb 0.23 -0.22 -0.05 0.00 -1.68 0.00 0.00 37.83 36.11 1q3s s LYS 223 CO -0.12 -0.55 0.10 -1.83 -0.76 0.00 0.00 175.35 172.18 1q3s s GLU 224 N -3.61 1.36 -0.05 1.68 -1.05 -1.26 -3.71 118.70 112.05 1q3s s GLU 224 Ca 0.30 -1.73 -0.30 0.00 -0.15 0.00 0.00 54.97 53.10 1q3s s GLU 224 Cb 0.02 -0.18 -0.07 0.00 -0.44 0.00 0.00 34.13 33.47 1q3s s GLU 224 CO 0.19 -0.30 1.85 0.08 0.95 0.00 0.00 175.26 178.04 1q3s s VAL 225 N -3.81 3.29 0.44 1.83 1.01 -1.26 -4.64 120.40 117.25 1q3s s VAL 225 Ca 0.37 0.34 0.18 0.00 0.00 0.00 0.00 61.98 62.87 1q3s s VAL 225 Cb 0.08 -3.24 0.37 0.00 0.00 0.00 0.00 36.38 33.58 1q3s s VAL 225 CO 0.13 -0.06 1.92 1.62 0.00 0.00 0.00 175.10 178.70 1q3s h VAL 226 N 5.84 0.76 -4.33 2.92 3.04 -1.60 -3.43 116.25 119.46 1q3s h VAL 226 Ca -0.43 -0.12 -0.63 0.00 -1.01 0.00 0.00 66.70 64.51 1q3s h VAL 226 Cb 1.21 0.37 -0.28 0.00 -2.01 0.00 0.00 31.29 30.59 1q3s h VAL 226 CO 0.95 0.06 -0.86 -2.28 -1.01 0.00 0.00 177.57 174.44 1q3s s HIS 227 N -5.35 2.00 0.15 3.17 2.46 -1.26 -5.07 115.29 111.39 1q3s s HIS 227 Ca -0.08 -0.38 -0.21 0.00 0.47 0.00 0.00 55.06 54.87 1q3s s HIS 227 Cb 0.21 -1.24 0.03 0.00 -0.13 0.00 0.00 32.58 31.45 1q3s s HIS 227 CO 0.77 0.05 1.66 -1.35 -2.47 0.00 0.00 174.74 173.39 1q3s h PRO 228 N 5.15 -0.13 0.00 2.88 0.11 -2.00 -2.85 132.00 135.16 1q3s h PRO 228 Ca -0.42 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1q3s h PRO 228 Cb 1.14 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1q3s h PRO 228 CO 0.45 -0.09 0.00 0.54 -0.21 0.00 0.00 178.00 178.69 1q3s n ARG 229 N -5.32 0.67 -2.63 1.05 5.12 -1.26 -4.84 116.66 109.46 1q3s n ARG 229 Ca -0.01 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.64 1q3s n ARG 229 Cb 0.23 -1.39 -0.00 0.00 -1.16 0.00 0.00 32.46 30.14 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 -2.00 3.56 0.24 5.56 -1.94 -1.08 -4.92 119.30 118.72 1q3s s MET 230 Ca 0.25 0.23 -0.30 0.00 -1.71 0.00 0.00 55.69 54.15 1q3s s MET 230 Cb 0.11 -2.37 -0.10 0.00 2.01 0.00 0.00 34.83 34.48 1q3s s MET 230 CO 0.19 -0.21 1.51 -2.14 -0.01 0.00 0.00 175.02 174.37 1q3s s PRO 231 N -4.71 4.22 0.00 2.03 0.02 -1.26 -4.89 135.00 130.41 1q3s s PRO 231 Ca 0.48 2.39 0.20 0.00 0.02 0.00 0.00 61.00 64.08 1q3s s PRO 231 Cb -0.10 -3.10 0.54 0.00 0.02 0.00 0.00 34.50 31.85 1q3s s PRO 231 CO 0.44 -0.52 1.44 1.63 -0.33 0.00 0.00 177.00 179.66 1q3s n LYS 232 N 2.71 2.16 -3.64 5.54 4.76 -1.26 -4.75 118.16 123.68 1q3s n LYS 232 Ca 0.09 -1.77 -0.06 0.00 -2.87 0.00 0.00 58.31 53.70 1q3s n LYS 232 Cb 0.39 -1.43 -0.07 0.00 -1.84 0.00 0.00 35.03 32.08 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 -1.50 0.57 -0.09 1.97 3.52 -1.26 -1.24 118.95 120.92 1q3s s ARG 233 Ca 0.35 0.91 0.03 0.00 -0.13 0.00 0.00 55.73 56.89 1q3s s ARG 233 Cb 0.19 0.15 0.01 0.00 -1.56 0.00 0.00 34.95 33.75 1q3s s ARG 233 CO 0.27 -0.11 -0.18 0.08 -0.81 0.00 0.00 175.30 174.55 1q3s s VAL 234 N 1.22 1.59 0.00 7.11 1.01 -0.75 -5.00 120.40 125.58 1q3s s VAL 234 Ca -0.07 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.17 1q3s s VAL 234 Cb -0.04 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 34.93 1q3s s VAL 234 CO -0.14 0.46 0.31 -0.62 0.00 0.00 0.00 175.10 175.11 1q3s n GLU 235 N 3.73 0.00 -3.50 2.72 -0.58 -1.26 -2.43 120.64 119.32 1q3s n GLU 235 Ca -0.21 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.12 1q3s n GLU 235 Cb 0.52 -0.80 -0.04 0.00 -0.57 0.00 0.00 31.44 30.55 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 -1.69 6.41 0.27 1.62 0.01 -1.26 -3.10 114.94 117.20 1q3s s ASN 236 Ca 0.00 -3.32 -0.29 0.00 -0.71 0.00 0.00 52.86 48.54 1q3s s ASN 236 Cb 0.00 -2.05 -0.10 0.00 0.41 0.00 0.00 41.25 39.51 1q3s s ASN 236 CO 0.00 -0.33 1.32 0.00 -1.51 0.00 0.00 177.10 176.58 1q3s s ALA 237 N -0.78 3.53 -0.32 0.60 0.00 -0.87 -4.94 121.76 118.98 1q3s s ALA 237 Ca 0.25 1.21 -0.00 0.00 0.00 0.00 0.00 51.96 53.41 1q3s s ALA 237 Cb -0.11 -3.48 0.07 0.00 0.00 0.00 0.00 23.12 19.60 1q3s s ALA 237 CO -0.09 -0.60 0.02 0.15 0.00 0.00 0.00 175.76 175.25 1q3s s LYS 238 N -0.99 2.18 -0.09 0.00 1.02 -1.26 -2.53 119.74 118.06 1q3s s LYS 238 Ca 0.53 -1.47 -0.10 0.00 0.02 0.00 0.00 55.97 54.95 1q3s s LYS 238 Cb -0.39 -3.20 -0.05 0.00 -0.52 0.00 0.00 37.83 33.67 1q3s s LYS 238 CO 0.46 -0.74 0.22 0.42 -0.92 0.00 0.00 175.35 174.79 1q3s s ILE 239 N 1.15 5.36 -0.14 2.17 1.01 0.11 -1.96 121.20 128.90 1q3s s ILE 239 Ca -0.01 0.40 0.00 0.00 0.00 0.00 0.00 60.65 61.04 1q3s s ILE 239 Cb -0.20 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.76 1q3s s ILE 239 CO -0.03 0.59 -0.14 0.00 0.00 0.00 0.00 174.94 175.35 1q3s s ALA 240 N -0.90 2.55 -0.51 9.38 0.00 0.81 -0.64 121.76 132.46 1q3s s ALA 240 Ca 0.17 -0.97 -0.09 0.00 0.00 0.00 0.00 51.96 51.08 1q3s s ALA 240 Cb -0.13 -1.22 0.13 0.00 0.00 0.00 0.00 23.12 21.90 1q3s s ALA 240 CO 0.06 0.11 0.38 -0.51 0.00 0.00 0.00 175.76 175.80 1q3s s LEU 241 N 0.59 5.72 -0.32 0.00 1.02 -1.26 -0.60 118.68 123.84 1q3s s LEU 241 Ca -0.08 -2.05 -0.07 0.00 0.02 0.00 0.00 54.13 51.94 1q3s s LEU 241 Cb -0.16 -2.01 0.02 0.00 0.02 0.00 0.00 46.19 44.07 1q3s s LEU 241 CO 0.03 -0.65 0.09 -0.63 0.02 0.00 0.00 176.35 175.21 1q3s s ILE 242 N 1.15 3.92 -1.10 -0.59 -1.09 -0.18 -0.80 121.20 122.50 1q3s s ILE 242 Ca 0.08 -0.87 -0.05 0.00 -2.23 0.00 0.00 60.65 57.58 1q3s s ILE 242 Cb -0.25 -3.10 0.29 0.00 -1.58 0.00 0.00 42.46 37.83 1q3s s ILE 242 CO -0.02 -0.03 1.54 -3.20 -1.23 0.00 0.00 174.94 172.00 1q3s n ASN 243 N 4.85 6.31 -3.60 3.58 2.85 0.91 -2.05 115.26 128.10 1q3s n ASN 243 Ca -0.14 -3.39 -0.16 0.00 -0.11 0.00 0.00 54.58 50.79 1q3s n ASN 243 Cb 0.47 -1.29 -0.07 0.00 1.24 0.00 0.00 39.78 40.12 1q3s n ASN 243 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 1q3s s GLU 244 N -2.47 0.89 -0.14 1.20 2.12 -1.26 -4.50 118.70 114.53 1q3s s GLU 244 Ca 0.32 0.51 -0.29 0.00 0.36 0.00 0.00 54.97 55.88 1q3s s GLU 244 Cb 0.06 0.42 -0.01 0.00 0.26 0.00 0.00 34.13 34.86 1q3s s GLU 244 CO 0.09 -0.21 1.00 0.00 -0.54 0.00 0.00 175.26 175.60 1q3s s ALA 245 N -0.50 3.48 -1.41 6.30 0.00 -1.26 -4.44 121.76 123.92 1q3s s ALA 245 Ca -0.06 0.29 -0.12 0.00 0.00 0.00 0.00 51.96 52.07 1q3s s ALA 245 Cb -0.03 -3.44 0.07 0.00 0.00 0.00 0.00 23.12 19.72 1q3s s ALA 245 CO 0.05 -0.71 2.20 1.28 0.00 0.00 0.00 175.76 178.58 1q3s n LEU 246 N 5.34 7.04 -3.74 0.00 4.32 -0.90 -4.85 117.00 124.20 1q3s n LEU 246 Ca 0.09 -4.35 -0.10 0.00 -0.02 0.00 0.00 56.01 51.63 1q3s n LEU 246 Cb 0.48 -1.58 -0.05 0.00 -1.62 0.00 0.00 43.42 40.65 1q3s n LEU 246 CO 0.52 1.33 0.10 -1.83 -1.22 0.00 0.00 177.39 176.28 1q3s s GLU 247 N 2.04 1.09 -0.82 3.23 -1.05 -1.26 -0.64 118.70 121.28 1q3s s GLU 247 Ca 0.47 -0.85 -0.27 0.00 -0.15 0.00 0.00 54.97 54.18 1q3s s GLU 247 Cb 0.13 0.44 -0.18 0.00 -0.44 0.00 0.00 34.13 34.08 1q3s s GLU 247 CO -0.06 -0.42 2.53 0.28 0.95 0.00 0.00 175.26 178.55 1q3s n VAL 248 N -0.21 -0.03 -1.64 1.83 0.31 -1.26 -4.91 118.33 112.42 1q3s n VAL 248 Ca -0.14 -0.35 -0.36 0.00 -0.01 0.00 0.00 64.34 63.49 1q3s n VAL 248 Cb 0.63 -1.31 0.08 0.00 -0.91 0.00 0.00 33.84 32.33 1q3s n VAL 248 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1q3s s LYS 249 N 8.56 2.41 0.19 5.55 1.02 -1.26 -5.04 119.74 131.17 1q3s s LYS 249 Ca 1.20 1.92 0.07 0.00 0.02 0.00 0.00 55.97 59.18 1q3s s LYS 249 Cb -0.79 -1.85 -0.05 0.00 -0.52 0.00 0.00 37.83 34.63 1q3s s LYS 249 CO 0.40 -1.67 -0.12 0.15 -0.92 0.00 0.00 175.35 173.18 1q3s s LYS 250 N -3.58 1.26 0.36 1.68 1.02 -1.26 -5.15 119.74 114.08 1q3s s LYS 250 Ca 0.79 -1.56 -0.18 0.00 0.02 0.00 0.00 55.97 55.03 1q3s s LYS 250 Cb -0.34 -0.97 -0.10 0.00 -0.52 0.00 0.00 37.83 35.91 1q3s s LYS 250 CO 0.41 0.14 0.84 0.95 -0.92 0.00 0.00 175.35 176.77 1q3s s THR 251 N -3.09 4.53 0.27 2.17 -4.23 -1.26 -4.95 115.64 109.08 1q3s s THR 251 Ca 0.21 1.24 -0.03 0.00 -1.18 0.00 0.00 61.69 61.94 1q3s s THR 251 Cb 0.01 -3.64 0.18 0.00 1.34 0.00 0.00 72.50 70.39 1q3s s THR 251 CO 0.05 -0.20 1.85 -0.08 -0.54 0.00 0.00 174.62 175.70 1q3s h GLU 252 N 2.22 0.96 -6.23 3.99 4.57 -2.04 -3.40 114.58 114.65 1q3s h GLU 252 Ca -0.48 -0.15 -0.56 0.00 -1.18 0.00 0.00 59.36 56.98 1q3s h GLU 252 Cb 1.18 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 29.57 1q3s h GLU 252 CO 0.63 0.78 0.85 0.99 -1.18 0.00 0.00 179.01 181.08 1q3s s THR 253 N -5.45 4.15 0.24 0.32 2.01 -1.26 -4.93 115.64 110.72 1q3s s THR 253 Ca -0.11 1.44 -0.28 0.00 0.31 0.00 0.00 61.69 63.05 1q3s s THR 253 Cb 0.16 -3.93 -0.16 0.00 0.01 0.00 0.00 72.50 68.59 1q3s s THR 253 CO 0.81 -0.08 0.78 -0.67 -0.69 0.00 0.00 174.62 174.77 1q3s n ASP 254 N 6.09 0.08 -3.69 3.53 4.64 -1.26 -4.97 116.55 120.96 1q3s n ASP 254 Ca 0.13 1.15 -0.11 0.00 -1.38 0.00 0.00 54.79 54.59 1q3s n ASP 254 Cb 0.45 -1.12 -0.06 0.00 -1.04 0.00 0.00 41.12 39.35 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 -0.98 -0.80 -0.17 -1.67 0.00 -1.26 -5.07 121.76 111.80 1q3s s ALA 255 Ca 0.62 -0.04 -0.25 0.00 0.00 0.00 0.00 51.96 52.29 1q3s s ALA 255 Cb -0.82 0.52 0.06 0.00 0.00 0.00 0.00 23.12 22.88 1q3s s ALA 255 CO 0.58 -0.54 0.64 0.21 0.00 0.00 0.00 175.76 176.65 1q3s s LYS 256 N -3.29 0.85 -0.07 0.00 2.20 -1.26 -5.08 119.74 113.09 1q3s s LYS 256 Ca -0.00 0.65 -0.22 0.00 -0.36 0.00 0.00 55.97 56.04 1q3s s LYS 256 Cb 0.01 0.41 -0.04 0.00 -1.51 0.00 0.00 37.83 36.70 1q3s s LYS 256 CO -0.08 -0.17 0.63 0.42 -0.36 0.00 0.00 175.35 175.79 1q3s s ILE 257 N -0.22 5.06 -0.54 5.43 1.01 -1.26 -5.04 121.20 125.65 1q3s s ILE 257 Ca -0.04 1.29 -0.06 0.00 0.00 0.00 0.00 60.65 61.84 1q3s s ILE 257 Cb -0.03 -3.97 0.14 0.00 0.01 0.00 0.00 42.46 38.61 1q3s s ILE 257 CO 0.04 0.30 0.37 0.20 0.00 0.00 0.00 174.94 175.85 1q3s s ASN 258 N 0.58 5.50 0.08 3.58 0.01 -1.26 -5.07 114.94 118.36 1q3s s ASN 258 Ca 0.33 -2.34 -0.31 0.00 -0.71 0.00 0.00 52.86 49.84 1q3s s ASN 258 Cb -0.17 -1.92 -0.07 0.00 0.41 0.00 0.00 41.25 39.50 1q3s s ASN 258 CO 0.16 -0.53 1.35 -0.63 -1.51 0.00 0.00 177.10 175.94 1q3s s ILE 259 N 0.71 3.54 -0.01 0.60 1.09 -1.26 -4.91 121.20 120.95 1q3s s ILE 259 Ca 0.11 1.08 0.03 0.00 -1.10 0.00 0.00 60.65 60.77 1q3s s ILE 259 Cb -0.22 -3.69 -0.04 0.00 -1.06 0.00 0.00 42.46 37.45 1q3s s ILE 259 CO -0.03 0.07 0.04 0.35 -0.10 0.00 0.00 174.94 175.26 1q3s n THR 260 N 4.08 0.09 -3.90 2.92 -2.24 -1.26 -5.05 114.28 108.92 1q3s n THR 260 Ca 0.11 -0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.69 1q3s n THR 260 Cb 0.43 -0.19 -0.13 0.00 -2.10 0.00 0.00 70.33 68.35 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 -2.80 0.07 