#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dpy h VAL 18 N 0.00 0.00 0.00 -1.45 3.04 -2.12 -3.20 116.25 112.52 3dpy h VAL 18 Ca 0.00 -0.54 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 3dpy h VAL 18 Cb 0.00 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 30.35 3dpy h VAL 18 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 177.57 173.89 3dpy n TRP 19 N -2.15 0.00 -2.59 3.17 4.27 -1.26 -4.86 117.44 114.02 3dpy n TRP 19 Ca 0.03 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.22 3dpy n TRP 19 Cb 0.45 -0.50 -0.03 0.00 -1.36 0.00 0.00 31.31 29.87 3dpy n TRP 19 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 3dpy s SER 20 N -3.00 7.25 -0.21 -0.67 0.15 -1.21 -5.03 113.70 110.97 3dpy s SER 20 Ca 0.13 1.81 -0.17 0.00 0.70 0.00 0.00 55.95 58.42 3dpy s SER 20 Cb 0.17 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.87 3dpy s SER 20 CO 0.48 -0.35 0.46 -0.70 1.20 0.00 0.00 173.24 174.33 3dpy s GLU 21 N 1.02 4.16 0.22 5.44 2.56 -1.26 -4.97 118.70 125.87 3dpy s GLU 21 Ca 0.55 0.29 0.25 0.00 0.00 0.00 0.00 54.97 56.06 3dpy s GLU 21 Cb -0.25 -3.57 0.88 0.00 2.00 0.00 0.00 34.13 33.19 3dpy s GLU 21 CO 0.29 -0.14 1.76 -0.35 -0.56 0.00 0.00 175.26 176.25 3dpy n PRO 22 N 4.80 0.23 -3.64 4.30 -0.04 -1.26 -4.73 135.00 134.66 3dpy n PRO 22 Ca -0.06 0.28 -0.37 0.00 -0.04 0.00 0.00 63.50 63.30 3dpy n PRO 22 Cb 0.51 -1.82 -0.10 0.00 -0.04 0.00 0.00 33.50 32.05 3dpy n PRO 22 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dpy s LEU 23 N -4.46 4.06 0.39 1.53 1.43 -1.26 -4.99 118.68 115.39 3dpy s LEU 23 Ca 0.09 0.05 0.07 0.00 -1.03 0.00 0.00 54.13 53.31 3dpy s LEU 23 Cb 0.11 -2.11 0.81 0.00 0.03 0.00 0.00 46.19 45.03 3dpy s LEU 23 CO 0.52 0.02 1.99 0.22 0.23 0.00 0.00 176.35 179.33 3dpy h TYR 24 N 7.89 0.45 0.00 0.29 3.20 -1.95 -2.16 116.97 124.68 3dpy h TYR 24 Ca -0.37 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.49 3dpy h TYR 24 Cb 1.18 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.31 3dpy h TYR 24 CO 0.71 0.37 0.00 0.43 -1.64 0.00 0.00 178.16 178.02 3dpy n SER 25 N -4.40 0.73 -0.00 -2.11 7.64 -1.26 -3.49 113.62 110.73 3dpy n SER 25 Ca 0.02 0.57 0.10 0.00 1.01 0.00 0.00 58.87 60.57 3dpy n SER 25 Cb 0.14 -0.77 -0.13 0.00 -1.01 0.00 0.00 64.21 62.45 3dpy n SER 25 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3dpy n LEU 26 N -2.19 0.75 -4.74 -3.43 4.77 -0.83 -4.93 117.00 106.41 3dpy n LEU 26 Ca 0.06 -0.38 -0.40 0.00 -0.03 0.00 0.00 56.01 55.26 3dpy n LEU 26 Cb 0.41 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.53 3dpy n LEU 26 CO 0.30 0.19 1.00 0.54 -1.33 0.00 0.00 177.39 178.08 3dpy n ARG 27 N -1.67 2.00 -0.20 3.23 1.74 -1.14 -4.91 116.66 115.71 3dpy n ARG 27 Ca 0.02 0.72 -0.00 0.00 -0.77 0.00 0.00 57.85 57.82 3dpy n ARG 27 Cb 0.38 -2.56 0.11 0.00 -1.02 0.00 0.00 32.46 29.37 3dpy n ARG 27 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3dpy h PRO 28 N 1.96 0.40 -0.90 5.56 0.11 -1.94 -2.01 132.00 135.19 3dpy h PRO 28 Ca -0.50 -0.02 0.13 0.00 0.11 0.00 0.00 66.00 65.71 3dpy h PRO 28 Cb 1.29 -0.09 -0.07 0.00 0.11 0.00 0.00 31.00 32.23 3dpy h PRO 28 CO 0.59 0.27 0.58 0.93 -0.21 0.00 0.00 178.00 180.16 3dpy h GLU 29 N 0.42 0.75 -0.24 1.05 3.07 -1.96 -1.69 114.58 115.97 3dpy h GLU 29 Ca 0.30 -0.05 0.07 0.00 -0.50 0.00 0.00 59.36 59.19 3dpy h GLU 29 Cb 0.37 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.10 3dpy h GLU 29 CO -0.30 0.50 0.48 1.25 -1.40 0.00 0.00 179.01 179.54 3dpy h HIS 30 N 0.77 0.00 0.00 4.33 2.76 -1.65 0.58 115.15 121.94 3dpy h HIS 30 Ca 0.44 0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.57 3dpy h HIS 30 Cb 0.62 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.57 3dpy h HIS 30 CO -0.00 0.00 -0.21 0.00 -1.30 0.00 0.00 177.93 176.42 3dpy h ALA 31 N 1.26 1.34 0.00 5.26 0.00 -1.44 -1.95 119.26 123.74 3dpy h ALA 31 Ca 0.11 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3dpy h ALA 31 Cb 1.08 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3dpy h ALA 31 CO -0.00 0.26 0.00 0.54 0.00 0.00 0.00 179.25 180.05 3dpy n ARG 32 N -3.84 0.08 -0.05 0.00 1.74 0.20 -2.99 116.66 111.80 3dpy n ARG 32 Ca -0.02 0.19 0.05 0.00 -0.77 0.00 0.00 57.85 57.30 3dpy n ARG 32 Cb 0.30 -1.61 0.23 0.00 -1.02 0.00 0.00 32.46 30.36 3dpy n ARG 32 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3dpy n GLU 33 N -1.75 1.28 -1.13 5.56 -0.58 -0.73 -4.87 120.64 118.41 3dpy n GLU 33 Ca 0.05 -0.42 -0.31 0.00 -0.42 0.00 0.00 57.16 56.05 3dpy n GLU 33 Cb 0.28 -1.19 0.11 0.00 -0.57 0.00 0.00 31.44 30.08 3dpy n GLU 33 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3dpy s ARG 34 N -1.87 1.89 0.26 3.49 1.81 -1.16 -4.01 118.95 119.36 3dpy s ARG 34 Ca 0.17 1.34 -0.30 0.00 -1.72 0.00 0.00 55.73 55.22 3dpy s ARG 34 Cb 0.08 -1.84 -0.11 0.00 -0.45 0.00 0.00 34.95 32.63 3dpy s ARG 34 CO 0.13 -1.94 1.60 -1.17 -0.68 0.00 0.00 175.30 173.23 3dpy s LEU 35 N -6.01 4.36 -0.38 2.53 2.96 -1.26 -4.99 118.68 115.88 3dpy s LEU 35 Ca 0.64 2.87 -0.10 0.00 -0.22 0.00 0.00 54.13 57.32 3dpy s LEU 35 Cb -0.20 -3.62 0.04 0.00 0.50 0.00 0.00 46.19 42.91 3dpy s LEU 35 CO 0.55 -0.89 0.21 -1.10 -1.32 0.00 0.00 176.35 173.80 3dpy s GLN 36 N -0.01 2.75 0.00 1.98 -0.21 -1.26 -4.95 119.66 117.95 3dpy s GLN 36 Ca 0.66 -1.19 0.24 0.00 0.02 0.00 0.00 55.36 55.08 3dpy s GLN 36 Cb -0.47 -3.73 1.00 0.00 1.00 0.00 0.00 33.01 30.82 3dpy s GLN 36 CO 0.43 -0.77 1.70 -0.40 -2.12 0.00 0.00 175.29 174.13 3dpy n ASP 37 N 4.97 1.23 -2.29 5.90 5.75 -1.26 -4.91 116.55 125.95 3dpy n ASP 37 Ca -0.11 -1.54 -0.13 0.00 -0.01 0.00 0.00 54.79 53.00 3dpy n ASP 37 Cb 0.45 -0.05 -0.01 0.00 -1.03 0.00 0.00 41.12 40.48 3dpy n ASP 37 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 3dpy n ASP 38 N 0.00 -4.01 0.00 -1.12 8.00 -1.26 -1.11 116.55 117.05 3dpy n ASP 38 Ca 0.17 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.87 3dpy n ASP 38 Cb 0.28 -3.44 0.00 0.00 -0.02 0.00 0.00 41.12 37.94 3dpy n ASP 38 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3dpy n SER 39 N -1.63 -4.60 -4.44 -2.24 7.64 -1.26 -4.94 113.62 102.15 3dpy n SER 39 Ca -0.15 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.32 3dpy n SER 39 Cb 0.59 -3.20 -0.11 0.00 -1.01 0.00 0.00 64.21 60.48 3dpy n SER 39 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3dpy s VAL 40 N -1.04 4.96 -0.21 0.44 1.01 -0.27 -5.08 120.40 120.21 3dpy s VAL 40 Ca 0.00 -0.60 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 3dpy s VAL 40 Cb 0.00 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 3dpy s VAL 40 CO 0.00 -0.17 0.14 -1.61 0.00 0.00 0.00 175.10 173.45 3dpy s GLU 41 N 1.64 4.14 0.34 2.72 2.02 -1.26 -4.87 118.70 123.42 3dpy s GLU 41 Ca 0.04 -0.24 0.03 0.00 0.02 0.00 0.00 54.97 54.83 3dpy s GLU 41 Cb -0.18 -3.45 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 3dpy s GLU 41 CO 0.09 0.22 0.13 0.95 0.02 0.00 0.00 175.26 176.67 3dpy s THR 42 N 0.58 0.55 0.38 3.63 -4.23 -1.26 -5.02 115.64 110.26 3dpy s THR 42 Ca 0.08 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.66 3dpy s THR 42 Cb -0.12 -2.51 0.30 0.00 1.34 0.00 0.00 72.50 71.51 3dpy s THR 42 CO 0.00 0.00 1.97 0.58 -0.54 0.00 0.00 174.62 176.63 3dpy h VAL 43 N 2.07 1.01 -0.41 2.29 2.07 -1.99 -1.70 116.25 119.59 3dpy h VAL 43 Ca -0.35 -0.23 -0.08 0.00 0.82 0.00 0.00 66.70 66.85 3dpy h VAL 43 Cb 1.26 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 3dpy h VAL 43 CO 0.56 0.12 -0.07 0.74 0.02 0.00 0.00 177.57 178.94 3dpy h THR 44 N 0.67 1.27 -0.23 2.57 2.02 -1.96 -2.34 112.91 114.91 3dpy h THR 44 Ca 0.29 -1.15 -0.18 0.00 0.77 0.00 0.00 66.41 66.13 3dpy h THR 44 Cb 0.28 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 3dpy h THR 44 CO -0.09 0.39 -0.58 0.77 0.37 0.00 0.00 175.52 176.38 3dpy h SER 45 N 0.59 0.82 -0.26 4.18 4.64 -1.80 -2.35 113.55 119.37 3dpy h SER 45 Ca 0.11 -0.45 -0.01 0.00 -0.47 0.00 0.00 61.79 60.96 3dpy h SER 45 Cb 0.59 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 3dpy h SER 45 CO 0.04 1.22 0.11 0.40 -0.87 0.00 0.00 176.83 177.72 3dpy h ILE 46 N 0.55 1.17 -0.19 0.95 2.04 -1.34 -0.36 117.51 120.34 3dpy h ILE 46 Ca 0.00 -0.52 -0.10 0.00 1.00 0.00 0.00 64.86 65.24 3dpy h ILE 46 Cb 1.17 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 3dpy h ILE 46 CO 0.12 0.17 -0.33 -0.33 0.00 0.00 0.00 178.15 177.78 3dpy h GLU 47 N 0.27 0.39 -0.01 2.37 4.39 -1.44 -1.62 114.58 118.92 3dpy h GLU 47 Ca 0.09 -0.16 -0.17 0.00 0.34 0.00 0.00 59.36 59.45 3dpy h GLU 47 Cb 0.18 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 3dpy h GLU 47 CO -0.01 0.67 -0.78 0.37 -1.16 0.00 0.00 179.01 178.11 3dpy h GLN 48 N 0.33 0.15 -0.28 2.33 5.75 -1.29 -2.93 115.11 119.17 3dpy h GLN 48 Ca 0.04 -0.14 -0.12 0.00 -0.15 0.00 0.00 58.65 58.28 3dpy h GLN 48 Cb 0.74 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.32 3dpy h GLN 48 CO 0.06 0.85 -0.33 0.00 -2.65 0.00 0.00 178.83 176.76 3dpy h ALA 49 N 1.11 0.91 -0.24 3.38 0.00 -0.73 -1.97 119.26 121.71 3dpy h ALA 49 Ca -0.02 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 3dpy h ALA 49 Cb 1.36 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3dpy h ALA 49 CO 0.11 0.62 0.10 0.87 0.00 0.00 0.00 179.25 180.96 3dpy h LYS 50 N 0.51 0.36 -0.28 0.00 1.57 -1.21 -1.51 116.57 116.00 3dpy h LYS 50 Ca 0.06 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 3dpy h LYS 50 Cb 0.82 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 3dpy h LYS 50 CO 0.07 0.40 0.10 0.28 -0.57 0.00 0.00 179.45 179.73 3dpy h VAL 51 N 0.24 1.19 -0.85 0.50 2.07 -1.49 -1.59 116.25 116.33 3dpy h VAL 51 Ca 0.08 -0.60 0.09 0.00 0.82 0.00 0.00 66.70 67.09 3dpy h VAL 51 Cb 0.17 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 3dpy h VAL 51 CO -0.01 0.20 0.55 -0.33 0.02 0.00 0.00 177.57 178.01 3dpy h GLU 52 N 0.30 0.80 -0.34 1.57 5.08 -1.27 0.31 114.58 121.03 3dpy h GLU 52 Ca 0.09 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 3dpy h GLU 52 Cb 0.22 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3dpy h GLU 52 CO -0.00 0.53 -0.22 1.49 -1.00 0.00 0.00 179.01 179.81 3dpy h GLU 53 N 0.83 0.75 -0.55 2.33 4.81 -0.98 -0.21 114.58 121.56 3dpy h GLU 53 Ca 0.39 -0.35 -0.06 0.00 -0.13 0.00 0.00 59.36 59.20 3dpy h GLU 53 Cb 0.41 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 3dpy h GLU 53 CO -0.16 0.97 0.08 -0.22 -0.73 0.00 0.00 179.01 178.96 3dpy h LYS 54 N 0.53 0.88 -0.10 1.92 1.63 -0.20 -2.32 116.57 118.90 3dpy h LYS 54 Ca 0.07 -0.21 -0.18 0.00 -0.85 0.00 0.00 60.65 59.48 3dpy h LYS 54 Cb 0.78 -0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 32.29 3dpy h LYS 54 CO 0.06 0.82 -0.70 0.82 -3.45 0.00 0.00 179.45 177.00 3dpy h ILE 55 N 0.83 1.36 -0.16 2.00 1.08 -0.34 -3.14 117.51 119.14 3dpy h ILE 55 Ca 0.17 -2.06 0.01 0.00 -0.39 0.00 0.00 64.86 62.59 3dpy h ILE 55 Cb 0.38 2.04 -0.01 0.00 -3.07 0.00 0.00 36.82 36.15 3dpy h ILE 55 CO 0.01 0.63 0.08 -0.61 -0.69 0.00 0.00 178.15 177.56 3dpy h GLN 56 N 0.33 0.16 -0.78 2.37 5.75 -0.74 -1.46 115.11 120.75 3dpy h GLN 56 Ca -0.03 -0.01 0.14 0.00 -0.15 0.00 0.00 58.65 58.61 3dpy h GLN 56 Cb 1.28 -0.04 -0.09 0.00 1.07 0.00 0.00 27.48 29.70 3dpy h GLN 56 CO 0.12 0.11 0.34 0.93 -2.65 0.00 0.00 178.83 177.68 3dpy h GLU 57 N 0.17 0.48 -0.58 1.69 5.08 -1.44 0.15 114.58 120.13 3dpy h GLU 57 Ca 0.06 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 3dpy h GLU 57 Cb 0.02 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 3dpy h GLU 57 CO -0.05 0.32 0.08 0.28 -1.00 0.00 0.00 179.01 178.64 3dpy h VAL 58 N 0.50 1.25 0.11 3.13 2.07 -1.40 -2.04 116.25 119.87 3dpy h VAL 58 Ca 0.43 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 3dpy h VAL 58 Cb 0.63 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 3dpy h VAL 58 CO -0.39 0.36 -0.05 -0.26 0.02 0.00 0.00 177.57 177.25 3dpy h PHE 59 N 0.88 -0.14 -0.21 1.57 0.05 -0.06 -3.20 116.94 115.83 3dpy h PHE 59 Ca 0.18 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.97 3dpy h PHE 59 Cb 0.40 0.05 0.00 0.00 2.00 0.00 0.00 35.95 38.40 3dpy h PHE 59 CO 0.03 0.29 0.00 -1.13 -0.18 0.00 0.00 178.31 177.32 3dpy n SER 60 N -4.94 2.11 0.26 2.17 3.41 -0.12 -3.98 113.62 112.53 3dpy n SER 60 Ca -0.09 -2.19 0.15 0.00 -0.26 0.00 0.00 58.87 56.48 3dpy n SER 60 Cb 0.25 -0.41 0.69 0.00 -0.26 0.00 0.00 64.21 64.48 3dpy n SER 60 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3dpy h SER 61 N 1.38 0.00 0.38 4.04 4.64 -1.36 -2.58 113.55 120.05 3dpy h SER 61 Ca 0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 3dpy h SER 61 Cb 0.74 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.86 3dpy h SER 61 CO 0.10 0.10 -1.44 1.88 -0.87 0.00 0.00 176.83 176.60 3dpy h TYR 62 N 0.00 0.80 -0.32 4.77 -1.99 -1.82 -2.44 116.97 115.97 3dpy h TYR 62 Ca -0.00 -0.58 -0.09 0.00 2.00 0.00 0.00 58.73 60.06 3dpy h TYR 62 Cb 0.48 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 39.17 3dpy h TYR 62 CO 0.00 1.48 -0.14 -0.22 -0.00 0.00 0.00 178.16 179.28 3dpy h LYS 63 N 0.12 0.66 -0.08 4.88 3.64 -1.79 -0.22 116.57 123.77 3dpy h LYS 63 Ca -0.23 -0.28 -0.01 0.00 -1.27 0.00 0.00 60.65 58.87 3dpy h LYS 63 Cb 2.10 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.90 3dpy h LYS 63 CO 0.24 0.87 0.03 0.74 -2.27 0.00 0.00 179.45 179.06 3dpy h PHE 64 N 0.42 0.13 0.00 1.91 0.05 -1.54 -2.58 116.94 115.33 3dpy h PHE 64 Ca 0.07 -0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.85 3dpy h PHE 64 Cb 0.66 -0.04 0.00 0.00 2.00 0.00 0.00 35.95 38.57 3dpy h PHE 64 CO 0.06 0.26 0.00 0.09 -0.18 0.00 0.00 178.31 178.54 3dpy n ASN 65 N -4.92 0.00 -3.15 2.17 3.02 -0.92 -4.92 115.26 106.54 3dpy n ASN 65 Ca -0.06 0.10 -0.15 0.00 -0.03 0.00 0.00 54.58 54.45 3dpy n ASN 65 Cb 0.12 -0.35 0.08 0.00 -0.61 0.00 0.00 39.78 