#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1umc s LEU 3 N 0.00 4.62 0.02 0.00 1.02 -1.26 0.53 118.68 123.61 1umc s LEU 3 Ca 0.00 1.93 -0.28 0.00 0.02 0.00 0.00 54.13 55.80 1umc s LEU 3 Cb 0.00 -3.61 0.09 0.00 0.02 0.00 0.00 46.19 42.69 1umc s LEU 3 CO 0.00 0.10 0.76 0.00 0.02 0.00 0.00 176.35 177.23 1umc s MET 4 N -0.94 0.99 0.93 1.70 0.23 -0.05 -4.86 119.30 117.30 1umc s MET 4 Ca 0.42 -0.16 -0.15 0.00 -1.03 0.00 0.00 55.69 54.77 1umc s MET 4 Cb -0.26 0.46 0.17 0.00 -1.53 0.00 0.00 34.83 33.67 1umc s MET 4 CO 0.32 -0.39 1.26 0.95 -2.03 0.00 0.00 175.02 175.12 1umc s THR 5 N -2.59 1.97 0.16 3.16 -4.23 -1.26 -1.83 115.64 111.02 1umc s THR 5 Ca -0.01 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.37 1umc s THR 5 Cb -0.01 -2.95 0.05 0.00 1.34 0.00 0.00 72.50 70.93 1umc s THR 5 CO -0.04 0.00 1.70 -0.03 -0.54 0.00 0.00 174.62 175.70 1umc h MET 6 N -1.53 0.83 -0.37 3.99 4.05 -1.64 -1.48 114.93 118.78 1umc h MET 6 Ca -0.45 -0.17 0.07 0.00 -0.28 0.00 0.00 59.70 58.87 1umc h MET 6 Cb 1.27 -0.13 -0.06 0.00 -0.80 0.00 0.00 31.60 31.88 1umc h MET 6 CO 0.47 0.75 -0.03 0.28 0.23 0.00 0.00 176.91 178.61 1umc h VAL 7 N 0.74 0.69 -0.74 -5.77 2.07 -1.63 0.12 116.25 111.73 1umc h VAL 7 Ca 0.18 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.68 1umc h VAL 7 Cb 0.25 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 1umc h VAL 7 CO -0.01 0.01 0.48 1.56 0.02 0.00 0.00 177.57 179.64 1umc h GLN 8 N 0.06 0.99 -0.08 1.57 4.20 -1.78 -0.04 115.11 120.03 1umc h GLN 8 Ca 0.18 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.82 1umc h GLN 8 Cb 0.26 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1umc h GLN 8 CO -0.33 0.66 0.03 0.00 -0.67 0.00 0.00 178.83 178.52 1umc h ALA 9 N 1.26 0.11 -0.69 3.87 0.00 -0.34 -0.30 119.26 123.17 1umc h ALA 9 Ca 0.27 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.10 1umc h ALA 9 Cb -0.10 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 1umc h ALA 9 CO -0.06 -0.29 0.43 -0.07 0.00 0.00 0.00 179.25 179.26 1umc h LEU 10 N -0.05 0.71 -0.57 0.00 3.38 -0.59 0.16 115.31 118.35 1umc h LEU 10 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1umc h LEU 10 Cb 0.20 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1umc h LEU 10 CO -0.00 0.49 0.29 -1.13 0.09 0.00 0.00 178.44 178.18 1umc h ASN 11 N 0.84 0.73 -0.35 -0.43 -0.73 -0.82 -1.68 115.58 113.14 1umc h ASN 11 Ca 0.28 -0.11 -0.08 0.00 1.87 0.00 0.00 56.30 58.25 1umc h ASN 11 Cb 0.02 -0.19 -0.02 0.00 0.27 0.00 0.00 38.32 38.40 1umc h ASN 11 CO -0.11 0.64 -0.06 -0.09 -0.37 0.00 0.00 177.43 177.44 1umc h ARG 12 N 0.77 0.75 -0.23 6.67 9.65 -0.52 -0.59 114.38 130.89 1umc h ARG 12 Ca 0.20 -0.22 -0.01 0.00 -1.10 0.00 0.00 59.98 58.85 1umc h ARG 12 Cb 0.09 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 1umc h ARG 12 CO -0.03 0.80 0.11 0.00 2.80 0.00 0.00 179.97 183.65 1umc h ALA 13 N 1.24 0.29 -0.05 2.80 0.00 -0.60 0.82 119.26 123.76 1umc h ALA 13 Ca 0.13 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1umc h ALA 13 Cb 0.51 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1umc h ALA 13 CO 0.03 -0.15 0.02 -0.07 0.00 0.00 0.00 179.25 179.08 1umc h LEU 14 N 0.24 0.07 -0.24 0.00 3.38 -1.06 -0.90 115.31 116.79 1umc h LEU 14 Ca 0.08 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 57.97 1umc h LEU 14 Cb 0.11 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.78 1umc h LEU 14 CO -0.01 0.18 -0.14 -0.78 0.09 0.00 0.00 178.44 177.78 1umc h ASP 15 N -0.05 -0.46 -0.03 -0.43 1.82 -0.95 0.74 116.42 117.07 1umc h ASP 15 Ca 0.02 0.10 0.02 0.00 -0.39 0.00 0.00 57.03 56.78 1umc h ASP 15 Cb 0.13 0.24 -0.03 0.00 0.68 0.00 0.00 39.33 40.36 1umc h ASP 15 CO -0.00 -0.18 -0.11 -0.33 -1.61 0.00 0.00 179.24 177.02 1umc h GLU 16 N -0.12 -0.16 -0.52 0.28 5.08 -0.69 -1.00 114.58 117.46 1umc h GLU 16 Ca 0.13 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.45 1umc h GLU 16 Cb 0.32 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1umc h GLU 16 CO -0.31 -0.11 0.10 0.93 -1.00 0.00 0.00 179.01 178.62 1umc h GLU 17 N -0.17 0.81 -0.10 2.33 4.39 -0.85 -1.90 114.58 119.10 1umc h GLU 17 Ca 0.05 -0.18 -0.10 0.00 0.34 0.00 0.00 59.36 59.47 1umc h GLU 17 Cb 0.23 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1umc h GLU 17 CO -0.13 0.75 -0.39 0.52 -1.16 0.00 0.00 179.01 178.60 1umc h MET 18 N 0.78 0.22 -0.13 2.33 2.86 -0.57 -1.03 114.93 119.39 1umc h MET 18 Ca 0.17 -0.10 -0.15 0.00 -2.06 0.00 0.00 59.70 57.56 1umc h MET 18 Cb 0.33 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1umc h MET 18 CO 0.00 0.59 -0.55 0.00 1.06 0.00 0.00 176.91 178.01 1umc h ALA 19 N 1.41 0.82 0.01 6.32 0.00 -0.72 -3.25 119.26 123.84 1umc h ALA 19 Ca 0.02 -0.51 -0.25 0.00 0.00 0.00 0.00 54.91 54.17 1umc h ALA 19 Cb 0.78 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1umc h ALA 19 CO 0.06 0.69 -1.01 0.87 0.00 0.00 0.00 179.25 179.86 1umc h LYS 20 N 0.29 0.56 -4.09 0.00 1.57 -1.00 -3.44 116.57 110.46 1umc h LYS 20 Ca 0.00 -0.61 -0.52 0.00 -1.87 0.00 0.00 60.65 57.65 1umc h LYS 20 Cb 1.06 0.18 -0.37 0.00 0.08 0.00 0.00 32.23 33.17 1umc h LYS 20 CO 0.09 1.23 -0.79 0.34 -0.57 0.00 0.00 179.45 179.75 1umc s ASP 21 N -7.20 2.27 0.60 0.86 -1.08 -0.42 -5.00 116.67 106.70 1umc s ASP 21 Ca -0.08 -0.37 0.38 0.00 -0.52 0.00 0.00 52.55 51.96 1umc s ASP 21 Cb 0.08 -0.78 1.90 0.00 -1.46 0.00 0.00 42.92 42.65 1umc s ASP 21 CO 0.90 -0.16 2.19 -0.65 0.52 0.00 0.00 175.17 177.97 1umc h PRO 22 N 8.19 0.00 0.00 4.34 0.11 -1.87 -2.34 132.00 140.44 1umc h PRO 22 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1umc h PRO 22 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1umc h PRO 22 CO 0.38 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.19 1umc h ARG 23 N 0.00 0.00 -6.15 1.05 3.08 -1.91 -3.43 114.38 107.02 1umc h ARG 23 Ca -0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 1umc h ARG 23 Cb 0.23 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.24 1umc h ARG 23 CO 0.00 0.00 0.84 0.08 -1.07 0.00 0.00 179.97 179.82 1umc s VAL 24 N -3.33 4.42 0.07 2.04 1.01 -0.88 0.49 120.40 124.22 1umc s VAL 24 Ca 0.05 1.71 0.04 0.00 0.00 0.00 0.00 61.98 63.79 1umc s VAL 24 Cb 0.09 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1umc s VAL 24 CO 0.51 -0.13 -0.13 0.68 0.00 0.00 0.00 175.10 176.03 1umc s VAL 25 N 3.23 0.99 -0.12 2.92 -7.23 -0.93 -4.86 120.40 114.40 1umc s VAL 25 Ca 0.51 -1.29 -0.00 0.00 -1.81 0.00 0.00 61.98 59.39 1umc s VAL 25 Cb -0.20 -1.01 -0.02 0.00 0.56 0.00 0.00 36.38 35.71 1umc s VAL 25 CO 0.13 -0.28 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.84 1umc s VAL 26 N -1.39 3.29 0.01 1.32 1.01 0.78 -0.23 120.40 125.18 1umc s VAL 26 Ca -0.03 -0.59 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 1umc s VAL 26 Cb -0.09 -2.38 -0.01 0.00 0.00 0.00 0.00 36.38 33.90 1umc s VAL 26 CO 0.02 0.53 0.03 -1.48 0.00 0.00 0.00 175.10 174.20 1umc s LEU 27 N 0.09 1.98 0.00 3.92 2.34 -1.04 -0.30 118.68 125.67 1umc s LEU 27 Ca -0.04 -0.30 0.00 0.00 0.06 0.00 0.00 54.13 53.85 1umc s LEU 27 Cb -0.14 0.26 0.00 0.00 -0.56 0.00 0.00 46.19 45.74 1umc s LEU 27 CO 0.04 -0.26 0.00 0.61 -1.06 0.00 0.00 176.35 175.68 1umc n GLY 28 N 1.88 -2.60 3.68 -3.48 0.00 -0.94 -1.48 105.19 102.26 1umc n GLY 28 Ca -0.21 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 1umc n GLY 28 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1umc s GLU 29 N -1.97 