0.39 3.42 1.04 -1.26 -5.07 113.70 109.49 1q3s s SER 261 Ca -0.01 -0.16 0.23 0.00 0.48 0.00 0.00 55.95 56.49 1q3s s SER 261 Cb 0.01 0.05 1.33 0.00 0.10 0.00 0.00 66.02 67.52 1q3s s SER 261 CO 0.12 -0.11 1.60 -0.65 0.98 0.00 0.00 173.24 175.18 1q3s h PRO 262 N 5.60 0.08 0.00 4.02 0.11 -2.04 0.17 132.00 139.94 1q3s h PRO 262 Ca -0.27 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1q3s h PRO 262 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1q3s h PRO 262 CO 0.47 0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 177.91 1q3s n ASP 263 N -5.03 0.36 0.07 -2.05 5.68 -1.26 -2.76 116.55 111.55 1q3s n ASP 263 Ca 0.37 0.63 -0.12 0.00 -0.50 0.00 0.00 54.79 55.18 1q3s n ASP 263 Cb 1.30 -0.69 -0.03 0.00 -1.14 0.00 0.00 41.12 40.55 1q3s n ASP 263 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1q3s h GLN 264 N 0.00 0.33 -0.77 0.11 4.20 -1.39 -2.89 115.11 114.70 1q3s h GLN 264 Ca 0.00 -0.36 0.14 0.00 0.06 0.00 0.00 58.65 58.49 1q3s h GLN 264 Cb 0.12 0.10 -0.09 0.00 0.30 0.00 0.00 27.48 27.91 1q3s h GLN 264 CO 0.00 1.05 0.33 -0.07 -0.67 0.00 0.00 178.83 179.47 1q3s h LEU 265 N 0.18 0.34 0.04 1.46 3.38 -1.71 -2.29 115.31 116.71 1q3s h LEU 265 Ca -0.07 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1q3s h LEU 265 Cb 1.55 0.07 0.01 0.00 0.09 0.00 0.00 40.66 42.38 1q3s h LEU 265 CO 0.15 0.13 -0.25 0.24 0.09 0.00 0.00 178.44 178.81 1q3s h MET 266 N 0.48 0.10 -0.82 1.13 2.86 -1.76 -3.20 114.93 113.73 1q3s h MET 266 Ca 0.42 -0.16 0.19 0.00 -2.06 0.00 0.00 59.70 58.09 1q3s h MET 266 Cb 0.62 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 32.28 1q3s h MET 266 CO -0.39 1.05 0.55 0.66 1.06 0.00 0.00 176.91 179.84 1q3s h SER 267 N -0.76 0.32 0.00 1.22 4.64 -1.33 -1.09 113.55 116.56 1q3s h SER 267 Ca -0.04 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.29 1q3s h SER 267 Cb 1.16 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1q3s h SER 267 CO 0.05 0.14 -0.06 -0.26 -0.87 0.00 0.00 176.83 175.84 1q3s h PHE 268 N 0.33 0.05 -0.87 4.77 -1.00 -1.55 -2.05 116.94 116.62 1q3s h PHE 268 Ca 0.41 -0.03 0.11 0.00 2.81 0.00 0.00 57.97 61.27 1q3s h PHE 268 Cb 1.11 -0.01 -0.08 0.00 3.61 0.00 0.00 35.95 40.58 1q3s h PHE 268 CO -0.00 0.87 0.51 -0.07 -1.61 0.00 0.00 178.31 178.00 1q3s h LEU 269 N -0.78 0.71 -0.60 1.54 4.07 -1.42 -0.45 115.31 118.38 1q3s h LEU 269 Ca -0.01 0.06 -0.11 0.00 0.08 0.00 0.00 57.88 57.89 1q3s h LEU 269 Cb 0.89 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.53 1q3s h LEU 269 CO 0.01 0.38 -0.13 -0.33 -1.08 0.00 0.00 178.44 177.30 1q3s h GLU 270 N 0.81 0.98 -0.51 1.13 5.08 -1.28 -0.13 114.58 120.66 1q3s h GLU 270 Ca 0.43 -0.36 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1q3s h GLU 270 Cb 0.45 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1q3s h GLU 270 CO -0.27 1.04 0.34 0.37 -1.00 0.00 0.00 179.01 179.48 1q3s h GLN 271 N 0.87 0.58 0.05 2.33 5.75 -0.37 0.14 115.11 124.45 1q3s h GLN 271 Ca 0.13 -0.03 -0.24 0.00 -0.15 0.00 0.00 58.65 58.36 1q3s h GLN 271 Cb 0.68 -0.13 0.02 0.00 1.07 0.00 0.00 27.48 29.12 1q3s h GLN 271 CO 0.05 0.38 -0.98 0.93 -2.65 0.00 0.00 178.83 176.56 1q3s h GLU 272 N 0.59 0.57 -0.64 1.69 5.08 -0.70 -1.92 114.58 119.25 1q3s h GLU 272 Ca 0.20 -0.69 0.09 0.00 -1.00 0.00 0.00 59.36 57.97 1q3s h GLU 272 Cb 0.07 0.21 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 1q3s h GLU 272 CO -0.05 1.28 0.28 0.93 -1.00 0.00 0.00 179.01 180.45 1q3s h GLU 273 N 0.17 0.47 0.11 2.33 5.08 -0.20 0.11 114.58 122.66 1q3s h GLU 273 Ca -0.14 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1q3s h GLU 273 Cb 1.67 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.80 1q3s h GLU 273 CO 0.19 0.31 -0.12 -0.22 -1.00 0.00 0.00 179.01 178.17 1q3s h LYS 274 N 0.49 -0.25 -0.43 2.33 3.64 -0.73 0.48 116.57 122.10 1q3s h LYS 274 Ca 0.32 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.80 1q3s h LYS 274 Cb 0.37 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.16 1q3s h LYS 274 CO -0.28 -0.17 -0.10 0.52 -2.27 0.00 0.00 179.45 177.15 1q3s h MET 275 N -0.26 0.01 0.23 1.90 2.86 -0.39 0.13 114.93 119.41 1q3s h MET 275 Ca 0.01 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1q3s h MET 275 Cb 0.26 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1q3s h MET 275 CO -0.04 0.01 -0.19 -0.07 1.06 0.00 0.00 176.91 177.67 1q3s h LEU 276 N 0.01 -0.51 -1.41 1.22 4.07 -0.37 -2.88 115.31 115.44 1q3s h LEU 276 Ca 0.21 0.04 0.06 0.00 0.08 0.00 0.00 57.88 58.27 1q3s h LEU 276 Cb 0.32 0.17 -0.04 0.00 1.08 0.00 0.00 40.66 42.18 1q3s h LEU 276 CO -0.44 -0.30 0.45 0.50 -1.08 0.00 0.00 178.44 177.58 1q3s h LYS 277 N -0.44 0.70 0.00 1.13 3.64 0.83 -1.57 116.57 120.86 1q3s h LYS 277 Ca -0.01 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 1q3s h LYS 277 Cb 0.40 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1q3s h LYS 277 CO -0.03 0.46 -0.27 -0.44 -2.27 0.00 0.00 179.45 176.91 1q3s h ASP 278 N 0.72 0.00 -0.10 4.20 3.32 -0.57 0.19 116.42 124.19 1q3s h ASP 278 Ca 0.29 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.27 1q3s h ASP 278 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1q3s h ASP 278 CO -0.09 0.27 -0.23 0.24 -1.72 0.00 0.00 179.24 177.71 1q3s h MET 279 N 0.00 0.33 -0.35 3.56 2.86 -1.09 -2.19 114.93 118.04 1q3s h MET 279 Ca -0.00 -0.22 -0.07 0.00 -2.06 0.00 0.00 59.70 57.34 1q3s h MET 279 Cb 0.73 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.40 1q3s h MET 279 CO 0.03 0.83 -0.08 0.28 1.06 0.00 0.00 176.91 179.03 1q3s h VAL 280 N -0.12 1.23 -0.64 -2.22 2.07 -1.26 -2.62 116.25 112.69 1q3s h VAL 280 Ca -0.00 -1.01 -0.07 0.00 0.82 0.00 0.00 66.70 66.44 1q3s h VAL 280 Cb 0.83 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 1q3s h VAL 280 CO 0.05 0.34 0.12 0.44 0.02 0.00 0.00 177.57 178.54 1q3s h ASP 281 N 0.55 1.01 -0.25 0.57 5.19 -0.92 0.03 116.42 122.61 1q3s h ASP 281 Ca 0.10 -0.25 -0.00 0.00 -0.62 0.00 0.00 57.03 56.26 1q3s h ASP 281 Cb 0.48 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 1q3s h ASP 281 CO 0.03 1.01 0.16 0.45 -3.12 0.00 0.00 179.24 177.76 1q3s h HIS 282 N 0.97 0.33 0.14 4.55 3.86 -1.03 0.08 115.15 124.06 1q3s h HIS 282 Ca 0.20 0.01 -0.19 0.00 -1.16 0.00 0.00 60.37 59.22 1q3s h HIS 282 Cb 0.42 -0.11 0.02 0.00 1.06 0.00 0.00 27.41 28.80 1q3s h HIS 282 CO 0.03 0.22 -0.84 0.82 0.86 0.00 0.00 177.93 179.02 1q3s h ILE 283 N 0.35 1.50 -0.27 2.45 2.04 -1.21 -3.34 117.51 119.04 1q3s h ILE 283 Ca 0.09 -2.53 0.02 0.00 1.00 0.00 0.00 64.86 63.44 1q3s h ILE 283 Cb -0.02 3.17 -0.02 0.00 -0.74 0.00 0.00 36.82 39.21 1q3s h ILE 283 CO -0.02 0.72 0.13 0.00 0.00 0.00 0.00 178.15 178.98 1q3s h ALA 284 N 0.10 0.32 0.00 1.87 0.00 -0.63 -2.77 119.26 118.14 1q3s h ALA 284 Ca -0.14 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1q3s h ALA 284 Cb 1.66 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1q3s h ALA 284 CO 0.16 -0.26 0.23 1.04 0.00 0.00 0.00 179.25 180.42 1q3s n GLN 285 N -4.97 0.02 0.01 0.00 6.02 -0.02 -0.29 117.38 118.15 1q3s n GLN 285 Ca -0.01 0.35 0.11 0.00 -0.01 0.00 0.00 57.00 57.44 1q3s n GLN 285 Cb 0.06 -1.80 0.10 0.00 1.02 0.00 0.00 30.24 29.63 1q3s n GLN 285 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1q3s n THR 286 N -1.46 0.05 -0.47 5.09 -2.24 -1.05 -4.94 114.28 109.27 1q3s n THR 286 Ca -0.00 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1q3s n THR 286 Cb 0.24 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 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 1.47 0.74 3.69 3.38 0.00 0.61 -4.60 105.19 110.48 1q3s n GLY 287 Ca 0.04 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 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 3.36 -0.68 4.61 0.00 -1.25 -4.73 121.76 121.07 1q3s s ALA 288 Ca 0.00 0.39 0.18 0.00 0.00 0.00 0.00 51.96 52.52 1q3s s ALA 288 Cb 0.00 -3.41 -0.21 0.00 0.00 0.00 0.00 23.12 19.51 1q3s s ALA 288 CO 0.00 -0.54 0.68 0.27 0.00 0.00 0.00 175.76 176.17 1q3s n ASN 289 N 4.81 0.83 -3.97 0.00 0.23 -0.83 -4.74 115.26 111.60 1q3s n ASN 289 Ca 0.08 -0.75 -0.25 0.00 -0.53 0.00 0.00 54.58 53.13 1q3s n ASN 289 Cb 0.49 1.15 -0.17 0.00 -2.08 0.00 0.00 39.78 39.18 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 -2.77 1.05 -0.08 3.53 1.01 -1.11 0.13 120.40 122.16 1q3s s VAL 290 Ca 0.04 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.67 1q3s s VAL 290 Cb 0.13 -1.01 0.01 0.00 0.00 0.00 0.00 36.38 35.51 1q3s s VAL 290 CO 0.73 0.35 -0.13 -0.69 0.00 0.00 0.00 175.10 175.35 1q3s s VAL 291 N 1.12 1.29 -0.27 2.92 1.01 0.25 -0.13 120.40 126.60 1q3s s VAL 291 Ca -0.06 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.33 1q3s s VAL 291 Cb -0.14 -1.18 0.02 0.00 0.00 0.00 0.00 36.38 35.07 1q3s s VAL 291 CO -0.02 0.39 0.01 -0.36 0.00 0.00 0.00 175.10 175.13 1q3s s PHE 292 N 0.82 3.11 -0.24 5.22 2.99 0.23 -1.27 117.98 128.85 1q3s s PHE 292 Ca -0.11 -1.28 -0.05 0.00 0.00 0.00 0.00 56.93 55.49 1q3s s PHE 292 Cb -0.15 -2.15 -0.00 0.00 0.00 0.00 0.00 43.02 40.71 1q3s s PHE 292 CO 0.02 -0.66 -0.01 0.08 -0.00 0.00 0.00 175.22 174.65 1q3s s VAL 293 N 1.41 3.55 0.31 -0.44 1.01 -0.17 -1.01 120.40 125.05 1q3s s VAL 293 Ca 0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.44 1q3s s VAL 293 Cb -0.17 -2.68 0.26 0.00 0.00 0.00 0.00 36.38 33.79 1q3s s VAL 293 CO -0.01 0.33 1.97 -0.61 0.00 0.00 0.00 175.10 176.78 1q3s h GLN 294 N 8.14 1.02 0.00 2.72 4.15 -1.64 -1.53 115.11 127.98 1q3s h GLN 294 Ca -0.38 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 58.97 1q3s h GLN 294 Cb 1.15 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.61 1q3s h GLN 294 CO 0.60 0.68 0.00 1.63 -1.93 0.00 0.00 178.83 179.81 1q3s n LYS 295 N -4.41 2.64 -1.25 1.69 4.76 -1.26 -3.33 118.16 117.00 1q3s n LYS 295 Ca 0.08 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.23 1q3s n LYS 295 Cb 0.04 0.00 0.20 0.00 -1.84 0.00 0.00 35.03 33.43 1q3s n LYS 295 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1q3s s GLY 296 N -1.12 1.59 -0.31 0.72 0.00 -1.26 -1.88 107.32 105.06 1q3s s GLY 296 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 43.97 1q3s s GLY 296 CO 0.00 -0.00 0.31 -0.42 0.00 0.00 0.00 173.10 172.99 1q3s s ILE 297 N -3.12 -0.37 0.99 0.90 1.01 -1.26 -2.11 121.20 117.24 1q3s s ILE 297 Ca 0.69 -0.62 -0.17 0.00 0.00 0.00 0.00 60.65 60.55 1q3s s ILE 297 Cb -0.12 -0.93 -0.13 0.00 0.01 0.00 0.00 42.46 41.29 1q3s s ILE 297 CO 0.56 -0.51 -0.69 -0.67 0.00 0.00 0.00 174.94 173.63 1q3s n ASP 298 N 5.06 -5.43 