39.01 3dpy n ASN 65 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3dpy n HIS 66 N -1.35 -2.01 -4.31 3.10 8.25 -0.22 -5.04 115.22 113.63 3dpy n HIS 66 Ca 0.10 0.83 -0.17 0.00 -0.26 0.00 0.00 57.72 58.22 3dpy n HIS 66 Cb 0.23 -4.60 -0.10 0.00 1.12 0.00 0.00 29.99 26.65 3dpy n HIS 66 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3dpy s LEU 67 N -5.74 2.54 -0.12 2.41 1.43 -0.48 -5.04 118.68 113.69 3dpy s LEU 67 Ca 0.09 -1.01 -0.28 0.00 -1.03 0.00 0.00 54.13 51.90 3dpy s LEU 67 Cb -0.01 -0.56 -0.02 0.00 0.03 0.00 0.00 46.19 45.63 3dpy s LEU 67 CO 0.66 -0.22 0.92 -0.69 0.23 0.00 0.00 176.35 177.24 3dpy s VAL 68 N -3.05 4.85 0.13 -1.59 1.01 -1.26 -4.60 120.40 115.88 3dpy s VAL 68 Ca 0.20 1.85 -0.31 0.00 0.00 0.00 0.00 61.98 63.72 3dpy s VAL 68 Cb 0.00 -4.23 -0.10 0.00 0.00 0.00 0.00 36.38 32.06 3dpy s VAL 68 CO 0.05 0.05 1.64 -2.84 0.00 0.00 0.00 175.10 173.99 3dpy s PRO 69 N 1.87 4.19 -0.02 2.72 0.02 -1.26 -5.02 135.00 137.50 3dpy s PRO 69 Ca 0.44 2.39 0.02 0.00 0.02 0.00 0.00 61.00 63.87 3dpy s PRO 69 Cb -0.18 -3.35 0.00 0.00 0.02 0.00 0.00 34.50 30.99 3dpy s PRO 69 CO 0.17 -0.69 -0.06 -0.98 -0.33 0.00 0.00 177.00 175.11 3dpy s ARG 70 N 1.85 0.66 -0.48 5.54 1.70 -1.26 -5.12 118.95 121.85 3dpy s ARG 70 Ca 0.73 -0.20 -0.13 0.00 -0.47 0.00 0.00 55.73 55.66 3dpy s ARG 70 Cb -0.43 -0.65 0.10 0.00 -0.57 0.00 0.00 34.95 33.39 3dpy s ARG 70 CO 0.32 0.07 0.39 -0.51 -1.08 0.00 0.00 175.30 174.49 3dpy s LEU 71 N 0.23 5.68 -0.18 -1.89 1.43 -1.26 -5.03 118.68 117.66 3dpy s LEU 71 Ca -0.03 -1.57 -0.03 0.00 -1.03 0.00 0.00 54.13 51.47 3dpy s LEU 71 Cb -0.07 -2.13 -0.02 0.00 0.03 0.00 0.00 46.19 44.01 3dpy s LEU 71 CO -0.00 -0.69 -0.05 -0.69 0.23 0.00 0.00 176.35 175.15 3dpy s VAL 72 N 1.55 3.56 -0.36 -1.59 1.01 -1.26 -2.34 120.40 120.97 3dpy s VAL 72 Ca 0.04 -0.45 -0.28 0.00 0.00 0.00 0.00 61.98 61.28 3dpy s VAL 72 Cb -0.26 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.56 3dpy s VAL 72 CO 0.04 0.46 1.04 -0.22 0.00 0.00 0.00 175.10 176.41 3dpy s LEU 73 N 0.89 3.90 -0.69 3.92 2.96 -1.26 -4.93 118.68 123.48 3dpy s LEU 73 Ca -0.01 0.82 -0.17 0.00 -0.22 0.00 0.00 54.13 54.55 3dpy s LEU 73 Cb -0.15 -3.45 -0.14 0.00 0.50 0.00 0.00 46.19 42.95 3dpy s LEU 73 CO 0.01 -0.93 1.89 0.00 -1.32 0.00 0.00 176.35 176.00 3dpy n GLN 74 N 6.99 1.42 -0.15 1.98 1.13 -1.26 -4.72 117.38 122.77 3dpy n GLN 74 Ca 0.10 -1.58 -0.03 0.00 -1.94 0.00 0.00 57.00 53.56 3dpy n GLN 74 Cb 0.48 -2.70 0.05 0.00 0.11 0.00 0.00 30.24 28.18 3dpy n GLN 74 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dpy h ARG 75 N 7.67 0.09 -0.29 -1.09 3.08 -1.96 -1.35 114.38 120.54 3dpy h ARG 75 Ca 0.40 -0.01 -0.16 0.00 0.07 0.00 0.00 59.98 60.28 3dpy h ARG 75 Cb 0.49 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 3dpy h ARG 75 CO 1.77 0.06 -0.46 1.49 -1.07 0.00 0.00 179.97 181.76 3dpy h GLU 76 N 0.10 0.83 -0.25 0.04 4.57 -1.99 -0.85 114.58 117.01 3dpy h GLU 76 Ca 0.24 -0.50 0.03 0.00 -1.18 0.00 0.00 59.36 57.95 3dpy h GLU 76 Cb 0.37 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 3dpy h GLU 76 CO -0.42 1.13 0.09 0.87 -1.18 0.00 0.00 179.01 179.50 3dpy h LYS 77 N 0.59 0.19 -0.69 1.92 1.79 -1.87 -1.77 116.57 116.74 3dpy h LYS 77 Ca 0.02 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 3dpy h LYS 77 Cb 1.06 -0.04 -0.03 0.00 -1.58 0.00 0.00 32.23 31.64 3dpy h LYS 77 CO 0.11 0.13 0.30 0.45 -1.08 0.00 0.00 179.45 179.36 3dpy h HIS 78 N 0.20 1.02 -0.59 -1.35 3.86 -1.17 -2.47 115.15 114.66 3dpy h HIS 78 Ca 0.11 -0.06 0.03 0.00 -1.16 0.00 0.00 60.37 59.29 3dpy h HIS 78 Cb 0.08 -0.31 -0.04 0.00 1.06 0.00 0.00 27.41 28.20 3dpy h HIS 78 CO -0.13 0.78 0.35 0.35 0.86 0.00 0.00 177.93 180.14 3dpy h PHE 79 N 0.97 0.66 -0.36 2.45 3.57 -0.89 -0.19 116.94 123.14 3dpy h PHE 79 Ca 0.23 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.73 3dpy h PHE 79 Cb 0.17 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 3dpy h PHE 79 CO 0.01 0.37 0.13 1.25 -2.23 0.00 0.00 178.31 177.84 3dpy h HIS 80 N 0.69 0.57 -0.62 0.41 2.76 -1.09 0.41 115.15 118.27 3dpy h HIS 80 Ca 0.24 -0.05 0.09 0.00 -2.20 0.00 0.00 60.37 58.45 3dpy h HIS 80 Cb 0.04 -0.17 -0.07 0.00 1.55 0.00 0.00 27.41 28.76 3dpy h HIS 80 CO -0.06 0.53 0.26 -0.92 -1.30 0.00 0.00 177.93 176.45 3dpy h TYR 81 N 0.44 0.47 -0.02 5.26 3.20 -1.12 -2.13 116.97 123.06 3dpy h TYR 81 Ca 0.12 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 3dpy h TYR 81 Cb 0.22 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.37 3dpy h TYR 81 CO 0.00 0.15 -0.09 -0.07 -1.64 0.00 0.00 178.16 176.52 3dpy h LEU 82 N 0.47 0.11 -0.85 2.82 3.38 -0.62 -2.25 115.31 118.38 3dpy h LEU 82 Ca 0.31 -0.65 0.18 0.00 0.09 0.00 0.00 57.88 57.80 3dpy h LEU 82 Cb 0.34 -0.03 -0.11 0.00 0.09 0.00 0.00 40.66 40.95 3dpy h LEU 82 CO -0.28 0.74 0.39 0.50 0.09 0.00 0.00 178.44 179.88 3dpy h LYS 83 N -0.51 0.48 0.27 1.13 3.64 -0.14 -1.51 116.57 119.92 3dpy h LYS 83 Ca -0.00 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 3dpy h LYS 83 Cb 0.74 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 3dpy h LYS 83 CO 0.02 0.31 -0.13 -0.09 -2.27 0.00 0.00 179.45 177.29 3dpy h ARG 84 N 0.49 -0.35 -0.74 1.90 2.43 -1.41 -3.28 114.38 113.41 3dpy h ARG 84 Ca 0.49 0.02 0.21 0.00 -0.81 0.00 0.00 59.98 59.90 3dpy h ARG 84 Cb 0.81 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.41 3dpy h ARG 84 CO -0.44 -0.06 0.58 0.78 -1.51 0.00 0.00 179.97 179.32 3dpy h GLY 85 N -1.00 0.00 2.00 2.80 0.00 -1.23 0.29 103.07 105.92 3dpy h GLY 85 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.29 3dpy h GLY 85 CO 0.06 0.00 0.00 -2.00 0.00 0.00 0.00 176.54 174.60 3dpy h LEU 86 N 0.00 0.00 0.00 3.11 5.85 -1.34 -3.18 115.31 119.76 3dpy h LEU 86 Ca 0.35 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.86 3dpy h LEU 86 Cb 1.51 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.51 3dpy h LEU 86 CO -0.00 0.00 -1.79 -1.14 -0.34 0.00 0.00 178.44 175.17 3dpy n ARG 87 N -3.02 0.34 -3.75 1.25 3.00 0.90 -5.05 116.66 110.33 3dpy n ARG 87 Ca -0.02 0.09 -0.13 0.00 -0.00 0.00 0.00 57.85 57.79 3dpy n ARG 87 Cb 0.13 -1.25 -0.11 0.00 0.00 0.00 0.00 32.46 31.23 3dpy n ARG 87 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 3dpy s GLN 88 N -2.27 0.40 0.04 -0.14 0.74 -0.55 -5.15 119.66 112.72 3dpy s GLN 88 Ca -0.19 0.50 0.04 0.00 0.05 0.00 0.00 55.36 55.76 3dpy s GLN 88 Cb 0.05 0.18 -0.02 0.00 1.10 0.00 0.00 33.01 34.32 3dpy s GLN 88 CO 0.31 -0.06 -0.12 -0.51 -0.55 0.00 0.00 175.29 174.36 3dpy s LEU 89 N 0.27 2.20 1.03 3.68 1.43 -1.26 -3.96 118.68 122.06 3dpy s LEU 89 Ca -0.01 -0.48 -0.15 0.00 -1.03 0.00 0.00 54.13 52.46 3dpy s LEU 89 Cb -0.03 -0.47 0.20 0.00 0.03 0.00 0.00 46.19 45.93 3dpy s LEU 89 CO -0.00 -0.04 1.17 0.42 0.23 0.00 0.00 176.35 178.13 3dpy s THR 90 N -0.99 1.87 -1.97 5.49 -4.23 -1.26 -4.89 115.64 109.66 3dpy s THR 90 Ca -0.01 0.00 0.14 0.00 -1.18 0.00 0.00 61.69 60.63 3dpy s THR 90 Cb -0.08 -2.70 0.38 0.00 1.34 0.00 0.00 72.50 71.44 3dpy s THR 90 CO 0.01 0.00 1.25 -0.90 -0.54 0.00 0.00 174.62 174.44 3dpy n ASP 91 N -4.12 0.00 0.22 3.99 5.75 -1.26 -1.82 116.55 119.31 3dpy n ASP 91 Ca 0.11 -0.40 0.08 0.00 -0.01 0.00 0.00 54.79 54.56 3dpy n ASP 91 Cb 0.59 -0.01 0.53 0.00 -1.03 0.00 0.00 41.12 41.20 3dpy n ASP 91 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3dpy h ALA 92 N 2.84 1.27 -0.69 2.12 0.00 -2.05 -2.75 119.26 120.01 3dpy h ALA 92 Ca 0.00 -0.22 -0.32 0.00 0.00 0.00 0.00 54.91 54.37 3dpy h ALA 92 Cb 0.01 -0.04 -0.19 0.00 0.00 0.00 0.00 17.79 17.57 3dpy h ALA 92 CO 0.00 0.30 0.40 0.66 0.00 0.00 0.00 179.25 180.61 3dpy n TYR 93 N -3.77 2.18 0.11 0.00 4.02 -0.76 -4.13 117.16 114.81 3dpy n TYR 93 Ca -0.01 -1.34 -0.02 0.00 -0.01 0.00 0.00 57.90 56.52 3dpy n TYR 93 Cb 0.34 -0.71 0.20 0.00 -0.02 0.00 0.00 39.34 39.15 3dpy n TYR 93 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 3dpy h GLU 94 N 1.17 0.17 0.00 -0.72 5.08 -1.69 -2.63 114.58 115.96 3dpy h GLU 94 Ca 0.39 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3dpy h GLU 94 Cb 2.27 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.52 3dpy h GLU 94 CO 0.75 0.64 0.00 0.00 -1.00 0.00 0.00 179.01 179.40 3dpy n LEU 96 N -1.14 2.32 0.32 0.00 4.77 -1.00 -4.68 117.00 117.59 3dpy n LEU 96 Ca 0.12 -3.05 0.20 0.00 -0.03 0.00 0.00 56.01 53.25 3dpy n LEU 96 Cb 0.11 -0.42 1.04 0.00 -2.33 0.00 0.00 43.42 41.82 3dpy n LEU 96 CO 0.13 0.70 1.12 -0.78 -1.33 0.00 0.00 177.39 177.23 3dpy h ASP 97 N 0.00 0.00 -0.54 -1.43 3.58 -1.39 -0.77 116.42 115.87 3dpy h ASP 97 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 3dpy h ASP 97 Cb 1.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.05 3dpy h ASP 97 CO 0.00 0.01 0.00 0.00 -2.88 0.00 0.00 179.24 176.37 3dpy n ALA 98 N -2.13 3.49 -2.75 -0.78 0.00 -1.26 -4.41 120.51 112.67 3dpy n ALA 98 Ca -0.02 -1.88 -0.03 0.00 0.00 0.00 0.00 53.44 51.50 3dpy n ALA 98 Cb 0.14 -1.01 0.04 0.00 0.00 0.00 0.00 19.45 18.62 3dpy n ALA 98 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3dpy n SER 99 N 0.57 1.87 0.03 0.00 7.64 -0.30 -4.15 113.62 119.29 3dpy n SER 99 Ca 0.26 -2.26 -0.10 0.00 1.01 0.00 0.00 58.87 57.78 3dpy n SER 99 Cb 1.05 -0.47 0.04 0.00 -1.01 0.00 0.00 64.21 63.82 3dpy n SER 99 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 3dpy h ARG 100 N 2.62 0.49 -0.08 1.43 3.08 -1.20 -2.29 114.38 118.42 3dpy h ARG 100 Ca -0.09 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.61 3dpy h ARG 100 Cb 1.28 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.38 3dpy h ARG 100 CO 0.27 0.97 0.01 -1.35 -1.07 0.00 0.00 179.97 178.80 3dpy h PRO 101 N 0.35 0.11 -0.81 0.04 0.11 -1.84 -1.29 132.00 128.67 3dpy h PRO 101 Ca -0.01 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 3dpy h PRO 101 Cb 1.20 -0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 3dpy h PRO 101 CO 0.12 0.12 0.44 -1.49 -0.21 0.00 0.00 178.00 176.97 3dpy h TRP 102 N 0.11 1.12 -0.78 0.65 4.06 -1.73 0.39 115.95 119.77 3dpy h TRP 102 Ca 0.03 -0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 3dpy h TRP 102 Cb 0.07 -0.36 -0.04 0.00 -1.00 0.00 0.00 29.16 27.83 3dpy h TRP 102 CO 0.00 0.79 0.40 -0.07 -3.56 0.00 0.00 178.44 176.00 3dpy h LEU 103 N 1.13 0.99 0.53 -4.49 3.38 -1.03 0.36 115.31 116.19 3dpy h LEU 103 Ca 0.29 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 3dpy h LEU 103 Cb 0.04 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.53 3dpy h LEU 103 CO -0.04 0.82 -0.32 0.00 0.09 0.00 0.00 178.44 178.98 3dpy h TYR 105 N -0.81 -0.50 -0.91 0.00 3.20 -0.56 0.74 116.97 118.13 3dpy h TYR 105 Ca -0.06 0.01 0.14 0.00 3.14 0.00 0.00 58.73 61.95 3dpy h TYR 105 Cb 0.66 0.20 -0.09 0.00 1.54 0.00 0.00 36.73 39.04 3dpy h TYR 105 CO -0.09 -0.28 0.53 -1.49 -1.64 0.00 0.00 178.16 175.19 3dpy h TRP 106 N -0.37 0.94 0.03 -3.82 6.55 -0.32 0.36 115.95 119.32 3dpy h TRP 106 Ca 0.02 0.03 -0.00 0.00 0.95 0.00 0.00 58.89 59.89 3dpy h TRP 106 Cb 0.38 -0.28 0.00 0.00 -0.86 0.00 0.00 29.16 28.40 3dpy h TRP 106 CO -0.18 0.29 -0.01 0.82 -1.05 0.00 0.00 178.44 178.31 3dpy h ILE 107 N 0.78 1.25 -0.78 1.49 2.04 -1.21 -2.45 117.51 118.63 3dpy h ILE 107 Ca 0.48 -1.77 0.10 0.00 1.00 0.00 0.00 64.86 64.67 3dpy h ILE 107 Cb 0.60 2.30 -0.07 0.00 -0.74 0.00 0.00 36.82 38.90 3dpy h ILE 107 CO -0.32 0.40 0.42 -0.07 0.00 0.00 0.00 178.15 178.58 3dpy h LEU 108 N -0.93 0.57 -0.71 1.44 3.38 -0.73 0.90 115.31 119.23 3dpy h LEU 108 Ca -0.00 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 3dpy h LEU 108 Cb 0.68 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3dpy h LEU 108 CO 0.01 0.32 -0.24 -0.74 0.09 0.00 0.00 178.44 177.87 3dpy h HIS 109 N 0.69 0.83 -0.41 1.13 2.76 -1.02 -0.92 115.15 118.21 3dpy h HIS 109 Ca 0.39 -0.19 -0.04 0.00 -2.20 0.00 0.00 60.37 58.32 3dpy h HIS 109 Cb 0.40 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.15 3dpy h HIS 109 CO -0.08 0.90 0.10 0.77 -1.30 0.00 0.00 177.93 178.31 3dpy h SER 110 N 0.63 0.63 -0.83 3.26 0.02 -0.82 -0.88 113.55 115.55 3dpy h SER 110 Ca 0.08 -0.24 0.02 0.00 -0.84 0.00 0.00 61.79 60.82 3dpy h SER 110 Cb 0.75 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 63.07 3dpy h SER 110 CO 0.06 0.70 0.54 -0.07 -1.14 0.00 0.00 176.83 176.92 3dpy h LEU 111 N 0.53 0.92 -0.81 5.07 3.38 -0.65 -1.92 115.31 121.82 3dpy h LEU 111 Ca 0.13 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3dpy h LEU 111 Cb 0.32 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 3dpy h LEU 111 CO 0.00 0.65 0.22 -0.08 0.09 0.00 0.00 178.44 179.33 3dpy h GLU 112 N 1.08 1.11 -0.39 1.13 4.81 -0.83 0.14 114.58 121.63 3dpy h GLU 112 Ca 0.32 -0.23 -0.12 0.00 -0.13 0.00 0.00 59.36 59.20 3dpy h GLU 112 Cb -0.06 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 3dpy h GLU 112 CO -0.09 0.95 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.82 3dpy h LEU 113 N 1.07 0.81 0.00 1.64 3.38 -0.90 -2.18 115.31 119.13 3dpy h LEU 113 Ca 0.23 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.90 3dpy h LEU 113 Cb 0.30 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3dpy h LEU 113 CO -0.01 1.01 0.00 0.18 0.09 0.00 0.00 178.44 179.71 3dpy n LEU 114 N -4.10 0.00 -2.58 1.67 4.77 -0.74 -1.27 117.00 114.74 3dpy n LEU 114 Ca -0.00 0.36 -0.07 0.00 -0.03 0.00 0.00 56.01 56.26 3dpy n LEU 114 Cb 0.44 -0.36 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 3dpy n LEU 114 CO 0.45 -0.00 0.06 -0.67 -1.33 0.00 0.00 177.39 175.90 3dpy n ASP 115 N -1.36 -5.10 -4.21 -1.43 2.03 -0.12 -4.94 116.55 101.42 3dpy n ASP 115 Ca 0.12 -0.36 -0.32 0.00 0.52 0.00 0.00 54.79 54.75 3dpy n ASP 115 Cb 0.27 -3.53 -0.17 0.00 -0.72 0.00 0.00 41.12 36.97 3dpy n ASP 115 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3dpy s GLU 116 N -3.68 3.04 0.44 -0.67 0.41 -0.31 -5.01 118.70 112.92 3dpy s GLU 116 Ca 0.23 -0.87 -0.25 0.00 -0.41 0.00 0.00 54.97 53.66 3dpy s GLU 116 Cb -0.03 -2.31 -0.09 0.00 -1.78 0.00 0.00 34.13 29.92 3dpy s GLU 116 CO 0.47 0.16 1.41 -0.35 -0.49 0.00 0.00 175.26 176.46 3dpy n PRO 117 N 3.58 2.22 -3.38 0.39 -0.04 -1.26 -4.57 135.00 131.95 3dpy n PRO 117 Ca -0.19 0.79 -0.45 0.00 -0.04 0.00 0.00 63.50 63.61 3dpy n PRO 117 Cb 0.53 -2.59 -0.07 0.00 -0.04 0.00 0.00 33.50 31.33 3dpy n PRO 117 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3dpy s ILE 118 N -1.19 5.11 0.22 0.52 -1.09 -1.26 -5.05 121.20 118.45 3dpy s ILE 118 Ca 0.61 -1.32 -0.31 0.00 -2.23 0.00 0.00 60.65 57.41 3dpy s ILE 118 Cb -0.46 -4.17 -0.15 0.00 -1.58 0.00 0.00 42.46 36.10 3dpy s ILE 118 CO 0.58 -0.71 1.01 -2.65 -1.23 0.00 0.00 174.94 171.94 3dpy n PRO 119 N 5.19 1.04 0.00 2.79 -0.02 -1.26 -4.65 135.00 138.08 3dpy n PRO 119 Ca -0.13 0.37 0.06 0.00 -2.02 0.00 0.00 63.50 61.78 3dpy n PRO 119 Cb 0.42 -1.75 0.27 0.00 -0.02 0.00 0.00 33.50 32.42 3dpy n PRO 119 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3dpy n GLN 120 N 1.25 0.05 -0.00 -0.52 1.13 -1.26 -0.46 117.38 117.56 3dpy n GLN 120 Ca 0.13 0.26 -0.17 0.00 -1.94 0.00 0.00 57.00 55.29 3dpy n GLN 120 Cb 0.27 -1.50 -0.12 0.00 0.11 0.00 0.00 30.24 29.00 3dpy n GLN 120 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 3dpy h ILE 121 N 0.00 1.49 -0.21 5.09 2.04 -2.00 -2.88 117.51 121.04 3dpy h ILE 121 Ca 0.00 -2.10 -0.04 0.00 1.00 0.00 0.00 64.86 63.72 3dpy h ILE 121 Cb 0.18 2.76 -0.01 0.00 -0.74 0.00 0.00 36.82 39.01 3dpy h ILE 121 CO 0.00 0.60 -0.03 0.58 0.00 0.00 0.00 178.15 179.30 3dpy h VAL 122 N -0.30 1.27 -0.75 1.67 2.07 -1.50 -2.54 116.25 116.17 3dpy h VAL 122 Ca -0.07 -0.97 0.13 0.00 0.82 0.00 0.00 66.70 66.62 3dpy h VAL 122 Cb 1.24 1.50 -0.09 0.00 -1.52 0.00 0.00 31.29 32.42 3dpy h VAL 122 CO 0.10 0.30 0.32 0.00 0.02 0.00 0.00 177.57 178.30 3dpy h ALA 123 N 0.76 1.06 0.00 1.67 0.00 -0.88 0.78 119.26 122.64 3dpy h ALA 123 Ca 0.05 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 3dpy h ALA 123 Cb 0.46 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3dpy h ALA 123 CO 0.02 -0.17 -0.65 0.00 0.00 0.00 0.00 179.25 178.45 3dpy h THR 124 N 0.48 1.34 -0.18 0.00 1.03 -1.47 -1.91 112.91 112.21 3dpy h THR 124 Ca 0.40 -2.31 -0.13 0.00 -0.01 0.00 0.00 66.41 64.36 3dpy h THR 124 Cb 0.58 2.29 0.00 0.00 -1.07 0.00 0.00 68.15 69.95 3dpy h THR 124 CO -0.37 0.63 -0.41 0.44 -0.01 0.00 0.00 175.52 175.80 3dpy h ASP 125 N 0.00 0.67 -0.44 0.00 3.32 -0.84 -0.50 116.42 118.62 3dpy h ASP 125 Ca -0.01 -0.57 0.03 0.00 0.02 0.00 0.00 57.03 56.50 3dpy h ASP 125 Cb 1.24 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.56 3dpy h ASP 125 CO 0.08 1.11 0.24 0.58 -1.72 0.00 0.00 179.24 179.54 3dpy h VAL 126 N 0.25 1.01 0.14 -1.35 2.07 -0.86 0.13 116.25 117.64 3dpy h VAL 126 Ca -0.00 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.37 3dpy h VAL 126 Cb 1.02 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 3dpy h VAL 126 CO 0.09 0.09 -0.33 0.00 0.02 0.00 0.00 177.57 177.44 3dpy h GLN 128 N -0.56 0.99 -0.22 0.00 4.20 -0.68 -1.19 115.11 117.64 3dpy h GLN 128 Ca 0.03 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 3dpy h GLN 128 Cb 0.58 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 3dpy h GLN 128 CO -0.18 0.66 0.04 0.35 -0.67 0.00 0.00 178.83 179.03 3dpy h PHE 129 N 1.02 0.39 0.00 2.96 3.57 -0.40 -2.60 116.94 121.88 3dpy h PHE 129 Ca 0.37 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.79 3dpy h PHE 129 Cb 0.13 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.75 3dpy h PHE 129 CO -0.03 0.50 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.36 3dpy h LEU 130 N 0.17 0.00 -1.13 0.59 3.38 -0.70 -1.61 115.31 116.03 3dpy h LEU 130 Ca 0.07 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 3dpy h LEU 130 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3dpy h LEU 130 CO 0.00 0.12 -0.24 -0.33 0.09 0.00 0.00 178.44 178.09 3dpy h GLU 131 N 0.00 0.32 0.00 1.13 5.08 -0.87 -2.03 114.58 118.21 3dpy h GLU 131 Ca -0.00 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 3dpy h GLU 131 Cb 0.22 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3dpy h GLU 131 CO 0.02 0.54 -0.30 -0.07 -1.00 0.00 0.00 179.01 178.20 3dpy h LEU 132 N 0.29 0.00 0.00 1.33 3.38 -0.94 -2.99 115.31 116.38 3dpy h LEU 132 Ca 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3dpy h LEU 132 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 3dpy h LEU 132 CO 0.04 0.30 -0.20 0.00 0.09 0.00 0.00 178.44 178.67 3dpy s GLN 134 N -3.22 4.43 0.33 0.00 0.74 -0.87 -0.00 119.66 121.07 3dpy s GLN 134 Ca 0.06 1.82 -0.26 0.00 0.05 0.00 0.00 55.36 57.02 3dpy s GLN 134 Cb 0.06 -3.32 -0.09 0.00 1.10 0.00 0.00 33.01 30.76 3dpy s GLN 134 CO 0.69 -0.24 1.02 0.45 -0.55 0.00 0.00 175.29 176.66 3dpy s SER 135 N 0.90 7.14 0.55 6.67 0.15 0.22 -4.91 113.70 124.41 3dpy s SER 135 Ca 0.58 2.02 0.23 0.00 0.70 0.00 0.00 55.95 59.49 3dpy s SER 135 Cb -0.31 -2.60 1.49 0.00 -1.71 0.00 0.00 66.02 62.90 3dpy s SER 135 CO 0.30 -0.22 2.14 1.55 1.20 0.00 0.00 173.24 178.21 3dpy h PRO 136 N 3.17 0.00 -0.12 5.44 0.13 -1.94 -0.93 132.00 137.75 3dpy h PRO 136 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3dpy h PRO 136 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3dpy h PRO 136 CO 0.65 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.17 3dpy n ASP 137 N -4.21 1.46 0.00 1.44 10.43 -1.26 -4.99 116.55 119.41 3dpy n ASP 137 Ca -0.00 -1.62 0.00 0.00 2.57 0.00 0.00 54.79 55.74 3dpy n ASP 137 Cb 0.22 -0.07 0.00 0.00 1.84 0.00 0.00 41.12 43.11 3dpy n ASP 137 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3dpy n GLY 138 N 1.11 2.42 0.10 0.44 0.00 -0.36 -4.21 105.19 104.69 3dpy n GLY 138 Ca 0.17 -1.81 0.01 0.00 0.00 0.00 0.00 46.02 44.39 3dpy n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpy n GLY 139 N 1.45 -1.33 3.38 -0.02 0.00 -1.26 -4.38 105.19 103.03 3dpy n GLY 139 Ca 0.00 -1.51 -0.28 0.00 0.00 0.00 0.00 46.02 44.23 3dpy n GLY 139 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dpy s PHE 140 N -1.11 2.21 0.58 1.61 0.40 -1.26 -0.61 117.98 119.79 3dpy s PHE 140 Ca 0.00 -0.39 0.09 0.00 -0.60 0.00 0.00 56.93 56.04 3dpy s PHE 140 Cb 0.00 -1.18 0.09 0.00 0.51 0.00 0.00 43.02 42.44 3dpy s PHE 140 CO 0.00 0.34 0.80 0.20 0.70 0.00 0.00 175.22 177.26 3dpy s GLY 141 N -2.14 1.73 0.02 4.36 0.00 0.99 -1.25 107.32 111.04 3dpy s GLY 141 Ca 0.14 -2.14 0.23 0.00 0.00 0.00 0.00 44.72 42.95 3dpy s GLY 141 CO 0.06 -1.67 1.72 0.61 0.00 0.00 0.00 173.10 173.82 3dpy n GLY 142 N -2.26 -1.29 0.00 0.20 0.00 -1.26 -4.69 105.19 95.89 3dpy n GLY 142 Ca 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3dpy n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpy n GLY 143 N 0.80 -0.52 3.67 -0.02 0.00 -1.26 -1.20 105.19 106.65 3dpy n GLY 143 Ca 0.05 -0.94 -0.47 0.00 0.00 0.00 0.00 46.02 44.66 3dpy n GLY 143 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dpy n PRO 144 N -0.00 2.05 -0.72 1.61 -0.02 -1.26 -1.65 135.00 135.01 3dpy n PRO 144 Ca 0.00 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 3dpy n PRO 144 Cb 0.00 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 30.96 3dpy n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dpy n GLY 145 N 3.56 1.51 3.85 -1.23 0.00 -1.25 -5.01 105.19 106.62 3dpy n GLY 145 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 3dpy n GLY 145 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dpy s GLN 146 N -0.02 3.93 0.61 1.61 -0.21 -0.66 -5.03 119.66 119.89 3dpy s GLN 146 Ca 0.00 0.80 -0.18 0.00 0.02 0.00 0.00 55.36 56.00 3dpy s GLN 146 Cb 0.00 -2.24 -0.03 0.00 1.00 0.00 0.00 33.01 31.74 3dpy s GLN 146 CO 0.00 -0.14 1.22 0.71 -2.12 0.00 0.00 175.29 174.96 3dpy s TYR 147 N -2.45 2.33 0.57 0.91 4.12 -1.26 -4.37 117.35 117.19 3dpy s TYR 147 Ca 0.56 1.52 -0.20 0.00 0.02 0.00 0.00 57.07 58.97 3dpy s TYR 147 Cb -0.10 -3.51 -0.04 0.00 -1.52 0.00 0.00 41.96 36.79 3dpy s TYR 147 CO 0.28 -2.33 1.23 -1.25 0.02 0.00 0.00 175.55 173.51 3dpy s PRO 148 N -3.39 3.10 -0.07 -1.71 0.04 -1.26 -4.25 135.00 127.46 3dpy s PRO 148 Ca 0.78 1.90 -0.16 0.00 0.04 0.00 0.00 61.00 63.56 3dpy s PRO 148 Cb -0.31 -2.06 0.03 0.00 0.04 0.00 0.00 34.50 32.21 3dpy s PRO 148 CO 0.35 -1.12 0.38 -1.58 0.04 0.00 0.00 177.00 175.07 3dpy s HIS 149 N -1.52 -0.33 0.06 0.56 2.46 -0.38 -4.56 115.29 111.58 3dpy s HIS 149 Ca 0.75 0.67 0.26 0.00 0.47 0.00 0.00 55.06 57.20 3dpy s HIS 149 Cb -0.32 0.15 0.92 0.00 -0.13 0.00 0.00 32.58 33.20 3dpy s HIS 149 CO 0.36 -0.34 1.82 -0.07 -2.47 0.00 0.00 174.74 174.05 3dpy h LEU 150 N 4.46 0.00 0.04 8.88 3.38 -0.94 -2.34 115.31 128.79 3dpy h LEU 150 Ca -0.28 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.69 3dpy h LEU 150 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3dpy h LEU 150 CO 0.34 0.17 -0.02 0.00 0.09 0.00 0.00 178.44 179.02 3dpy h ALA 151 N 1.83 -0.06 0.00 1.53 0.00 -1.93 -1.88 119.26 118.76 3dpy h ALA 151 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3dpy h ALA 151 Cb 0.75 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3dpy h ALA 151 CO 0.02 -0.20 0.00 -1.00 0.00 0.00 0.00 179.25 178.07 3dpy h PRO 152 N -0.72 0.00 -0.32 0.00 0.13 -1.85 -1.29 132.00 127.95 3dpy h PRO 152 Ca -0.01 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 3dpy h PRO 152 Cb 0.63 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.75 3dpy h PRO 152 CO 0.01 0.00 -0.33 1.15 -0.23 0.00 0.00 178.00 178.60 3dpy h THR 153 N 0.00 1.29 -0.54 1.56 2.02 -1.43 0.22 112.91 116.03 3dpy h THR 153 Ca 0.00 -1.50 -0.04 0.00 0.77 0.00 0.00 66.41 65.64 3dpy h THR 153 Cb 0.61 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.51 3dpy h THR 153 CO 0.00 0.49 0.17 0.22 0.37 0.00 0.00 175.52 176.76 3dpy h TYR 154 N 0.57 0.81 -0.09 3.16 3.20 -1.04 -2.16 116.97 121.43 3dpy h TYR 154 Ca 0.05 -0.06 -0.22 0.00 3.14 0.00 0.00 58.73 61.64 3dpy h TYR 154 Cb 0.91 -0.24 0.01 0.00 1.54 0.00 0.00 36.73 38.95 3dpy h TYR 154 CO 0.07 0.66 -0.80 0.00 -1.64 0.00 0.00 178.16 176.45 3dpy h ALA 155 N 1.40 0.21 0.48 1.82 0.00 -1.05 -2.11 119.26 120.02 3dpy h ALA 155 Ca 0.18 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 3dpy h ALA 155 Cb 0.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3dpy h ALA 155 CO -0.01 0.60 -0.23 0.00 0.00 0.00 0.00 179.25 179.61 3dpy h ALA 156 N 0.47 -0.65 -0.19 0.00 0.00 -0.50 -1.17 119.26 117.23 3dpy h ALA 156 Ca -0.08 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.71 3dpy h ALA 156 Cb 1.45 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 19.44 3dpy h ALA 156 CO 0.16 -0.81 -0.10 0.28 0.00 0.00 0.00 179.25 178.78 3dpy h VAL 157 N -0.76 0.69 -0.72 0.00 2.07 -1.47 0.89 116.25 116.95 3dpy h VAL 157 Ca -0.07 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.56 3dpy h VAL 157 Cb 0.55 0.69 -0.08 0.00 -1.52 0.00 0.00 31.29 30.93 3dpy h VAL 157 CO 0.11 0.00 0.35 0.78 0.02 0.00 0.00 177.57 178.82 3dpy h ASN 158 N -0.09 0.43 -0.07 0.57 4.21 -1.35 -1.30 115.58 117.99 3dpy h ASN 158 Ca 0.10 0.07 -0.00 0.00 1.21 0.00 0.00 56.30 57.68 3dpy h ASN 158 Cb 0.24 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.44 3dpy h ASN 158 CO -0.24 0.23 0.03 0.00 -1.29 0.00 0.00 177.43 176.15 3dpy h ALA 159 N 1.46 0.09 -0.62 -0.83 0.00 -0.26 -1.87 119.26 117.23 3dpy h ALA 159 Ca 0.37 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.23 3dpy h ALA 159 Cb 0.43 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3dpy h ALA 159 CO -0.30 -0.32 0.41 -0.07 0.00 0.00 0.00 179.25 178.97 3dpy h LEU 160 N -0.06 0.55 -0.65 0.00 3.38 -0.46 -1.33 115.31 116.75 3dpy h LEU 160 Ca 0.02 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 3dpy h LEU 160 Cb 0.18 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3dpy h LEU 160 CO -0.00 0.37 -0.62 0.00 0.09 0.00 0.00 178.44 178.27 3dpy h ILE 162 N 0.15 1.26 -0.36 0.00 2.04 -0.43 -2.67 117.51 117.50 3dpy h ILE 162 Ca -0.01 -1.14 -0.07 0.00 1.00 0.00 0.00 64.86 64.65 3dpy h ILE 162 Cb 1.13 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 3dpy h ILE 162 CO 0.09 0.41 -0.03 0.40 0.00 0.00 0.00 178.15 179.02 3dpy h ILE 163 N 0.90 1.27 0.00 -0.67 2.04 -1.14 -3.47 117.51 116.44 3dpy h ILE 163 Ca 0.16 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 64.97 3dpy h ILE 163 Cb 0.55 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 3dpy h ILE 163 CO 0.03 0.35 0.00 0.61 0.00 0.00 0.00 178.15 179.14 3dpy n GLY 164 N -0.28 0.20 3.91 5.37 0.00 0.38 -4.98 105.19 109.80 3dpy n GLY 164 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 3dpy n GLY 164 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dpy s THR 165 N -1.50 2.03 0.30 2.61 -4.23 -1.26 -4.89 115.64 108.69 3dpy s THR 165 Ca 0.00 -0.03 0.05 0.00 -1.18 0.00 0.00 61.69 60.53 3dpy s THR 165 Cb 0.00 -2.99 0.07 0.00 1.34 0.00 0.00 72.50 70.91 3dpy s THR 165 CO 0.00 0.00 1.74 -0.08 -0.54 0.00 0.00 174.62 175.74 3dpy h GLU 166 N -1.14 0.36 -0.14 3.99 4.57 -1.98 -2.10 114.58 118.14 3dpy h GLU 166 Ca -0.45 -0.14 -0.01 0.00 -1.18 0.00 0.00 59.36 57.58 3dpy h GLU 166 Cb 1.31 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.87 3dpy h GLU 166 CO 0.59 0.62 0.06 1.49 -1.18 0.00 0.00 179.01 180.60 3dpy h GLU 167 N 0.32 0.21 0.20 1.92 4.81 -1.99 -2.11 114.58 117.93 3dpy h GLU 167 Ca 0.04 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3dpy h GLU 167 Cb 0.68 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 3dpy h GLU 167 CO 0.05 0.28 -0.15 0.00 -0.73 0.00 0.00 179.01 178.46 3dpy h ALA 168 N 0.92 -0.34 -0.82 2.92 0.00 -1.84 -2.73 119.26 117.37 3dpy h ALA 168 Ca 0.05 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.01 