4.34 -1.61 1.61 2.02 -1.26 -1.05 118.70 120.78 1umc s GLU 29 Ca 0.00 1.63 -0.02 0.00 0.02 0.00 0.00 54.97 56.60 1umc s GLU 29 Cb 0.00 -3.58 0.01 0.00 0.10 0.00 0.00 34.13 30.65 1umc s GLU 29 CO 0.00 -0.47 0.24 -0.25 0.02 0.00 0.00 175.26 174.80 1umc n ASP 30 N 5.38 -5.68 0.09 -0.19 8.00 -1.26 -4.83 116.55 118.05 1umc n ASP 30 Ca 0.11 -0.11 0.11 0.00 0.71 0.00 0.00 54.79 55.61 1umc n ASP 30 Cb 0.46 -4.68 0.00 0.00 -0.02 0.00 0.00 41.12 36.88 1umc n ASP 30 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1umc n VAL 31 N -4.13 0.54 0.00 2.53 0.24 -1.25 -0.76 118.33 115.50 1umc n VAL 31 Ca -0.18 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.61 1umc n VAL 31 Cb 0.65 -0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.75 1umc n VAL 31 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1umc n GLY 32 N 1.21 1.55 0.30 7.63 0.00 -1.26 -3.52 105.19 111.10 1umc n GLY 32 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1umc n GLY 32 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1umc h LYS 33 N 0.00 0.02 0.00 1.61 3.11 -1.94 0.27 116.57 119.64 1umc h LYS 33 Ca 0.00 -0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 57.81 1umc h LYS 33 Cb 0.00 -0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.22 1umc h LYS 33 CO 0.00 0.01 -0.16 0.00 -2.81 0.00 0.00 179.45 176.49 1umc h ARG 34 N 0.02 0.00 -0.14 1.90 3.08 -1.84 -3.47 114.38 113.93 1umc h ARG 34 Ca 0.42 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.41 1umc h ARG 34 Cb 0.68 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 1umc h ARG 34 CO -0.82 0.16 -0.05 0.41 -1.07 0.00 0.00 179.97 178.60 1umc n GLY 35 N 0.24 0.61 0.00 0.04 0.00 0.93 -4.82 105.19 102.20 1umc n GLY 35 Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1umc n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umc n GLY 36 N -2.47 0.07 0.13 -0.02 0.00 0.06 -2.09 105.19 100.86 1umc n GLY 36 Ca -0.03 -1.55 0.11 0.00 0.00 0.00 0.00 46.02 44.56 1umc n GLY 36 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1umc n VAL 37 N 0.52 0.91 -0.00 1.61 0.24 -1.26 -1.65 118.33 118.69 1umc n VAL 37 Ca 0.00 0.34 0.00 0.00 -2.04 0.00 0.00 64.34 62.64 1umc n VAL 37 Cb 0.00 -1.27 0.00 0.00 -1.47 0.00 0.00 33.84 31.10 1umc n VAL 37 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1umc n PHE 38 N -2.18 0.00 -1.37 6.34 3.72 -1.26 -5.00 117.46 117.71 1umc n PHE 38 Ca 0.01 -0.38 -0.13 0.00 -0.05 0.00 0.00 57.45 56.91 1umc n PHE 38 Cb 0.18 -0.04 -0.05 0.00 -0.94 0.00 0.00 39.48 38.63 1umc n PHE 38 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1umc n LEU 39 N -0.37 -0.87 0.22 4.37 4.77 -0.66 -4.90 117.00 119.56 1umc n LEU 39 Ca 0.00 0.32 0.05 0.00 -0.03 0.00 0.00 56.01 56.35 1umc n LEU 39 Cb 0.19 -2.05 0.48 0.00 -2.33 0.00 0.00 43.42 39.71 1umc n LEU 39 CO 0.00 -0.72 0.85 0.58 -1.33 0.00 0.00 177.39 176.77 1umc h VAL 40 N 0.00 1.11 -0.39 4.08 2.07 -1.80 -2.70 116.25 118.62 1umc h VAL 40 Ca -0.26 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.44 1umc h VAL 40 Cb 0.89 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1umc h VAL 40 CO 0.38 0.23 0.00 0.35 0.02 0.00 0.00 177.57 178.55 1umc n THR 41 N -4.17 2.16 -1.67 2.57 -2.24 -0.89 -3.92 114.28 106.13 1umc n THR 41 Ca -0.02 -1.58 -0.45 0.00 -2.27 0.00 0.00 64.05 59.73 1umc n THR 41 Cb 0.30 -0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.39 1umc n THR 41 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1umc n GLU 42 N 0.06 1.99 0.00 -0.78 2.13 -0.93 -2.24 120.64 120.87 1umc n GLU 42 Ca 0.22 0.71 0.00 0.00 0.66 0.00 0.00 57.16 58.75 1umc n GLU 42 Cb 0.89 -2.36 0.00 0.00 0.27 0.00 0.00 31.44 30.25 1umc n GLU 42 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1umc n GLY 43 N 2.14 2.27 0.22 8.31 0.00 -1.26 -4.86 105.19 112.01 1umc n GLY 43 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1umc n GLY 43 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1umc h LEU 44 N 0.00 0.67 -0.48 0.99 3.38 -1.80 -2.12 115.31 115.95 1umc h LEU 44 Ca 0.00 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1umc h LEU 44 Cb 0.00 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 1umc h LEU 44 CO 0.00 0.72 0.23 0.25 0.09 0.00 0.00 178.44 179.73 1umc h LEU 45 N 0.59 0.63 -1.21 1.67 5.85 -1.83 0.28 115.31 121.29 1umc h LEU 45 Ca 0.14 -0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.81 1umc h LEU 45 Cb 0.30 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 1umc h LEU 45 CO -0.00 0.58 0.56 -0.61 -0.34 0.00 0.00 178.44 178.64 1umc h GLN 46 N 0.64 0.90 0.14 1.25 4.15 -1.88 0.20 115.11 120.51 1umc h GLN 46 Ca 0.17 -0.05 -0.34 0.00 0.77 0.00 0.00 58.65 59.19 1umc h GLN 46 Cb 0.12 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 1umc h GLN 46 CO -0.02 0.60 -1.75 -0.22 -1.93 0.00 0.00 178.83 175.51 1umc h LYS 47 N 0.93 0.29 0.00 1.69 3.64 -0.85 -3.40 116.57 118.87 1umc h LYS 47 Ca 0.38 -0.50 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1umc h LYS 47 Cb 0.28 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1umc h LYS 47 CO -0.15 1.17 -0.99 0.66 -2.27 0.00 0.00 179.45 177.88 1umc n TYR 48 N -3.48 0.00 0.00 1.91 4.01 0.93 -5.10 117.16 115.42 1umc n TYR 48 Ca -0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 1umc n TYR 48 Cb 1.06 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 40.01 1umc n TYR 48 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1umc n GLY 49 N 1.42 -0.15 0.25 2.72 0.00 0.70 -4.28 105.19 105.85 1umc n GLY 49 Ca 0.02 -1.71 0.17 0.00 0.00 0.00 0.00 46.02 44.50 1umc n GLY 49 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1umc h PRO 50 N 0.00 0.00 -0.00 1.61 0.13 -1.78 -1.46 132.00 130.49 1umc h PRO 50 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1umc h PRO 50 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1umc h PRO 50 CO 0.00 0.00 -0.34 -0.25 -0.23 0.00 0.00 178.00 177.18 1umc n ASP 51 N -2.72 0.52 -0.03 1.44 8.00 -1.26 -4.06 116.55 118.44 1umc n ASP 51 Ca -0.02 -0.29 -0.01 0.00 0.71 0.00 0.00 54.79 55.19 1umc n ASP 51 Cb 0.10 0.09 -0.07 0.00 -0.02 0.00 0.00 41.12 41.22 1umc n ASP 51 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1umc n ARG 52 N -1.29 1.82 -3.77 -1.24 5.12 -0.63 -4.92 116.66 111.75 1umc n ARG 52 Ca 0.08 -0.03 -0.28 0.00 -1.93 0.00 0.00 57.85 55.69 1umc n ARG 52 Cb 0.33 -1.22 -0.16 0.00 -1.16 0.00 0.00 32.46 30.25 1umc n ARG 52 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1umc s VAL 53 N -2.35 0.68 -0.07 1.55 1.01 -0.73 -0.16 120.40 120.33 1umc s VAL 53 Ca -0.04 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1umc s VAL 53 Cb 0.04 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.32 1umc s VAL 53 CO 0.36 -0.14 -0.10 0.00 0.00 0.00 0.00 175.10 175.21 1umc s MET 54 N 1.79 1.51 0.28 2.72 0.23 0.59 -4.35 119.30 122.07 1umc s MET 54 Ca -0.01 -0.32 -0.29 0.00 -1.03 0.00 0.00 55.69 54.03 1umc s MET 54 Cb -0.17 -1.34 -0.10 0.00 -1.53 0.00 0.00 34.83 31.69 1umc s MET 54 CO -0.08 -0.05 1.31 -0.51 -2.03 0.00 0.00 175.02 173.66 1umc s ASP 55 N 0.93 6.83 0.38 -1.18 1.01 -1.26 -2.22 116.67 121.15 1umc s ASP 55 Ca -0.10 2.58 0.08 0.00 0.71 0.00 0.00 52.55 55.82 1umc s ASP 55 Cb -0.15 -2.63 -0.05 0.00 1.01 0.00 0.00 42.92 41.09 1umc s ASP 55 CO 0.01 -0.53 0.11 0.42 0.21 0.00 0.00 175.17 175.39 1umc s THR 56 N -0.63 2.49 0.99 -1.27 -4.23 -0.22 -4.85 115.64 107.92 1umc s THR 56 Ca 0.52 -1.81 -0.12 0.00 -1.18 0.00 0.00 