0.01 3.58 2.03 0.18 -4.66 116.55 117.32 1q3s n ASP 298 Ca 0.01 0.19 -0.12 0.00 0.52 0.00 0.00 54.79 55.39 1q3s n ASP 298 Cb 0.46 -0.81 -0.08 0.00 -0.72 0.00 0.00 41.12 39.98 1q3s n ASP 298 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1q3s h ASP 299 N -1.08 0.05 -0.02 1.67 3.32 -2.00 -2.28 116.42 116.08 1q3s h ASP 299 Ca -0.44 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.42 1q3s h ASP 299 Cb 1.30 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.84 1q3s h ASP 299 CO 0.24 0.23 0.01 -0.07 -1.72 0.00 0.00 179.24 177.93 1q3s h LEU 300 N -0.14 0.02 -1.98 1.55 3.38 -1.96 -0.95 115.31 115.23 1q3s h LEU 300 Ca 0.01 -0.01 0.30 0.00 0.09 0.00 0.00 57.88 58.27 1q3s h LEU 300 Cb 0.20 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1q3s h LEU 300 CO -0.00 0.03 0.75 0.00 0.09 0.00 0.00 178.44 179.31 1q3s h ALA 301 N 0.99 2.98 -0.07 1.53 0.00 -1.84 0.58 119.26 123.42 1q3s h ALA 301 Ca 0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1q3s h ALA 301 Cb 0.01 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1q3s h ALA 301 CO -0.00 -1.28 -0.31 1.96 0.00 0.00 0.00 179.25 179.62 1q3s h GLN 302 N 0.01 0.35 -0.23 0.00 4.20 -0.61 -2.64 115.11 116.19 1q3s h GLN 302 Ca 0.50 -0.27 0.03 0.00 0.06 0.00 0.00 58.65 58.97 1q3s h GLN 302 Cb 1.99 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 29.79 1q3s h GLN 302 CO -0.01 0.91 0.02 1.25 -0.67 0.00 0.00 178.83 180.33 1q3s h HIS 303 N -0.14 0.04 -0.75 2.96 2.76 1.00 0.04 115.15 121.06 1q3s h HIS 303 Ca -0.02 0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.13 1q3s h HIS 303 Cb 0.96 0.02 -0.03 0.00 1.55 0.00 0.00 27.41 29.90 1q3s h HIS 303 CO 0.13 -0.00 0.32 1.88 -1.30 0.00 0.00 177.93 178.95 1q3s h TYR 304 N 0.11 1.11 -0.05 5.26 0.05 -1.22 -1.74 116.97 120.48 1q3s h TYR 304 Ca 0.10 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 58.78 1q3s h TYR 304 Cb 0.12 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 1q3s h TYR 304 CO -0.17 0.84 -0.09 -0.07 -1.05 0.00 0.00 178.16 177.62 1q3s h LEU 305 N 1.06 0.07 -0.07 3.88 3.38 -1.05 -2.53 115.31 120.05 1q3s h LEU 305 Ca 0.25 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 1q3s h LEU 305 Cb 0.18 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1q3s h LEU 305 CO -0.02 0.17 -0.14 0.00 0.09 0.00 0.00 178.44 178.54 1q3s h ALA 306 N 1.84 0.11 -0.72 1.53 0.00 -0.26 -1.23 119.26 120.53 1q3s h ALA 306 Ca 0.02 -0.34 0.10 0.00 0.00 0.00 0.00 54.91 54.68 1q3s h ALA 306 Cb 0.21 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1q3s h ALA 306 CO 0.01 0.01 0.35 0.87 0.00 0.00 0.00 179.25 180.50 1q3s h LYS 307 N -0.26 0.58 0.00 0.00 1.57 -0.95 0.34 116.57 117.85 1q3s h LYS 307 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1q3s h LYS 307 Cb 0.72 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1q3s h LYS 307 CO 0.03 0.38 0.00 0.66 -0.57 0.00 0.00 179.45 179.95 1q3s n TYR 308 N -4.87 0.00 -3.21 -1.35 4.02 -0.99 -4.85 117.16 105.91 1q3s n TYR 308 Ca 0.11 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.81 1q3s n TYR 308 Cb 0.29 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.66 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 0.30 -0.30 3.71 2.72 0.00 0.12 -5.00 105.19 106.73 1q3s n GLY 309 Ca 0.12 0.05 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.19 4.75 -0.28 -0.61 1.01 -0.47 -4.79 121.20 117.62 1q3s s ILE 310 Ca 0.40 -0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.81 1q3s s ILE 310 Cb -0.18 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.20 1q3s s ILE 310 CO 0.49 0.55 0.46 -0.32 0.00 0.00 0.00 174.94 176.13 1q3s s MET 311 N -0.43 3.96 0.03 2.79 -2.45 0.34 -4.44 119.30 119.11 1q3s s MET 311 Ca 0.09 0.13 0.07 0.00 -1.25 0.00 0.00 55.69 54.73 1q3s s MET 311 Cb -0.12 -3.68 -0.02 0.00 1.25 0.00 0.00 34.83 32.25 1q3s s MET 311 CO 0.02 -0.38 -0.21 0.00 1.05 0.00 0.00 175.02 175.50 1q3s s ALA 312 N 2.24 1.79 -0.04 4.11 0.00 -1.26 0.88 121.76 129.48 1q3s s ALA 312 Ca 0.18 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 51.14 1q3s s ALA 312 Cb -0.16 -0.37 -0.00 0.00 0.00 0.00 0.00 23.12 22.59 1q3s s ALA 312 CO 0.10 0.41 -0.15 0.08 0.00 0.00 0.00 175.76 176.20 1q3s s VAL 313 N -0.74 1.25 0.54 0.00 1.01 -0.39 -1.34 120.40 120.72 1q3s s VAL 313 Ca 0.08 -0.61 0.07 0.00 0.00 0.00 0.00 61.98 61.52 1q3s s VAL 313 Cb -0.09 -1.08 0.05 0.00 0.00 0.00 0.00 36.38 35.26 1q3s s VAL 313 CO 0.01 0.37 0.52 0.00 0.00 0.00 0.00 175.10 176.00 1q3s s ARG 314 N 0.11 2.31 -1.06 2.72 1.70 -1.26 -1.00 118.95 122.47 1q3s s ARG 314 Ca -0.04 -1.84 -0.07 0.00 -0.47 0.00 0.00 55.73 53.31 1q3s s ARG 314 Cb -0.11 -2.30 0.06 0.00 -0.57 0.00 0.00 34.95 32.02 1q3s s ARG 314 CO 0.02 -0.64 0.30 0.54 -1.08 0.00 0.00 175.30 174.44 1q3s n ARG 315 N -1.89 -2.87 -2.21 3.89 3.00 -0.61 -4.85 116.66 111.13 1q3s n ARG 315 Ca 0.04 0.40 -0.41 0.00 -0.01 0.00 0.00 57.85 57.87 1q3s n ARG 315 Cb 0.63 -5.04 -0.03 0.00 0.00 0.00 0.00 32.46 28.03 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 -2.72 3.05 0.26 1.55 1.01 -0.98 -4.95 120.40 117.62 1q3s s VAL 316 Ca 0.27 0.95 -0.30 0.00 0.00 0.00 0.00 61.98 62.90 1q3s s VAL 316 Cb -0.15 -3.60 -0.11 0.00 0.00 0.00 0.00 36.38 32.52 1q3s s VAL 316 CO 0.33 0.18 1.58 -0.54 0.00 0.00 0.00 175.10 176.66 1q3s s LYS 317 N -0.89 4.16 0.41 2.72 1.02 -1.26 -4.47 119.74 121.42 1q3s s LYS 317 Ca 0.52 2.51 0.20 0.00 0.02 0.00 0.00 55.97 59.23 1q3s s LYS 317 Cb -0.37 -3.06 1.15 0.00 -0.52 0.00 0.00 37.83 35.03 1q3s s LYS 317 CO 0.44 -0.60 1.78 -0.22 -0.92 0.00 0.00 175.35 175.83 1q3s h LYS 318 N 5.29 0.34 -0.04 1.68 3.64 -1.92 1.29 116.57 126.85 1q3s h LYS 318 Ca -0.46 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 58.79 1q3s h LYS 318 Cb 1.22 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 1q3s h LYS 318 CO 0.82 0.23 -0.50 0.66 -2.27 0.00 0.00 179.45 178.39 1q3s h SER 319 N 0.35 0.10 0.02 4.20 4.64 -2.01 -2.86 113.55 118.00 1q3s h SER 319 Ca 0.58 -0.05 -0.15 0.00 -0.47 0.00 0.00 61.79 61.70 1q3s h SER 319 Cb 1.54 -0.03 0.01 0.00 -0.31 0.00 0.00 62.40 63.61 1q3s h SER 319 CO -0.25 0.58 -0.61 0.44 -0.87 0.00 0.00 176.83 176.11 1q3s h ASP 320 N 0.07 0.50 -0.65 4.97 3.45 0.11 -3.17 116.42 121.71 1q3s h ASP 320 Ca 0.00 -0.79 0.12 0.00 0.43 0.00 0.00 57.03 56.79 1q3s h ASP 320 Cb 0.90 -0.16 -0.08 0.00 -0.56 0.00 0.00 39.33 39.43 1q3s h ASP 320 CO 0.07 1.23 0.21 0.24 -1.57 0.00 0.00 179.24 179.42 1q3s h MET 321 N -0.17 0.35 0.00 3.56 2.86 -0.61 0.27 114.93 121.19 1q3s h MET 321 Ca -0.08 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 1q3s h MET 321 Cb 1.34 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.92 1q3s h MET 321 CO 0.12 0.23 -0.26 0.93 1.06 0.00 0.00 176.91 178.99 1q3s h GLU 322 N 0.36 0.00 -0.10 1.72 5.08 -1.59 -0.45 114.58 119.60 1q3s h GLU 322 Ca 0.34 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.46 1q3s h GLU 322 Cb 0.49 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.76 1q3s h GLU 322 CO -0.38 0.26 -0.88 0.87 -1.00 0.00 0.00 179.01 177.89 1q3s h LYS 323 N 0.00 0.76 -0.70 2.33 1.57 -1.05 -2.29 116.57 117.19 1q3s h LYS 323 Ca -0.00 -0.69 -0.06 0.00 -1.87 0.00 0.00 60.65 58.02 1q3s h LYS 323 Cb 0.57 0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.02 1q3s h LYS 323 CO 0.03 1.29 0.21 -0.07 -0.57 0.00 0.00 179.45 180.34 1q3s h LEU 324 N 0.48 1.04 -1.00 2.94 3.38 -0.54 -0.48 115.31 121.13 1q3s h LEU 324 Ca -0.08 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.61 1q3s h LEU 324 Cb 1.52 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1q3s h LEU 324 CO 0.18 0.98 0.07 0.00 0.09 0.00 0.00 178.44 179.76 1q3s h ALA 325 N 1.10 1.19 0.00 1.53 0.00 -1.05 -0.51 119.26 121.52 1q3s h ALA 325 Ca 0.23 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1q3s h ALA 325 Cb 0.32 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1q3s h ALA 325 CO -0.00 0.54 -0.74 0.87 0.00 0.00 0.00 179.25 179.92 1q3s h LYS 326 N 0.76 0.00 0.14 0.00 1.57 -1.08 -2.45 116.57 115.51 1q3s h LYS 326 Ca 0.16 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.63 1q3s h LYS 326 Cb 0.35 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 1q3s h LYS 326 CO 0.01 0.66 -1.59 0.00 -0.57 0.00 0.00 179.45 177.96 1q3s h ALA 327 N 1.31 0.20 0.00 3.86 0.00 -0.92 0.25 119.26 123.96 1q3s h ALA 327 Ca -0.02 -1.14 -0.04 0.00 0.00 0.00 0.00 54.91 53.72 1q3s h ALA 327 Cb 1.54 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 1q3s h ALA 327 CO 0.09 0.94 -1.11 0.25 0.00 0.00 0.00 179.25 179.42 1q3s n THR 328 N -3.78 0.73 -0.46 0.00 -2.24 -0.21 -3.92 114.28 104.40 1q3s n THR 328 Ca -0.26 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 1q3s n THR 328 Cb 0.97 -0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 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 1.23 0.82 3.71 3.38 0.00 -0.92 -1.39 105.19 112.01 1q3s n GLY 329 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.96 1.42 -0.11 4.61 0.00 -1.23 -4.66 121.76 118.83 1q3s s ALA 330 Ca 0.00 -0.08 0.04 0.00 0.00 0.00 0.00 51.96 51.91 1q3s s ALA 330 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1q3s s ALA 330 CO 0.00 -2.46 -0.23 0.15 0.00 0.00 0.00 175.76 173.22 1q3s s LYS 331 N -4.92 3.01 0.39 0.00 1.02 0.99 -4.61 119.74 115.62 1q3s s LYS 331 Ca 0.64 -0.86 -0.27 0.00 0.02 0.00 0.00 55.97 55.50 1q3s s LYS 331 Cb -0.18 -2.31 -0.09 0.00 -0.52 0.00 0.00 37.83 34.72 1q3s s LYS 331 CO 0.57 0.13 1.34 0.42 -0.92 0.00 0.00 175.35 176.89 1q3s s ILE 332 N 0.47 2.51 -0.02 2.17 1.01 -1.26 -4.41 121.20 121.67 1q3s s ILE 332 Ca -0.16 0.48 0.04 0.00 0.00 0.00 0.00 60.65 61.01 1q3s s ILE 332 Cb -0.17 -3.29 -0.01 0.00 0.01 0.00 0.00 42.46 39.00 1q3s s ILE 332 CO 0.06 0.08 -0.14 -0.69 0.00 0.00 0.00 174.94 174.26 1q3s s VAL 333 N -1.22 1.12 -0.05 2.92 1.01 0.02 -4.98 120.40 119.22 1q3s s VAL 333 Ca 0.55 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 62.04 1q3s s VAL 333 Cb -0.40 -0.95 -0.24 0.00 0.00 0.00 0.00 36.38 34.79 1q3s s VAL 333 CO 0.52 0.32 0.65 0.74 0.00 0.00 0.00 175.10 177.34 1q3s h THR 334 N 5.07 0.87 -3.31 3.92 2.02 -1.89 0.26 112.91 119.85 1q3s h THR 334 Ca -0.34 -2.68 -0.65 0.00 0.77 0.00 0.00 66.41 63.51 1q3s h THR 334 Cb 1.17 2.48 -0.36 0.00 -1.74 0.00 0.00 68.15 69.70 1q3s h THR 334 CO 0.48 0.61 -0.84 0.21 0.37 0.00 0.00 175.52 176.36 1q3s s ASN 335 N -6.37 3.42 0.38 4.18 3.84 -1.26 -4.47 114.94 114.66 1q3s s ASN 335 Ca -0.08 -0.84 0.06 0.00 0.21 0.00 0.00 52.86 52.21 1q3s s ASN 335 Cb 0.08 -1.42 