3dpy h ALA 168 Cb 0.15 0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 3dpy h ALA 168 CO -0.00 -0.71 0.53 1.88 0.00 0.00 0.00 179.25 180.95 3dpy h TYR 169 N -0.36 0.78 0.00 0.00 0.99 -1.32 -2.33 116.97 114.73 3dpy h TYR 169 Ca -0.01 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.74 3dpy h TYR 169 Cb 0.32 -0.25 0.00 0.00 1.00 0.00 0.00 36.73 37.80 3dpy h TYR 169 CO -0.11 0.34 -0.02 0.09 -0.00 0.00 0.00 178.16 178.47 3dpy n ASN 170 N -4.52 0.65 -0.08 3.88 3.02 -0.80 -3.23 115.26 114.18 3dpy n ASN 170 Ca 0.14 0.55 -0.07 0.00 -0.03 0.00 0.00 54.58 55.17 3dpy n ASN 170 Cb 0.37 -0.71 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 3dpy n ASN 170 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3dpy h VAL 171 N 0.00 0.85 -2.57 2.41 2.07 -1.20 -3.42 116.25 114.39 3dpy h VAL 171 Ca 0.00 -0.06 -0.53 0.00 0.82 0.00 0.00 66.70 66.93 3dpy h VAL 171 Cb 0.69 0.67 0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3dpy h VAL 171 CO 0.00 0.03 1.08 -0.63 0.02 0.00 0.00 177.57 178.07 3dpy s ILE 172 N -6.17 2.82 -0.61 4.57 1.01 -1.20 -4.95 121.20 116.66 3dpy s ILE 172 Ca -0.13 0.24 -0.20 0.00 0.00 0.00 0.00 60.65 60.55 3dpy s ILE 172 Cb 0.11 -3.15 0.09 0.00 0.01 0.00 0.00 42.46 39.52 3dpy s ILE 172 CO 0.70 -0.00 0.80 0.21 0.00 0.00 0.00 174.94 176.65 3dpy s ASN 173 N 2.83 6.18 0.21 3.58 3.84 -1.26 -4.95 114.94 125.37 3dpy s ASN 173 Ca 0.79 -1.22 -0.06 0.00 0.21 0.00 0.00 52.86 52.58 3dpy s ASN 173 Cb -0.43 -2.35 0.15 0.00 -0.55 0.00 0.00 41.25 38.08 3dpy s ASN 173 CO 0.35 -1.23 1.63 0.03 -2.79 0.00 0.00 177.10 175.09 3dpy h ARG 174 N 9.32 0.85 -0.18 0.43 3.08 -1.96 -0.46 114.38 125.47 3dpy h ARG 174 Ca -0.29 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.43 3dpy h ARG 174 Cb 1.08 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.07 3dpy h ARG 174 CO 1.12 0.96 0.12 0.93 -1.07 0.00 0.00 179.97 182.03 3dpy h GLU 175 N 0.75 0.24 -0.08 0.04 3.07 -1.98 -2.13 114.58 114.49 3dpy h GLU 175 Ca 0.11 -0.02 -0.16 0.00 -0.50 0.00 0.00 59.36 58.80 3dpy h GLU 175 Cb 0.70 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.54 3dpy h GLU 175 CO 0.05 0.17 -0.64 0.87 -1.40 0.00 0.00 179.01 178.06 3dpy h LYS 176 N 0.24 0.31 -0.28 2.33 1.79 -1.87 -1.46 116.57 117.62 3dpy h LYS 176 Ca 0.07 -0.23 0.01 0.00 -2.18 0.00 0.00 60.65 58.32 3dpy h LYS 176 Cb -0.02 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 3dpy h LYS 176 CO -0.01 0.85 0.16 1.25 -1.08 0.00 0.00 179.45 180.62 3dpy h LEU 177 N 0.23 0.25 -0.48 2.94 5.85 -0.97 0.13 115.31 123.27 3dpy h LEU 177 Ca -0.01 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 3dpy h LEU 177 Cb 1.18 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 3dpy h LEU 177 CO 0.10 0.19 0.08 0.25 -0.34 0.00 0.00 178.44 178.73 3dpy h LEU 178 N 0.33 0.75 -0.54 2.25 5.85 -1.20 -1.06 115.31 121.69 3dpy h LEU 178 Ca 0.11 -0.26 0.07 0.00 0.84 0.00 0.00 57.88 58.64 3dpy h LEU 178 Cb 0.01 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 3dpy h LEU 178 CO -0.06 0.82 0.24 1.56 -0.34 0.00 0.00 178.44 180.65 3dpy h GLN 179 N 0.66 0.43 -0.30 1.25 4.20 -1.05 -1.68 115.11 118.61 3dpy h GLN 179 Ca 0.15 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.84 3dpy h GLN 179 Cb 0.38 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 3dpy h GLN 179 CO 0.01 0.29 0.18 -0.92 -0.67 0.00 0.00 178.83 177.71 3dpy h TYR 180 N 0.45 0.33 -0.77 2.96 3.20 -0.59 -1.24 116.97 121.31 3dpy h TYR 180 Ca 0.26 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.16 3dpy h TYR 180 Cb 0.24 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 3dpy h TYR 180 CO -0.13 0.20 0.49 -0.07 -1.64 0.00 0.00 178.16 177.01 3dpy h LEU 181 N 0.36 0.82 -0.45 2.82 3.38 -0.86 -2.12 115.31 119.27 3dpy h LEU 181 Ca 0.12 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.08 3dpy h LEU 181 Cb -0.01 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3dpy h LEU 181 CO -0.05 0.58 0.29 1.88 0.09 0.00 0.00 178.44 181.23 3dpy h TYR 182 N 0.97 0.55 0.00 1.13 -1.99 -0.95 -1.95 116.97 114.73 3dpy h TYR 182 Ca 0.30 0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.04 3dpy h TYR 182 Cb -0.02 -0.19 0.00 0.00 2.00 0.00 0.00 36.73 38.52 3dpy h TYR 182 CO -0.03 0.35 0.00 -1.13 -0.00 0.00 0.00 178.16 177.35 3dpy n SER 183 N -4.78 0.00 -0.00 3.88 3.41 -0.50 -1.70 113.62 113.92 3dpy n SER 183 Ca 0.02 0.27 0.06 0.00 -0.26 0.00 0.00 58.87 58.95 3dpy n SER 183 Cb 0.03 -0.33 -0.08 0.00 -0.26 0.00 0.00 64.21 63.56 3dpy n SER 183 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dpy n LEU 184 N -1.33 0.10 -4.72 1.04 4.77 -0.78 -4.97 117.00 111.11 3dpy n LEU 184 Ca 0.03 -0.10 -0.42 0.00 -0.03 0.00 0.00 56.01 55.48 3dpy n LEU 184 Cb 0.05 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3dpy n LEU 184 CO 0.05 0.03 1.35 1.17 -1.33 0.00 0.00 177.39 178.65 3dpy n LYS 185 N -1.77 2.76 -3.99 3.23 3.00 -0.69 -0.99 118.16 119.72 3dpy n LYS 185 Ca -0.01 0.99 -0.24 0.00 -0.00 0.00 0.00 58.31 59.05 3dpy n LYS 185 Cb 0.27 -2.83 -0.03 0.00 0.00 0.00 0.00 35.03 32.44 3dpy n LYS 185 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 3dpy s GLN 186 N 0.82 3.32 0.40 1.64 -1.52 0.17 -4.93 119.66 119.56 3dpy s GLN 186 Ca 0.73 -0.72 0.11 0.00 -1.95 0.00 0.00 55.36 53.53 3dpy s GLN 186 Cb -0.50 -2.87 0.93 0.00 -0.22 0.00 0.00 33.01 30.35 3dpy s GLN 186 CO 0.36 0.48 1.94 -1.35 -0.25 0.00 0.00 175.29 176.47 3dpy h PRO 187 N 1.86 0.53 -0.10 2.91 0.11 -1.95 -2.26 132.00 133.10 3dpy h PRO 187 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3dpy h PRO 187 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3dpy h PRO 187 CO 0.65 0.35 0.00 -0.40 -0.21 0.00 0.00 178.00 178.39 3dpy n ASP 188 N -4.49 0.67 0.00 -2.05 3.85 -1.26 -4.87 116.55 108.40 3dpy n ASP 188 Ca 0.12 -1.74 0.00 0.00 -0.71 0.00 0.00 54.79 52.46 3dpy n ASP 188 Cb 0.38 -0.06 0.00 0.00 -1.35 0.00 0.00 41.12 40.09 3dpy n ASP 188 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dpy n GLY 189 N 0.83 1.72 3.93 6.12 0.00 -0.85 -4.47 105.19 112.48 3dpy n GLY 189 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 3dpy n GLY 189 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dpy s SER 190 N -1.54 3.98 0.08 1.61 1.04 -1.26 -3.78 113.70 113.82 3dpy s SER 190 Ca 0.00 0.32 0.06 0.00 0.48 0.00 0.00 55.95 56.81 3dpy s SER 190 Cb 0.00 -0.64 -0.03 0.00 0.10 0.00 0.00 66.02 65.45 3dpy s SER 190 CO 0.00 -2.17 -0.17 -0.36 0.98 0.00 0.00 173.24 171.52 3dpy s PHE 191 N -3.56 1.42 0.67 5.02 0.40 -1.26 0.44 117.98 121.11 3dpy s PHE 191 Ca 0.67 -0.43 -0.12 0.00 -0.60 0.00 0.00 56.93 56.45 3dpy s PHE 191 Cb -0.07 -0.80 -0.00 0.00 0.51 0.00 0.00 43.02 42.66 3dpy s PHE 191 CO 0.49 0.10 1.06 -0.51 0.70 0.00 0.00 175.22 177.07 3dpy s LEU 192 N -1.70 3.24 0.12 -0.37 1.43 -0.16 -4.39 118.68 116.85 3dpy s LEU 192 Ca 0.01 1.70 -0.07 0.00 -1.03 0.00 0.00 54.13 54.75 3dpy s LEU 192 Cb -0.10 -4.51 -0.11 0.00 0.03 0.00 0.00 46.19 41.51 3dpy s LEU 192 CO 0.03 -1.42 1.30 0.24 0.23 0.00 0.00 176.35 176.73 3dpy h MET 193 N -0.39 0.52 -3.09 1.70 2.86 -1.34 -3.47 114.93 111.72 3dpy h MET 193 Ca -0.45 -0.52 0.02 0.00 -2.06 0.00 0.00 59.70 56.69 3dpy h MET 193 Cb 1.22 0.14 -0.04 0.00 0.06 0.00 0.00 31.60 32.98 3dpy h MET 193 CO 0.56 1.15 0.20 -3.38 1.06 0.00 0.00 176.91 176.51 3dpy s HIS 194 N -3.40 -0.00 0.13 -0.22 0.00 -1.26 -0.29 115.29 110.24 3dpy s HIS 194 Ca -0.07 -0.51 -0.31 0.00 -3.00 0.00 0.00 55.06 51.16 3dpy s HIS 194 Cb 0.09 0.68 -0.10 0.00 -4.00 0.00 0.00 32.58 29.25 3dpy s HIS 194 CO 0.88 -1.33 1.70 0.08 -1.00 0.00 0.00 174.74 175.08 3dpy s VAL 195 N -3.37 2.65 -0.11 -5.38 1.01 -1.26 -0.73 120.40 113.21 3dpy s VAL 195 Ca 0.14 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.39 3dpy s VAL 195 Cb -0.05 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.15 3dpy s VAL 195 CO 0.09 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.81 3dpy n GLY 196 N 4.02 0.47 2.21 4.51 0.00 -1.26 -5.01 105.19 110.13 3dpy n GLY 196 Ca 0.16 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 3dpy n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpy n GLY 197 N -2.22 2.22 3.86 -0.02 0.00 0.09 -5.11 105.19 104.01 3dpy n GLY 197 Ca -0.01 -2.20 -0.30 0.00 0.00 0.00 0.00 46.02 43.51 3dpy n GLY 197 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3dpy s GLU 198 N -3.44 2.29 -0.10 1.61 1.03 -1.26 -4.63 118.70 114.20 3dpy s GLU 198 Ca 0.30 0.38 0.03 0.00 0.03 0.00 0.00 54.97 55.71 3dpy s GLU 198 Cb -0.02 -1.96 0.00 0.00 -0.80 0.00 0.00 34.13 31.35 3dpy s GLU 198 CO 0.19 -1.42 -0.22 0.08 -1.33 0.00 0.00 175.26 172.56 3dpy s VAL 199 N -3.38 1.92 0.32 1.83 1.01 -1.26 -1.02 120.40 119.82 3dpy s VAL 199 Ca 0.60 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 3dpy s VAL 199 Cb -0.12 -1.68 0.05 0.00 0.00 0.00 0.00 36.38 34.64 3dpy s VAL 199 CO 0.52 0.53 0.69 -0.90 0.00 0.00 0.00 175.10 175.93 3dpy n ASP 200 N 3.66 -1.91 0.15 3.32 5.68 -1.26 -4.85 116.55 121.34 3dpy n ASP 200 Ca -0.20 -2.30 0.12 0.00 -0.50 0.00 0.00 54.79 51.91 3dpy n ASP 200 Cb 0.53 3.18 0.55 0.00 -1.14 0.00 0.00 41.12 44.24 3dpy n ASP 200 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 3dpy h VAL 201 N 1.84 0.00 -0.96 2.12 3.04 -1.61 -2.37 116.25 118.32 3dpy h VAL 201 Ca -0.28 -0.18 0.04 0.00 -1.01 0.00 0.00 66.70 65.27 3dpy h VAL 201 Cb 1.04 0.87 -0.06 0.00 -2.01 0.00 0.00 31.29 31.14 3dpy h VAL 201 CO 0.36 0.00 0.63 0.03 -1.01 0.00 0.00 177.57 177.57 3dpy h ARG 202 N 0.00 1.16 -0.57 4.17 3.08 -1.91 -2.77 114.38 117.54 3dpy h ARG 202 Ca 0.00 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 3dpy h ARG 202 Cb 0.27 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3dpy h ARG 202 CO 0.00 0.77 0.22 0.66 -1.07 0.00 0.00 179.97 180.55 3dpy h SER 203 N 1.20 0.78 -0.14 7.04 4.64 -1.73 -0.09 113.55 125.26 3dpy h SER 203 Ca 0.38 -0.17 0.05 0.00 -0.47 0.00 0.00 61.79 61.58 3dpy h SER 203 Cb 0.03 -0.20 -0.06 0.00 -0.31 0.00 0.00 62.40 61.86 3dpy h SER 203 CO -0.12 0.74 -0.23 0.00 -0.87 0.00 0.00 176.83 176.35 3dpy h ALA 204 N 1.07 -0.20 -0.33 5.18 0.00 -1.65 0.15 119.26 123.48 3dpy h ALA 204 Ca 0.19 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 3dpy h ALA 204 Cb 0.21 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3dpy h ALA 204 CO -0.01 -0.69 0.07 -0.92 0.00 0.00 0.00 179.25 177.69 3dpy h TYR 205 N -0.29 0.56 -0.34 0.00 3.20 -1.30 -0.32 116.97 118.47 3dpy h TYR 205 Ca 0.10 -0.07 0.02 0.00 3.14 0.00 0.00 58.73 61.92 3dpy h TYR 205 Cb 0.45 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 3dpy h TYR 205 CO -0.34 0.59 0.19 0.00 -1.64 0.00 0.00 178.16 176.96 3dpy h ALA 207 N 1.16 0.54 -0.34 0.00 0.00 -0.56 -2.58 119.26 117.47 3dpy h ALA 207 Ca 0.14 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 3dpy h ALA 207 Cb 0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3dpy h ALA 207 CO -0.08 -0.01 -0.34 0.00 0.00 0.00 0.00 179.25 178.81 3dpy h ALA 208 N 1.16 0.75 -0.18 0.00 0.00 -0.70 -1.33 119.26 118.94 3dpy h ALA 208 Ca 0.16 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3dpy h ALA 208 Cb -0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3dpy h ALA 208 CO -0.04 0.66 0.07 1.03 0.00 0.00 0.00 179.25 180.97 3dpy h SER 209 N 0.65 0.25 0.55 0.00 0.87 -0.27 -1.87 113.55 113.72 3dpy h SER 209 Ca 0.06 -0.17 -0.24 0.00 -1.23 0.00 0.00 61.79 60.22 3dpy h SER 209 Cb 0.89 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.78 3dpy h SER 209 CO 0.08 0.35 -1.05 -0.37 -0.53 0.00 0.00 176.83 175.31 3dpy h VAL 210 N 0.14 1.48 -0.48 2.23 -1.51 -1.46 -2.95 116.25 113.69 3dpy h VAL 210 Ca 0.06 -2.79 -0.12 0.00 -1.23 0.00 0.00 66.70 62.62 3dpy h VAL 210 Cb 0.18 2.66 -0.02 0.00 -2.13 0.00 0.00 31.29 31.99 3dpy h VAL 210 CO -0.00 0.82 -0.17 0.00 -1.23 0.00 0.00 177.57 176.98 3dpy h ALA 211 N 0.74 0.78 0.02 5.19 0.00 -1.21 -2.12 119.26 122.66 3dpy h ALA 211 Ca -0.09 -0.37 -0.24 0.00 0.00 0.00 0.00 54.91 54.21 3dpy h ALA 211 Cb 1.73 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 19.35 3dpy h ALA 211 CO 0.17 0.66 -1.01 0.66 0.00 0.00 0.00 179.25 179.73 3dpy h SER 212 N 0.83 0.63 -0.45 0.00 4.64 -1.41 -0.10 113.55 117.69 3dpy h SER 212 Ca 0.12 -0.52 -0.06 0.00 -0.47 0.00 0.00 61.79 60.85 3dpy h SER 212 Cb 0.73 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.61 3dpy h SER 212 CO 0.06 1.33 0.05 -0.07 -0.87 0.00 0.00 176.83 177.33 3dpy h LEU 213 N 0.26 0.74 -1.29 5.97 3.38 -1.51 -2.96 115.31 119.90 3dpy h LEU 213 Ca -0.10 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3dpy h LEU 213 Cb 1.65 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3dpy h LEU 213 CO 0.18 0.83 0.00 0.35 0.09 0.00 0.00 178.44 179.89 3dpy n THR 214 N -4.44 0.40 -3.59 0.22 -2.24 -0.80 -4.20 114.28 99.64 3dpy n THR 214 Ca 0.00 -0.45 -0.28 0.00 -2.27 0.00 0.00 64.05 61.06 3dpy n THR 214 Cb 0.26 0.30 0.05 0.00 -2.10 0.00 0.00 70.33 68.84 3dpy n THR 214 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3dpy n ASN 215 N 0.51 -5.65 0.00 3.42 5.15 -0.85 -4.87 115.26 112.96 3dpy n ASN 215 Ca 0.14 -0.94 0.00 0.00 -0.60 0.00 0.00 54.58 53.18 3dpy n ASN 215 Cb 0.32 -3.73 0.00 0.00 -0.53 0.00 0.00 39.78 35.84 3dpy n ASN 215 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 3dpy n ILE 216 N -3.93 0.58 -2.05 -1.44 -5.35 -0.11 -4.32 119.36 102.73 3dpy n ILE 216 Ca -0.09 -0.67 -0.43 0.00 -0.27 0.00 0.00 62.75 61.29 3dpy n ILE 216 Cb 0.59 0.77 -0.03 0.00 -1.74 0.00 0.00 39.64 39.24 3dpy n ILE 216 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3dpy s ILE 217 N -0.58 3.58 0.53 7.28 1.01 -1.24 -4.86 121.20 126.92 3dpy s ILE 217 Ca 0.00 0.63 -0.07 0.00 0.00 0.00 0.00 60.65 61.20 3dpy s ILE 217 Cb 0.00 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 3dpy