61.69 59.11 1umc s THR 56 Cb -0.39 -2.93 0.18 0.00 1.34 0.00 0.00 72.50 70.71 1umc s THR 56 CO 0.47 -0.09 1.08 -2.84 -0.54 0.00 0.00 174.62 172.70 1umc s PRO 57 N -3.82 0.48 -1.33 3.99 0.02 -1.26 -4.59 135.00 128.49 1umc s PRO 57 Ca 0.38 0.87 -0.17 0.00 0.02 0.00 0.00 61.00 62.10 1umc s PRO 57 Cb 0.02 -1.71 0.07 0.00 0.02 0.00 0.00 34.50 32.89 1umc s PRO 57 CO 0.21 -2.79 1.82 -0.11 -0.33 0.00 0.00 177.00 175.80 1umc n LEU 58 N -4.27 5.28 -3.39 -5.54 0.00 -1.26 -4.79 117.00 103.03 1umc n LEU 58 Ca 0.06 -3.97 -0.05 0.00 0.00 0.00 0.00 56.01 52.06 1umc n LEU 58 Cb 0.55 -1.73 -0.06 0.00 0.00 0.00 0.00 43.42 42.18 1umc n LEU 58 CO 0.55 0.33 0.05 -0.55 0.00 0.00 0.00 177.39 177.77 1umc s SER 59 N 4.02 -0.43 0.31 1.96 0.15 -1.26 -5.03 113.70 113.43 1umc s SER 59 Ca 0.53 0.69 0.11 0.00 0.70 0.00 0.00 55.95 57.97 1umc s SER 59 Cb 0.06 1.56 0.51 0.00 -1.71 0.00 0.00 66.02 66.44 1umc s SER 59 CO 0.05 -0.27 1.71 -0.33 1.20 0.00 0.00 173.24 175.60 1umc h GLU 60 N 8.11 0.04 -0.42 5.44 3.07 -1.87 -1.53 114.58 127.43 1umc h GLU 60 Ca -0.20 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 58.60 1umc h GLU 60 Cb 1.14 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.04 1umc h GLU 60 CO 0.22 0.53 0.11 0.00 -1.40 0.00 0.00 179.01 178.47 1umc h ALA 61 N 1.47 0.56 -0.54 3.43 0.00 -1.85 -0.54 119.26 121.79 1umc h ALA 61 Ca -0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.65 1umc h ALA 61 Cb 0.88 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1umc h ALA 61 CO 0.07 0.23 0.05 0.00 0.00 0.00 0.00 179.25 179.59 1umc h ALA 62 N 0.96 1.07 0.35 0.00 0.00 -1.88 0.91 119.26 120.67 1umc h ALA 62 Ca 0.13 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1umc h ALA 62 Cb 0.30 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1umc h ALA 62 CO -0.00 0.59 -0.17 0.82 0.00 0.00 0.00 179.25 180.50 1umc h ILE 63 N 0.83 0.58 -0.26 0.00 2.04 -0.96 -0.60 117.51 119.15 1umc h ILE 63 Ca 0.16 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 1umc h ILE 63 Cb 0.42 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 1umc h ILE 63 CO 0.01 0.11 0.12 0.58 0.00 0.00 0.00 178.15 178.97 1umc h VAL 64 N -0.85 1.15 -0.30 1.67 2.07 -1.12 -1.83 116.25 117.04 1umc h VAL 64 Ca -0.05 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1umc h VAL 64 Cb 0.53 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 1umc h VAL 64 CO 0.08 0.15 0.14 1.23 0.02 0.00 0.00 177.57 179.19 1umc h GLY 65 N 0.28 0.47 1.27 2.17 0.00 -0.88 -1.70 103.07 104.69 1umc h GLY 65 Ca 0.09 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.09 1umc h GLY 65 CO -0.01 0.23 0.00 0.00 0.00 0.00 0.00 176.54 176.76 1umc h ALA 66 N 0.99 1.02 -0.63 3.60 0.00 -1.10 -1.49 119.26 121.64 1umc h ALA 66 Ca 0.10 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.75 1umc h ALA 66 Cb 0.14 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1umc h ALA 66 CO -0.01 0.61 0.40 0.00 0.00 0.00 0.00 179.25 180.25 1umc h ALA 67 N 1.18 0.80 -0.52 0.00 0.00 -1.13 0.36 119.26 119.95 1umc h ALA 67 Ca 0.15 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1umc h ALA 67 Cb 0.49 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1umc h ALA 67 CO 0.02 0.18 0.33 1.25 0.00 0.00 0.00 179.25 181.03 1umc h LEU 68 N 0.81 0.55 -0.51 0.00 7.12 -0.82 0.15 115.31 122.61 1umc h LEU 68 Ca 0.24 -0.01 -0.03 0.00 0.13 0.00 0.00 57.88 58.21 1umc h LEU 68 Cb -0.04 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 39.94 1umc h LEU 68 CO -0.07 0.40 0.18 1.23 -0.13 0.00 0.00 178.44 180.04 1umc h GLY 69 N 0.66 0.83 0.96 3.75 0.00 -0.42 0.13 103.07 108.99 1umc h GLY 69 Ca 0.20 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1umc h GLY 69 CO -0.06 0.44 0.20 -0.33 0.00 0.00 0.00 176.54 176.79 1umc h MET 70 N 0.68 0.52 -0.75 4.80 2.86 0.14 -1.60 114.93 121.58 1umc h MET 70 Ca 0.17 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1umc h MET 70 Cb 0.24 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.76 1umc h MET 70 CO -0.01 0.43 0.34 0.00 1.06 0.00 0.00 176.91 178.73 1umc h ALA 71 N 1.05 0.97 -0.07 6.32 0.00 -0.50 0.11 119.26 127.13 1umc h ALA 71 Ca 0.13 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1umc h ALA 71 Cb 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1umc h ALA 71 CO -0.02 0.55 -0.33 0.00 0.00 0.00 0.00 179.25 179.45 1umc h ALA 72 N 1.17 1.31 0.00 0.00 0.00 -0.77 -3.33 119.26 117.64 1umc h ALA 72 Ca 0.25 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1umc h ALA 72 Cb 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1umc h ALA 72 CO -0.03 0.49 -0.72 1.25 0.00 0.00 0.00 179.25 180.23 1umc h HIS 73 N 0.12 0.00 0.00 0.00 6.17 -0.76 -3.45 115.15 117.24 1umc h HIS 73 Ca 0.02 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.10 1umc h HIS 73 Cb 0.65 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.58 1umc h HIS 73 CO 0.01 1.26 0.00 0.41 0.71 0.00 0.00 177.93 180.32 1umc n GLY 74 N 1.51 0.14 4.00 5.26 0.00 0.26 -5.10 105.19 111.26 1umc n GLY 74 Ca -0.23 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 1umc n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1umc s LEU 75 N 0.00 3.49 -0.68 0.99 1.43 -0.51 -4.91 118.68 118.48 1umc s LEU 75 Ca 0.00 -0.34 0.05 0.00 -1.03 0.00 0.00 54.13 52.81 1umc s LEU 75 Cb 0.00 -2.62 0.19 0.00 0.03 0.00 0.00 46.19 43.79 1umc s LEU 75 CO 0.00 -0.94 0.54 0.54 0.23 0.00 0.00 176.35 176.72 1umc n ARG 76 N -2.05 1.91 -2.48 1.70 1.74 0.18 -3.97 116.66 113.69 1umc n ARG 76 Ca 0.09 -4.47 -0.41 0.00 -0.77 0.00 0.00 57.85 52.29 1umc n ARG 76 Cb 0.59 -2.25 -0.04 0.00 -1.02 0.00 0.00 32.46 29.74 1umc n ARG 76 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1umc s PRO 77 N -1.62 4.62 -0.38 5.56 0.04 -1.26 -2.19 135.00 139.77 1umc s PRO 77 Ca 0.28 1.79 0.01 0.00 0.04 0.00 0.00 61.00 63.13 1umc s PRO 77 Cb 0.00 -3.22 0.11 0.00 0.04 0.00 0.00 34.50 31.43 1umc s PRO 77 CO -0.14 0.15 0.12 0.08 0.04 0.00 0.00 177.00 177.26 1umc s VAL 78 N -0.84 2.68 0.21 -0.36 1.01 0.68 -1.43 120.40 122.35 1umc s VAL 78 Ca 0.46 -2.31 -0.12 0.00 0.00 0.00 0.00 61.98 60.02 1umc s VAL 78 Cb -0.31 -2.91 -0.07 0.00 0.00 0.00 0.00 36.38 33.08 1umc s VAL 78 CO 0.39 -0.65 0.56 0.00 0.00 0.00 0.00 175.10 175.40 1umc s ALA 79 N 0.90 3.55 -0.08 5.51 0.00 0.17 -2.49 121.76 129.32 1umc s ALA 79 Ca 0.10 -0.20 0.05 0.00 0.00 0.00 0.00 51.96 51.91 1umc s ALA 79 Cb -0.21 -2.49 -0.01 0.00 0.00 0.00 0.00 23.12 20.42 1umc s ALA 79 CO -0.06 0.48 -0.24 -2.00 0.00 0.00 0.00 175.76 173.94 1umc s GLU 80 N -2.54 2.82 -0.27 0.00 2.12 -0.55 -0.58 118.70 119.69 1umc s GLU 80 Ca 0.45 -0.88 -0.07 0.00 0.36 0.00 0.00 54.97 54.84 1umc s GLU 80 Cb -0.12 -2.26 -0.00 0.00 0.26 0.00 0.00 34.13 32.01 1umc s GLU 80 CO 0.20 0.29 0.06 0.42 -0.54 0.00 0.00 175.26 175.69 1umc s ILE 81 N 0.07 3.97 0.47 -3.70 -1.09 -0.53 -4.38 121.20 116.00 1umc s ILE 81 Ca -0.10 -0.53 0.33 0.00 -2.23 0.00 0.00 60.65 58.12 1umc s ILE 81 Cb -0.16 -2.97 0.53 0.00 -1.58 0.00 0.00 42.46 38.28 1umc s ILE 81 CO 0.06 0.20 1.67 -0.61 -1.23 0.00 0.00 174.94 175.02 1umc h GLN 82 N 8.22 0.10 -2.68 2.79 4.15 -1.90 -3.38 115.11 122.41 1umc h GLN 82 Ca -0.35 -0.01 -0.11 0.00 0.77 0.00 0.00 58.65 58.95 1umc h GLN 82 Cb 1.14 -0.02 -0.24 0.00 0.21 0.00 0.00 27.48 28.58 1umc h GLN 82 CO 0.60 0.07 -0.20 -0.06 -1.93 0.00 0.00 178.83 177.31 1umc s PHE 83 N -5.20 -0.47 0.36 3.99 0.08 -1.26 -4.34 117.98 111.14 1umc s PHE 83 Ca -0.07 1.14 0.14 0.00 0.12 0.00 0.00 56.93 58.25 1umc s PHE 83 Cb 0.28 0.17 0.98 0.00 -0.57 0.00 0.00 43.02 43.87 1umc s PHE 83 CO 0.83 -0.24 1.75 0.00 -0.10 0.00 0.00 175.22 177.46 1umc h ALA 84 N 5.35 2.00 -0.62 5.36 0.00 -0.90 -0.22 119.26 130.23 1umc h ALA 84 Ca -0.27 0.09 0.08 0.00 0.00 0.00 0.00 54.91 54.81 1umc h ALA 84 Cb 1.18 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 1umc h ALA 84 CO 0.24 -0.43 0.41 -0.44 0.00 0.00 0.00 179.25 179.03 1umc h ASP 85 N 0.51 0.45 -0.20 0.00 3.32 -1.84 -2.65 116.42 116.01 1umc h ASP 85 Ca 0.61 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.67 1umc h ASP 85 Cb 1.33 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.80 1umc h ASP 85 CO -0.38 0.28 0.00 -1.22 -1.72 0.00 0.00 179.24 176.20 1umc n TYR 86 N -4.48 0.52 0.16 4.55 4.01 -0.09 -3.85 117.16 117.99 1umc n TYR 86 Ca 0.10 -0.20 0.04 0.00 -0.16 0.00 0.00 57.90 57.68 1umc n TYR 86 Cb 0.32 -0.15 0.16 0.00 -0.31 0.00 0.00 39.34 39.36 1umc n TYR 86 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 1umc h ILE 87 N 1.27 0.88 -0.85 -0.72 6.09 -1.58 -3.34 117.51 119.25 1umc h ILE 87 Ca 0.00 -1.93 0.10 0.00 -1.37 0.00 0.00 64.86 61.66 1umc h ILE 87 Cb 0.72 2.21 -0.08 0.00 0.47 0.00 0.00 36.82 40.15 1umc h ILE 87 CO 0.10 0.45 0.49 -0.26 -3.07 0.00 0.00 178.15 175.86 1umc h PHE 88 N 0.00 0.90 -0.22 2.19 0.04 -1.82 -1.07 116.94 116.95 1umc h PHE 88 Ca -0.00 0.03 0.06 0.00 2.80 0.00 0.00 57.97 60.86 1umc h PHE 88 Cb 1.18 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 1umc h PHE 88 CO 0.00 0.36 0.22 -1.35 -0.60 0.00 0.00 178.31 176.93 1umc h PRO 89 N 0.81 0.00 -0.29 1.51 0.11 -1.89 -0.03 132.00 132.23 1umc h PRO 89 Ca 0.42 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.37 1umc h PRO 89 Cb 0.40 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.41 1umc h PRO 89 CO -0.26 0.00 -0.18 0.41 -0.21 0.00 0.00 178.00 177.77 1umc n GLY 90 N -1.46 4.99 0.29 -0.55 0.00 -0.45 -4.25 105.19 103.76 1umc n GLY 90 Ca 0.03 -1.27 -0.06 0.00 0.00 0.00 0.00 46.02 44.71 1umc n GLY 90 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1umc h PHE 91 N 1.02 1.01 -0.78 1.61 3.57 -0.44 -2.57 116.94 120.36 1umc h PHE 91 Ca 0.19 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 1umc h PHE 91 Cb 1.53 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.93 1umc h PHE 91 CO 1.00 0.77 0.28 0.22 -2.23 0.00 0.00 178.31 178.34 1umc h ASP 92 N 0.95 1.10 -0.56 0.41 3.58 -1.85 -0.60 116.42 119.46 1umc h ASP 92 Ca 0.23 -0.19 0.04 0.00 0.42 0.00 0.00 57.03 57.53 1umc h ASP 92 Cb 0.16 -0.29 -0.04 0.00 1.72 0.00 0.00 39.33 40.88 1umc h ASP 92 CO -0.02 1.00 0.32 1.56 -2.88 0.00 0.00 179.24 179.21 1umc h GLN 93 N 1.15 0.60 -0.09 0.28 1.08 -1.87 0.40 115.11 116.66 1umc h GLN 93 Ca 0.26 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.41 1umc h GLN 93 Cb 0.26 -0.14 -0.00 0.00 -0.05 0.00 0.00 27.48 27.55 1umc h GLN 93 CO -0.02 0.40 0.02 1.25 -0.95 0.00 0.00 178.83 179.53 1umc h LEU 94 N 0.62 0.14 0.01 1.46 5.85 -1.02 -0.25 115.31 122.12 1umc h LEU 94 Ca 0.23 -0.25 -0.27 0.00 0.84 0.00 0.00 57.88 58.43 1umc h LEU 94 Cb 0.08 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1umc h LEU 94 CO -0.13 0.36 -1.53 -0.37 -0.34 0.00 0.00 178.44 176.44 1umc h VAL 95 N -0.08 1.08 0.01 1.05 -1.51 -1.00 -1.06 116.25 114.73 1umc h VAL 95 Ca 0.03 -2.88 -0.32 0.00 -1.23 0.00 0.00 66.70 62.30 1umc h VAL 95 Cb 0.27 2.56 -0.06 0.00 -2.13 0.00 0.00 31.29 31.93 1umc h VAL 95 CO 0.00 0.65 -1.96 -1.20 -1.23 0.00 0.00 177.57 173.83 1umc n SER 96 N -3.17 0.67 -0.09 4.19 7.64 0.14 -4.13 113.62 118.87 1umc n SER 96 Ca -0.13 0.26 -0.13 0.00 1.01 0.00 0.00 58.87 59.88 1umc n SER 96 Cb 1.02 0.24 -0.04 0.00 -1.01 0.00 0.00 64.21 64.42 1umc n SER 96 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1umc n GLN 97 N -2.97 0.47 0.43 1.43 1.13 -0.83 -4.41 117.38 112.62 1umc n GLN 97 Ca -0.23 0.19 -0.17 0.00 -1.94 0.00 0.00 57.00 54.85 1umc n GLN 97 Cb 1.09 -1.32 -0.08 0.00 0.11 0.00 0.00 30.24 30.04 1umc n GLN 97 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1umc h VAL 98 N -0.86 0.05 -0.85 5.09 2.07 -1.09 -2.40 116.25 118.26 1umc h VAL 98 Ca -0.18 -0.17 0.08 0.00 0.82 0.00 0.00 66.70 67.25 1umc h VAL 98 Cb 1.06 0.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 1umc h VAL 98 CO -0.11 0.00 0.55 0.00 0.02 0.00 0.00 177.57 178.04 1umc h ALA 99 N -1.21 1.64 -0.18 1.67 0.00 -1.37 -3.08 119.26 116.73 1umc h ALA 99 Ca -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1umc h ALA 99 Cb 0.85 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1umc h ALA 99 CO 0.18 0.21 0.00 1.63 0.00 0.00 0.00 179.25 181.27 1umc n LYS 100 N -4.51 2.22 0.06 0.00 5.02 -1.24 -4.31 118.16 115.40 1umc n LYS 100 Ca 0.14 -1.99 -0.12 0.00 -2.02 0.00 0.00 58.31 54.32 1umc n LYS 100 Cb 0.27 -1.45 -0.05 0.00 -0.02 0.00 0.00 35.03 33.78 1umc n LYS 100 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1umc h LEU 101 N 4.26 -0.94 -0.29 -0.35 5.85 -1.33 0.69 115.31 123.20 1umc h LEU 101 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1umc h LEU 101 Cb 0.93 0.38 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 1umc h LEU 101 CO 0.00 -0.38 0.18 -0.09 -0.34 0.00 0.00 178.44 177.81 1umc h ARG 102 N -0.47 0.38 0.57 1.25 2.43 -1.81 -2.15 114.38 114.58 1umc h ARG 102 Ca 0.06 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1umc h ARG 102 Cb 0.56 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1umc h ARG 102 CO -0.26 0.28 -0.27 -0.92 -1.51 0.00 0.00 179.97 177.29 1umc h TYR 103 N 0.37 -0.71 0.00 2.20 3.20 -1.80 0.11 116.97 120.34 1umc h TYR 103 Ca 0.10 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 1umc h TYR 103 Cb -0.01 0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.49 1umc h TYR 103 CO -0.05 -0.41 -0.04 0.07 -1.64 0.00 0.00 178.16 176.09 1umc h ARG 104 N -0.85 0.00 -0.62 1.82 0.11 -0.88 -2.15 114.38 111.81 1umc h ARG 104 Ca -0.08 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.00 1umc h ARG 104 Cb 0.62 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.70 1umc h ARG 104 CO 0.13 0.04 0.00 -1.13 0.10 0.00 0.00 179.97 179.11 1umc n SER 105 N -3.24 3.58 -1.89 0.08 3.41 -0.81 -4.92 113.62 109.83 1umc n SER 105 Ca -0.01 -1.99 -0.20 0.00 -0.26 0.00 0.00 58.87 56.41 1umc n SER 105 Cb 0.21 -0.41 -0.05 0.00 -0.26 0.00 0.00 64.21 63.70 1umc n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1umc n GLY 106 N 1.57 0.75 1.34 5.00 0.00 -0.81 -1.73 105.19 111.29 1umc n GLY 106 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1umc n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umc n GLY 107 N -0.77 0.73 0.16 -0.02 0.00 0.35 -4.94 105.19 100.70 1umc n GLY 107 Ca -0.22 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.81 1umc n GLY 107 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1umc h GLN 108 N 4.10 0.00 -5.44 1.61 4.20 -1.58 -3.43 115.11 114.56 1umc h GLN 108 Ca 0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 1umc h GLN 108 Cb 0.00 0.00 -0.31 0.00 0.30 0.00 0.00 27.48 27.47 1umc h GLN 108 CO 0.00 0.48 -0.84 -0.06 -0.67 0.00 0.00 178.83 177.75 1umc s PHE 109 N -3.86 1.65 0.30 2.96 0.08 -1.26 -5.13 117.98 112.73 1umc s PHE 109 Ca -0.02 -0.41 0.10 0.00 0.12 0.00 0.00 56.93 56.72 1umc s PHE 109 Cb 0.13 -1.09 -0.06 0.00 -0.57 0.00 0.00 43.02 41.43 1umc s PHE 109 CO 0.74 -0.11 -0.13 0.95 -0.10 0.00 0.00 175.22 176.57 1umc s THR 