0.77 0.00 -0.55 0.00 0.00 41.25 40.13 1q3s s ASN 335 CO 0.82 -0.07 2.00 -0.37 -2.79 0.00 0.00 177.10 176.68 1q3s h VAL 336 N 6.22 1.06 -0.77 -5.21 -1.51 -1.94 -2.17 116.25 111.93 1q3s h VAL 336 Ca -0.36 -0.24 0.22 0.00 -1.23 0.00 0.00 66.70 65.09 1q3s h VAL 336 Cb 1.11 0.30 -0.03 0.00 -2.13 0.00 0.00 31.29 30.54 1q3s h VAL 336 CO 0.56 0.13 0.55 0.11 -1.23 0.00 0.00 177.57 177.69 1q3s h LYS 337 N 0.70 0.01 -0.55 5.19 1.57 -1.93 -0.11 116.57 121.45 1q3s h LYS 337 Ca 0.25 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1q3s h LYS 337 Cb 0.13 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1q3s h LYS 337 CO -0.07 0.01 0.00 -0.25 -0.57 0.00 0.00 179.45 178.56 1q3s n ASP 338 N -4.31 4.36 -4.65 0.86 9.92 -0.82 -4.95 116.55 116.97 1q3s n ASP 338 Ca 0.15 -2.46 -0.43 0.00 -0.53 0.00 0.00 54.79 51.53 1q3s n ASP 338 Cb 0.83 -0.52 -0.02 0.00 -0.64 0.00 0.00 41.12 40.77 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 -1.85 4.09 0.32 0.64 2.96 -0.05 -5.01 118.68 119.78 1q3s s LEU 339 Ca 0.46 1.66 0.09 0.00 -0.22 0.00 0.00 54.13 56.12 1q3s s LEU 339 Cb 0.30 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.40 1q3s s LEU 339 CO 0.21 -0.95 0.02 0.42 -1.32 0.00 0.00 176.35 174.73 1q3s s THR 340 N 4.10 2.88 -0.14 3.68 -4.23 -1.26 -4.87 115.64 115.79 1q3s s THR 340 Ca 0.61 -1.93 0.27 0.00 -1.18 0.00 0.00 61.69 59.45 1q3s s THR 340 Cb -0.23 -2.81 0.28 0.00 1.34 0.00 0.00 72.50 71.08 1q3s s THR 340 CO 0.22 -0.25 1.81 -0.65 -0.54 0.00 0.00 174.62 175.20 1q3s h PRO 341 N 1.81 0.00 -0.00 3.99 0.11 -1.93 -1.64 132.00 134.34 1q3s h PRO 341 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1q3s h PRO 341 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1q3s h PRO 341 CO 0.64 0.00 -0.01 0.39 -0.21 0.00 0.00 178.00 178.81 1q3s n GLU 342 N -2.45 0.47 0.08 1.05 4.71 -1.26 -2.78 120.64 120.47 1q3s n GLU 342 Ca -0.00 -0.02 0.07 0.00 -0.01 0.00 0.00 57.16 57.20 1q3s n GLU 342 Cb 0.13 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.03 1q3s n GLU 342 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1q3s n ASP 343 N -1.25 0.85 -4.78 1.62 10.43 -0.62 -4.80 116.55 118.01 1q3s n ASP 343 Ca 0.15 0.34 -0.31 0.00 2.57 0.00 0.00 54.79 57.54 1q3s n ASP 343 Cb 0.24 0.35 0.08 0.00 1.84 0.00 0.00 41.12 43.63 1q3s n ASP 343 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1q3s s LEU 344 N -5.50 3.01 0.26 0.64 1.43 -1.12 -0.01 118.68 117.39 1q3s s LEU 344 Ca -0.01 1.74 0.06 0.00 -1.03 0.00 0.00 54.13 54.88 1q3s s LEU 344 Cb 0.09 -4.47 -0.06 0.00 0.03 0.00 0.00 46.19 41.79 1q3s s LEU 344 CO 0.80 -1.91 -0.05 -0.83 0.23 0.00 0.00 176.35 174.59 1q3s s GLY 345 N -3.51 1.72 -0.05 -3.19 0.00 0.19 -4.28 107.32 98.20 1q3s s GLY 345 Ca 0.60 -1.85 -0.00 0.00 0.00 0.00 0.00 44.72 43.47 1q3s s GLY 345 CO 0.56 -1.78 -0.01 -0.47 0.00 0.00 0.00 173.10 171.40 1q3s s TYR 346 N -3.13 3.10 -0.08 1.90 5.04 -0.49 0.10 117.35 123.78 1q3s s TYR 346 Ca 0.29 0.13 -0.03 0.00 -2.44 0.00 0.00 57.07 55.01 1q3s s TYR 346 Cb 0.04 -1.73 0.05 0.00 0.35 0.00 0.00 41.96 40.66 1q3s s TYR 346 CO 0.11 0.45 0.16 0.00 -1.34 0.00 0.00 175.55 174.92 1q3s s ALA 347 N -0.95 -0.21 0.61 3.97 0.00 -1.05 -4.20 121.76 119.94 1q3s s ALA 347 Ca 0.15 0.61 0.33 0.00 0.00 0.00 0.00 51.96 53.05 1q3s s ALA 347 Cb -0.11 -0.74 1.92 0.00 0.00 0.00 0.00 23.12 24.18 1q3s s ALA 347 CO 0.05 -0.47 2.23 1.49 0.00 0.00 0.00 175.76 179.06 1q3s h GLU 348 N 8.09 0.00 -1.73 0.00 4.81 -1.19 -2.31 114.58 122.26 1q3s h GLU 348 Ca -0.20 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.09 1q3s h GLU 348 Cb 1.12 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.26 1q3s h GLU 348 CO 0.21 0.00 0.25 0.08 -0.73 0.00 0.00 179.01 178.82 1q3s s VAL 349 N -4.50 0.00 -0.27 0.32 1.01 -1.10 -4.25 120.40 111.60 1q3s s VAL 349 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1q3s s VAL 349 Cb 0.14 -1.00 0.08 0.00 0.00 0.00 0.00 36.38 35.61 1q3s s VAL 349 CO 0.50 0.00 0.06 -0.69 0.00 0.00 0.00 175.10 174.98 1q3s s VAL 350 N 1.29 0.90 0.06 2.92 1.01 -1.02 -2.02 120.40 123.53 1q3s s VAL 350 Ca -0.08 -1.19 0.03 0.00 0.00 0.00 0.00 61.98 60.75 1q3s s VAL 350 Cb -0.04 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.77 1q3s s VAL 350 CO -0.15 -0.49 -0.10 -0.70 0.00 0.00 0.00 175.10 173.66 1q3s s GLU 351 N 1.64 0.66 -0.67 2.72 2.12 -0.65 -1.80 118.70 122.71 1q3s s GLU 351 Ca 0.05 -0.86 -0.21 0.00 0.36 0.00 0.00 54.97 54.31 1q3s s GLU 351 Cb -0.17 -0.51 0.09 0.00 0.26 0.00 0.00 34.13 33.79 1q3s s GLU 351 CO -0.18 0.10 0.91 -2.00 -0.54 0.00 0.00 175.26 173.55 1q3s s GLU 352 N -1.73 3.15 -0.12 4.30 2.12 -0.37 -0.91 118.70 125.14 1q3s s GLU 352 Ca -0.06 -1.10 -0.08 0.00 0.36 0.00 0.00 54.97 54.09 1q3s s GLU 352 Cb -0.09 -4.33 -0.04 0.00 0.26 0.00 0.00 34.13 29.93 1q3s s GLU 352 CO 0.01 -1.73 0.16 1.03 -0.54 0.00 0.00 175.26 174.19 1q3s s ARG 353 N 3.47 3.50 -1.16 4.30 0.52 -0.37 -4.88 118.95 124.33 1q3s s ARG 353 Ca 0.20 -0.10 -0.12 0.00 -0.52 0.00 0.00 55.73 55.20 1q3s s ARG 353 Cb -0.17 -3.20 0.21 0.00 0.52 0.00 0.00 34.95 32.31 1q3s s ARG 353 CO 0.06 0.76 1.29 0.21 0.02 0.00 0.00 175.30 177.64 1q3s s LYS 354 N -0.98 4.12 -0.17 3.54 2.20 -1.26 -1.21 119.74 125.98 1q3s s LYS 354 Ca 0.15 -2.83 -0.24 0.00 -0.36 0.00 0.00 55.97 52.70 1q3s s LYS 354 Cb -0.12 -4.85 -0.02 0.00 -1.51 0.00 0.00 37.83 31.33 1q3s s LYS 354 CO 0.04 -1.55 0.76 -1.17 -0.36 0.00 0.00 175.35 173.07 1q3s s LEU 355 N 0.43 4.18 -1.23 5.43 2.96 -0.33 -4.07 118.68 126.05 1q3s s LEU 355 Ca 0.37 1.07 -0.01 0.00 -0.22 0.00 0.00 54.13 55.34 1q3s s LEU 355 Cb -0.06 -3.12 -0.00 0.00 0.50 0.00 0.00 46.19 43.51 1q3s s LEU 355 CO -0.03 -0.34 0.87 0.00 -1.32 0.00 0.00 176.35 175.53 1q3s n ALA 356 N 5.07 -2.06 0.00 5.97 0.00 -1.26 -2.06 120.51 126.17 1q3s n ALA 356 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1q3s n ALA 356 Cb 0.49 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.45 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 -1.32 0.86 3.80 0.00 0.00 -1.26 -4.93 105.19 102.35 1q3s n GLY 357 Ca -0.28 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 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 3.60 0.14 1.61 8.01 -0.87 -5.05 118.70 126.14 1q3s s GLU 358 Ca 0.00 -0.20 -0.30 0.00 0.01 0.00 0.00 54.97 54.48 1q3s s GLU 358 Cb 0.00 -3.19 -0.07 0.00 -4.31 0.00 0.00 34.13 26.56 1q3s s GLU 358 CO 0.00 0.62 0.97 -0.80 0.01 0.00 0.00 175.26 176.07 1q3s s ASN 359 N -0.58 7.50 0.14 -0.19 0.01 -1.26 -1.18 114.94 119.37 1q3s s ASN 359 Ca 0.12 1.86 -0.05 0.00 -0.71 0.00 0.00 52.86 54.09 1q3s s ASN 359 Cb -0.12 -2.59 -0.03 0.00 0.41 0.00 0.00 41.25 38.92 1q3s s ASN 359 CO 0.02 -0.04 0.16 -0.04 -1.51 0.00 0.00 177.10 175.69 1q3s s MET 360 N -0.28 1.02 -0.16 -0.60 -1.94 -0.35 -4.37 119.30 112.61 1q3s s MET 360 Ca 0.46 -1.31 0.01 0.00 -1.71 0.00 0.00 55.69 53.15 1q3s s MET 360 Cb -0.25 0.30 0.02 0.00 2.01 0.00 0.00 34.83 36.92 1q3s s MET 360 CO 0.31 -0.33 -0.19 0.42 -0.01 0.00 0.00 175.02 175.22 1q3s s ILE 361 N -4.01 1.95 -0.20 2.53 1.01 -0.05 -1.23 121.20 121.21 1q3s s ILE 361 Ca 0.20 -0.88 -0.09 0.00 0.00 0.00 0.00 60.65 59.88 1q3s s ILE 361 Cb 0.06 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.71 1q3s s ILE 361 CO 0.00 0.52 0.10 -0.36 0.00 0.00 0.00 174.94 175.21 1q3s s PHE 362 N 1.22 3.33 -0.63 3.97 0.40 -0.09 -0.74 117.98 125.43 1q3s s PHE 362 Ca 0.02 0.20 0.04 0.00 -0.60 0.00 0.00 56.93 56.59 1q3s s PHE 362 Cb -0.14 -2.14 0.15 0.00 0.51 0.00 0.00 43.02 41.41 1q3s s PHE 362 CO -0.10 0.20 0.41 0.08 0.70 0.00 0.00 175.22 176.51 1q3s s VAL 363 N 0.46 2.86 0.53 -0.44 1.01 -0.37 -1.63 120.40 122.81 1q3s s VAL 363 Ca 0.06 -3.82 0.05 0.00 0.00 0.00 0.00 61.98 58.27 1q3s s VAL 363 Cb -0.12 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.37 1q3s s VAL 363 CO -0.00 -0.92 0.34 -1.83 0.00 0.00 0.00 175.10 172.69 1q3s s GLU 364 N -0.92 2.26 -0.81 2.72 -1.05 -0.86 -1.41 118.70 118.64 1q3s s GLU 364 Ca 0.21 -2.03 0.00 0.00 -0.15 0.00 0.00 54.97 53.01 1q3s s GLU 364 Cb -0.14 -2.04 0.00 0.00 -0.44 0.00 0.00 34.13 31.51 1q3s s GLU 364 CO -0.09 -0.54 0.00 0.41 0.95 0.00 0.00 175.26 176.00 1q3s n GLY 365 N -1.66 0.77 3.74 -3.83 0.00 -1.21 -2.55 105.19 100.44 1q3s n GLY 365 Ca -0.03 -0.65 -0.33 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.98 0.00 -3.14 0.00 4.81 -1.26 -4.52 118.16 111.07 1q3s n LYS 367 Ca 0.11 0.00 -0.26 0.00 -0.87 0.00 0.00 58.31 57.30 1q3s n LYS 367 Cb 0.52 -0.29 -0.05 0.00 0.02 0.00 0.00 35.03 35.22 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 3.44 -4.59 3.14 5.15 -1.26 -5.09 115.26 116.04 1q3s n ASN 368 Ca 0.00 -3.45 -0.61 0.00 -0.60 0.00 0.00 54.58 49.93 1q3s n ASN 368 Cb 0.00 -0.61 -0.08 0.00 -0.53 0.00 0.00 39.78 38.56 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 0.28 0.15 -0.04 1.20 -0.04 -1.25 -4.87 135.00 130.43 1q3s n PRO 369 Ca 0.29 0.06 0.12 0.00 -0.04 0.00 0.00 63.50 63.93 1q3s n PRO 369 Cb 0.44 -1.58 0.30 0.00 -0.04 0.00 0.00 33.50 32.63 1q3s n PRO 369 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1q3s n LYS 370 N 2.48 2.05 -3.74 0.54 4.01 0.88 -4.26 118.16 120.11 1q3s n LYS 370 Ca 0.23 -1.54 -0.12 0.00 -0.51 0.00 0.00 58.31 56.37 1q3s n LYS 370 Cb 0.05 -1.47 -0.13 0.00 -0.51 0.00 0.00 35.03 32.98 1q3s n LYS 370 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1q3s s ALA 371 N -1.89 -0.56 0.06 7.82 0.00 -1.24 -4.68 121.76 121.27 1q3s s ALA 371 Ca 0.34 0.94 0.02 0.00 0.00 0.00 0.00 51.96 53.26 1q3s s ALA 371 Cb 0.20 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.71 1q3s s ALA 371 CO 0.31 -0.18 -0.08 0.54 0.00 0.00 0.00 175.76 176.34 1q3s s VAL 372 N 1.07 0.63 -0.08 0.00 0.11 -0.35 -4.32 120.40 117.47 1q3s s VAL 372 Ca -0.08 -1.24 -0.00 0.00 -2.93 0.00 0.00 61.98 57.73 1q3s s VAL 372 Cb -0.09 -0.83 -0.03 0.00 -1.53 0.00 0.00 36.38 33.90 1q3s s VAL 372 CO -0.07 -0.44 -0.05 -0.89 -3.33 0.00 0.00 175.10 170.32 1q3s s THR 373 N -1.72 3.90 -0.29 5.04 2.01 -0.71 -1.97 115.64 121.90 1q3s s THR 373 Ca -0.06 -0.40 -0.05 0.00 0.31 0.00 0.00 61.69 61.49 1q3s s THR 373 Cb -0.08 -2.62 0.02 0.00 0.01 0.00 0.00 72.50 69.84 1q3s s THR 373 CO -0.00 0.60 0.04 -0.63 -0.69 0.00 0.00 174.62 173.94 1q3s s ILE 374 N -0.77 3.62 -0.14 1.82 1.01 0.13 -0.06 121.20 126.80 1q3s s ILE 374 Ca 0.12 -0.87 -0.22 0.00 0.00 0.00 0.00 60.65 59.67 1q3s s ILE 374 Cb -0.11 -2.89 -0.03 0.00 0.01 0.00 0.00 42.46 39.43 1q3s s ILE 374 CO 0.02 0.07 0.68 -0.22 0.00 0.00 0.00 174.94 175.49 1q3s s LEU 375 N 1.43 