s ILE 217 CO 0.00 -0.35 0.87 0.42 0.00 0.00 0.00 174.94 175.88 3dpy s THR 218 N 5.95 4.83 0.47 2.92 -4.23 -1.26 -4.97 115.64 119.35 3dpy s THR 218 Ca 0.76 0.46 0.26 0.00 -1.18 0.00 0.00 61.69 61.98 3dpy s THR 218 Cb -0.24 -3.86 0.45 0.00 1.34 0.00 0.00 72.50 70.19 3dpy s THR 218 CO 0.32 -0.95 1.83 -0.65 -0.54 0.00 0.00 174.62 174.63 3dpy h PRO 219 N 0.06 0.20 0.00 3.99 0.11 -2.04 -2.88 132.00 131.45 3dpy h PRO 219 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3dpy h PRO 219 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3dpy h PRO 219 CO 0.62 0.13 -0.76 -0.40 -0.21 0.00 0.00 178.00 177.38 3dpy n ASP 220 N -4.41 0.75 -0.23 -2.05 5.75 -1.26 -4.62 116.55 110.49 3dpy n ASP 220 Ca 0.22 -0.84 0.02 0.00 -0.01 0.00 0.00 54.79 54.19 3dpy n ASP 220 Cb 0.94 1.02 0.11 0.00 -1.03 0.00 0.00 41.12 42.16 3dpy n ASP 220 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3dpy h LEU 221 N 0.00 -0.40 -3.87 -2.12 5.85 -1.90 -2.09 115.31 110.79 3dpy h LEU 221 Ca 0.00 0.18 -0.57 0.00 0.84 0.00 0.00 57.88 58.33 3dpy h LEU 221 Cb 0.38 0.34 -0.30 0.00 0.37 0.00 0.00 40.66 41.44 3dpy h LEU 221 CO 0.00 -0.17 0.36 0.49 -0.34 0.00 0.00 178.44 178.78 3dpy n PHE 222 N -5.35 2.85 -2.23 1.25 3.01 -1.26 -4.95 117.46 110.77 3dpy n PHE 222 Ca 0.10 -2.52 -0.43 0.00 1.01 0.00 0.00 57.45 55.61 3dpy n PHE 222 Cb 0.39 -1.03 -0.02 0.00 -0.01 0.00 0.00 39.48 38.81 3dpy n PHE 222 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 3dpy s GLU 223 N -3.64 4.15 0.00 -1.08 2.56 -0.79 -2.45 118.70 117.46 3dpy s GLU 223 Ca 0.58 1.84 0.00 0.00 0.00 0.00 0.00 54.97 57.39 3dpy s GLU 223 Cb 0.47 -3.88 0.00 0.00 2.00 0.00 0.00 34.13 32.72 3dpy s GLU 223 CO 0.02 -0.84 0.00 0.41 -0.56 0.00 0.00 175.26 174.29 3dpy n GLY 224 N 3.95 2.40 0.20 -1.50 0.00 -1.26 -4.40 105.19 104.59 3dpy n GLY 224 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.10 3dpy n GLY 224 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3dpy h THR 225 N 0.00 1.14 -0.09 2.61 2.02 -1.57 -0.98 112.91 116.04 3dpy h THR 225 Ca 0.00 -0.29 -0.06 0.00 0.77 0.00 0.00 66.41 66.83 3dpy h THR 225 Cb 0.00 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 3dpy h THR 225 CO 0.00 0.14 -0.24 0.00 0.37 0.00 0.00 175.52 175.79 3dpy h ALA 226 N 1.15 1.44 -0.04 6.16 0.00 -1.88 -1.09 119.26 125.01 3dpy h ALA 226 Ca 0.17 -0.26 -0.25 0.00 0.00 0.00 0.00 54.91 54.57 3dpy h ALA 226 Cb -0.03 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.70 3dpy h ALA 226 CO -0.03 0.40 -0.97 0.93 0.00 0.00 0.00 179.25 179.58 3dpy h GLU 227 N 0.14 0.71 -0.79 0.00 3.07 -1.82 -1.68 114.58 114.22 3dpy h GLU 227 Ca 0.02 -0.71 -0.00 0.00 -0.50 0.00 0.00 59.36 58.17 3dpy h GLU 227 Cb 0.50 0.19 -0.04 0.00 -0.84 0.00 0.00 28.75 28.56 3dpy h GLU 227 CO 0.03 1.30 0.49 2.35 -1.40 0.00 0.00 179.01 181.78 3dpy h TRP 228 N 0.43 1.02 -0.56 4.33 7.01 -0.89 -1.26 115.95 126.02 3dpy h TRP 228 Ca -0.11 0.01 -0.06 0.00 2.11 0.00 0.00 58.89 60.84 3dpy h TRP 228 Cb 1.61 -0.34 -0.03 0.00 -2.10 0.00 0.00 29.16 28.31 3dpy h TRP 228 CO 0.10 0.67 0.12 0.82 -2.79 0.00 0.00 178.44 177.35 3dpy h ILE 229 N 1.07 1.24 -0.16 2.65 2.04 -1.12 -2.14 117.51 121.08 3dpy h ILE 229 Ca 0.28 -0.88 -0.05 0.00 1.00 0.00 0.00 64.86 65.21 3dpy h ILE 229 Cb -0.07 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 3dpy h ILE 229 CO -0.06 0.32 -0.14 0.00 0.00 0.00 0.00 178.15 178.28 3dpy h ALA 230 N 1.29 1.46 0.00 1.87 0.00 -0.76 -1.10 119.26 122.01 3dpy h ALA 230 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3dpy h ALA 230 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3dpy h ALA 230 CO 0.00 0.38 0.00 0.00 0.00 0.00 0.00 179.25 179.63 3dpy h ARG 231 N 0.25 0.00 0.00 0.00 3.08 -0.56 -2.74 114.38 114.41 3dpy h ARG 231 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3dpy h ARG 231 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3dpy h ARG 231 CO 0.02 0.00 -0.04 0.00 -1.07 0.00 0.00 179.97 178.88 3dpy s GLN 233 N -3.20 4.34 0.06 0.00 0.74 -1.04 -1.42 119.66 119.14 3dpy s GLN 233 Ca 0.07 1.99 0.00 0.00 0.05 0.00 0.00 55.36 57.47 3dpy s GLN 233 Cb 0.06 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 30.86 3dpy s GLN 233 CO 0.67 -0.41 0.03 0.27 -0.55 0.00 0.00 175.29 175.29 3dpy n ASN 234 N 4.14 1.41 0.00 6.67 6.94 -0.58 -4.94 115.26 128.90 3dpy n ASN 234 Ca 0.11 -1.21 0.01 0.00 -0.02 0.00 0.00 54.58 53.47 3dpy n ASN 234 Cb 0.43 0.01 0.04 0.00 -2.36 0.00 0.00 39.78 37.90 3dpy n ASN 234 CO 0.00 0.00 0.00 -2.67 -1.03 0.00 0.00 177.26 173.56 3dpy n TRP 235 N -0.51 0.00 0.22 -2.53 4.27 -1.26 -1.99 117.44 115.64 3dpy n TRP 235 Ca -0.01 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.72 3dpy n TRP 235 Cb 0.07 -0.49 0.09 0.00 -1.36 0.00 0.00 31.31 29.62 3dpy n TRP 235 CO 0.00 0.00 0.00 0.93 -2.29 0.00 0.00 177.69 176.33 3dpy h GLU 236 N 0.00 0.00 0.00 -2.67 5.08 -1.96 -3.47 114.58 111.55 3dpy h GLU 236 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dpy h GLU 236 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3dpy h GLU 236 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 3dpy n GLY 237 N 1.18 2.55 2.69 -3.84 0.00 -0.84 -4.54 105.19 102.39 3dpy n GLY 237 Ca 0.02 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 3dpy n GLY 237 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpy n GLY 238 N 0.00 -0.42 3.49 -0.02 0.00 -1.26 -3.24 105.19 103.73 3dpy n GLY 238 Ca 0.00 -1.84 -0.33 0.00 0.00 0.00 0.00 46.02 43.85 3dpy n GLY 238 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dpy s ILE 239 N -2.58 3.22 0.45 -0.61 1.01 -1.26 -1.53 121.20 119.89 3dpy s ILE 239 Ca 0.49 -0.66 0.08 0.00 0.00 0.00 0.00 60.65 60.56 3dpy s ILE 239 Cb -0.02 -2.28 0.00 0.00 0.01 0.00 0.00 42.46 40.17 3dpy s ILE 239 CO 0.34 0.59 0.47 -0.83 0.00 0.00 0.00 174.94 175.51 3dpy s GLY 240 N -0.65 2.07 0.10 6.18 0.00 -0.51 -0.40 107.32 114.11 3dpy s GLY 240 Ca 0.10 -1.80 -0.27 0.00 0.00 0.00 0.00 44.72 42.75 3dpy s GLY 240 CO 0.01 -1.67 1.67 -1.33 0.00 0.00 0.00 173.10 171.78 3dpy h GLY 241 N 0.81 -0.41 -2.35 0.20 0.00 -1.84 -3.45 103.07 96.05 3dpy h GLY 241 Ca -0.39 0.22 -0.42 0.00 0.00 0.00 0.00 47.33 46.74 3dpy h GLY 241 CO 0.52 -0.19 -0.66 -1.34 0.00 0.00 0.00 176.54 174.88 3dpy s VAL 242 N -6.11 1.22 0.12 4.60 -7.23 -1.26 -1.61 120.40 110.14 3dpy s VAL 242 Ca -0.15 -2.06 -0.35 0.00 -1.81 0.00 0.00 61.98 57.61 3dpy s VAL 242 Cb 0.07 -2.41 -0.15 0.00 0.56 0.00 0.00 36.38 34.44 3dpy s VAL 242 CO 0.65 -0.29 1.47 -2.65 -0.31 0.00 0.00 175.10 173.97 3dpy n PRO 243 N -0.49 1.67 0.00 4.82 -0.02 -1.26 -1.83 135.00 137.89 3dpy n PRO 243 Ca -0.05 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3dpy n PRO 243 Cb 0.64 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3dpy n PRO 243 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dpy n GLY 244 N 3.02 1.80 3.93 -1.23 0.00 -1.26 -5.04 105.19 106.40 3dpy n GLY 244 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 3dpy n GLY 244 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dpy s MET 245 N -0.85 3.35 0.51 1.61 -1.94 -0.76 -5.04 119.30 116.17 3dpy s MET 245 Ca 0.00 -0.12 -0.23 0.00 -1.71 0.00 0.00 55.69 53.63 3dpy s MET 245 Cb 0.00 -2.48 -0.06 0.00 2.01 0.00 0.00 34.83 34.30 3dpy s MET 245 CO 0.00 -0.18 1.35 -2.00 -0.01 0.00 0.00 175.02 174.17 3dpy s GLU 246 N -4.62 3.37 0.22 2.03 2.12 -1.26 -4.18 118.70 116.38 3dpy s GLU 246 Ca 0.46 2.22 -0.30 0.00 0.36 0.00 0.00 54.97 57.71 3dpy s GLU 246 Cb -0.10 -2.39 -0.10 0.00 0.26 0.00 0.00 34.13 31.80 3dpy s GLU 246 CO 0.41 -1.00 1.45 0.00 -0.54 0.00 0.00 175.26 175.58 3dpy s ALA 247 N -1.31 3.64 -0.01 6.30 0.00 -1.26 -3.96 121.76 125.17 3dpy s ALA 247 Ca 0.68 1.30 -0.01 0.00 0.00 0.00 0.00 51.96 53.92 3dpy s ALA 247 Cb -0.40 -3.56 0.01 0.00 0.00 0.00 0.00 23.12 19.17 3dpy s ALA 247 CO 0.48 -0.72 0.03 -1.58 0.00 0.00 0.00 175.76 173.97 3dpy s HIS 248 N 0.32 -0.02 0.17 0.00 2.46 0.46 -4.62 115.29 114.06 3dpy s HIS 248 Ca 0.62 0.08 -0.16 0.00 0.47 0.00 0.00 55.06 56.06 3dpy s HIS 248 Cb -0.41 -0.02 0.12 0.00 -0.13 0.00 0.00 32.58 32.14 3dpy s HIS 248 CO 0.39 -0.02 1.67 0.78 -2.47 0.00 0.00 174.74 175.09 3dpy h GLY 249 N 6.25 0.33 1.15 1.59 0.00 -1.09 0.37 103.07 111.68 3dpy h GLY 249 Ca -0.27 0.13 -0.06 0.00 0.00 0.00 0.00 47.33 47.13 3dpy h GLY 249 CO 0.49 -0.16 0.18 -1.33 0.00 0.00 0.00 176.54 175.72 3dpy h GLY 250 N 0.02 1.14 1.33 4.60 0.00 -1.86 0.57 103.07 108.86 3dpy h GLY 250 Ca 0.21 -0.69 -0.20 0.00 0.00 0.00 0.00 47.33 46.65 3dpy h GLY 250 CO -0.43 0.64 -0.72 -0.97 0.00 0.00 0.00 176.54 175.06 3dpy h TYR 251 N 1.01 0.89 -0.36 5.60 0.99 -1.71 -2.46 116.97 120.94 3dpy h TYR 251 Ca 0.22 -0.38 -0.02 0.00 2.00 0.00 0.00 58.73 60.55 3dpy h TYR 251 Cb 0.34 -0.14 -0.02 0.00 1.00 0.00 0.00 36.73 37.91 3dpy h TYR 251 CO 0.02 1.18 0.14 1.15 -0.00 0.00 0.00 178.16 180.66 3dpy h THR 252 N 0.47 1.19 -0.27 -2.88 2.02 0.11 -0.44 112.91 113.10 3dpy h THR 252 Ca -0.03 -0.59 0.03 0.00 0.77 0.00 0.00 66.41 66.58 3dpy h THR 252 Cb 1.33 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 68.61 3dpy h THR 252 CO 0.14 0.21 0.08 0.15 0.37 0.00 0.00 175.52 176.47 3dpy h PHE 253 N 0.44 0.14 -0.60 3.16 3.57 -0.90 -0.05 116.94 122.70 3dpy h PHE 253 Ca 0.12 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.68 3dpy h PHE 253 Cb 0.19 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.86 3dpy h PHE 253 CO -0.00 0.05 0.33 0.00 -2.23 0.00 0.00 178.31 176.46 3dpy h GLY 255 N 0.62 -0.45 0.87 0.00 0.00 -0.71 -0.56 103.07 102.84 3dpy h GLY 255 Ca 0.26 0.17 0.02 0.00 0.00 0.00 0.00 47.33 47.78 3dpy h GLY 255 CO -0.16 -0.16 0.12 -2.00 0.00 0.00 0.00 176.54 174.33 3dpy h LEU 256 N -0.77 0.17 -1.03 3.11 5.85 -0.90 0.79 115.31 122.53 3dpy h LEU 256 Ca -0.04 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 3dpy h LEU 256 Cb 0.51 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 3dpy h LEU 256 CO 0.07 0.14 0.16 0.00 -0.34 0.00 0.00 178.44 178.47 3dpy h ALA 257 N 1.14 1.22 -0.64 1.25 0.00 -0.76 0.14 119.26 121.60 3dpy h ALA 257 Ca 0.11 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 3dpy h ALA 257 Cb 0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3dpy h ALA 257 CO -0.08 0.55 0.12 0.00 0.00 0.00 0.00 179.25 179.84 3dpy h ALA 258 N 1.34 0.85 -0.40 0.00 0.00 -0.55 -2.22 119.26 118.27 3dpy h ALA 258 Ca 0.19 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 3dpy h ALA 258 Cb 0.27 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3dpy h ALA 258 CO -0.01 0.60 -0.23 -0.07 0.00 0.00 0.00 179.25 179.55 3dpy h LEU 259 N 0.97 0.83 -0.84 0.00 3.38 0.12 -1.72 115.31 118.05 3dpy h LEU 259 Ca 0.20 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.88 3dpy h LEU 259 Cb 0.41 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 3dpy h LEU 259 CO 0.01 1.03 0.55 0.58 0.09 0.00 0.00 178.44 180.70 3dpy h VAL 260 N 0.71 1.19 -0.44 1.22 2.07 -0.63 0.27 116.25 120.63 3dpy h VAL 260 Ca 0.10 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3dpy h VAL 260 Cb 0.75 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 3dpy h VAL 260 CO 0.06 0.20 0.18 0.40 0.02 0.00 0.00 177.57 178.43 3dpy h ILE 261 N 1.11 1.20 0.00 4.57 2.04 -0.99 -2.01 117.51 123.43 3dpy h ILE 261 Ca 0.32 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3dpy h ILE 261 Cb -0.09 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 3dpy h ILE 261 CO -0.08 0.22 0.00 0.18 0.00 0.00 0.00 178.15 178.47 3dpy n LEU 262 N -4.62 0.00 -3.37 1.44 4.77 -0.68 -4.89 117.00 109.64 3dpy n LEU 262 Ca 0.01 0.18 -0.22 0.00 -0.03 0.00 0.00 56.01 55.95 3dpy n LEU 262 Cb 0.14 -0.18 0.07 0.00 -2.33 0.00 0.00 43.42 41.13 3dpy n LEU 262 CO 0.37 -0.01 0.22 0.29 -1.33 0.00 0.00 177.39 176.94 3dpy n LYS 263 N -1.18 -7.36 -0.90 3.23 5.02 0.16 -4.91 118.16 112.22 3dpy n LYS 263 Ca 0.17 0.77 0.05 0.00 -2.02 0.00 0.00 58.31 57.29 3dpy n LYS 263 Cb 0.19 -5.65 0.13 0.00 -0.02 0.00 0.00 35.03 29.68 3dpy n LYS 263 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3dpy n LYS 264 N -4.65 0.98 -0.14 1.97 4.76 0.70 -4.82 118.16 116.96 3dpy n LYS 264 Ca -0.01 -2.76 0.26 0.00 -2.87 0.00 0.00 58.31 52.93 3dpy n LYS 264 Cb 0.56 -1.01 0.71 0.00 -1.84 0.00 0.00 35.03 33.45 3dpy n LYS 264 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 3dpy h GLU 265 N 0.94 0.02 0.00 1.97 3.07 -1.89 -1.65 114.58 117.04 3dpy h GLU 265 Ca -0.08 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.78 3dpy h GLU 265 Cb 1.33 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 3dpy h GLU 265 CO 0.04 0.01 0.00 0.54 -1.40 0.00 0.00 179.01 178.20 3dpy n ARG 266 N -4.31 0.06 0.29 2.33 1.74 -1.26 -2.52 116.66 113.00 3dpy n ARG 266 Ca 0.16 0.14 0.20 0.00 -0.77 0.00 0.00 57.85 57.58 3dpy n ARG 266 Cb 0.86 -1.58 1.04 0.00 -1.02 0.00 0.00 32.46 31.76 3dpy n ARG 266 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 3dpy h SER 267 N 0.00 0.00 -2.60 0.55 0.02 -1.69 -3.43 113.55 106.40 3dpy h SER 267 Ca 0.00 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.41 3dpy h SER 267 Cb 0.46 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 3dpy h SER 267 CO 0.00 0.00 -0.43 -0.76 -1.14 0.00 0.00 176.83 174.50 3dpy s LEU 268 N -5.78 4.31 -0.85 5.07 1.43 -1.05 -4.90 118.68 116.92 3dpy s LEU 268 Ca -0.04 0.22 -0.25 0.00 -1.03 0.00 0.00 54.13 53.03 3dpy s LEU 268 Cb 0.11 -2.97 0.02 0.00 0.03 0.00 0.00 46.19 43.38 3dpy s LEU 268 CO 0.38 0.02 1.54 0.21 0.23 0.00 0.00 176.35 178.73 3dpy s ASN 269 N -3.26 5.98 0.43 2.29 3.84 -1.26 -4.82 114.94 118.13 3dpy s ASN 269 Ca 0.35 -0.73 0.23 0.00 0.21 0.00 0.00 52.86 52.93 3dpy s ASN 269 Cb -0.11 -2.56 0.84 0.00 -0.55 0.00 0.00 41.25 38.87 3dpy s ASN 269 CO 0.29 -1.95 1.79 -0.07 -2.79 0.00 0.00 177.10 174.37 3dpy h LEU 270 N 14.26 0.00 