110 N -0.14 2.19 -0.55 0.64 -4.23 -1.26 -3.19 115.64 109.10 1umc s THR 110 Ca 0.00 -2.26 0.07 0.00 -1.18 0.00 0.00 61.69 58.32 1umc s THR 110 Cb -0.10 -2.46 0.26 0.00 1.34 0.00 0.00 72.50 71.55 1umc s THR 110 CO 0.01 -0.31 0.69 0.00 -0.54 0.00 0.00 174.62 174.47 1umc n ALA 111 N -0.67 3.54 -1.92 3.99 0.00 -1.26 -3.65 120.51 120.54 1umc n ALA 111 Ca -0.05 -4.31 -0.38 0.00 0.00 0.00 0.00 53.44 48.70 1umc n ALA 111 Cb 0.62 -0.86 -0.03 0.00 0.00 0.00 0.00 19.45 19.17 1umc n ALA 111 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1umc n PRO 112 N 0.93 2.20 -4.16 0.00 -0.04 -1.12 -3.07 135.00 129.74 1umc n PRO 112 Ca 0.27 -2.55 -0.13 0.00 -0.04 0.00 0.00 63.50 61.06 1umc n PRO 112 Cb 0.45 -3.40 -0.11 0.00 -0.04 0.00 0.00 33.50 30.41 1umc n PRO 112 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 1umc s LEU 113 N 5.39 2.43 -0.05 1.53 0.05 -1.26 -4.13 118.68 122.64 1umc s LEU 113 Ca 0.58 -0.86 0.04 0.00 0.05 0.00 0.00 54.13 53.94 1umc s LEU 113 Cb 0.07 -0.20 -0.00 0.00 -2.05 0.00 0.00 46.19 44.01 1umc s LEU 113 CO 0.08 -0.34 -0.17 -0.69 -0.55 0.00 0.00 176.35 174.68 1umc s VAL 114 N -2.79 1.47 -0.31 1.48 1.01 -0.51 -1.71 120.40 119.03 1umc s VAL 114 Ca 0.06 -0.72 0.04 0.00 0.00 0.00 0.00 61.98 61.36 1umc s VAL 114 Cb -0.00 -1.27 0.08 0.00 0.00 0.00 0.00 36.38 35.19 1umc s VAL 114 CO -0.02 0.42 -0.02 -0.69 0.00 0.00 0.00 175.10 174.80 1umc s VAL 115 N 0.14 2.24 0.26 2.92 1.01 -0.20 0.43 120.40 127.20 1umc s VAL 115 Ca -0.06 -2.05 0.03 0.00 0.00 0.00 0.00 61.98 59.90 1umc s VAL 115 Cb -0.13 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 1umc s VAL 115 CO 0.03 -0.36 0.41 0.00 0.00 0.00 0.00 175.10 175.18 1umc s ARG 116 N 0.99 3.46 -0.22 2.72 1.70 0.25 -0.05 118.95 127.80 1umc s ARG 116 Ca 0.03 -0.57 -0.28 0.00 -0.47 0.00 0.00 55.73 54.44 1umc s ARG 116 Cb -0.19 -2.83 0.13 0.00 -0.57 0.00 0.00 34.95 31.49 1umc s ARG 116 CO -0.07 0.36 1.03 0.00 -1.08 0.00 0.00 175.30 175.54 1umc s MET 117 N -3.91 0.54 0.43 3.89 0.23 -0.32 -1.46 119.30 118.70 1umc s MET 117 Ca 0.36 0.35 -0.21 0.00 -1.03 0.00 0.00 55.69 55.17 1umc s MET 117 Cb -0.10 0.26 -0.11 0.00 -1.53 0.00 0.00 34.83 33.35 1umc s MET 117 CO 0.31 -0.12 0.95 -2.14 -2.03 0.00 0.00 175.02 171.98 1umc s PRO 118 N -0.46 4.21 0.25 3.16 0.02 -1.26 -0.34 135.00 140.59 1umc s PRO 118 Ca 0.01 1.10 -0.10 0.00 0.02 0.00 0.00 61.00 62.03 1umc s PRO 118 Cb -0.03 -2.19 -0.01 0.00 0.02 0.00 0.00 34.50 32.30 1umc s PRO 118 CO -0.02 -0.04 0.43 -1.54 -0.33 0.00 0.00 177.00 175.50 1umc s SER 119 N -2.22 0.06 0.16 2.53 1.04 -0.44 -0.34 113.70 114.48 1umc s SER 119 Ca 0.62 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.98 1umc s SER 119 Cb -0.09 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.60 1umc s SER 119 CO 0.14 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 173.84 1umc n GLY 120 N -0.39 -2.07 0.00 7.32 0.00 0.22 -1.84 105.19 108.42 1umc n GLY 120 Ca -0.01 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1umc n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umc n GLY 121 N -2.96 1.45 2.37 -0.02 0.00 -1.26 -2.00 105.19 102.78 1umc n GLY 121 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 1umc n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umc n GLY 122 N 5.00 0.55 3.64 -0.02 0.00 -1.26 -4.26 105.19 108.84 1umc n GLY 122 Ca 0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 46.02 45.74 1umc n GLY 122 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1umc s VAL 123 N -1.83 0.00 -0.94 1.61 0.11 -1.26 -4.91 120.40 113.18 1umc s VAL 123 Ca 0.00 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1umc s VAL 123 Cb 0.00 -1.00 0.27 0.00 -1.53 0.00 0.00 36.38 34.12 1umc s VAL 123 CO 0.00 0.00 1.07 -1.14 -3.33 0.00 0.00 175.10 171.70 1umc n ARG 124 N 3.88 3.40 -0.49 1.54 0.63 -1.26 -4.76 116.66 119.59 1umc n ARG 124 Ca -0.19 -4.55 0.10 0.00 -0.92 0.00 0.00 57.85 52.29 1umc n ARG 124 Cb 0.58 -2.43 0.32 0.00 0.45 0.00 0.00 32.46 31.38 1umc n ARG 124 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1umc n GLY 125 N 1.69 2.38 0.88 5.14 0.00 -1.26 -4.88 105.19 109.15 1umc n GLY 125 Ca 0.25 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1umc n GLY 125 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1umc n GLY 126 N 1.27 0.72 3.87 -0.02 0.00 -1.26 -5.06 105.19 104.70 1umc n GLY 126 Ca 0.23 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.02 1umc n GLY 126 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1umc s HIS 127 N -2.45 3.25 0.27 1.61 3.76 -1.26 -5.08 115.29 115.38 1umc s HIS 127 Ca 0.00 -0.03 -0.30 0.00 -0.15 0.00 0.00 55.06 54.57 1umc s HIS 127 Cb 0.00 -1.50 -0.13 0.00 1.11 0.00 0.00 32.58 32.06 1umc s HIS 127 CO 0.00 0.50 1.46 1.58 -0.85 0.00 0.00 174.74 177.44 1umc n HIS 128 N -0.93 2.42 -3.07 1.40 -0.00 -1.26 -4.96 115.22 108.81 1umc n HIS 128 Ca -0.08 0.38 -0.40 0.00 0.46 0.00 0.00 57.72 58.08 1umc n HIS 128 Cb 0.56 -2.50 -0.06 0.00 -0.12 0.00 0.00 29.99 27.87 1umc n HIS 128 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 1umc s HIS 129 N -0.14 3.36 -0.31 1.57 3.76 -1.26 -4.94 115.29 117.33 1umc s HIS 129 Ca 0.65 0.96 -0.12 0.00 -0.15 0.00 0.00 55.06 56.40 1umc s HIS 129 Cb -0.59 -2.85 -0.03 0.00 1.11 0.00 0.00 32.58 30.22 1umc s HIS 129 CO 0.50 -0.22 0.23 0.45 -0.85 0.00 0.00 174.74 174.86 1umc s SER 130 N 1.25 6.06 -0.10 1.40 0.15 -0.85 -4.90 113.70 116.70 1umc s SER 130 Ca 0.30 -0.22 -0.30 0.00 0.70 0.00 0.00 55.95 56.43 1umc s SER 130 Cb -0.16 -2.14 -0.03 0.00 -1.71 0.00 0.00 66.02 61.98 1umc s SER 130 CO 0.10 -0.17 1.40 -1.58 1.20 0.00 0.00 173.24 174.19 1umc s GLN 131 N 1.77 4.23 -0.07 5.44 0.74 -1.26 0.72 119.66 131.23 1umc s GLN 131 Ca 0.07 1.86 -0.29 0.00 0.05 0.00 0.00 55.36 57.05 1umc s GLN 131 Cb -0.17 -3.80 -0.07 0.00 1.10 0.00 0.00 33.01 30.07 1umc s GLN 131 CO 0.11 -0.72 2.09 0.43 -0.55 0.00 0.00 175.29 176.65 1umc n SER 132 N 6.54 3.78 -1.76 6.67 7.64 -1.26 -4.48 113.62 130.75 1umc n SER 132 Ca 0.15 0.59 0.08 0.00 1.01 0.00 0.00 58.87 60.70 1umc n SER 132 Cb 0.44 -1.54 0.39 0.00 -1.01 0.00 0.00 64.21 62.48 1umc n SER 132 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1umc n PRO 133 N 8.09 4.35 -0.29 1.43 -0.04 -1.26 -4.61 135.00 142.68 1umc n PRO 133 Ca 0.24 -3.03 0.22 0.00 -0.04 0.00 0.00 63.50 60.89 1umc n PRO 133 Cb 0.43 -2.09 0.52 0.00 -0.04 0.00 0.00 33.50 32.32 1umc n PRO 133 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1umc h GLU 134 N 4.09 0.37 -0.82 0.54 9.09 -1.98 -1.11 114.58 124.75 1umc h GLU 134 Ca 0.00 -0.02 0.11 0.00 0.05 0.00 0.00 59.36 59.49 1umc h GLU 134 Cb 1.73 -0.08 -0.08 0.00 -1.65 0.00 0.00 28.75 28.67 1umc h GLU 134 CO 0.37 0.24 0.45 0.00 0.05 0.00 0.00 179.01 180.12 1umc h ALA 135 N 1.60 1.18 -0.83 1.06 0.00 -1.91 0.76 119.26 121.12 1umc h ALA 135 Ca 0.54 0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.58 1umc h ALA 135 Cb 1.40 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 19.04 1umc h ALA 135 CO -0.22 0.03 0.54 0.45 0.00 0.00 0.00 179.25 180.05 1umc h HIS 136 N 0.73 0.87 0.02 0.00 3.86 -1.56 0.18 115.15 119.25 1umc h HIS 136 Ca 0.41 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.54 1umc h HIS 136 Cb 0.43 -0.28 0.01 0.00 1.06 0.00 0.00 27.41 28.63 1umc h HIS 136 CO -0.07 0.42 -0.39 0.74 0.86 0.00 0.00 177.93 179.49 1umc h PHE 137 N 0.82 0.35 -0.74 2.45 0.04 -1.08 -3.16 116.94 115.62 1umc h PHE 137 Ca 0.38 -0.21 0.01 