4.23 -0.17 2.97 2.96 -0.07 -0.67 118.68 129.35 1q3s s LEU 375 Ca 0.01 1.03 -0.04 0.00 -0.22 0.00 0.00 54.13 54.91 1q3s s LEU 375 Cb -0.17 -3.01 -0.02 0.00 0.50 0.00 0.00 46.19 43.48 1q3s s LEU 375 CO 0.01 -0.22 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.16 1q3s s ILE 376 N 1.43 3.85 0.21 6.68 1.01 0.26 -2.23 121.20 132.41 1q3s s ILE 376 Ca 0.34 -0.36 0.10 0.00 0.00 0.00 0.00 60.65 60.73 1q3s s ILE 376 Cb -0.17 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 1q3s s ILE 376 CO 0.14 0.47 -0.15 -0.13 0.00 0.00 0.00 174.94 175.27 1q3s s ARG 377 N 0.62 1.86 0.00 2.79 1.81 -1.26 -1.75 118.95 123.02 1q3s s ARG 377 Ca -0.02 -1.44 0.00 0.00 -1.72 0.00 0.00 55.73 52.55 1q3s s ARG 377 Cb -0.14 -2.01 0.00 0.00 -0.45 0.00 0.00 34.95 32.35 1q3s s ARG 377 CO 0.02 0.40 0.00 0.41 -0.68 0.00 0.00 175.30 175.45 1q3s n GLY 378 N -0.08 1.42 0.18 -3.53 0.00 -0.37 -3.09 105.19 99.72 1q3s n GLY 378 Ca -0.10 -0.68 -0.14 0.00 0.00 0.00 0.00 46.02 45.10 1q3s n GLY 378 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1q3s h GLY 379 N 0.00 -0.39 -2.10 -0.02 0.00 -1.65 0.44 103.07 99.35 1q3s h GLY 379 Ca 0.00 0.15 -0.60 0.00 0.00 0.00 0.00 47.33 46.88 1q3s h GLY 379 CO 0.00 -0.14 -0.65 -1.08 0.00 0.00 0.00 176.54 174.67 1q3s s THR 380 N -6.04 2.55 0.24 4.70 -1.32 -1.26 -4.13 115.64 110.39 1q3s s THR 380 Ca -0.15 -2.07 -0.04 0.00 -1.21 0.00 0.00 61.69 58.22 1q3s s THR 380 Cb 0.05 -2.72 0.21 0.00 -1.51 0.00 0.00 72.50 68.53 1q3s s THR 380 CO 0.64 -0.23 1.77 -0.08 -2.21 0.00 0.00 174.62 174.51 1q3s h GLU 381 N 1.91 0.59 -0.55 7.08 4.57 -1.99 -2.09 114.58 124.10 1q3s h GLU 381 Ca -0.42 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 57.70 1q3s h GLU 381 Cb 1.25 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.68 1q3s h GLU 381 CO 0.67 0.39 0.25 0.45 -1.18 0.00 0.00 179.01 179.59 1q3s h HIS 382 N 0.61 0.80 -0.95 0.92 3.86 -1.97 -0.81 115.15 117.60 1q3s h HIS 382 Ca 0.40 -0.04 0.05 0.00 -1.16 0.00 0.00 60.37 59.62 1q3s h HIS 382 Cb 0.51 -0.25 -0.06 0.00 1.06 0.00 0.00 27.41 28.67 1q3s h HIS 382 CO -0.11 0.63 0.62 0.28 0.86 0.00 0.00 177.93 180.21 1q3s h VAL 383 N 0.74 1.13 0.69 2.45 2.07 -1.79 -2.29 116.25 119.25 1q3s h VAL 383 Ca 0.19 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1q3s h VAL 383 Cb 0.14 -0.13 0.01 0.00 -1.52 0.00 0.00 31.29 29.78 1q3s h VAL 383 CO -0.02 0.21 -0.33 0.40 0.02 0.00 0.00 177.57 177.85 1q3s h ILE 384 N 1.16 0.00 -0.98 4.57 2.04 -1.03 -1.75 117.51 121.52 1q3s h ILE 384 Ca 0.39 -0.12 0.16 0.00 1.00 0.00 0.00 64.86 66.29 1q3s h ILE 384 Cb 0.08 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.06 1q3s h ILE 384 CO -0.13 0.00 0.59 0.44 0.00 0.00 0.00 178.15 179.05 1q3s h ASP 385 N -1.05 0.80 0.17 1.72 3.32 -1.10 -0.28 116.42 120.00 1q3s h ASP 385 Ca -0.09 0.08 -0.15 0.00 0.02 0.00 0.00 57.03 56.89 1q3s h ASP 385 Cb 0.71 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 1q3s h ASP 385 CO 0.16 0.33 -0.55 -0.08 -1.72 0.00 0.00 179.24 177.38 1q3s h GLU 386 N 0.82 0.40 -0.39 3.56 4.57 -1.44 -1.93 114.58 120.17 1q3s h GLU 386 Ca 0.54 -0.25 -0.08 0.00 -1.18 0.00 0.00 59.36 58.39 1q3s h GLU 386 Cb 0.74 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.35 1q3s h GLU 386 CO -0.35 0.85 -0.08 0.28 -1.18 0.00 0.00 179.01 178.53 1q3s h VAL 387 N 0.31 1.27 -0.52 0.32 2.07 -0.30 -0.66 116.25 118.75 1q3s h VAL 387 Ca 0.01 -1.15 0.03 0.00 0.82 0.00 0.00 66.70 66.41 1q3s h VAL 387 Cb 1.06 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 32.02 1q3s h VAL 387 CO 0.09 0.38 0.29 -0.08 0.02 0.00 0.00 177.57 178.28 1q3s h GLU 388 N 0.54 0.55 -0.97 1.57 4.81 -0.96 0.99 114.58 121.12 1q3s h GLU 388 Ca 0.10 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1q3s h GLU 388 Cb 0.59 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.80 1q3s h GLU 388 CO 0.03 0.37 0.60 0.00 -0.73 0.00 0.00 179.01 179.28 1q3s h ARG 389 N 0.57 1.30 -0.16 1.92 3.08 -1.09 0.79 114.38 120.78 1q3s h ARG 389 Ca 0.22 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.16 1q3s h ARG 389 Cb 0.08 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 29.84 1q3s h ARG 389 CO -0.12 0.89 0.09 0.00 -1.07 0.00 0.00 179.97 179.76 1q3s h ALA 390 N 1.33 0.20 -0.74 0.04 0.00 -0.19 -2.83 119.26 117.08 1q3s h ALA 390 Ca 0.35 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1q3s h ALA 390 Cb -0.09 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1q3s h ALA 390 CO -0.07 -0.27 0.39 -0.07 0.00 0.00 0.00 179.25 179.23 1q3s h LEU 391 N 0.16 0.95 -1.81 0.00 3.38 -0.18 -1.40 115.31 116.42 1q3s h LEU 391 Ca 0.06 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1q3s h LEU 391 Cb 0.06 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1q3s h LEU 391 CO -0.01 0.79 -0.10 -0.33 0.09 0.00 0.00 178.44 178.88 1q3s h GLU 392 N 1.03 0.00 0.21 1.13 5.08 -0.73 0.55 114.58 121.85 1q3s h GLU 392 Ca 0.26 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.30 1q3s h GLU 392 Cb 0.07 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.35 1q3s h GLU 392 CO -0.04 0.10 -1.40 -0.44 -1.00 0.00 0.00 179.01 176.23 1q3s h ASP 393 N 0.00 0.78 -0.33 1.42 3.32 -1.23 -2.44 116.42 117.95 1q3s h ASP 393 Ca -0.00 -0.81 -0.02 0.00 0.02 0.00 0.00 57.03 56.22 1q3s h ASP 393 Cb 0.18 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1q3s h ASP 393 CO 0.01 1.63 0.13 0.00 -1.72 0.00 0.00 179.24 179.29 1q3s h ALA 394 N 0.26 0.42 -0.02 3.45 0.00 -0.27 -0.75 119.26 122.34 1q3s h ALA 394 Ca -0.22 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 1q3s h ALA 394 Cb 2.09 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.75 1q3s h ALA 394 CO 0.26 0.03 0.01 0.28 0.00 0.00 0.00 179.25 179.83 1q3s h VAL 395 N 0.38 1.11 -0.06 0.00 2.07 -0.04 -2.44 116.25 117.27 1q3s h VAL 395 Ca 0.11 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.31 1q3s h VAL 395 Cb 0.19 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1q3s h VAL 395 CO -0.01 0.09 0.04 0.11 0.02 0.00 0.00 177.57 177.82 1q3s h LYS 396 N -0.11 0.03 0.22 1.57 1.57 -1.24 -1.16 116.57 117.45 1q3s h LYS 396 Ca 0.01 -0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.46 1q3s h LYS 396 Cb 0.14 -0.01 0.03 0.00 0.08 0.00 0.00 32.23 32.47 1q3s h LYS 396 CO -0.00 0.02 -1.47 -0.39 -0.57 0.00 0.00 179.45 177.03 1q3s h VAL 397 N 0.03 1.28 -0.84 0.50 -1.51 -1.05 -2.79 116.25 111.86 1q3s h VAL 397 Ca 0.03 -2.76 0.01 0.00 -1.23 0.00 0.00 66.70 62.75 1q3s h VAL 397 Cb 0.07 2.98 -0.04 0.00 -2.13 0.00 0.00 31.29 32.17 1q3s h VAL 397 CO -0.00 0.83 0.55 0.58 -1.23 0.00 0.00 177.57 178.30 1q3s h VAL 398 N 0.13 1.20 -0.90 7.19 2.07 -1.08 -1.78 116.25 123.06 1q3s h VAL 398 Ca -0.24 -0.38 0.04 0.00 0.82 0.00 0.00 66.70 66.93 1q3s h VAL 398 Cb 2.12 -0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 1q3s h VAL 398 CO 0.25 0.20 0.59 0.50 0.02 0.00 0.00 177.57 179.13 1q3s h LYS 399 N 1.12 1.10 -0.31 1.57 3.64 -1.23 -1.92 116.57 120.54 1q3s h LYS 399 Ca 0.31 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.54 1q3s h LYS 399 Cb -0.10 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.46 1q3s h LYS 399 CO -0.08 0.73 -0.13 -0.44 -2.27 0.00 0.00 179.45 177.26 1q3s h ASP 400 N 1.13 0.65 -0.40 4.20 3.32 -1.06 -2.63 116.42 121.63 1q3s h ASP 400 Ca 0.36 -0.40 -0.10 0.00 0.02 0.00 0.00 57.03 56.91 1q3s h ASP 400 Cb 0.02 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1q3s h ASP 400 CO -0.11 0.90 -0.10 0.58 -1.72 0.00 0.00 179.24 178.80 1q3s h VAL 401 N 0.40 1.26 -0.29 -1.35 2.07 -1.14 0.53 116.25 117.73 1q3s h VAL 401 Ca 0.07 -1.19 -0.10 0.00 0.82 0.00 0.00 66.70 66.30 1q3s h VAL 401 Cb 0.65 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1q3s h VAL 401 CO 0.04 0.41 -0.25 0.24 0.02 0.00 0.00 177.57 178.04 1q3s h MET 402 N 0.77 0.57 0.17 1.57 2.86 -1.35 1.36 114.93 120.88 1q3s h MET 402 Ca 0.13 -0.22 -0.32 0.00 -2.06 0.00 0.00 59.70 57.22 1q3s h MET 402 Cb 0.60 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.24 1q3s h MET 402 CO 0.04 0.77 -1.53 0.93 1.06 0.00 0.00 176.91 178.19 1q3s h GLU 403 N 0.50 0.36 0.08 1.72 5.08 -1.21 -3.39 114.58 117.73 1q3s h GLU 403 Ca 0.07 -0.62 -0.29 0.00 -1.00 0.00 0.00 59.36 57.52 1q3s h GLU 403 Cb 0.70 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 1q3s h GLU 403 CO 0.05 1.27 -1.53 -0.44 -1.00 0.00 0.00 179.01 177.36 1q3s h ASP 404 N 0.10 0.25 -3.22 1.42 3.45 0.09 -3.45 116.42 115.07 1q3s h ASP 404 Ca -0.25 -0.77 -0.24 0.00 0.43 0.00 0.00 57.03 56.19 1q3s h ASP 404 Cb 2.07 -0.08 0.05 0.00 -0.56 0.00 0.00 39.33 40.81 1q3s h ASP 404 CO 0.20 1.65 -0.38 0.61 -1.57 0.00 0.00 179.24 179.75 1q3s n GLY 405 N 1.71 -0.01 3.25 2.75 0.00 0.47 -4.97 105.19 108.40 1q3s n GLY 405 Ca -0.30 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.01 -0.99 0.41 4.61 0.00 -1.26 -0.72 121.76 120.80 1q3s s ALA 406 Ca 0.24 1.42 0.02 0.00 0.00 0.00 0.00 51.96 53.63 1q3s s ALA 406 Cb -0.10 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 1q3s s ALA 406 CO 0.29 -0.25 0.08 1.33 0.00 0.00 0.00 175.76 177.22 1q3s n VAL 407 N 4.03 0.00 -3.73 0.00 0.24 -0.89 -2.02 118.33 115.97 1q3s n VAL 407 Ca -0.22 -2.19 -0.10 0.00 -2.04 0.00 0.00 64.34 59.78 1q3s n VAL 407 Cb 0.55 0.64 -0.06 0.00 -1.47 0.00 0.00 33.84 33.50 1q3s n VAL 407 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1q3s s LEU 408 N 0.00 0.80 0.64 1.34 1.43 0.02 -1.11 118.68 121.80 1q3s s LEU 408 Ca 0.11 -0.34 -0.14 0.00 -1.03 0.00 0.00 54.13 52.72 1q3s s LEU 408 Cb 0.01 1.49 -0.01 0.00 0.03 0.00 0.00 46.19 47.70 1q3s s LEU 408 CO 0.08 -0.74 1.07 -2.16 0.23 0.00 0.00 176.35 174.83 1q3s s PRO 409 N -3.38 3.06 0.00 1.29 0.04 -1.26 -0.40 135.00 134.35 1q3s s PRO 409 Ca 0.01 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.23 1q3s s PRO 409 Cb 0.02 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.56 1q3s s PRO 409 CO -0.09 -1.02 0.00 0.00 0.04 0.00 0.00 177.00 175.93 1q3s n ALA 410 N -2.45 0.00 -4.33 8.56 0.00 -0.33 -4.21 120.51 117.75 1q3s n ALA 410 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.16 1q3s n ALA 410 Cb 0.53 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.34 3.33 0.00 0.00 -1.26 -0.40 105.19 111.52 1q3s n GLY 411 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.58 1.13 0.26 -0.02 0.00 -1.26 -0.34 105.19 103.38 1q3s n GLY 412 Ca -0.04 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.02 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 0.76 0.06 4.61 0.00 -0.93 0.01 119.26 123.77 1q3s h ALA 413 Ca 0.00 