0.22 3.21 3.38 -1.91 -2.27 115.31 132.21 3dpy h LEU 270 Ca -0.04 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3dpy h LEU 270 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 3dpy h LEU 270 CO 1.31 0.23 -0.11 0.50 0.09 0.00 0.00 178.44 180.47 3dpy h LYS 271 N 0.00 -0.29 -0.07 1.13 1.63 -1.98 -1.61 116.57 115.38 3dpy h LYS 271 Ca -0.00 0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.72 3dpy h LYS 271 Cb 0.80 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.49 3dpy h LYS 271 CO 0.03 0.03 -0.40 0.66 -3.45 0.00 0.00 179.45 176.32 3dpy h SER 272 N -0.65 0.16 -0.38 4.20 4.64 -1.87 -2.33 113.55 117.33 3dpy h SER 272 Ca -0.03 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.21 3dpy h SER 272 Cb 0.46 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 3dpy h SER 272 CO 0.05 0.56 0.19 0.25 -0.87 0.00 0.00 176.83 177.00 3dpy h LEU 273 N 0.13 0.49 -0.59 5.97 5.85 -1.38 -1.64 115.31 124.14 3dpy h LEU 273 Ca 0.01 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 3dpy h LEU 273 Cb 0.78 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 3dpy h LEU 273 CO 0.06 0.47 0.33 0.25 -0.34 0.00 0.00 178.44 179.21 3dpy h LEU 274 N 0.47 0.73 -0.95 2.25 5.85 -0.98 -0.39 115.31 122.28 3dpy h LEU 274 Ca 0.13 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3dpy h LEU 274 Cb 0.11 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.91 3dpy h LEU 274 CO -0.02 0.61 0.50 -0.61 -0.34 0.00 0.00 178.44 178.58 3dpy h GLN 275 N 0.79 1.23 -0.16 1.25 4.15 -1.31 -2.10 115.11 118.97 3dpy h GLN 275 Ca 0.21 -0.13 -0.05 0.00 0.77 0.00 0.00 58.65 59.44 3dpy h GLN 275 Cb 0.04 -0.25 -0.00 0.00 0.21 0.00 0.00 27.48 27.48 3dpy h GLN 275 CO -0.03 0.89 -0.11 2.35 -1.93 0.00 0.00 178.83 180.00 3dpy h TRP 276 N 1.24 0.42 -0.68 3.99 7.01 -0.74 -2.72 115.95 124.47 3dpy h TRP 276 Ca 0.32 -0.11 -0.07 0.00 2.11 0.00 0.00 58.89 61.14 3dpy h TRP 276 Cb 0.00 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 26.94 3dpy h TRP 276 CO 0.01 0.70 0.16 -0.24 -2.79 0.00 0.00 178.44 176.28 3dpy h VAL 277 N 0.01 1.26 0.00 2.65 3.04 -0.95 -2.76 116.25 119.50 3dpy h VAL 277 Ca 0.03 -0.96 -0.03 0.00 -1.01 0.00 0.00 66.70 64.73 3dpy h VAL 277 Cb 0.61 0.57 -0.00 0.00 -2.01 0.00 0.00 31.29 30.45 3dpy h VAL 277 CO 0.03 0.37 -0.15 0.71 -1.01 0.00 0.00 177.57 177.51 3dpy h THR 278 N 1.03 0.36 0.00 3.17 1.35 -1.42 -1.43 112.91 115.98 3dpy h THR 278 Ca 0.21 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 3dpy h THR 278 Cb 0.37 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 3dpy h THR 278 CO 0.00 0.15 0.00 -1.20 -0.25 0.00 0.00 175.52 174.22 3dpy n SER 279 N -3.28 0.00 -0.26 5.36 7.64 -1.03 -3.42 113.62 118.64 3dpy n SER 279 Ca 0.01 -0.29 0.12 0.00 1.01 0.00 0.00 58.87 59.72 3dpy n SER 279 Cb 0.42 -0.21 0.25 0.00 -1.01 0.00 0.00 64.21 63.66 3dpy n SER 279 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3dpy n ARG 280 N -1.21 0.78 -2.87 1.43 5.12 -0.54 -4.80 116.66 114.58 3dpy n ARG 280 Ca 0.15 -0.53 -0.41 0.00 -1.93 0.00 0.00 57.85 55.13 3dpy n ARG 280 Cb 0.18 -1.49 -0.04 0.00 -1.16 0.00 0.00 32.46 29.95 3dpy n ARG 280 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 3dpy s GLN 281 N -2.58 4.34 0.11 5.56 0.74 -1.22 -1.05 119.66 125.56 3dpy s GLN 281 Ca 0.21 1.07 -0.30 0.00 0.05 0.00 0.00 55.36 56.38 3dpy s GLN 281 Cb 0.19 -3.55 -0.07 0.00 1.10 0.00 0.00 33.01 30.67 3dpy s GLN 281 CO 0.57 -0.28 1.24 -1.64 -0.55 0.00 0.00 175.29 174.62 3dpy s MET 282 N 1.97 4.43 0.38 1.67 -1.94 0.52 -4.92 119.30 121.40 3dpy s MET 282 Ca 0.40 1.86 0.13 0.00 -1.71 0.00 0.00 55.69 56.37 3dpy s MET 282 Cb -0.17 -3.29 0.73 0.00 2.01 0.00 0.00 34.83 34.11 3dpy s MET 282 CO 0.14 -0.24 1.84 0.07 -0.01 0.00 0.00 175.02 176.82 3dpy h ARG 283 N 6.28 0.00 0.01 2.03 0.11 -1.89 -1.14 114.38 119.79 3dpy h ARG 283 Ca -0.43 -0.00 -0.36 0.00 0.10 0.00 0.00 59.98 59.29 3dpy h ARG 283 Cb 1.21 -0.00 -0.05 0.00 1.11 0.00 0.00 29.97 32.24 3dpy h ARG 283 CO 0.80 0.36 -2.00 0.34 0.10 0.00 0.00 179.97 179.57 3dpy n PHE 284 N -4.11 0.49 0.07 4.08 7.35 -1.26 -4.58 117.46 119.51 3dpy n PHE 284 Ca -0.02 0.19 -0.12 0.00 -0.76 0.00 0.00 57.45 56.75 3dpy n PHE 284 Cb 0.40 -1.05 -0.03 0.00 0.35 0.00 0.00 39.48 39.14 3dpy n PHE 284 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 3dpy h GLU 285 N -0.85 0.35 0.00 -4.13 3.07 -1.92 -3.48 114.58 107.61 3dpy h GLU 285 Ca -0.54 -0.37 0.00 0.00 -0.50 0.00 0.00 59.36 57.95 3dpy h GLU 285 Cb 1.54 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 29.56 3dpy h GLU 285 CO -0.28 1.05 0.00 0.41 -1.40 0.00 0.00 179.01 178.79 3dpy n GLY 286 N 0.90 3.19 2.42 -3.84 0.00 -0.43 -4.49 105.19 102.94 3dpy n GLY 286 Ca -0.06 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.79 3dpy n GLY 286 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpy n GLY 287 N -2.00 -0.86 3.73 -0.02 0.00 -1.26 -3.56 105.19 101.23 3dpy n GLY 287 Ca 0.00 -1.77 -0.27 0.00 0.00 0.00 0.00 46.02 43.98 3dpy n GLY 287 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dpy s PHE 288 N -2.58 3.01 0.30 1.61 0.40 -1.26 -0.35 117.98 119.10 3dpy s PHE 288 Ca 0.46 -0.07 0.07 0.00 -0.60 0.00 0.00 56.93 56.79 3dpy s PHE 288 Cb -0.02 -1.46 -0.03 0.00 0.51 0.00 0.00 43.02 42.03 3dpy s PHE 288 CO 0.32 0.52 0.27 1.14 0.70 0.00 0.00 175.22 178.16 3dpy s GLN 289 N -2.98 2.86 0.07 0.44 -2.07 -0.21 -1.02 119.66 116.74 3dpy s GLN 289 Ca 0.29 -1.16 0.06 0.00 -1.82 0.00 0.00 55.36 52.73 3dpy s GLN 289 Cb -0.10 -2.55 -0.23 0.00 -1.09 0.00 0.00 33.01 29.04 3dpy s GLN 289 CO 0.21 0.23 1.09 0.78 -1.32 0.00 0.00 175.29 176.28 3dpy h GLY 290 N 1.32 0.06 -3.10 2.60 0.00 -1.89 -3.46 103.07 98.61 3dpy h GLY 290 Ca -0.47 -0.16 -0.05 0.00 0.00 0.00 0.00 47.33 46.65 3dpy h GLY 290 CO 0.59 0.14 -0.08 1.09 0.00 0.00 0.00 176.54 178.29 3dpy s ARG 291 N -2.67 1.06 0.26 4.80 1.70 -1.26 -0.52 118.95 122.32 3dpy s ARG 291 Ca -0.02 -0.70 -0.30 0.00 -0.47 0.00 0.00 55.73 54.24 3dpy s ARG 291 Cb 0.09 0.47 -0.14 0.00 -0.57 0.00 0.00 34.95 34.80 3dpy s ARG 291 CO 0.83 -0.41 1.27 0.00 -1.08 0.00 0.00 175.30 175.91 3dpy n ASN 293 N 1.67 -4.77 -1.94 0.00 3.02 -1.26 -5.01 115.26 106.97 3dpy n ASN 293 Ca 0.10 0.35 0.00 0.00 -0.03 0.00 0.00 54.58 55.00 3dpy n ASN 293 Cb 0.31 -3.60 0.00 0.00 -0.61 0.00 0.00 39.78 35.88 3dpy n ASN 293 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3dpy n LYS 294 N -2.56 1.69 -3.60 3.52 5.02 -0.91 -4.96 118.16 116.36 3dpy n LYS 294 Ca -0.15 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 55.87 3dpy n LYS 294 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.48 3dpy n LYS 294 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dpy s LEU 295 N 0.00 4.17 0.62 -0.35 1.43 -1.26 -4.91 118.68 118.38 3dpy s LEU 295 Ca 0.00 0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 53.38 3dpy s LEU 295 Cb 0.00 -3.25 -0.02 0.00 0.03 0.00 0.00 46.19 42.95 3dpy s LEU 295 CO 0.00 -0.10 1.21 0.54 0.23 0.00 0.00 176.35 178.23 3dpy s VAL 296 N -1.96 2.56 -0.25 -1.59 0.11 -1.26 -4.29 120.40 113.72 3dpy s VAL 296 Ca 0.40 0.33 -0.10 0.00 -2.93 0.00 0.00 61.98 59.67 3dpy s VAL 296 Cb -0.11 -3.07 0.10 0.00 -1.53 0.00 0.00 36.38 31.76 3dpy s VAL 296 CO 0.30 -0.09 0.55 -0.62 -3.33 0.00 0.00 175.10 171.91 3dpy s ASP 297 N -1.69 -0.75 0.63 3.54 3.68 -0.19 -4.83 116.67 117.06 3dpy s ASP 297 Ca 0.77 1.29 0.29 0.00 2.13 0.00 0.00 52.55 57.03 3dpy s ASP 297 Cb -0.30 1.59 1.59 0.00 -1.45 0.00 0.00 42.92 44.34 3dpy s ASP 297 CO 0.36 -0.22 1.93 1.23 0.13 0.00 0.00 175.17 178.60 3dpy h GLY 298 N 7.69 0.00 2.00 2.66 0.00 -1.32 -0.88 103.07 113.22 3dpy h GLY 298 Ca -0.23 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.07 3dpy h GLY 298 CO 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 176.54 176.54 3dpy n TYR 300 N -3.14 0.18 0.32 0.00 0.53 -0.33 -2.19 117.16 112.52 3dpy n TYR 300 Ca 0.03 0.06 0.17 0.00 -1.02 0.00 0.00 57.90 57.15 3dpy n TYR 300 Cb 0.59 -0.60 0.91 0.00 -1.03 0.00 0.00 39.34 39.21 3dpy n TYR 300 CO 0.00 0.00 0.00 0.77 -1.02 0.00 0.00 176.86 176.61 3dpy h SER 301 N 0.00 0.00 0.00 7.72 0.02 -1.48 -1.68 113.55 118.13 3dpy h SER 301 Ca 0.00 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 60.73 3dpy h SER 301 Cb 0.38 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 3dpy h SER 301 CO 0.00 0.00 -1.68 0.33 -1.14 0.00 0.00 176.83 174.34 3dpy n PHE 302 N -3.04 0.00 -0.23 3.45 7.35 -0.93 -4.03 117.46 120.03 3dpy n PHE 302 Ca -0.01 0.00 -0.04 0.00 -0.76 0.00 0.00 57.45 56.64 3dpy n PHE 302 Cb 0.32 -0.68 0.07 0.00 0.35 0.00 0.00 39.48 39.53 3dpy n PHE 302 CO 0.00 0.00 0.00 -1.49 -0.76 0.00 0.00 176.76 174.51 3dpy h TRP 303 N -0.90 0.75 0.00 -5.13 4.06 -1.52 0.65 115.95 113.86 3dpy h TRP 303 Ca -0.33 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.64 3dpy h TRP 303 Cb 1.24 -0.24 0.00 0.00 -1.00 0.00 0.00 29.16 29.16 3dpy h TRP 303 CO -0.23 0.42 -0.01 1.96 -3.56 0.00 0.00 178.44 177.02 3dpy h GLN 304 N 0.78 0.00 0.00 0.49 1.08 -1.56 -3.35 115.11 112.55 3dpy h GLN 304 Ca 0.26 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.45 3dpy h GLN 304 Cb 0.03 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.46 3dpy h GLN 304 CO -0.11 0.00 -0.05 0.00 -0.95 0.00 0.00 178.83 177.72 3dpy h ALA 305 N -1.08 1.67 0.00 3.87 0.00 -1.55 -1.24 119.26 120.94 3dpy h ALA 305 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3dpy h ALA 305 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3dpy h ALA 305 CO 0.00 0.06 0.00 0.41 0.00 0.00 0.00 179.25 179.72 3dpy n GLY 306 N -1.25 -1.20 0.21 0.00 0.00 0.23 -2.51 105.19 100.67 3dpy n GLY 306 Ca -0.03 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.07 3dpy n GLY 306 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dpy h LEU 307 N 0.00 0.00 -0.37 0.99 3.38 -1.35 -3.31 115.31 114.64 3dpy h LEU 307 Ca 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 3dpy h LEU 307 Cb 0.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 3dpy h LEU 307 CO 0.00 0.25 -0.66 -0.07 0.09 0.00 0.00 178.44 178.05 3dpy h LEU 308 N 0.00 0.69 -1.45 1.67 3.38 -1.65 0.11 115.31 118.06 3dpy h LEU 308 Ca -0.00 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.50 3dpy h LEU 308 Cb 0.86 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 3dpy h LEU 308 CO 0.03 1.17 -0.16 -0.65 0.09 0.00 0.00 178.44 178.92 3dpy h PRO 309 N 0.44 0.16 -0.18 1.13 0.11 -1.75 0.13 132.00 132.02 3dpy h PRO 309 Ca -0.02 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.96 3dpy h PRO 309 Cb 1.24 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 3dpy h PRO 309 CO 0.13 0.32 -0.27 -0.07 -0.21 0.00 0.00 178.00 177.90 3dpy h LEU 310 N 0.15 0.56 -0.84 2.35 3.38 -1.50 -1.99 115.31 117.40 3dpy h LEU 310 Ca 0.03 -0.52 -0.11 0.00 0.09 0.00 0.00 57.88 57.37 3dpy h LEU 310 Cb 0.38 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3dpy h LEU 310 CO 0.02 0.97 -0.33 -0.07 0.09 0.00 0.00 178.44 179.12 3dpy h LEU 311 N 0.16 0.49 -0.60 1.67 3.38 -0.69 -1.50 115.31 118.23 3dpy h LEU 311 Ca 0.02 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 3dpy h LEU 311 Cb 0.84 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3dpy h LEU 311 CO 0.06 0.79 0.08 -0.74 0.09 0.00 0.00 178.44 178.73 3dpy h HIS 312 N 0.41 1.07 0.00 1.13 2.76 -0.69 -0.56 115.15 119.27 3dpy h HIS 312 Ca 0.05 -0.15 -0.13 0.00 -2.20 0.00 0.00 60.37 57.94 3dpy h HIS 312 Cb 0.77 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 29.42 3dpy h HIS 312 CO 0.03 0.92 -0.60 -0.09 -1.30 0.00 0.00 177.93 176.89 3dpy h ARG 313 N 0.90 0.00 0.01 5.26 2.43 -1.19 -2.21 114.38 119.58 3dpy h ARG 313 Ca 0.18 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.26 3dpy h ARG 313 Cb 0.44 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.00 3dpy h ARG 313 CO 0.01 0.60 -0.37 0.00 -1.51 0.00 0.00 179.97 178.70 3dpy h ALA 314 N 1.40 0.04 -0.43 2.80 0.00 -1.05 -2.69 119.26 119.33 3dpy h ALA 314 Ca -0.01 -0.51 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 3dpy h ALA 314 Cb 1.19 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3dpy h ALA 314 CO 0.08 0.17 -0.08 -0.07 0.00 0.00 0.00 179.25 179.35 3dpy h LEU 315 N -0.40 0.73 -1.44 0.00 3.38 -1.15 -2.23 115.31 114.19 3dpy h LEU 315 Ca -0.05 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 3dpy h LEU 315 Cb 1.12 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 3dpy h LEU 315 CO 0.07 0.84 -0.28 -0.74 0.09 0.00 0.00 178.44 178.42 3dpy h HIS 316 N 0.68 0.00 -0.05 1.13 2.76 -1.47 -1.55 115.15 116.66 3dpy h HIS 316 Ca 0.12 0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 58.18 3dpy h HIS 316 Cb 0.53 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.48 3dpy h HIS 316 CO 0.03 0.28 -0.50 0.00 -1.30 0.00 0.00 177.93 176.44 3dpy h ALA 317 N 1.72 1.08 0.00 5.26 0.00 -1.06 -2.29 119.26 123.96 3dpy h ALA 317 Ca -0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 3dpy h ALA 317 Cb 0.51 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3dpy h ALA 317 CO 0.04 0.64 -0.16 1.96 0.00 0.00 0.00 179.25 181.73 3dpy h GLN 318 N 0.10 0.00 0.00 0.00 4.20 -1.01 -3.47 115.11 114.93 3dpy h GLN 318 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3dpy h GLN 318 Cb 0.