0.00 2.80 0.00 0.00 57.97 60.95 1umc h PHE 137 Cb 0.37 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 38.45 1umc h PHE 137 CO -0.00 1.05 0.49 0.28 -0.60 0.00 0.00 178.31 179.53 1umc h VAL 138 N -0.45 1.18 0.00 -0.55 2.07 -0.60 -0.75 116.25 117.14 1umc h VAL 138 Ca -0.06 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 1umc h VAL 138 Cb 1.18 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1umc h VAL 138 CO 0.08 0.18 -0.07 -0.74 0.02 0.00 0.00 177.57 177.03 1umc h HIS 139 N 0.99 0.00 -3.49 1.57 -0.00 -1.04 -3.41 115.15 109.78 1umc h HIS 139 Ca 0.28 0.00 -0.66 0.00 -0.00 0.00 0.00 60.37 59.98 1umc h HIS 139 Cb -0.09 0.00 -0.16 0.00 -0.00 0.00 0.00 27.41 27.16 1umc h HIS 139 CO -0.00 0.07 0.09 0.99 -0.00 0.00 0.00 177.93 179.09 1umc s THR 140 N -3.94 4.84 0.25 6.26 2.01 -0.29 -5.04 115.64 119.74 1umc s THR 140 Ca -0.01 -0.07 -0.31 0.00 0.31 0.00 0.00 61.69 61.61 1umc s THR 140 Cb 0.11 -4.23 -0.11 0.00 0.01 0.00 0.00 72.50 68.28 1umc s THR 140 CO 0.55 -0.65 1.63 0.00 -0.69 0.00 0.00 174.62 175.45 1umc s ALA 141 N 2.76 3.81 0.00 7.40 0.00 -1.26 -3.25 121.76 131.21 1umc s ALA 141 Ca 0.20 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.71 1umc s ALA 141 Cb -0.16 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.31 1umc s ALA 141 CO 0.17 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.40 1umc n GLY 142 N 2.85 0.84 3.41 0.00 0.00 -1.26 -4.55 105.19 106.49 1umc n GLY 142 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1umc n GLY 142 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1umc s LEU 143 N 0.00 2.77 0.02 0.99 1.43 -1.20 -4.46 118.68 118.22 1umc s LEU 143 Ca 0.00 -0.28 -0.15 0.00 -1.03 0.00 0.00 54.13 52.67 1umc s LEU 143 Cb 0.00 -1.61 -0.06 0.00 0.03 0.00 0.00 46.19 44.55 1umc s LEU 143 CO 0.00 0.21 0.44 -0.54 0.23 0.00 0.00 176.35 176.69 1umc s LYS 144 N 0.09 3.96 -0.10 1.70 1.02 -0.30 -4.86 119.74 121.26 1umc s LYS 144 Ca -0.05 0.46 0.02 0.00 0.02 0.00 0.00 55.97 56.42 1umc s LYS 144 Cb -0.15 -3.21 0.01 0.00 -0.52 0.00 0.00 37.83 33.97 1umc s LYS 144 CO 0.04 0.67 -0.15 0.08 -0.92 0.00 0.00 175.35 175.08 1umc s VAL 145 N -1.10 1.44 -0.01 3.17 1.01 -0.63 -0.24 120.40 124.03 1umc s VAL 145 Ca 0.25 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.65 1umc s VAL 145 Cb -0.17 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.89 1umc s VAL 145 CO 0.15 0.43 -0.14 -0.69 0.00 0.00 0.00 175.10 174.84 1umc s VAL 146 N 0.85 1.10 -0.12 2.92 1.01 -0.43 0.02 120.40 125.75 1umc s VAL 146 Ca -0.10 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 1umc s VAL 146 Cb -0.15 -0.92 0.04 0.00 0.00 0.00 0.00 36.38 35.35 1umc s VAL 146 CO 0.01 0.30 0.01 0.00 0.00 0.00 0.00 175.10 175.42 1umc s ALA 147 N -0.34 0.86 0.29 5.51 0.00 0.70 -0.05 121.76 128.72 1umc s ALA 147 Ca 0.05 -0.36 0.04 0.00 0.00 0.00 0.00 51.96 51.69 1umc s ALA 147 Cb -0.05 -0.91 -0.03 0.00 0.00 0.00 0.00 23.12 22.12 1umc s ALA 147 CO -0.00 -0.71 0.43 0.14 0.00 0.00 0.00 175.76 175.62 1umc s VAL 148 N 1.91 5.01 0.00 0.00 -7.23 -1.08 -4.26 120.40 114.75 1umc s VAL 148 Ca 0.03 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 1umc s VAL 148 Cb -0.14 -3.78 0.00 0.00 0.56 0.00 0.00 36.38 33.02 1umc s VAL 148 CO -0.06 -0.36 0.13 -1.54 -0.31 0.00 0.00 175.10 172.96 1umc n SER 149 N -1.56 0.00 -3.98 4.85 3.41 -1.26 -4.35 113.62 110.73 1umc n SER 149 Ca -0.06 -1.00 -0.09 0.00 -0.26 0.00 0.00 58.87 57.46 1umc n SER 149 Cb 0.57 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.41 1umc n SER 149 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1umc s THR 150 N 0.00 0.11 0.28 6.66 -4.23 -1.26 -5.03 115.64 112.18 1umc s THR 150 Ca 0.00 -0.92 -0.02 0.00 -1.18 0.00 0.00 61.69 59.57 1umc s THR 150 Cb 0.00 -0.27 0.27 0.00 1.34 0.00 0.00 72.50 73.84 1umc s THR 150 CO 0.00 -0.51 1.92 -0.65 -0.54 0.00 0.00 174.62 174.84 1umc h PRO 151 N 4.63 1.10 -0.35 3.99 0.11 -1.87 0.13 132.00 139.75 1umc h PRO 151 Ca -0.32 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.72 1umc h PRO 151 Cb 1.21 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 32.05 1umc h PRO 151 CO 0.41 0.73 0.20 -0.92 -0.21 0.00 0.00 178.00 178.21 1umc h TYR 152 N 1.13 0.47 -0.35 0.65 3.20 -1.91 -2.56 116.97 117.60 1umc h TYR 152 Ca 0.38 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 62.10 1umc h TYR 152 Cb 0.08 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.18 1umc h TYR 152 CO -0.00 0.35 -0.35 -0.44 -1.64 0.00 0.00 178.16 176.08 1umc h ASP 153 N 0.44 0.85 -0.20 -2.11 3.32 -1.84 -2.55 116.42 114.34 1umc h ASP 153 Ca 0.12 -0.37 0.06 0.00 0.02 0.00 0.00 57.03 56.86 1umc h ASP 153 Cb 0.03 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.28 1umc h ASP 153 CO -0.02 1.11 -0.23 0.00 -1.72 0.00 0.00 179.24 178.38 1umc h ALA 154 N 0.93 -0.15 0.15 3.45 0.00 -0.52 0.12 119.26 123.23 1umc h ALA 154 Ca 0.06 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1umc h ALA 154 Cb 0.90 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1umc h ALA 154 CO 0.08 -0.67 -0.07 -0.22 0.00 0.00 0.00 179.25 178.37 1umc h LYS 155 N -0.26 -0.19 -0.39 0.00 3.64 -1.46 -1.68 116.57 116.23 1umc h LYS 155 Ca 0.12 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.57 1umc h LYS 155 Cb 0.45 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.26 1umc h LYS 155 CO -0.35 0.10 0.10 0.78 -2.27 0.00 0.00 179.45 177.81 1umc h GLY 156 N -0.48 0.47 1.32 5.01 0.00 -1.25 -2.43 103.07 105.71 1umc h GLY 156 Ca -0.02 -0.04 -0.23 0.00 0.00 0.00 0.00 47.33 47.04 1umc h GLY 156 CO 0.03 -0.01 -0.85 1.41 0.00 0.00 0.00 176.54 177.12 1umc h LEU 157 N 0.23 0.80 -0.74 3.11 3.38 -0.82 -2.28 115.31 118.99 1umc h LEU 157 Ca 0.18 -0.56 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1umc h LEU 157 Cb 0.20 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1umc h LEU 157 CO -0.22 1.35 0.38 0.25 0.09 0.00 0.00 178.44 180.29 1umc h LEU 158 N 0.42 0.95 -0.89 1.67 5.85 -1.25 0.26 115.31 122.33 1umc h LEU 158 Ca -0.07 -0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.48 1umc h LEU 158 Cb 1.48 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 1umc h LEU 158 CO 0.16 0.79 0.17 0.11 -0.34 0.00 0.00 178.44 179.34 1umc h LYS 159 N 1.03 0.99 -0.52 1.25 1.57 -1.47 -1.22 116.57 118.21 1umc h LYS 159 Ca 0.26 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1umc h LYS 159 Cb 0.08 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 1umc h LYS 159 CO -0.04 0.87 0.13 0.00 -0.57 0.00 0.00 179.45 179.84 1umc h ALA 160 N 1.23 0.68 -0.49 3.86 0.00 -0.71 -2.55 119.26 121.27 1umc h ALA 160 Ca 0.21 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1umc h ALA 160 Cb 0.31 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1umc h ALA 160 CO -0.00 0.38 0.28 0.00 0.00 0.00 0.00 179.25 179.90 1umc h ALA 161 N 1.00 0.63 0.00 0.00 0.00 -0.13 -0.25 119.26 120.52 1umc h ALA 161 Ca 0.16 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1umc h ALA 161 Cb 0.33 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1umc h ALA 161 CO 0.00 0.14 -0.05 0.82 0.00 0.00 0.00 179.25 180.17 1umc h ILE 162 N 0.66 0.42 0.00 0.00 2.04 -1.02 -1.48 117.51 118.13 1umc h ILE 162 Ca 0.18 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1umc h ILE 162 Cb 0.03 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1umc h ILE 162 CO -0.03 0.05 -1.42 0.54 0.00 0.00 0.00 178.15 177.29 1umc n ARG 163 N -3.60 0.63 -2.29 