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 1q3s h ALA 413 Cb 0.00 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1q3s h ALA 413 CO 0.00 -0.40 -0.03 -1.35 0.00 0.00 0.00 179.25 177.48 1q3s h PRO 414 N 0.14 -0.08 -0.63 0.00 0.11 -1.79 -2.21 132.00 127.55 1q3s h PRO 414 Ca 0.38 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.49 1q3s h PRO 414 Cb 0.65 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.75 1q3s h PRO 414 CO -0.58 0.05 0.36 1.05 -0.21 0.00 0.00 178.00 178.67 1q3s h GLU 415 N -0.18 0.85 -0.24 1.05 9.09 -1.73 0.12 114.58 123.53 1q3s h GLU 415 Ca -0.01 -0.08 -0.01 0.00 0.05 0.00 0.00 59.36 59.31 1q3s h GLU 415 Cb 0.16 -0.18 -0.01 0.00 -1.65 0.00 0.00 28.75 27.07 1q3s h GLU 415 CO 0.01 0.61 0.11 0.82 0.05 0.00 0.00 179.01 180.61 1q3s h ILE 416 N 0.86 1.15 -0.93 -1.06 2.04 -0.91 0.33 117.51 118.99 1q3s h ILE 416 Ca 0.22 -0.45 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1q3s h ILE 416 Cb -0.01 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 1q3s h ILE 416 CO -0.04 0.15 0.62 -0.08 0.00 0.00 0.00 178.15 178.80 1q3s h GLU 417 N 0.24 1.23 -0.26 2.37 4.57 -0.72 -0.65 114.58 121.38 1q3s h GLU 417 Ca 0.08 -0.08 -0.16 0.00 -1.18 0.00 0.00 59.36 58.02 1q3s h GLU 417 Cb 0.14 -0.28 -0.00 0.00 -0.16 0.00 0.00 28.75 28.45 1q3s h GLU 417 CO -0.01 0.82 -0.50 -0.07 -1.18 0.00 0.00 179.01 178.07 1q3s h LEU 418 N 1.27 0.78 0.52 1.64 3.38 -0.25 -1.51 115.31 121.14 1q3s h LEU 418 Ca 0.34 -0.40 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1q3s h LEU 418 Cb -0.14 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.39 1q3s h LEU 418 CO -0.07 1.14 -0.25 0.00 0.09 0.00 0.00 178.44 179.35 1q3s h ALA 419 N 0.88 -1.14 -0.66 1.53 0.00 0.21 0.22 119.26 120.30 1q3s h ALA 419 Ca 0.02 -0.15 0.11 0.00 0.00 0.00 0.00 54.91 54.89 1q3s h ALA 419 Cb 1.06 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 19.00 1q3s h ALA 419 CO 0.10 -1.09 -0.34 0.82 0.00 0.00 0.00 179.25 178.75 1q3s h ILE 420 N -0.73 0.14 0.57 0.00 2.04 -1.18 -2.43 117.51 115.93 1q3s h ILE 420 Ca -0.07 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1q3s h ILE 420 Cb 0.54 0.14 0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1q3s h ILE 420 CO 0.12 0.00 -0.28 -0.09 0.00 0.00 0.00 178.15 177.90 1q3s h ARG 421 N -0.13 -0.74 0.00 2.37 9.65 -1.29 -3.19 114.38 121.05 1q3s h ARG 421 Ca 0.26 0.05 0.00 0.00 -1.10 0.00 0.00 59.98 59.19 1q3s h ARG 421 Cb 0.56 0.17 0.00 0.00 -1.39 0.00 0.00 29.97 29.31 1q3s h ARG 421 CO -0.73 -0.44 0.34 -0.07 2.80 0.00 0.00 179.97 181.86 1q3s h LEU 422 N -1.09 0.00 0.00 3.80 3.38 -0.34 0.58 115.31 121.64 1q3s h LEU 422 Ca -0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1q3s h LEU 422 Cb 0.65 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1q3s h LEU 422 CO 0.13 0.00 -0.06 -0.78 0.09 0.00 0.00 178.44 177.82 1q3s h ASP 423 N 0.00 0.05 -0.91 -0.43 1.82 -1.42 -2.50 116.42 113.03 1q3s h ASP 423 Ca 0.00 -0.86 0.09 0.00 -0.39 0.00 0.00 57.03 55.87 1q3s h ASP 423 Cb 0.67 -0.01 -0.06 0.00 0.68 0.00 0.00 39.33 40.60 1q3s h ASP 423 CO 0.00 0.90 0.59 -0.33 -1.61 0.00 0.00 179.24 178.79 1q3s h GLU 424 N -0.80 0.91 -0.74 0.28 4.39 -0.98 0.16 114.58 117.81 1q3s h GLU 424 Ca -0.01 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 1q3s h GLU 424 Cb 0.91 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 29.32 1q3s h GLU 424 CO 0.01 0.60 0.33 -0.92 -1.16 0.00 0.00 179.01 177.87 1q3s h TYR 425 N 0.94 1.08 -0.63 4.33 3.20 -1.53 -1.68 116.97 122.68 1q3s h TYR 425 Ca 0.41 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.21 1q3s h TYR 425 Cb 0.36 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 1q3s h TYR 425 CO -0.00 0.80 0.33 0.00 -1.64 0.00 0.00 178.16 177.65 1q3s h ALA 426 N 1.29 1.38 0.56 1.82 0.00 -0.25 -1.48 119.26 122.60 1q3s h ALA 426 Ca 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1q3s h ALA 426 Cb 0.15 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1q3s h ALA 426 CO -0.03 0.50 -0.27 0.87 0.00 0.00 0.00 179.25 180.32 1q3s h LYS 427 N 0.89 -0.73 -0.04 0.00 1.79 -0.41 0.15 116.57 118.22 1q3s h LYS 427 Ca 0.22 0.05 0.01 0.00 -2.18 0.00 0.00 60.65 58.76 1q3s h LYS 427 Cb 0.06 0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.87 1q3s h LYS 427 CO -0.03 -0.46 0.04 -0.56 -1.08 0.00 0.00 179.45 177.36 1q3s h GLN 428 N -0.83 0.00 0.09 3.15 3.07 -1.15 -2.37 115.11 117.07 1q3s h GLN 428 Ca -0.08 0.00 -0.13 0.00 0.09 0.00 0.00 58.65 58.53 1q3s h GLN 428 Cb 0.61 0.00 0.02 0.00 0.08 0.00 0.00 27.48 28.18 1q3s h GLN 428 CO 0.13 0.00 -0.58 0.28 0.09 0.00 0.00 178.83 178.74 1q3s h VAL 429 N 0.00 1.58 -3.13 1.86 2.07 -0.93 -3.50 116.25 114.20 1q3s h VAL 429 Ca 0.02 -2.44 0.38 0.00 0.82 0.00 0.00 66.70 65.48 1q3s h VAL 429 Cb 0.10 3.20 -0.10 0.00 -1.52 0.00 0.00 31.29 32.97 1q3s h VAL 429 CO -0.00 0.68 -0.51 0.61 0.02 0.00 0.00 177.57 178.37 1q3s n GLY 430 N 1.59 -1.88 7.00 2.17 0.00 0.51 -4.81 105.19 109.78 1q3s n GLY 430 Ca -0.13 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.73 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 -4.16 -1.57 0.32 -0.02 0.00 -1.26 -2.52 105.19 95.98 1q3s n GLY 431 Ca 0.01 -1.31 -0.05 0.00 0.00 0.00 0.00 46.02 44.67 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 1.10 -0.80 1.61 1.79 -1.98 -2.46 116.57 115.84 1q3s h LYS 432 Ca 0.00 -0.13 0.14 0.00 -2.18 0.00 0.00 60.65 58.48 1q3s h LYS 432 Cb 0.00 -0.21 -0.14 0.00 -1.58 0.00 0.00 32.23 30.29 1q3s h LYS 432 CO 0.00 0.82 -0.31 0.93 -1.08 0.00 0.00 179.45 179.81 1q3s h GLU 433 N 1.09 -0.06 -1.06 3.15 3.07 -1.85 0.54 114.58 119.47 1q3s h GLU 433 Ca 0.28 0.00 0.29 0.00 -0.50 0.00 0.00 59.36 59.43 1q3s h GLU 433 Cb 0.04 0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 27.90 1q3s h GLU 433 CO -0.04 -0.04 0.72 0.00 -1.40 0.00 0.00 179.01 178.25 1q3s h ALA 434 N 1.39 2.59 -0.29 3.43 0.00 -1.13 0.33 119.26 125.59 1q3s h ALA 434 Ca 0.32 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 55.07 1q3s h ALA 434 Cb 0.59 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1q3s h ALA 434 CO -0.84 -0.95 -0.54 -0.07 0.00 0.00 0.00 179.25 176.85 1q3s h LEU 435 N 0.22 0.96 -0.24 0.00 4.07 0.04 0.83 115.31 121.18 1q3s h LEU 435 Ca 0.56 -0.51 -0.08 0.00 0.08 0.00 0.00 57.88 57.92 1q3s h LEU 435 Cb 1.76 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 43.22 1q3s h LEU 435 CO -0.16 1.31 -0.17 0.00 -1.08 0.00 0.00 178.44 178.33 1q3s h ALA 436 N 0.71 0.35 -0.74 1.53 0.00 -0.16 -1.77 119.26 119.18 1q3s h ALA 436 Ca 0.02 -0.34 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 1q3s h ALA 436 Cb 1.15 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1q3s h ALA 436 CO 0.12 0.26 0.23 0.82 0.00 0.00 0.00 179.25 180.68 1q3s h ILE 437 N 0.25 1.26 -0.40 0.00 2.04 -0.57 -1.06 117.51 119.04 1q3s h ILE 437 Ca 0.05 -0.91 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 1q3s h ILE 437 Cb 0.71 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1q3s h ILE 437 CO 0.05 0.36 0.05 -0.33 0.00 0.00 0.00 178.15 178.28 1q3s h GLU 438 N 1.10 0.68 -0.29 2.37 5.08 -0.77 -1.36 114.58 121.38 1q3s h GLU 438 Ca 0.24 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 1q3s h GLU 438 Cb 0.31 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1q3s h GLU 438 CO -0.01 0.73 -0.10 -0.91 -1.00 0.00 0.00 179.01 177.73 1q3s h ASN 439 N 0.52 0.46 0.13 1.42 4.21 -1.08 -1.42 115.58 119.82 1q3s h ASN 439 Ca 0.12 -0.11 -0.01 0.00 1.21 0.00 0.00 56.30 57.52 1q3s h ASN 439 Cb 0.39 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.47 1q3s h ASN 439 CO 0.01 0.60 -0.06 0.15 -1.29 0.00 0.00 177.43 176.83 1q3s h PHE 440 N 0.45 -0.16 -0.68 1.19 3.57 -1.02 -0.44 116.94 119.84 1q3s h PHE 440 Ca 0.09 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.70 1q3s h PHE 440 Cb 0.45 0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 1q3s h PHE 440 CO 0.01 0.12 0.46 0.00 -2.23 0.00 0.00 178.31 176.67 1q3s h ALA 441 N 0.38 2.05 -0.04 2.41 0.00 -0.97 -2.05 119.26 121.05 1q3s h ALA 441 Ca -0.02 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1q3s h ALA 441 Cb 0.36 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1q3s h ALA 441 CO 0.03 -0.22 -0.37 0.22 0.00 0.00 0.00 179.25 178.92 1q3s h ASP 442 N 0.43 0.39 -0.96 0.00 -0.00 -1.02 -3.26 116.42 111.99 1q3s h ASP 442 Ca 0.33 -0.71 0.20 0.00 -0.00 0.00 0.00 57.03 56.85 1q3s h ASP 442 Cb 0.68 -0.12 -0.11 0.00 -0.00 0.00 0.00 39.33 39.78 1q3s h ASP 442 CO -0.10 1.04 0.55 0.00 -0.00 0.00 0.00 179.24 180.72 1q3s h ALA 443 N 0.36 1.61 0.00 -0.78 0.00 -0.35 0.78 119.26 120.88 1q3s h ALA 443 Ca -0.04 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1q3s h ALA 443 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1q3s h ALA 443 CO 0.07 -0.16 0.18 1.28 0.00 0.00 0.00 179.25 180.62 1q3s n LEU 444 N -4.86 0.13 0.04 0.00 4.77 -1.08 -1.61 117.00 114.40 1q3s n LEU 444 Ca 0.23 0.43 0.13 0.00 -0.03 0.00 0.00 56.01 56.78 1q3s n LEU 444 Cb 0.61 -0.43 0.51 0.00 -2.33 0.00 0.00 43.42 41.78 1q3s n LEU 444 CO 0.19 -0.48 0.88 0.29 -1.33 0.00 0.00 177.39 176.93 1q3s n LYS 445 N -1.60 0.10 0.32 3.23 5.02 0.27 -3.48 118.16 122.01 1q3s n LYS 445 Ca -0.00 0.07 0.19 0.00 -2.02 0.00 0.00 58.31 56.55 1q3s n LYS 445 Cb 0.18 -1.61 1.06 0.00 -0.02 0.00 0.00 35.03 34.65 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 0.00 0.28 0.33 -0.18 -0.00 -1.51 0.96 117.51 117.40 1q3s h ILE 446 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 64.86 64.84 1q3s h ILE 446 Cb 0.59 1.00 0.00 0.00 -0.00 0.00 0.00 36.82 38.41 1q3s h ILE 446 CO 0.00 0.00 -0.16 0.40 -0.00 0.00 0.00 178.15 178.39 1q3s h ILE 447 N 0.00 0.00 -0.90 0.16 1.08 -1.81 1.93 117.51 117.97 1q3s h ILE 447 Ca 0.00 -0.27 0.11 0.00 -0.39 0.00 0.00 64.86 64.31 1q3s h ILE 447 Cb 0.01 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.68 1q3s h ILE 447 CO -0.00 0.00 0.53 -0.65 -0.69 0.00 0.00 178.15 177.34 1q3s h PRO 448 N -0.72 0.83 0.11 2.37 0.11 -1.72 0.03 132.00 133.00 1q3s h PRO 448 Ca -0.05 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 1q3s h PRO 448 Cb 0.34 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 1q3s h PRO 448 CO 0.08 0.55 -0.14 0.87 -0.21 0.00 0.00 178.00 179.15 1q3s h LYS 449 N 0.85 -0.24 0.00 1.05 1.57 -0.76 -1.78 116.57 117.26 1q3s h LYS 449 Ca 0.44 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1q3s h LYS 449 Cb 0.44 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1q3s h LYS 449 CO -0.27 -0.16 0.00 0.25 -0.57 