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 3dpy h GLN 318 CO 0.07 0.16 0.00 0.41 -0.67 0.00 0.00 178.83 178.81 3dpy n GLY 319 N 0.43 1.55 3.63 3.46 0.00 -0.80 -5.03 105.19 108.42 3dpy n GLY 319 Ca 0.01 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 3dpy n GLY 319 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dpy s ASP 320 N -2.27 6.08 0.33 1.61 -1.08 -0.67 -4.87 116.67 115.81 3dpy s ASP 320 Ca 0.00 2.23 0.24 0.00 -0.52 0.00 0.00 52.55 54.51 3dpy s ASP 320 Cb 0.00 -2.52 0.56 0.00 -1.46 0.00 0.00 42.92 39.50 3dpy s ASP 320 CO 0.00 -1.41 1.69 1.55 0.52 0.00 0.00 175.17 177.51 3dpy h PRO 321 N 12.24 0.00 -0.00 4.34 0.13 -1.96 -3.32 132.00 143.43 3dpy h PRO 321 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3dpy h PRO 321 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 3dpy h PRO 321 CO 0.96 0.00 -0.15 0.00 -0.23 0.00 0.00 178.00 178.58 3dpy n ALA 322 N -1.95 2.84 -1.82 -0.56 0.00 -1.26 -4.91 120.51 112.85 3dpy n ALA 322 Ca 0.05 -0.29 -0.41 0.00 0.00 0.00 0.00 53.44 52.78 3dpy n ALA 322 Cb 0.48 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.63 3dpy n ALA 322 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dpy s LEU 323 N -2.51 4.36 0.62 0.00 1.43 -1.25 -4.97 118.68 116.36 3dpy s LEU 323 Ca 0.27 2.82 -0.18 0.00 -1.03 0.00 0.00 54.13 56.01 3dpy s LEU 323 Cb 0.20 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.77 3dpy s LEU 323 CO 0.49 -0.81 1.21 -0.55 0.23 0.00 0.00 176.35 176.92 3dpy s SER 324 N 0.42 4.99 -0.06 2.29 0.15 -1.26 -4.96 113.70 115.28 3dpy s SER 324 Ca 0.61 2.38 0.13 0.00 0.70 0.00 0.00 55.95 59.77 3dpy s SER 324 Cb -0.45 -2.60 0.40 0.00 -1.71 0.00 0.00 66.02 61.66 3dpy s SER 324 CO 0.46 -1.72 1.33 0.23 1.20 0.00 0.00 173.24 174.73 3dpy n MET 325 N -1.83 2.93 0.00 5.44 0.00 -1.26 -4.62 117.12 117.79 3dpy n MET 325 Ca 0.14 -2.33 0.00 0.00 0.00 0.00 0.00 57.70 55.51 3dpy n MET 325 Cb 0.50 -1.47 0.00 0.00 0.00 0.00 0.00 33.22 32.25 3dpy n MET 325 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 3dpy n SER 326 N 0.27 0.30 -4.29 7.83 3.41 -1.26 -4.72 113.62 115.15 3dpy n SER 326 Ca 0.15 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.55 3dpy n SER 326 Cb 0.59 0.04 -0.12 0.00 -0.26 0.00 0.00 64.21 64.46 3dpy n SER 326 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3dpy s HIS 327 N -0.90 1.68 0.74 7.33 3.76 -1.26 -4.61 115.29 122.04 3dpy s HIS 327 Ca 0.00 -0.48 -0.12 0.00 -0.15 0.00 0.00 55.06 54.32 3dpy s HIS 327 Cb 0.00 -0.87 0.04 0.00 1.11 0.00 0.00 32.58 32.86 3dpy s HIS 327 CO 0.00 0.24 1.13 -1.58 -0.85 0.00 0.00 174.74 173.68 3dpy s TRP 328 N -1.83 3.18 -0.29 1.40 0.23 -1.26 -4.70 118.94 115.68 3dpy s TRP 328 Ca 0.11 0.95 -0.03 0.00 -2.03 0.00 0.00 56.10 55.10 3dpy s TRP 328 Cb -0.07 -3.22 0.03 0.00 0.03 0.00 0.00 33.47 30.24 3dpy s TRP 328 CO 0.05 -1.40 2.67 -1.33 0.96 0.00 0.00 176.95 177.90 3dpy n MET 329 N -3.13 2.04 -4.06 4.98 2.81 -1.26 -4.80 117.12 113.69 3dpy n MET 329 Ca 0.07 -1.66 -0.10 0.00 -1.81 0.00 0.00 57.70 54.21 3dpy n MET 329 Cb 0.58 -1.87 -0.09 0.00 -0.71 0.00 0.00 33.22 31.14 3dpy n MET 329 CO 0.00 0.00 0.00 -0.59 1.51 0.00 0.00 175.97 176.89 3dpy s PHE 330 N -1.05 0.64 -0.93 2.03 -0.12 -1.26 -4.86 117.98 112.43 3dpy s PHE 330 Ca 0.48 -1.01 -0.24 0.00 -0.05 0.00 0.00 56.93 56.11 3dpy s PHE 330 Cb 0.30 -0.28 -0.04 0.00 -0.63 0.00 0.00 43.02 42.37 3dpy s PHE 330 CO -0.10 -0.62 1.91 -1.58 -0.05 0.00 0.00 175.22 174.79 3dpy s HIS 331 N -4.01 1.87 0.21 3.49 5.65 -1.26 -4.79 115.29 116.44 3dpy s HIS 331 Ca 0.21 0.52 -0.09 0.00 0.25 0.00 0.00 55.06 55.95 3dpy s HIS 331 Cb 0.05 -4.09 0.17 0.00 -1.18 0.00 0.00 32.58 27.53 3dpy s HIS 331 CO 0.01 -1.72 1.83 1.96 -0.65 0.00 0.00 174.74 176.16 3dpy h GLN 332 N 11.08 1.12 0.18 2.88 4.20 -1.89 -2.04 115.11 130.64 3dpy h GLN 332 Ca 0.11 -0.14 0.01 0.00 0.06 0.00 0.00 58.65 58.69 3dpy h GLN 332 Cb 1.00 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.54 3dpy h GLN 332 CO 1.23 0.84 -0.23 0.37 -0.67 0.00 0.00 178.83 180.36 3dpy h GLN 333 N 1.12 -0.45 -0.05 1.46 4.15 -1.87 -2.38 115.11 117.08 3dpy h GLN 333 Ca 0.28 0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.68 3dpy h GLN 333 Cb 0.05 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 3dpy h GLN 333 CO -0.04 -0.30 -0.22 0.00 -1.93 0.00 0.00 178.83 176.34 3dpy h ALA 334 N 0.26 1.54 -0.28 3.38 0.00 -1.82 -0.42 119.26 121.93 3dpy h ALA 334 Ca 0.01 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.57 3dpy h ALA 334 Cb 0.45 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3dpy h ALA 334 CO -0.08 0.34 -0.29 1.25 0.00 0.00 0.00 179.25 180.46 3dpy h LEU 335 N 0.08 0.74 -0.50 0.00 5.85 -1.29 -1.51 115.31 118.68 3dpy h LEU 335 Ca 0.01 -0.48 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 3dpy h LEU 335 Cb 0.43 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 3dpy h LEU 335 CO 0.03 1.06 0.25 1.56 -0.34 0.00 0.00 178.44 181.01 3dpy h GLN 336 N 0.42 0.71 -0.45 1.25 4.20 -0.86 -1.65 115.11 118.73 3dpy h GLN 336 Ca 0.04 -0.10 0.06 0.00 0.06 0.00 0.00 58.65 58.72 3dpy h GLN 336 Cb 0.86 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.45 3dpy h GLN 336 CO 0.07 0.58 0.14 0.93 -0.67 0.00 0.00 178.83 179.88 3dpy h GLU 337 N 0.66 0.30 -0.33 1.46 5.08 -1.07 -0.49 114.58 120.20 3dpy h GLU 337 Ca 0.17 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3dpy h GLU 337 Cb 0.09 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 3dpy h GLU 337 CO -0.02 0.20 0.20 -0.92 -1.00 0.00 0.00 179.01 177.47 3dpy h TYR 338 N 0.31 0.43 0.11 4.33 3.20 -0.90 -1.68 116.97 122.76 3dpy h TYR 338 Ca 0.22 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 3dpy h TYR 338 Cb 0.23 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.36 3dpy h TYR 338 CO -0.17 0.30 -0.05 0.82 -1.64 0.00 0.00 178.16 177.42 3dpy h ILE 339 N 0.43 1.02 -0.57 1.81 2.04 -0.99 -0.23 117.51 121.03 3dpy h ILE 339 Ca 0.12 -0.51 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 3dpy h ILE 339 Cb -0.01 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 3dpy h ILE 339 CO -0.02 0.12 -0.02 -0.07 0.00 0.00 0.00 178.15 178.16 3dpy h LEU 340 N -0.38 0.98 0.14 1.44 3.38 -1.07 -1.24 115.31 118.56 3dpy h LEU 340 Ca -0.01 -0.28 -0.34 0.00 0.09 0.00 0.00 57.88 57.34 3dpy h LEU 340 Cb 0.31 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3dpy h LEU 340 CO 0.02 1.05 -1.74 0.24 0.09 0.00 0.00 178.44 178.10 3dpy h MET 341 N 0.91 0.30 0.00 1.13 2.86 -1.35 -3.41 114.93 115.37 3dpy h MET 341 Ca 0.16 -0.51 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 3dpy h MET 341 Cb 0.56 0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.41 3dpy h MET 341 CO 0.03 1.18 -1.53 0.00 1.06 0.00 0.00 176.91 177.65 3dpy s GLN 344 N -0.99 4.11 -0.13 0.00 -0.21 -1.23 -0.35 119.66 120.86 3dpy s GLN 344 Ca 0.21 -0.22 -0.19 0.00 0.02 0.00 0.00 55.36 55.19 3dpy s GLN 344 Cb 0.11 -3.39 -0.04 0.00 1.00 0.00 0.00 33.01 30.69 3dpy s GLN 344 CO 0.15 0.34 0.53 0.00 -2.12 0.00 0.00 175.29 174.20 3dpy h PRO 346 N 6.93 0.56 0.00 0.00 0.11 -1.98 0.18 132.00 137.80 3dpy h PRO 346 Ca -0.39 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3dpy h PRO 346 Cb 1.17 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3dpy h PRO 346 CO 0.75 0.37 0.00 0.00 -0.21 0.00 0.00 178.00 178.92 3dpy n ALA 347 N -2.48 2.32 0.00 -0.75 0.00 -1.26 -4.99 120.51 113.35 3dpy n ALA 347 Ca 0.10 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3dpy n ALA 347 Cb 0.28 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.30 3dpy n ALA 347 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dpy n GLY 348 N 0.96 2.89 0.00 0.00 0.00 0.62 -4.83 105.19 104.83 3dpy n GLY 348 Ca 0.13 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.28 3dpy n GLY 348 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dpy n GLY 349 N 0.15 -2.21 3.53 -0.02 0.00 -1.26 -4.55 105.19 100.84 3dpy n GLY 349 Ca 0.00 -1.49 -0.25 0.00 0.00 0.00 0.00 46.02 44.28 3dpy n GLY 349 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dpy s LEU 350 N -4.20 2.67 0.27 0.99 1.02 -1.26 -1.63 118.68 116.54 3dpy s LEU 350 Ca 0.00 -1.26 -0.00 0.00 0.02 0.00 0.00 54.13 52.89 3dpy s LEU 350 Cb 0.00 -0.83 -0.03 0.00 0.02 0.00 0.00 46.19 45.35 3dpy s LEU 350 CO 0.00 -0.34 0.27 -1.48 0.02 0.00 0.00 176.35 174.82 3dpy s LEU 351 N -3.59 1.21 0.01 1.79 0.05 0.52 -3.49 118.68 115.19 3dpy s LEU 351 Ca 0.33 -1.46 -0.09 0.00 0.05 0.00 0.00 54.13 52.96 3dpy s LEU 351 Cb 0.05 0.76 -0.05 0.00 -2.05 0.00 0.00 46.19 44.90 3dpy s LEU 351 CO 0.16 -1.01 1.08 -0.78 -0.55 0.00 0.00 176.35 175.25 3dpy h ASP 352 N 2.36 -0.29 -5.19 1.48 1.82 -1.88 -3.38 116.42 111.34 3dpy h ASP 352 Ca -0.30 0.01 -0.06 0.00 -0.39 0.00 0.00 57.03 56.28 3dpy h ASP 352 Cb 1.24 0.07 -0.11 0.00 0.68 0.00 0.00 39.33 41.22 3dpy h ASP 352 CO 0.44 -0.20 -0.16 -1.59 -1.61 0.00 0.00 179.24 176.12 3dpy s LYS 353 N -3.63 1.29 0.20 0.28 -2.85 -1.26 -1.15 119.74 112.62 3dpy s LYS 353 Ca -0.05 -1.06 -0.32 0.00 -1.00 0.00 0.00 55.97 53.54 3dpy s LYS 353 Cb 0.00 0.44 -0.15 0.00 -2.06 0.00 0.00 37.83 36.07 3dpy s LYS 353 CO 0.15 -0.51 1.21 -2.30 0.10 0.00 0.00 175.35 173.99 3dpy n PRO 354 N -0.28 1.39 0.00 1.78 -0.02 -1.18 -1.25 135.00 135.44 3dpy n PRO 354 Ca -0.08 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 3dpy n PRO 354 Cb 0.63 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 3dpy n PRO 354 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dpy n GLY 355 N 1.98 3.16 3.90 -1.23 0.00 -1.26 -5.05 105.19 106.68 3dpy n GLY 355 Ca 0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 3dpy n GLY 355 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dpy s LYS 356 N -0.60 3.59 0.02 1.61 -0.14 -0.38 -5.08 119.74 118.75 3dpy s LYS 356 Ca 0.00 0.30 -0.02 0.00 -1.36 0.00 0.00 55.97 54.89 3dpy s LYS 356 Cb 0.00 -2.35 -0.04 0.00 -1.68 0.00 0.00 37.83 33.76 3dpy s LYS 356 CO 0.00 -0.21 0.19 -1.54 -0.76 0.00 0.00 175.35 173.03 3dpy s SER 357 N -3.96 6.37 0.68 2.83 1.04 -1.26 -4.89 113.70 114.50 3dpy s SER 357 Ca 0.49 0.32 -0.17 0.00 0.48 0.00 0.00 55.95 57.07 3dpy s SER 357 Cb -0.10 -1.99 0.01 0.00 0.10 0.00 0.00 66.02 64.04 3dpy s SER 357 CO 0.44 0.23 1.25 0.00 0.98 0.00 0.00 173.24 176.14 3dpy s ARG 358 N -2.15 2.40 0.24 4.02 1.70 -1.26 -4.76 118.95 119.14 3dpy s ARG 358 Ca 0.30 1.92 -0.14 0.00 -0.47 0.00 0.00 55.73 57.35 3dpy s ARG 358 Cb -0.13 -1.84 0.00 0.00 -0.57 0.00 0.00 34.95 32.41 3dpy s ARG 358 CO 0.22 -1.68 0.50 0.16 -1.08 0.00 0.00 175.30 173.42 3dpy s ASP 359 N -1.67 -0.11 0.37 -2.89 1.47 -1.23 -5.03 116.67 107.58 3dpy s ASP 359 Ca 0.79 -0.86 0.19 0.00 1.18 0.00 0.00 52.55 53.85 3dpy s ASP 359 Cb -0.33 0.59 0.63 0.00 -0.34 0.00 0.00 42.92 43.47 3dpy s ASP 359 CO 0.41 -1.14 1.71 -0.26 0.68 0.00 0.00 175.17 176.57 3dpy h PHE 360 N 2.24 0.00 0.20 2.11 -1.00 -1.97 -2.18 116.94 116.33 3dpy h PHE 360 Ca -0.26 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.51 3dpy h PHE 360 Cb 1.25 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.81 3dpy h PHE 360 CO 0.40 0.37 -0.09 -0.92 -1.61 0.00 0.00 178.31 176.45 3dpy h TYR 361 N 0.00 -0.25 0.00 -0.55 3.20 -1.94 -1.13 116.97 116.31 3dpy h TYR 361 Ca -0.00 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 3dpy h TYR 361 Cb 0.94 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 3dpy h TYR 361 CO 0.00 -0.03 -0.25 0.45 -1.64 0.00 0.00 178.16 176.69 3dpy h HIS 362 N -0.43 0.00 -0.35 -3.82 3.86 -1.80 -2.45 115.15 110.15 3dpy h HIS 362 Ca -0.03 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.11 3dpy h HIS 362 Cb 0.33 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.79 3dpy h HIS 362 CO -0.02 0.25 -0.07 1.15 0.86 0.00 0.00 177.93 180.10 3dpy h THR 363 N 0.00 1.27 -0.40 2.45 2.02 -1.27 -1.44 112.91 115.54 3dpy h THR 363 Ca -0.00 -1.12 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 3dpy h THR 363 Cb 0.75 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 3dpy h THR 363 CO 0.03 0.37 0.21 0.00 0.37 0.00 0.00 175.52 176.51 3dpy n TYR 365 N -4.72 0.43 -0.01 0.00 4.02 -0.96 -1.80 117.16 114.12 3dpy n TYR 365 Ca 0.00 0.12 -0.13 0.00 -0.01 0.00 0.00 57.90 57.88 3dpy n TYR 365 Cb 0.09 -0.59 -0.01 0.00 -0.02 0.00 0.00 39.34 38.81 3dpy n TYR 365 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3dpy h LEU 367 N 0.48 0.41 -0.52 0.00 3.38 -1.57 -0.28 115.31 117.21 3dpy h LEU 367 Ca -0.02 -0.44 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 3dpy h LEU 367 Cb 1.27 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 3dpy h LEU 367 CO 0.13 1.34 0.29 0.28 0.09 0.00 0.00 178.44 180.57 3dpy h SER 368 N 0.07 0.64 -0.15 -0.43 0.02 -1.41 -0.56 113.55 111.73 3dpy h SER 368 Ca -0.13 -0.09 0.01 0.00 -0.84 0.00 0.00 61.79 60.75 3dpy h SER 368 Cb 1.96 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 64.32 3dpy h SER 368 CO 0.20 0.54 0.07 1.23 -1.14 0.00 0.00 176.83 177.73 3dpy h GLY 369 N 0.69 0.19 0.85 -3.77 0.00 -1.16 -1.63 103.07 98.25 3dpy h GLY 369 Ca 0.18 -0.05 0.03 0.00 0.00 0.00 0.00 47.33 47.49 3dpy h GLY 369 CO -0.03 0.04 0.25 -2.00 0.00 0.00 0.00 176.54 174.80 3dpy h LEU 370 N 0.15 0.40 -0.49 3.11 5.85 -0.81 -0.64 115.31 122.88 3dpy h LEU 370 Ca 0.06 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3dpy h LEU 370 Cb 0.02 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 3dpy h LEU 370 CO -0.05 0.28 0.22 -1.28 -0.34 0.00 0.00 178.44 177.27 3dpy h SER 371 N 0.51 0.28 -0.23 1.25 0.87 -0.98 -0.72 113.55 114.52 3dpy h SER 371 Ca 0.19 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.82 3dpy h SER 371 Cb 0.04 -0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 61.96 3dpy h SER 371 CO -0.10 0.20 0.01 0.40 -0.53 0.00 0.00 176.83 176.81 3dpy h ILE 372 N 0.43 0.85 0.00 2.23 1.08 -0.49 -0.55 117.51 121.06 3dpy h ILE 372 Ca 0.22 -0.03 0.00 0.00 -0.39 0.00 0.00 64.86 64.66 3dpy h ILE 372 Cb 0.18 0.75 0.00 0.00 -3.07 0.00 0.00 36.82 34.68 3dpy h ILE 372 CO -0.19 0.02 0.00 0.00 -0.69 0.00 0.00 178.15 177.29 3dpy n ALA 373 N -2.35 1.73 -0.03 1.87 0.00 -0.32 -2.60 120.51 118.80 3dpy n ALA 373 Ca -0.02 0.02 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 3dpy n ALA 373 Cb 0.12 -1.34 -0.14 0.00 0.00 0.00 0.00 19.45 18.09 3dpy n ALA 373 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3dpy n GLN 374 N -1.92 0.67 -4.52 0.00 6.02 -0.32 -4.60 117.38 112.70 3dpy n GLN 374 Ca 0.03 0.23 -0.33 0.00 -0.01 0.00 0.00 57.00 56.92 3dpy n GLN 374 Cb 0.22 -1.71 -0.14 0.00 1.02 0.00 0.00 30.24 29.63 3dpy n GLN 374 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 3dpy s HIS 375 N -2.57 2.85 -0.14 1.08 3.76 -0.29 -1.73 115.29 118.25 3dpy s HIS 375 Ca -0.12 -0.77 -0.02 0.00 -0.15 0.00 0.00 55.06 54.00 3dpy s HIS 375 Cb 0.07 -1.91 -0.02 0.00 1.11 0.00 0.00 32.58 31.83 3dpy s HIS 375 CO 0.80 -0.33 -0.09 0.12 -0.85 0.00 0.00 174.74 174.40 3dpy s PHE 376 N 0.67 2.91 -0.19 1.40 5.36 -0.49 -4.81 117.98 122.84 3dpy s PHE 376 Ca -0.06 -0.45 -0.04 0.00 -0.96 0.00 0.00 56.93 55.42 3dpy s PHE 376 Cb -0.15 -1.89 0.08 0.00 -0.34 0.00 0.00 43.02 40.72 3dpy s PHE 376 CO 0.02 -0.10 0.19 0.20 -1.46 0.00 0.00 175.22 174.07 3dpy s GLY 377 N 0.29 0.09 -0.46 13.12 0.00 -1.26 -2.74 107.32 116.35 3dpy s GLY 377 Ca -0.07 0.14 0.05 0.00 0.00 0.00 0.00 44.72 44.85 3dpy s GLY 377 CO 0.04 2.03 0.42 -1.26 0.00 0.00 0.00 173.10 174.32 3dpy n SER 378 N 5.31 0.35 0.00 1.64 2.88 -0.70 -5.04 113.62 118.05 3dpy n SER 378 Ca -0.06 -2.60 0.00 0.00 -1.33 0.00 0.00 58.87 54.88 3dpy n SER 378 Cb 0.49 -0.