0.00 0.00 179.45 178.70 1q3s n THR 450 N -3.15 0.88 -0.04 -0.16 -2.24 0.65 -1.35 114.28 108.87 1q3s n THR 450 Ca -0.03 0.22 -0.14 0.00 -2.27 0.00 0.00 64.05 61.83 1q3s n THR 450 Cb 0.12 -0.97 -0.12 0.00 -2.10 0.00 0.00 70.33 67.26 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 -0.69 3.22 3.38 -0.64 -2.30 115.31 118.34 1q3s h LEU 451 Ca 0.00 -0.82 -0.14 0.00 0.09 0.00 0.00 57.88 57.01 1q3s h LEU 451 Cb 0.21 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1q3s h LEU 451 CO 0.00 0.88 -0.57 0.00 0.09 0.00 0.00 178.44 178.84 1q3s h ALA 452 N 0.19 0.88 -0.14 1.53 0.00 -1.05 -2.97 119.26 117.69 1q3s h ALA 452 Ca -0.01 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 1q3s h ALA 452 Cb 0.89 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1q3s h ALA 452 CO 0.02 0.70 0.05 1.49 0.00 0.00 0.00 179.25 181.50 1q3s h GLU 453 N 0.21 0.21 0.00 0.00 4.81 -1.28 0.10 114.58 118.63 1q3s h GLU 453 Ca -0.00 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1q3s h GLU 453 Cb 1.06 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 1q3s h GLU 453 CO 0.09 0.33 -0.20 -0.91 -0.73 0.00 0.00 179.01 177.60 1q3s h ASN 454 N 0.05 0.00 0.67 1.04 2.35 -1.44 -1.95 115.58 116.30 1q3s h ASN 454 Ca 0.05 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.64 1q3s h ASN 454 Cb 0.21 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1q3s h ASN 454 CO -0.00 0.20 -0.72 0.00 -1.65 0.00 0.00 177.43 175.26 1q3s h ALA 455 N 1.80 0.80 0.00 -0.83 0.00 -1.29 -3.43 119.26 116.31 1q3s h ALA 455 Ca -0.00 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1q3s h ALA 455 Cb 0.44 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1q3s h ALA 455 CO 0.03 0.88 0.00 0.41 0.00 0.00 0.00 179.25 180.56 1q3s n GLY 456 N 0.52 1.17 3.93 0.00 0.00 -0.47 -5.10 105.19 105.25 1q3s n GLY 456 Ca -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 1q3s n GLY 456 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1q3s s LEU 457 N 0.00 2.76 -0.86 0.99 1.43 -0.10 -4.97 118.68 117.93 1q3s s LEU 457 Ca 0.00 0.39 -0.25 0.00 -1.03 0.00 0.00 54.13 53.24 1q3s s LEU 457 Cb 0.00 -2.88 0.02 0.00 0.03 0.00 0.00 46.19 43.37 1q3s s LEU 457 CO 0.00 -1.88 1.50 -0.62 0.23 0.00 0.00 176.35 175.58 1q3s s ASP 458 N -4.62 6.07 0.09 2.29 3.68 -1.26 -4.58 116.67 118.35 1q3s s ASP 458 Ca 0.64 -0.80 -0.19 0.00 2.13 0.00 0.00 52.55 54.33 1q3s s ASP 458 Cb -0.09 -2.56 -0.05 0.00 -1.45 0.00 0.00 42.92 38.77 1q3s s ASP 458 CO 0.47 -1.88 1.32 0.74 0.13 0.00 0.00 175.17 175.95 1q3s h THR 459 N 6.59 0.00 -0.04 1.71 2.02 -1.91 0.90 112.91 122.18 1q3s h THR 459 Ca -0.03 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.18 1q3s h THR 459 Cb 1.04 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.40 1q3s h THR 459 CO 1.33 0.00 -0.34 0.58 0.37 0.00 0.00 175.52 177.46 1q3s h VAL 460 N -0.08 0.27 -0.44 3.16 2.07 -1.97 -0.64 116.25 118.62 1q3s h VAL 460 Ca 0.08 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.49 1q3s h VAL 460 Cb 0.28 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1q3s h VAL 460 CO -0.49 0.00 -0.13 -0.08 0.02 0.00 0.00 177.57 176.88 1q3s h GLU 461 N -0.47 0.87 -0.26 1.57 4.81 -1.97 -3.19 114.58 115.94 1q3s h GLU 461 Ca 0.07 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1q3s h GLU 461 Cb 0.57 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 1q3s h GLU 461 CO -0.30 0.99 0.17 1.98 -0.73 0.00 0.00 179.01 181.11 1q3s h MET 462 N 0.70 0.35 0.00 1.92 4.05 -0.70 -1.88 114.93 119.37 1q3s h MET 462 Ca 0.11 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.50 1q3s h MET 462 Cb 0.68 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.41 1q3s h MET 462 CO 0.05 0.24 0.00 -0.11 0.23 0.00 0.00 176.91 177.32 1q3s n LEU 463 N -4.90 0.00 -0.10 3.39 7.94 -0.26 -1.89 117.00 121.20 1q3s n LEU 463 Ca -0.02 0.45 -0.13 0.00 -1.11 0.00 0.00 56.01 55.20 1q3s n LEU 463 Cb 0.03 -0.45 -0.14 0.00 0.53 0.00 0.00 43.42 43.39 1q3s n LEU 463 CO 0.34 -0.35 -1.14 0.52 -1.11 0.00 0.00 177.39 175.65 1q3s n VAL 464 N -1.45 1.47 -0.11 1.96 0.31 -0.76 -3.47 118.33 116.28 1q3s n VAL 464 Ca 0.02 -0.75 -0.12 0.00 -0.01 0.00 0.00 64.34 63.48 1q3s n VAL 464 Cb 0.07 -0.90 -0.03 0.00 -0.91 0.00 0.00 33.84 32.07 1q3s n VAL 464 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1q3s h LYS 465 N 0.00 0.73 -0.41 5.55 1.57 -0.87 -2.40 116.57 120.75 1q3s h LYS 465 Ca -0.53 -0.34 -0.10 0.00 -1.87 0.00 0.00 60.65 57.81 1q3s h LYS 465 Cb 2.10 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 34.39 1q3s h LYS 465 CO -0.00 0.95 -0.17 0.28 -0.57 0.00 0.00 179.45 179.95 1q3s h VAL 466 N 0.50 1.26 0.00 0.50 2.07 -1.56 -0.38 116.25 118.64 1q3s h VAL 466 Ca 0.07 -1.25 -0.11 0.00 0.82 0.00 0.00 66.70 66.23 1q3s h VAL 466 Cb 0.76 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1q3s h VAL 466 CO 0.06 0.42 -0.51 0.40 0.02 0.00 0.00 177.57 177.96 1q3s h ILE 467 N 0.68 1.11 0.49 4.57 2.04 -1.58 -2.20 117.51 122.63 1q3s h ILE 467 Ca 0.11 -1.94 -0.02 0.00 1.00 0.00 0.00 64.86 64.00 1q3s h ILE 467 Cb 0.66 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 1q3s h ILE 467 CO 0.05 0.50 -0.24 -1.28 0.00 0.00 0.00 178.15 177.19 1q3s h SER 468 N 0.00 -0.56 -0.53 1.72 0.87 -1.06 -1.83 113.55 112.16 1q3s h SER 468 Ca -0.01 0.02 0.10 0.00 -1.23 0.00 0.00 61.79 60.67 1q3s h SER 468 Cb 1.09 0.14 -0.11 0.00 -0.44 0.00 0.00 62.40 63.08 1q3s h SER 468 CO 0.07 -0.21 -0.29 -0.33 -0.53 0.00 0.00 176.83 175.54 1q3s h GLU 469 N -1.05 -0.15 -0.79 2.24 4.39 -1.13 0.63 114.58 118.73 1q3s h GLU 469 Ca -0.07 0.01 0.11 0.00 0.34 0.00 0.00 59.36 59.75 1q3s h GLU 469 Cb 0.51 0.03 -0.08 0.00 -0.10 0.00 0.00 28.75 29.11 1q3s h GLU 469 CO 0.11 -0.10 0.41 1.25 -1.16 0.00 0.00 179.01 179.52 1q3s h HIS 470 N -0.16 0.74 0.00 4.33 2.76 -1.47 0.87 115.15 122.22 1q3s h HIS 470 Ca 0.23 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.40 1q3s h HIS 470 Cb 0.52 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 29.27 1q3s h HIS 470 CO -0.57 0.25 -0.11 0.87 -1.30 0.00 0.00 177.93 177.06 1q3s h LYS 471 N 0.66 0.00 0.00 5.26 1.57 -0.04 -2.74 116.57 121.28 1q3s h LYS 471 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 1q3s h LYS 471 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1q3s h LYS 471 CO -0.29 0.11 0.00 0.09 -0.57 0.00 0.00 179.45 178.79 1q3s n ASN 472 N -3.69 0.00 -0.36 0.86 3.02 0.14 -4.75 115.26 110.48 1q3s n ASN 472 Ca -0.02 0.02 0.03 0.00 -0.03 0.00 0.00 54.58 54.57 1q3s n ASN 472 Cb 0.23 -0.10 0.18 0.00 -0.61 0.00 0.00 39.78 39.48 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 1.13 0.00 3.52 3.08 0.34 -3.49 114.38 118.96 1q3s h ARG 473 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1q3s h ARG 473 Cb 0.00 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.79 1q3s h ARG 473 CO 0.00 0.75 0.00 0.41 -1.07 0.00 0.00 179.97 180.06 1q3s n GLY 474 N -1.37 0.79 0.54 0.04 0.00 -1.03 -4.87 105.19 99.28 1q3s n GLY 474 Ca 0.15 -2.14 0.36 0.00 0.00 0.00 0.00 46.02 44.39 1q3s n GLY 474 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1q3s h LEU 475 N 0.00 0.06 -0.05 0.99 5.85 -1.95 -1.13 115.31 119.08 1q3s h LEU 475 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1q3s h LEU 475 Cb 0.00 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1q3s h LEU 475 CO 0.00 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.71 1q3s n GLY 476 N -1.74 -1.25 3.66 3.75 0.00 -1.26 -4.72 105.19 103.62 1q3s n GLY 476 Ca 0.29 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.03 4.18 0.05 -0.61 -1.09 -0.43 0.25 121.20 120.52 1q3s s ILE 477 Ca 0.10 1.42 -0.00 0.00 -2.23 0.00 0.00 60.65 59.93 1q3s s ILE 477 Cb 0.13 -3.95 0.00 0.00 -1.58 0.00 0.00 42.46 37.06 1q3s s ILE 477 CO 0.39 -0.16 0.06 0.61 -1.23 0.00 0.00 174.94 174.61 1q3s n GLY 478 N 3.75 2.99 3.86 6.18 0.00 -0.26 -4.37 105.19 117.35 1q3s n GLY 478 Ca 0.14 -1.40 -0.36 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.49 5.17 -0.36 -0.61 1.01 0.54 -0.79 121.20 123.68 1q3s s ILE 479 Ca 0.04 0.45 0.03 0.00 0.00 0.00 0.00 60.65 61.17 1q3s s ILE 479 Cb -0.00 -3.62 0.11 0.00 0.01 0.00 0.00 42.46 38.96 1q3s s ILE 479 CO 0.03 0.42 0.10 -0.62 0.00 0.00 0.00 174.94 174.86 1q3s s ASP 480 N -1.49 4.48 0.34 3.58 3.68 -1.16 -4.15 116.67 121.95 1q3s s ASP 480 Ca 0.27 -2.18 0.15 0.00 2.13 0.00 0.00 52.55 52.92 1q3s s ASP 480 Cb -0.14 -1.42 0.84 0.00 -1.45 0.00 0.00 42.92 40.74 1q3s s ASP 480 CO 0.15 -0.36 1.39 -0.37 0.13 0.00 0.00 175.17 176.11 1q3s h VAL 481 N 6.36 0.00 0.00 1.11 -1.51 -1.91 0.66 116.25 120.96 1q3s h VAL 481 Ca -0.06 0.00 -0.18 0.00 -1.23 0.00 0.00 66.70 65.23 1q3s h VAL 481 Cb 1.00 0.34 -0.03 0.00 -2.13 0.00 0.00 31.29 30.47 1q3s h VAL 481 CO 0.53 0.00 -1.50 0.49 -1.23 0.00 0.00 177.57 175.85 1q3s n PHE 482 N -2.13 0.89 0.31 5.19 3.72 -1.26 -4.04 117.46 120.13 1q3s n PHE 482 Ca -0.01 0.30 0.11 0.00 -0.05 0.00 0.00 57.45 57.80 1q3s n PHE 482 Cb 0.27 -1.06 -0.02 0.00 -0.94 0.00 0.00 39.48 37.73 1q3s n PHE 482 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1q3s n GLU 483 N -2.86 0.46 -0.97 -1.08 4.07 0.20 -4.95 120.64 115.53 1q3s n GLU 483 Ca -0.11 -0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.99 1q3s n GLU 483 Cb 0.85 -1.65 0.00 0.00 -0.06 0.00 0.00 31.44 30.58 1q3s n GLU 483 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1q3s n GLY 484 N 1.29 0.09 3.36 8.31 0.00 0.36 -4.92 105.19 113.69 1q3s n GLY 484 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.59 1.26 0.78 1.61 -2.85 -1.25 -5.00 119.74 112.71 1q3s s LYS 485 Ca 0.00 -1.33 -0.13 0.00 -1.00 0.00 0.00 55.97 53.51 1q3s s LYS 485 Cb 0.00 0.37 0.07 0.00 -2.06 0.00 0.00 37.83 36.21 1q3s s LYS 485 CO 0.00 -0.47 1.15 -2.14 0.10 0.00 0.00 175.35 173.99 1q3s s PRO 486 N -4.04 1.93 0.20 1.78 0.02 -1.26 -2.99 135.00 130.65 1q3s s PRO 486 Ca 0.25 1.52 -0.20 0.00 0.02 0.00 0.00 61.00 62.59 1q3s s PRO 486 Cb 0.03 -1.83 0.04 0.00 0.02 0.00 0.00 34.50 32.76 1q3s s PRO 486 CO 0.06 -1.94 0.60 0.00 -0.33 0.00 0.00 177.00 175.39 1q3s s ALA 487 N -2.42 -1.25 -0.63 -1.55 0.00 0.03 -4.87 121.76 111.06 1q3s s ALA 487 Ca 0.68 0.01 -0.22 0.00 0.00 0.00 0.00 51.96 52.44 1q3s s ALA 487 Cb -0.23 0.86 0.08 0.00 0.00 0.00 0.00 23.12 23.83 1q3s s ALA 487 CO 0.51 -0.85 0.88 0.34 0.00 0.00 0.00 175.76 176.63 1q3s s ASP 488 N -2.84 6.18 0.56 0.00 -1.08 -1.26 -1.11 116.67 117.13 1q3s s ASP 488 Ca 0.07 -1.08 0.27 0.00 -0.52 0.00 0.00 52.55 51.28 1q3s s ASP 488 Cb -0.02 -2.38 1.50 0.00 -1.46 0.00 0.00 42.92 