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.35 3dpy n SER 378 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dpy n GLY 379 N 2.35 1.68 0.03 0.46 0.00 -1.26 -2.84 105.19 105.61 3dpy n GLY 379 Ca 0.27 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.42 3dpy n GLY 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dpy n ALA 380 N 5.52 3.35 -2.66 4.61 0.00 -1.26 -4.89 120.51 125.18 3dpy n ALA 380 Ca 0.00 -0.46 -0.41 0.00 0.00 0.00 0.00 53.44 52.56 3dpy n ALA 380 Cb 0.00 -0.87 -0.04 0.00 0.00 0.00 0.00 19.45 18.54 3dpy n ALA 380 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3dpy s MET 381 N -3.29 4.26 -0.18 0.00 1.00 -1.13 -5.03 119.30 114.93 3dpy s MET 381 Ca -0.00 0.94 -0.04 0.00 0.00 0.00 0.00 55.69 56.59 3dpy s MET 381 Cb 0.14 -3.59 0.06 0.00 0.00 0.00 0.00 34.83 31.44 3dpy s MET 381 CO 0.85 -0.35 0.06 -0.51 0.00 0.00 0.00 175.02 175.07 3dpy s LEU 382 N 2.25 0.74 -0.00 -0.03 1.43 -1.26 -1.72 118.68 120.08 3dpy s LEU 382 Ca 0.36 -0.68 0.05 0.00 -1.03 0.00 0.00 54.13 52.83 3dpy s LEU 382 Cb -0.16 -0.41 -0.01 0.00 0.03 0.00 0.00 46.19 45.63 3dpy s LEU 382 CO 0.11 -0.32 -0.17 -2.28 0.23 0.00 0.00 176.35 173.92 3dpy s HIS 383 N 2.00 1.47 0.11 0.29 2.46 -1.11 -5.01 115.29 115.51 3dpy s HIS 383 Ca 0.01 -0.29 0.10 0.00 0.47 0.00 0.00 55.06 55.34 3dpy s HIS 383 Cb -0.16 -0.93 -0.04 0.00 -0.13 0.00 0.00 32.58 31.31 3dpy s HIS 383 CO -0.08 -0.01 -0.24 -0.51 -2.47 0.00 0.00 174.74 171.43 3dpy s ASP 384 N -0.55 3.46 -0.24 9.88 -0.00 -1.26 -1.40 116.67 126.56 3dpy s ASP 384 Ca 0.06 -0.68 -0.00 0.00 -0.00 0.00 0.00 52.55 51.93 3dpy s ASP 384 Cb -0.07 -0.32 0.07 0.00 -0.00 0.00 0.00 42.92 42.60 3dpy s ASP 384 CO -0.00 0.19 0.00 -0.69 -0.00 0.00 0.00 175.17 174.67 3dpy s VAL 385 N -1.05 1.16 -0.41 -1.27 1.01 -0.70 -5.04 120.40 114.10 3dpy s VAL 385 Ca 0.15 -1.12 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 3dpy s VAL 385 Cb -0.10 -1.60 0.10 0.00 0.00 0.00 0.00 36.38 34.78 3dpy s VAL 385 CO 0.07 -0.26 0.21 -0.69 0.00 0.00 0.00 175.10 174.43 3dpy s VAL 386 N 1.54 3.54 0.53 2.92 1.01 -1.26 -4.28 120.40 124.40 3dpy s VAL 386 Ca -0.01 -1.85 -0.18 0.00 0.00 0.00 0.00 61.98 59.93 3dpy s VAL 386 Cb -0.18 -3.33 -0.06 0.00 0.00 0.00 0.00 36.38 32.80 3dpy s VAL 386 CO -0.10 -0.62 1.05 -0.04 0.00 0.00 0.00 175.10 175.39 3dpy s MET 387 N 1.23 3.57 3.61 2.72 -1.94 -1.26 -4.80 119.30 122.44 3dpy s MET 387 Ca 0.06 1.32 0.00 0.00 -1.71 0.00 0.00 55.69 55.36 3dpy s MET 387 Cb -0.23 -2.06 0.00 0.00 2.01 0.00 0.00 34.83 34.55 3dpy s MET 387 CO -0.02 -0.61 0.00 0.41 -0.01 0.00 0.00 175.02 174.78 3dpy n GLY 388 N -0.50 0.59 3.77 -0.03 0.00 -1.26 -4.78 105.19 102.98 3dpy n GLY 388 Ca 0.09 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 3dpy n GLY 388 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dpy s VAL 389 N 0.00 2.58 -0.80 1.61 -7.23 -0.99 -4.88 120.40 110.69 3dpy s VAL 389 Ca 0.00 0.53 0.14 0.00 -1.81 0.00 0.00 61.98 60.84 3dpy s VAL 389 Cb 0.00 -3.31 0.13 0.00 0.56 0.00 0.00 36.38 33.76 3dpy s VAL 389 CO 0.00 0.08 1.45 -0.81 -0.31 0.00 0.00 175.10 175.50 3dpy n PRO 390 N 0.13 0.06 0.00 4.82 -0.04 -1.26 -1.52 135.00 137.19 3dpy n PRO 390 Ca 0.04 0.38 0.12 0.00 -0.04 0.00 0.00 63.50 63.99 3dpy n PRO 390 Cb 0.43 -1.63 0.61 0.00 -0.04 0.00 0.00 33.50 32.87 3dpy n PRO 390 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3dpy n GLU 391 N -1.74 0.32 0.17 0.54 4.71 -1.26 -2.91 120.64 120.46 3dpy n GLU 391 Ca 0.02 0.06 0.13 0.00 -0.01 0.00 0.00 57.16 57.36 3dpy n GLU 391 Cb 0.14 -1.50 0.56 0.00 -1.01 0.00 0.00 31.44 29.62 3dpy n GLU 391 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 3dpy h ASN 392 N 0.00 0.00 -2.98 1.62 2.35 -1.59 -3.46 115.58 111.52 3dpy h ASN 392 Ca 0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 3dpy h ASN 392 Cb 0.25 0.00 0.06 0.00 0.05 0.00 0.00 38.32 38.68 3dpy h ASN 392 CO 0.00 0.00 0.92 0.54 -1.65 0.00 0.00 177.43 177.24 3dpy s VAL 393 N -3.43 2.25 0.47 2.81 0.11 -1.15 -4.97 120.40 116.50 3dpy s VAL 393 Ca 0.03 0.19 0.07 0.00 -2.93 0.00 0.00 61.98 59.34 3dpy s VAL 393 Cb 0.09 -3.12 -0.00 0.00 -1.53 0.00 0.00 36.38 31.82 3dpy s VAL 393 CO 0.42 0.02 0.34 -0.76 -3.33 0.00 0.00 175.10 171.79 3dpy s LEU 394 N 0.49 3.04 0.39 2.54 1.43 -1.26 -5.01 118.68 120.30 3dpy s LEU 394 Ca 0.68 -1.03 -0.25 0.00 -1.03 0.00 0.00 54.13 52.50 3dpy s LEU 394 Cb -0.47 -1.55 -0.09 0.00 0.03 0.00 0.00 46.19 44.11 3dpy s LEU 394 CO 0.38 -0.81 1.11 -1.10 0.23 0.00 0.00 176.35 176.15 3dpy s GLN 395 N -4.14 4.14 0.81 1.70 -1.52 -0.40 -5.02 119.66 115.24 3dpy s GLN 395 Ca 0.41 1.68 -0.11 0.00 -1.95 0.00 0.00 55.36 55.39 3dpy s GLN 395 Cb -0.01 -2.64 0.08 0.00 -0.22 0.00 0.00 33.01 30.22 3dpy s GLN 395 CO 0.24 -0.20 1.10 -1.25 -0.25 0.00 0.00 175.29 174.92 3dpy s PRO 396 N -2.34 1.91 0.07 2.91 0.04 -1.26 -4.82 135.00 131.51 3dpy s PRO 396 Ca 0.57 1.12 0.06 0.00 0.04 0.00 0.00 61.00 62.78 3dpy s PRO 396 Cb -0.27 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 3dpy s PRO 396 CO 0.33 -1.87 -0.15 -0.08 0.04 0.00 0.00 177.00 175.27 3dpy s THR 397 N -2.89 1.19 -0.08 1.26 -1.32 -1.26 -4.36 115.64 108.18 3dpy s THR 397 Ca 0.62 -1.32 -0.30 0.00 -1.21 0.00 0.00 61.69 59.49 3dpy s THR 397 Cb -0.18 -1.13 -0.03 0.00 -1.51 0.00 0.00 72.50 69.65 3dpy s THR 397 CO 0.56 -0.19 1.29 -2.28 -2.21 0.00 0.00 174.62 171.79 3dpy s HIS 398 N -1.23 2.94 -0.72 9.09 2.46 0.09 -4.80 115.29 123.13 3dpy s HIS 398 Ca -0.01 1.01 0.14 0.00 0.47 0.00 0.00 55.06 56.67 3dpy s HIS 398 Cb -0.10 -3.52 0.63 0.00 -0.13 0.00 0.00 32.58 29.46 3dpy s HIS 398 CO 0.02 -1.81 1.42 -0.35 -2.47 0.00 0.00 174.74 171.56 3dpy n PRO 399 N 5.80 0.07 -0.11 2.88 -0.04 -1.26 -0.34 135.00 142.00 3dpy n PRO 399 Ca 0.13 0.45 -0.25 0.00 -0.04 0.00 0.00 63.50 63.79 3dpy n PRO 399 Cb 0.45 -1.68 -0.11 0.00 -0.04 0.00 0.00 33.50 32.12 3dpy n PRO 399 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3dpy n VAL 400 N -1.82 1.56 0.17 0.52 0.31 -1.26 -4.63 118.33 113.18 3dpy n VAL 400 Ca 0.01 -0.34 0.11 0.00 -0.01 0.00 0.00 64.34 64.11 3dpy n VAL 400 Cb 0.10 -1.84 -0.16 0.00 -0.91 0.00 0.00 33.84 31.04 3dpy n VAL 400 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3dpy n TYR 401 N -4.05 0.01 -3.79 3.52 4.02 -1.18 -4.98 117.16 110.71 3dpy n TYR 401 Ca -0.44 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.21 3dpy n TYR 401 Cb 0.86 -0.42 0.03 0.00 -0.02 0.00 0.00 39.34 39.79 3dpy n TYR 401 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 3dpy n ASN 402 N -2.13 -2.20 -4.34 7.72 5.15 0.53 -5.02 115.26 114.98 3dpy n ASN 402 Ca -0.03 -0.82 -0.18 0.00 -0.60 0.00 0.00 54.58 52.96 3dpy n ASN 402 Cb 0.53 -3.91 -0.10 0.00 -0.53 0.00 0.00 39.78 35.76 3dpy n ASN 402 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3dpy s ILE 403 N -3.58 0.82 0.17 -1.44 -4.36 -1.26 -4.89 121.20 106.65 3dpy s ILE 403 Ca 0.21 -2.01 -0.33 0.00 -0.26 0.00 0.00 60.65 58.26 3dpy s ILE 403 Cb -0.10 -2.57 -0.15 0.00 1.25 0.00 0.00 42.46 40.89 3dpy s ILE 403 CO 0.82 -0.11 1.37 0.61 0.24 0.00 0.00 174.94 177.87 3dpy n GLY 404 N -0.49 0.59 0.40 6.27 0.00 -1.26 -0.73 105.19 109.98 3dpy n GLY 404 Ca -0.02 0.59 0.21 0.00 0.00 0.00 0.00 46.02 46.80 3dpy n GLY 404 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dpy h PRO 405 N 4.45 0.15 -0.04 1.61 0.11 -1.87 0.13 132.00 136.53 3dpy h PRO 405 Ca -0.45 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 65.50 3dpy h PRO 405 Cb 1.30 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 3dpy h PRO 405 CO 0.78 0.10 -0.64 0.38 -0.21 0.00 0.00 178.00 178.41 3dpy h ASP 406 N 0.15 0.19 0.71 -2.05 2.03 -1.94 -2.87 116.42 112.64 3dpy h ASP 406 Ca 0.35 -0.12 -0.17 0.00 -0.73 0.00 0.00 57.03 56.37 3dpy h ASP 406 Cb 1.16 -0.06 -0.02 0.00 -0.83 0.00 0.00 39.33 39.58 3dpy h ASP 406 CO -0.05 0.78 -0.77 0.11 -1.03 0.00 0.00 179.24 178.27 3dpy h LYS 407 N 0.12 0.05 -0.07 4.15 1.79 -1.10 0.20 116.57 121.71 3dpy h LYS 407 Ca -0.01 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.39 3dpy h LYS 407 Cb 1.14 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.81 3dpy h LYS 407 CO 0.09 0.80 -0.02 0.28 -1.08 0.00 0.00 179.45 179.52 3dpy h VAL 408 N 0.03 1.30 -0.28 0.50 2.07 -1.38 -0.51 116.25 117.98 3dpy h VAL 408 Ca -0.01 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 3dpy h VAL 408 Cb 1.36 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 3dpy h VAL 408 CO 0.11 0.26 0.12 0.40 0.02 0.00 0.00 177.57 178.48 3dpy h ILE 409 N -0.21 1.17 -0.62 4.57 2.04 -1.47 -0.98 117.51 122.00 3dpy h ILE 409 Ca 0.02 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.41 3dpy h ILE 409 Cb 0.42 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 3dpy h ILE 409 CO 0.01 0.17 0.39 -0.61 0.00 0.00 0.00 178.15 178.10 3dpy h GLN 410 N 0.31 0.74 -0.08 2.37 4.15 -0.93 -1.24 115.11 120.43 3dpy h GLN 410 Ca 0.09 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.43 3dpy h GLN 410 Cb 0.16 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 27.68 3dpy h GLN 410 CO -0.01 0.49 -0.10 0.00 -1.93 0.00 0.00 178.83 177.28 3dpy h ALA 411 N 1.27 0.13 -0.53 3.38 0.00 -0.96 -2.41 119.26 120.14 3dpy h ALA 411 Ca 0.25 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3dpy h ALA 411 Cb 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3dpy h ALA 411 CO -0.10 -0.03 0.34 1.79 0.00 0.00 0.00 179.25 181.25 3dpy h THR 412 N -0.22 1.15 -0.70 0.00 1.35 -1.09 -1.24 112.91 112.16 3dpy h THR 412 Ca 0.01 -0.30 0.05 0.00 -0.55 0.00 0.00 66.41 65.63 3dpy h THR 412 Cb 0.63 0.40 -0.05 0.00 -1.73 0.00 0.00 68.15 67.40 3dpy h THR 412 CO 0.02 0.15 0.41 0.74 -0.25 0.00 0.00 175.52 176.59 3dpy h THR 413 N 0.71 1.02 -0.11 6.82 2.02 -1.25 0.03 112.91 122.15 3dpy h THR 413 Ca 0.19 -0.27 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 3dpy h THR 413 Cb -0.05 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 66.53 3dpy h THR 413 CO -0.04 0.14 0.05 -0.74 0.37 0.00 0.00 175.52 175.30 3dpy h HIS 414 N 0.77 0.16 0.00 3.16 6.17 -0.93 -3.12 115.15 121.37 3dpy h HIS 414 Ca 0.30 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.37 3dpy h HIS 414 Cb 0.13 -0.05 0.00 0.00 2.52 0.00 0.00 27.41 30.02 3dpy h HIS 414 CO -0.06 0.24 0.00 0.74 0.71 0.00 0.00 177.93 179.56 3dpy h PHE 415 N 0.04 0.00 0.00 5.26 -1.00 -0.93 -2.69 116.94 117.62 3dpy h PHE 415 Ca 0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.82 3dpy h PHE 415 Cb 0.14 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.70 3dpy h PHE 415 CO -0.02 0.00 0.00 -0.07 -1.61 0.00 0.00 178.31 176.61 3dpy h LEU 416 N 0.00 0.00 -0.38 1.54 3.38 -0.93 -2.21 115.31 116.71 3dpy h LEU 416 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dpy h LEU 416 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3dpy h LEU 416 CO 0.00 0.00 0.00 1.56 0.09 0.00 0.00 178.44 180.09 3dpy h GLN 417 N 0.00 0.00 -6.51 1.13 4.20 -1.52 -3.44 115.11 108.97 3dpy h GLN 417 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 3dpy h GLN 417 Cb 0.58 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 3dpy h GLN 417 CO 0.00 0.00 -0.04 0.15 -0.67 0.00 0.00 178.83 178.27 3dpy s LYS 418 N -3.26 3.91 0.40 1.46 -0.14 -0.83 -5.08 119.74 116.20 3dpy s LYS 418 Ca 0.07 0.45 -0.21 0.00 -1.36 0.00 0.00 55.97 54.92 3dpy s LYS 418 Cb 0.09 -2.64 -0.11 0.00 -1.68 0.00 0.00 37.83 33.50 3dpy s LYS 418 CO 0.57 0.30 0.92 -1.25 -0.76 0.00 0.00 175.35 175.13 3dpy s PRO 419 N -2.70 4.26 -0.09 -1.68 0.04 -1.26 -4.99 135.00 128.58 3dpy s PRO 419 Ca 0.48 1.10 -0.29 0.00 0.04 0.00 0.00 61.00 62.33 3dpy s PRO 419 Cb -0.12 -2.31 -0.07 0.00 0.04 0.00 0.00 34.50 32.04 3dpy s PRO 419 CO 0.20 0.04 2.10 0.28 0.04 0.00 0.00 177.00 179.66 3dpy n VAL 420 N -0.40 0.55 -1.25 -0.36 0.31 -1.26 -4.79 118.33 111.13 3dpy n VAL 420 Ca 0.06 -0.30 -0.56 0.00 -0.01 0.00 0.00 64.34 63.53 3dpy n VAL 420 Cb 0.53 -2.44 -0.10 0.00 -0.91 0.00 0.00 33.84 30.92 3dpy n VAL 420 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3dpy n PRO 421 N 8.15 0.00 0.00 5.55 -0.02 -1.26 -2.24 135.00 145.17 3dpy n PRO 421 Ca 0.25 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 3dpy n PRO 421 Cb 0.43 -1.34 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 3dpy n PRO 421 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dpy n GLY 422 N 5.82 1.85 2.95 -1.23 0.00 -1.26 -5.08 105.19 108.25 3dpy n GLY 422 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3dpy n GLY 422 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01