40.55 1q3s s ASP 488 CO -0.04 -1.33 2.02 0.24 0.52 0.00 0.00 175.17 176.58 1q3s h MET 489 N 9.44 0.00 -0.02 4.34 2.86 -0.52 -2.05 114.93 128.98 1q3s h MET 489 Ca -0.29 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.33 1q3s h MET 489 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 1q3s h MET 489 CO 1.15 0.00 -0.06 -0.07 1.06 0.00 0.00 176.91 178.99 1q3s h LEU 490 N 0.00 0.09 -1.81 1.22 4.07 -1.83 -1.30 115.31 115.75 1q3s h LEU 490 Ca 0.17 -0.59 0.00 0.00 0.08 0.00 0.00 57.88 57.54 1q3s h LEU 490 Cb 0.82 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.53 1q3s h LEU 490 CO -0.00 0.67 0.00 -0.33 -1.08 0.00 0.00 178.44 177.70 1q3s h GLU 491 N -0.48 0.00 0.00 1.13 5.08 -1.76 -1.97 114.58 116.58 1q3s h GLU 491 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 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 0.01 0.00 -1.10 1.63 -1.00 0.00 0.00 179.01 178.55 1q3s n LYS 492 N -2.54 0.17 -0.96 2.33 4.76 -0.96 -4.98 118.16 115.99 1q3s n LYS 492 Ca -0.01 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1q3s n LYS 492 Cb 0.08 -1.53 0.00 0.00 -1.84 0.00 0.00 35.03 31.74 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 1.43 0.86 3.50 0.72 0.00 -0.54 -4.97 105.19 106.20 1q3s n GLY 493 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.53 4.22 0.21 -0.61 1.01 -0.91 -4.69 121.20 116.90 1q3s s ILE 494 Ca 0.00 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 59.97 1q3s s ILE 494 Cb 0.00 -4.86 -0.05 0.00 0.01 0.00 0.00 42.46 37.56 1q3s s ILE 494 CO 0.00 -1.69 0.03 0.27 0.00 0.00 0.00 174.94 173.55 1q3s s ILE 495 N 4.22 0.73 0.07 2.92 -4.36 -1.26 -1.19 121.20 122.33 1q3s s ILE 495 Ca 0.35 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.73 1q3s s ILE 495 Cb -0.07 -2.30 -0.04 0.00 1.25 0.00 0.00 42.46 41.30 1q3s s ILE 495 CO -0.01 -0.32 -0.02 -1.83 0.24 0.00 0.00 174.94 173.01 1q3s s GLU 496 N -3.93 0.70 0.17 0.37 -1.05 0.46 -4.44 118.70 110.97 1q3s s GLU 496 Ca 0.29 -1.28 -0.32 0.00 -0.15 0.00 0.00 54.97 53.51 1q3s s GLU 496 Cb 0.06 0.17 -0.12 0.00 -0.44 0.00 0.00 34.13 33.80 1q3s s GLU 496 CO 0.08 -0.13 1.74 -2.30 0.95 0.00 0.00 175.26 175.60 1q3s n PRO 497 N 0.05 2.68 0.18 -4.83 -0.02 -1.26 -0.80 135.00 131.00 1q3s n PRO 497 Ca -0.12 0.97 0.18 0.00 -2.02 0.00 0.00 63.50 62.51 1q3s n PRO 497 Cb 0.62 -2.82 0.81 0.00 -0.02 0.00 0.00 33.50 32.08 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 7.26 0.00 -0.21 2.45 7.12 -1.65 -0.02 115.31 130.26 1q3s h LEU 498 Ca -0.44 0.00 -0.10 0.00 0.13 0.00 0.00 57.88 57.46 1q3s h LEU 498 Cb 1.22 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 41.34 1q3s h LEU 498 CO 0.94 0.00 -0.27 -0.09 -0.13 0.00 0.00 178.44 178.90 1q3s h ARG 499 N 0.00 0.56 -0.47 1.25 2.43 -1.89 -2.82 114.38 113.43 1q3s h ARG 499 Ca 0.12 -0.32 0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1q3s h ARG 499 Cb 0.73 0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 30.23 1q3s h ARG 499 CO -0.00 0.91 -0.01 0.28 -1.51 0.00 0.00 179.97 179.64 1q3s h VAL 500 N 0.25 0.62 0.04 0.20 2.07 -1.32 0.16 116.25 118.26 1q3s h VAL 500 Ca 0.03 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1q3s h VAL 500 Cb 0.84 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1q3s h VAL 500 CO 0.06 0.02 -0.02 0.11 0.02 0.00 0.00 177.57 177.76 1q3s h LYS 501 N 0.10 -0.06 -0.80 1.57 1.79 -1.60 -1.09 116.57 116.48 1q3s h LYS 501 Ca 0.24 0.00 0.15 0.00 -2.18 0.00 0.00 60.65 58.86 1q3s h LYS 501 Cb 0.35 0.01 -0.10 0.00 -1.58 0.00 0.00 32.23 30.92 1q3s h LYS 501 CO -0.41 0.19 0.37 0.87 -1.08 0.00 0.00 179.45 179.39 1q3s h LYS 502 N -0.29 0.51 -0.01 3.15 1.57 -1.19 -1.14 116.57 119.17 1q3s h LYS 502 Ca -0.01 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.61 1q3s h LYS 502 Cb 0.27 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 1q3s h LYS 502 CO 0.01 0.34 -0.62 0.37 -0.57 0.00 0.00 179.45 178.98 1q3s h GLN 503 N 0.52 0.05 0.69 3.15 5.75 -0.54 -2.03 115.11 122.70 1q3s h GLN 503 Ca 0.44 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.87 1q3s h GLN 503 Cb 0.66 0.01 0.01 0.00 1.07 0.00 0.00 27.48 29.22 1q3s h GLN 503 CO -0.39 0.65 -0.33 0.00 -2.65 0.00 0.00 178.83 176.11 1q3s h ALA 504 N 1.34 -0.92 0.16 3.38 0.00 0.03 0.87 119.26 124.13 1q3s h ALA 504 Ca -0.01 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.70 1q3s h ALA 504 Cb 1.10 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 1q3s h ALA 504 CO 0.08 -0.93 -0.44 0.82 0.00 0.00 0.00 179.25 178.78 1q3s h ILE 505 N -1.10 0.12 -0.67 0.00 1.08 -1.43 0.12 117.51 115.63 1q3s h ILE 505 Ca -0.09 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.44 1q3s h ILE 505 Cb 0.74 0.12 -0.09 0.00 -3.07 0.00 0.00 36.82 34.52 1q3s h ILE 505 CO 0.15 0.00 -0.51 0.50 -0.69 0.00 0.00 178.15 177.60 1q3s h LYS 506 N -0.70 -0.14 0.41 2.37 3.64 -1.35 -0.58 116.57 120.22 1q3s h LYS 506 Ca 0.01 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1q3s h LYS 506 Cb 0.71 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 1q3s h LYS 506 CO -0.23 -0.09 -0.48 0.77 -2.27 0.00 0.00 179.45 177.15 1q3s h SER 507 N -0.14 -1.34 0.31 4.20 0.02 -0.30 -2.52 113.55 113.77 1q3s h SER 507 Ca 0.11 0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1q3s h SER 507 Cb 0.43 0.45 -0.02 0.00 0.14 0.00 0.00 62.40 63.40 1q3s h SER 507 CO -0.71 -0.62 -0.28 0.00 -1.14 0.00 0.00 176.83 174.08 1q3s h ALA 508 N -0.69 -0.61 -0.86 3.77 0.00 -0.52 -1.31 119.26 119.04 1q3s h ALA 508 Ca -0.04 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.86 1q3s h ALA 508 Cb 0.82 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 1q3s h ALA 508 CO -0.10 -0.87 0.56 0.66 0.00 0.00 0.00 179.25 179.49 1q3s h SER 509 N -0.61 0.77 -0.25 0.00 4.64 -1.17 0.17 113.55 117.11 1q3s h SER 509 Ca -0.02 0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.22 1q3s h SER 509 Cb 0.55 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1q3s h SER 509 CO -0.04 0.46 -0.26 -0.33 -0.87 0.00 0.00 176.83 175.79 1q3s h GLU 510 N 0.86 0.61 -0.30 4.77 5.08 -1.28 0.53 114.58 124.85 1q3s h GLU 510 Ca 0.39 -0.33 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1q3s h GLU 510 Cb 0.38 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1q3s h GLU 510 CO -0.16 0.93 0.17 0.00 -1.00 0.00 0.00 179.01 178.95 1q3s h ALA 511 N 0.67 0.38 0.79 3.43 0.00 -0.43 0.57 119.26 124.67 1q3s h ALA 511 Ca 0.04 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1q3s h ALA 511 Cb 0.83 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1q3s h ALA 511 CO 0.06 -0.20 -0.44 0.00 0.00 0.00 0.00 179.25 178.68 1q3s h ALA 512 N 1.14 -1.16 -0.92 0.00 0.00 -0.59 -2.20 119.26 115.54 1q3s h ALA 512 Ca 0.12 -0.24 0.16 0.00 0.00 0.00 0.00 54.91 54.95 1q3s h ALA 512 Cb 0.01 0.51 -0.08 0.00 0.00 0.00 0.00 17.79 18.24 1q3s h ALA 512 CO -0.06 -1.16 0.59 0.82 0.00 0.00 0.00 179.25 179.43 1q3s h ILE 513 N -1.13 0.79 -0.46 0.00 2.04 -0.78 0.56 117.51 118.52 1q3s h ILE 513 Ca -0.10 -0.23 0.01 0.00 1.00 0.00 0.00 64.86 65.54 1q3s h ILE 513 Cb 0.89 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1q3s h ILE 513 CO 0.14 0.12 0.30 -0.03 0.00 0.00 0.00 178.15 178.68 1q3s h MET 514 N 0.66 0.59 -0.13 2.37 4.05 -0.47 -2.14 114.93 119.85 1q3s h MET 514 Ca 0.47 -0.04 -0.11 0.00 -0.28 0.00 0.00 59.70 59.74 1q3s h MET 514 Cb 0.82 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.49 1q3s h MET 514 CO -0.23 0.39 -0.36 0.82 0.23 0.00 0.00 176.91 177.76 1q3s h ILE 515 N 0.61 1.37 0.00 1.77 2.04 -0.65 -2.91 117.51 119.73 1q3s h ILE 515 Ca 0.17 -1.65 0.00 0.00 1.00 0.00 0.00 64.86 64.38 1q3s h ILE 515 Cb -0.05 2.07 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 1q3s h ILE 515 CO -0.05 0.49 0.19 -0.07 0.00 0.00 0.00 178.15 178.71 1q3s h LEU 516 N 0.09 0.00 0.00 1.44 3.38 -0.73 0.95 115.31 120.44 1q3s h LEU 516 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1q3s h LEU 516 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1q3s h LEU 516 CO 0.08 0.00 -1.13 0.54 0.09 0.00 0.00 178.44 178.02 1q3s n ARG 517 N -2.40 0.32 -2.90 1.13 1.74 -0.82 -4.86 116.66 108.86 1q3s n ARG 517 Ca -0.02 -0.02 -0.42 0.00 -0.77 0.00 0.00 57.85 56.62 1q3s n ARG 517 Cb 0.22 -1.59 -0.05 0.00 -1.02 0.00 0.00 32.46 30.03 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 -3.22 4.68 -1.14 0.55 1.01 0.33 -4.88 121.20 118.52 1q3s s ILE 518 Ca 0.03 0.98 0.13 0.00 0.00 0.00 0.00 60.65 61.79 1q3s s ILE 518 Cb 0.14 -4.26 0.37 0.00 0.01 0.00 0.00 42.46 38.72 1q3s s ILE 518 CO 0.82 -0.48 1.30 -0.90 0.00 0.00 0.00 174.94 175.68 1q3s n ASP 519 N 6.56 3.11 -3.64 3.58 5.75 -1.26 -4.29 116.55 126.36 1q3s n ASP 519 Ca 0.04 -1.99 -0.09 0.00 -0.01 0.00 0.00 54.79 52.75 1q3s n ASP 519 Cb 0.48 -0.28 -0.07 0.00 -1.03 0.00 0.00 41.12 40.23 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 -1.00 -0.78 -0.09 -1.12 2.15 -1.26 -1.64 116.67 112.93 1q3s s ASP 520 Ca 0.28 1.34 0.02 0.00 0.43 0.00 0.00 52.55 54.62 1q3s s ASP 520 Cb 0.15 1.34 0.02 0.00 -0.30 0.00 0.00 42.92 44.12 1q3s s ASP 520 CO 0.19 -0.22 -0.12 -0.69 -0.17 0.00 0.00 175.17 174.16 1q3s s VAL 521 N 1.07 1.24 -0.22 1.11 1.01 -0.82 -4.98 120.40 118.81 1q3s s VAL 521 Ca -0.05 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1q3s s VAL 521 Cb -0.05 -1.15 0.06 0.00 0.00 0.00 0.00 36.38 35.24 1q3s s VAL 521 CO -0.12 0.39 -0.05 -0.63 0.00 0.00 0.00 175.10 174.69 1q3s s ILE 522 N 0.96 1.43 0.10 2.22 1.01 -1.26 -2.42 121.20 123.24 1q3s s ILE 522 Ca -0.08 -1.10 0.08 0.00 0.00 0.00 0.00 60.65 59.56 1q3s s ILE 522 Cb -0.15 -1.68 -0.03 0.00 0.01 0.00 0.00 42.46 40.60 1q3s s ILE 522 CO -0.00 -0.06 -0.22 0.00 0.00 0.00 0.00 174.94 174.66 1q3s s ALA 523 N 1.45 1.88 -0.17 9.38 0.00 -0.92 -5.04 121.76 128.34 1q3s s ALA 523 Ca -0.04 -1.26 0.14 0.00 0.00 0.00 0.00 51.96 50.79 1q3s s ALA 523 Cb -0.18 -0.27 -0.20 0.00 0.00 0.00 0.00 23.12 22.46 1q3s s ALA 523 CO -0.07 0.39 0.03 0.00 0.00 0.00 0.00 175.76 176.11 1q3s n ALA 524 N 1.13 1.57 -2.98 0.00 0.00 -1.26 -2.06 120.51 116.92 1q3s n ALA 524 Ca -0.19 -1.10 -0.01 0.00 0.00 0.00 0.00 53.44 52.14 1q3s n ALA 524 Cb 0.53 -0.10 0.00 0.00 0.00 0.00 0.00 19.45 19.89 1q3s n ALA 524 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1q3s s LYS 525 N -2.41 0.75 0.00 0.00 -0.14 -1.26 -4.45 119.74 112.23 1q3s s LYS 525 Ca -0.11 -0.45 0.00 0.00 -1.36 0.00 0.00 55.97 54.05 1q3s s LYS 525 Cb 0.05 0.04 0.00 0.00 -1.68 0.00 0.00 37.83 36.24 1q3s s LYS 525 CO 0.68 -1.02 0.00 0.00 -0.76 0.00 0.00 175.35 174.25