2.37 1.74 -0.87 -4.90 116.66 109.74 1umc n ARG 163 Ca -0.02 -0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.64 1umc n ARG 163 Cb 0.15 -1.70 -0.03 0.00 -1.02 0.00 0.00 32.46 29.86 1umc n ARG 163 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1umc s ASP 164 N -5.04 7.00 0.37 0.55 -1.08 -0.16 -4.93 116.67 113.38 1umc s ASP 164 Ca -0.04 2.39 0.20 0.00 -0.52 0.00 0.00 52.55 54.58 1umc s ASP 164 Cb 0.11 -2.62 0.23 0.00 -1.46 0.00 0.00 42.92 39.18 1umc s ASP 164 CO 0.84 -0.41 1.52 -0.33 0.52 0.00 0.00 175.17 177.31 1umc h GLU 165 N 4.62 0.00 -6.85 4.34 4.39 -1.90 -3.43 114.58 115.75 1umc h GLU 165 Ca -0.46 0.00 -0.47 0.00 0.34 0.00 0.00 59.36 58.77 1umc h GLU 165 Cb 1.22 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 1umc h GLU 165 CO 0.72 0.17 0.24 -0.51 -1.16 0.00 0.00 179.01 178.47 1umc s ASP 166 N -6.25 7.01 0.26 1.42 1.01 -1.26 -2.81 116.67 116.05 1umc s ASP 166 Ca 0.06 1.58 -0.31 0.00 0.71 0.00 0.00 52.55 54.58 1umc s ASP 166 Cb 0.06 -2.49 -0.12 0.00 1.01 0.00 0.00 42.92 41.38 1umc s ASP 166 CO 0.70 -0.19 1.59 -2.65 0.21 0.00 0.00 175.17 174.84 1umc n PRO 167 N -0.05 2.59 -4.47 8.23 -0.02 -1.17 -4.56 135.00 135.55 1umc n PRO 167 Ca 0.03 0.92 -0.27 0.00 -2.02 0.00 0.00 63.50 62.17 1umc n PRO 167 Cb 0.52 -2.70 -0.17 0.00 -0.02 0.00 0.00 33.50 31.14 1umc n PRO 167 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1umc s VAL 168 N 0.28 1.31 -0.29 -1.45 1.01 -0.69 -1.14 120.40 119.42 1umc s VAL 168 Ca 0.68 -0.54 -0.15 0.00 0.00 0.00 0.00 61.98 61.97 1umc s VAL 168 Cb -0.53 -1.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.61 1umc s VAL 168 CO 0.45 0.40 0.36 -0.69 0.00 0.00 0.00 175.10 175.62 1umc s VAL 169 N 0.93 5.18 -0.36 2.92 1.01 0.67 -1.03 120.40 129.72 1umc s VAL 169 Ca -0.09 0.41 -0.07 0.00 0.00 0.00 0.00 61.98 62.23 1umc s VAL 169 Cb -0.15 -3.72 0.05 0.00 0.00 0.00 0.00 36.38 32.56 1umc s VAL 169 CO 0.00 0.10 0.15 0.12 0.00 0.00 0.00 175.10 175.47 1umc s PHE 170 N 2.04 3.29 -0.15 5.22 5.36 0.93 -1.32 117.98 133.36 1umc s PHE 170 Ca 0.14 -1.49 -0.15 0.00 -0.96 0.00 0.00 56.93 54.46 1umc s PHE 170 Cb -0.16 -2.49 -0.04 0.00 -0.34 0.00 0.00 43.02 39.99 1umc s PHE 170 CO 0.11 -0.77 0.36 -0.51 -1.46 0.00 0.00 175.22 172.95 1umc s LEU 171 N 1.40 4.24 -0.30 6.12 1.02 0.93 -1.18 118.68 130.91 1umc s LEU 171 Ca 0.00 0.59 0.02 0.00 0.02 0.00 0.00 54.13 54.77 1umc s LEU 171 Cb -0.20 -2.48 0.08 0.00 0.02 0.00 0.00 46.19 43.60 1umc s LEU 171 CO 0.02 0.05 -0.02 -1.61 0.02 0.00 0.00 176.35 174.81 1umc s GLU 172 N 0.63 1.98 -0.21 1.70 2.02 0.54 -2.64 118.70 122.72 1umc s GLU 172 Ca 0.19 -1.56 -0.28 0.00 0.02 0.00 0.00 54.97 53.34 1umc s GLU 172 Cb -0.14 -3.08 -0.05 0.00 0.10 0.00 0.00 34.13 30.96 1umc s GLU 172 CO 0.06 -0.74 2.13 -2.14 0.02 0.00 0.00 175.26 174.59 1umc s PRO 173 N 1.05 3.26 0.36 0.39 0.02 -1.26 -1.33 135.00 137.49 1umc s PRO 173 Ca -0.00 2.00 0.09 0.00 0.02 0.00 0.00 61.00 63.11 1umc s PRO 173 Cb -0.20 -4.32 0.83 0.00 0.02 0.00 0.00 34.50 30.83 1umc s PRO 173 CO -0.06 -1.95 1.86 1.57 -0.33 0.00 0.00 177.00 178.09 1umc h LYS 174 N 14.28 0.66 0.00 5.54 2.10 -1.65 0.58 116.57 138.08 1umc h LYS 174 Ca -0.41 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.20 1umc h LYS 174 Cb 1.23 -0.15 -0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1umc h LYS 174 CO 0.97 0.43 -0.01 0.07 -2.00 0.00 0.00 179.45 178.92 1umc h ARG 175 N 0.68 0.00 -0.34 0.07 0.11 -1.81 -2.12 114.38 110.97 1umc h ARG 175 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 1umc h ARG 175 Cb 0.78 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.86 1umc h ARG 175 CO -0.22 0.01 0.00 1.28 0.10 0.00 0.00 179.97 181.14 1umc n LEU 176 N -3.15 3.27 -0.15 0.08 4.77 0.19 -4.03 117.00 117.99 1umc n LEU 176 Ca -0.02 -1.38 0.04 0.00 -0.03 0.00 0.00 56.01 54.61 1umc n LEU 176 Cb 0.13 -0.22 0.34 0.00 -2.33 0.00 0.00 43.42 41.34 1umc n LEU 176 CO 0.22 0.69 1.21 1.88 -1.33 0.00 0.00 177.39 180.07 1umc h TYR 177 N 4.30 0.76 0.00 -1.77 0.05 -1.36 -3.30 116.97 115.64 1umc h TYR 177 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1umc h TYR 177 Cb 0.95 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 38.43 1umc h TYR 177 CO 0.22 0.44 -0.09 0.54 -1.05 0.00 0.00 178.16 178.22 1umc n ARG 178 N -4.46 0.03 0.25 4.88 1.74 -1.26 -1.69 116.66 116.14 1umc n ARG 178 Ca 0.08 -0.61 0.17 0.00 -0.77 0.00 0.00 57.85 56.72 1umc n ARG 178 Cb 0.12 -0.51 0.87 0.00 -1.02 0.00 0.00 32.46 31.93 1umc n ARG 178 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1umc h SER 179 N 0.00 0.00 -2.58 0.55 4.64 -1.70 -3.44 113.55 111.02 1umc h SER 179 Ca 0.00 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.47 1umc h SER 179 Cb 1.07 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.86 1umc h SER 179 CO 0.00 0.00 0.73 0.54 -0.87 0.00 0.00 176.83 177.23 1umc s VAL 180 N -3.80 0.00 0.36 0.95 0.11 -1.26 -5.10 120.40 111.65 1umc s VAL 180 Ca -0.03 0.00 -0.04 0.00 -2.93 0.00 0.00 61.98 58.98 1umc s VAL 180 Cb 0.10 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 33.90 1umc s VAL 180 CO 0.33 0.00 0.62 -0.54 -3.33 0.00 0.00 175.10 172.19 1umc s LYS 181 N 0.02 3.58 0.10 1.54 1.02 -1.26 -4.45 119.74 120.29 1umc s LYS 181 Ca 0.06 -0.01 -0.15 0.00 0.02 0.00 0.00 55.97 55.89 1umc s LYS 181 Cb -0.05 -2.57 0.03 0.00 -0.52 0.00 0.00 37.83 34.72 1umc s LYS 181 CO -0.12 0.08 0.36 -2.00 -0.92 0.00 0.00 175.35 172.75 1umc s GLU 182 N -4.06 0.98 -0.14 1.68 2.12 -0.76 -4.85 118.70 113.68 1umc s GLU 182 Ca 0.44 -0.67 -0.29 0.00 0.36 0.00 0.00 54.97 54.81 1umc s GLU 182 Cb -0.10 0.43 -0.03 0.00 0.26 0.00 0.00 34.13 34.69 1umc s GLU 182 CO 0.35 -0.36 1.42 -2.00 -0.54 0.00 0.00 175.26 174.13 1umc s GLU 183 N -3.47 4.17 -0.24 4.30 2.56 -1.26 -0.87 118.70 123.89 1umc s GLU 183 Ca 0.01 1.83 0.01 0.00 0.00 0.00 0.00 54.97 56.82 1umc s GLU 183 Cb 0.02 -3.86 0.06 0.00 2.00 0.00 0.00 34.13 32.34 1umc s GLU 183 CO -0.09 -0.81 -0.05 0.08 -0.56 0.00 0.00 175.26 173.82 1umc s VAL 184 N 3.83 1.56 0.32 3.70 1.01 0.19 -4.74 120.40 126.28 1umc s VAL 184 Ca 0.62 -1.25 -0.28 0.00 0.00 0.00 0.00 61.98 61.08 1umc s VAL 184 Cb -0.26 -1.83 -0.13 0.00 0.00 0.00 0.00 36.38 34.17 1umc s VAL 184 CO 0.21 -0.10 1.11 -2.65 0.00 0.00 0.00 175.10 173.66 1umc n PRO 185 N 4.66 1.63 0.09 2.72 -0.02 -1.26 -3.02 135.00 139.79 1umc n PRO 185 Ca -0.12 0.57 0.12 0.00 -2.02 0.00 0.00 63.50 62.05 1umc n PRO 185 Cb 0.44 -2.03 0.15 0.00 -0.02 0.00 0.00 33.50 32.04 1umc n PRO 185 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1umc h GLU 186 N 2.15 0.00 -7.19 -0.52 4.57 -1.99 -3.46 114.58 108.13 1umc h GLU 186 Ca -0.42 0.00 -0.51 0.00 -1.18 0.00 0.00 59.36 57.25 1umc h GLU 186 Cb 1.32 0.00 0.11 0.00 -0.16 0.00 0.00 28.75 30.02 1umc h GLU 186 CO 0.61 0.00 0.38 -1.83 -1.18 0.00 0.00 179.01 176.99 1umc s GLU 187 N -3.21 2.69 0.10 1.92 -1.05 -1.26 -4.95 118.70 112.94 1umc s GLU 187 Ca 0.05 1.48 -0.31 0.00 -0.15 0.00 0.00 54.97 56.04 1umc s GLU 187 Cb 0.12 -1.93 -0.08 0.00 -0.44 0.00 0.00 34.13 31.80 1umc s GLU 187 CO 0.72 -1.35 1.40 0.34 0.95 0.00 0.00 175.26 177.32 1umc s ASP 188 N -2.42 6.82 0.03 0.83 2.15 -1.26 -4.99 116.67 117.83 1umc s ASP 188 Ca 0.69 2.30 -0.28 0.00 0.43 0.00 0.00 52.55 55.69 1umc s ASP 188 Cb -0.22 -2.58 0.07 0.00 -0.30 0.00 0.00 42.92 39.89 1umc s ASP 188 CO 0.41 -0.67 0.66 -0.72 -0.17 0.00 0.00 175.17 174.69 1umc s TYR 189 N 1.34 -0.60 0.19 -5.34 -0.85 -1.26 -5.18 117.35 105.65 1umc s TYR 189 Ca 0.65 0.78 0.02 0.00 -0.52 0.00 0.00 57.07 57.99 1umc s TYR 189 Cb -0.36 0.47 -0.05 0.00 0.38 0.00 0.00 41.96 42.41 1umc s TYR 189 CO 0.30 -0.70 -0.00 0.95 -1.52 0.00 0.00 175.55 174.58 1umc s THR 190 N -2.25 0.77 0.18 -3.49 -4.23 -1.26 -4.58 115.64 100.77 1umc s THR 190 Ca -0.06 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.56 1umc s THR 190 Cb -0.00 -2.17 -0.04 0.00 1.34 0.00 0.00 72.50 71.62 1umc s THR 190 CO 0.00 -0.44 -0.20 -0.76 -0.54 0.00 0.00 174.62 172.69 1umc s LEU 191 N -3.21 2.59 -0.10 4.79 1.43 -0.99 -4.95 118.68 118.24 1umc s LEU 191 Ca 0.25 -0.75 -0.27 0.00 -1.03 0.00 0.00 54.13 52.34 1umc s LEU 191 Cb 0.06 -1.34 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 1umc s LEU 191 CO 0.05 0.13 0.87 -2.16 0.23 0.00 0.00 176.35 175.46 1umc s PRO 192 N -2.60 4.40 0.08 1.29 0.04 -1.26 -4.63 135.00 132.32 1umc s PRO 192 Ca 0.21 1.14 -0.31 0.00 0.04 0.00 0.00 61.00 62.08 1umc s PRO 192 Cb -0.09 -3.52 -0.06 0.00 0.04 0.00 0.00 34.50 30.87 1umc s PRO 192 CO 0.11 -0.19 1.24 0.42 0.04 0.00 0.00 177.00 178.62 1umc s ILE 193 N 1.62 3.84 0.00 0.56 1.01 -1.26 -2.96 121.20 124.02 1umc s ILE 193 Ca 0.43 1.34 0.00 0.00 0.00 0.00 0.00 60.65 62.42 1umc s ILE 193 Cb -0.18 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.43 1umc s ILE 193 CO 0.18 0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.84 1umc n GLY 194 N 3.19 0.57 3.36 6.18 0.00 -1.26 -4.98 105.19 112.25 1umc n GLY 194 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 1umc n GLY 194 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1umc s LYS 195 N -0.72 3.38 0.87 1.61 3.01 -1.16 -3.19 119.74 123.54 1umc s LYS 195 Ca 0.00 -0.69 -0.12 0.00 -1.01 0.00 0.00 55.97 54.15 1umc s LYS 195 Cb 0.00 -2.64 0.11 0.00 -1.01 0.00 0.00 37.83 34.30 1umc s LYS 195 CO 0.00 0.20 1.14 0.00 0.51 0.00 0.00 175.35 177.19 1umc s ALA 196 N 0.39 2.04 -0.08 5.17 0.00 -1.24 -4.55 121.76 123.49 1umc s ALA 196 Ca -0.10 -0.48 0.03 0.00 0.00 0.00 0.00 51.96 51.41 1umc s ALA 196 Cb -0.16 -3.03 0.01 0.00 0.00 0.00 0.00 23.12 19.93 1umc s ALA 196 CO 0.05 -2.05 -0.18 0.00 0.00 0.00 0.00 175.76 173.58 1umc s ALA 197 N -3.31 1.73 -0.56 0.00 0.00 0.79 -4.99 121.76 115.42 1umc s ALA 197 Ca 0.63 -0.70 -0.24 0.00 0.00 0.00 0.00 51.96 51.64 1umc s ALA 197 Cb -0.14 -0.68 0.04 0.00 0.00 0.00 0.00 23.12 22.34 1umc s ALA 197 CO 0.53 0.21 0.97 -1.17 0.00 0.00 0.00 175.76 176.30 1umc s LEU 198 N 0.47 4.05 0.07 0.00 1.98 -1.26 -1.14 118.68 122.84 1umc s LEU 198 Ca -0.16 -0.33 -0.06 0.00 -2.89 0.00 0.00 54.13 50.69 1umc s LEU 198 Cb -0.17 -2.85 -0.28 0.00 0.66 0.00 0.00 46.19 43.55 1umc s LEU 198 CO 0.06 -1.26 1.13 0.03 -1.89 0.00 0.00 176.35 174.42 1umc h ARG 199 N 9.34 0.32 -2.42 1.98 2.47 -1.58 -3.46 114.38 121.03 1umc h ARG 199 Ca -0.26 -0.54 -0.07 0.00 -1.26 0.00 0.00 59.98 57.85 1umc h ARG 199 Cb 1.07 0.20 -0.24 0.00 -1.65 0.00 0.00 29.97 29.35 1umc h ARG 199 CO 1.10 1.25 -0.15 0.50 0.56 0.00 0.00 179.97 183.23 1umc s ARG 200 N -2.68 0.55 0.14 0.04 3.52 -1.17 -4.95 118.95 114.40 1umc s ARG 200 Ca -0.05 0.89 -0.21 0.00 -0.13 0.00 0.00 55.73 56.23 1umc s ARG 200 Cb 0.07 0.13 -0.07 0.00 -1.56 0.00 0.00 34.95 33.51 1umc s ARG 200 CO 0.89 -0.13 0.66 -1.21 -0.81 0.00 0.00 175.30 174.71 1umc s GLU 201 N 1.09 4.31 0.25 5.12 2.02 -1.26 -0.95 118.70 129.28 1umc s GLU 201 Ca -0.07 0.88 -0.15 0.00 0.02 0.00 0.00 54.97 55.65 1umc s GLU 201 Cb -0.06 -3.15 0.01 0.00 0.10 0.00 0.00 34.13 31.02 1umc s GLU 201 CO -0.10 0.56 0.54 0.20 0.02 0.00 0.00 175.26 176.47 1umc s GLY 202 N -1.28 0.30 0.00 -1.39 0.00 -1.25 -4.61 107.32 99.10 1umc s GLY 202 Ca 0.35 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.41 1umc s GLY 202 CO 0.22 -0.46 0.06 0.58 0.00 0.00 0.00 173.10 173.50 1umc n LYS 203 N -0.39 2.12 -0.08 2.90 2.85 -1.06 -4.51 118.16 119.99 1umc n LYS 203 Ca -0.03 -0.06 -0.06 0.00 -1.05 0.00 0.00 58.31 57.10 1umc n LYS 203 Cb 0.61 -0.37 -0.15 0.00 -0.65 0.00 0.00 35.03 34.47 1umc n LYS 203 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1umc n ASP 204 N -0.32 0.26 -3.75 -5.58 8.00 -0.36 -4.18 116.55 110.62 1umc n ASP 204 Ca 0.00 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 1umc n ASP 204 Cb 0.04 1.14 -0.11 0.00 -0.02 0.00 0.00 41.12 42.17 1umc n ASP 204 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1umc s LEU 205 N -5.25 0.60 -0.20 0.64 0.20 -1.11 -4.57 118.68 109.00 1umc s LEU 205 Ca -0.09 0.72 -0.07 0.00 0.69 0.00 0.00 54.13 55.38 1umc s LEU 205 Cb 0.07 1.21 -0.03 0.00 -0.43 0.00 0.00 46.19 47.00 1umc s LEU 205 CO 0.80 -0.13 0.05 -0.89 -0.29 0.00 0.00 176.35 175.89 1umc s THR 206 N 0.28 4.49 -0.39 3.68 2.01 -0.32 0.83 115.64 126.22 1umc s THR 206 Ca -0.01 -0.13 -0.04 0.00 0.31 0.00 0.00 61.69 61.82 1umc s THR 206 Cb -0.03 -3.04 0.09 0.00 0.01 0.00 0.00 72.50 69.53 1umc s THR 206 CO -0.00 0.42 0.18 -0.76 -0.69 0.00 0.00 174.62 173.76 1umc s LEU 207 N 0.85 4.98 -0.13 4.42 1.43 0.79 -1.15 118.68 129.87 1umc s LEU 207 Ca 0.03 -1.76 -0.20 0.00 -1.03 0.00 0.00 54.13 51.16 1umc s LEU 207 Cb -0.14 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.20 1umc s LEU 207 CO 0.02 -0.49 0.58 -0.63 0.23 0.00 0.00 176.35 176.06 1umc s ILE 208 N 1.23 5.10 0.13 -0.59 1.01 -0.48 -0.88 121.20 126.73 1umc s ILE 208 Ca 0.04 1.16 -0.05 0.00 0.00 0.00 0.00 60.65 61.80 1umc s ILE 208 Cb -0.22 -3.92 0.02 0.00 0.01 0.00 0.00 42.46 38.35 1umc s ILE 208 CO -0.02 0.24 0.26 0.00 0.00 0.00 0.00 174.94 175.43 1umc n TYR 210 N -0.18 0.00 -0.56 0.00 0.18 -1.26 -0.82 117.16 114.53 1umc n TYR 210 Ca -0.03 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.75 1umc n TYR 210 Cb 0.20 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.16 1umc n TYR 210 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1umc n GLY 211 N -0.10 2.77 0.30 -7.48 0.00 -1.26 -3.76 105.19 95.66 1umc n GLY 211 Ca 0.00 -0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.05 1umc n GLY 211 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1umc n THR 212 N 0.00 -0.36 0.95 2.61 -1.04 -1.26 -1.30 114.28 113.87 1umc n THR 212 Ca 0.00 1.90 0.13 0.00 -2.04 0.00 0.00 64.05 64.04 1umc n THR 212 Cb 0.00 -2.80 0.58 0.00 -1.82 0.00 0.00 70.33 66.30 1umc n THR 212 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1umc n VAL 213 N -5.25 0.14 -0.32 12.58 0.24 -1.25 -4.41 118.33 120.07 1umc n VAL 213 Ca 0.21 0.04 -0.00 0.00 -2.04 0.00 0.00 64.34 62.54 1umc n VAL 213 Cb 0.69 -0.57 0.04 0.00 -1.47 0.00 0.00 33.84 32.53 1umc n VAL 213 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 1umc n MET 214 N -1.49 -0.19 0.03 7.34 1.56 -0.42 -1.84 117.12 122.12 1umc n MET 214 Ca 0.07 1.28 -0.11 0.00 -0.27 0.00 0.00 57.70 58.66 1umc n MET 214 Cb 0.31 -1.90 -0.05 0.00 2.15 0.00 0.00 33.22 33.74 1umc n MET 214 CO 0.00 0.00 0.00 -1.35 -0.73 0.00 0.00 175.97 173.89 1umc h PRO 215 N 0.00 -0.42 -0.72 2.12 0.11 -1.84 -0.37 132.00 130.89 1umc h PRO 215 Ca 0.30 0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.41 1umc h PRO 215 Cb 0.50 0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.67 1umc h PRO 215 CO -0.83 -0.28 0.34 0.93 -0.21 0.00 0.00 178.00 177.96 1umc h GLU 216 N -0.43 1.03 -0.47 1.05 3.07 -1.69 -2.08 114.58 115.05 1umc h GLU 216 Ca 0.08 -0.14 -0.04 0.00 -0.50 0.00 0.00 59.36 58.75 1umc h GLU 216 Cb 0.55 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.25 1umc h GLU 216 CO -0.31 0.80 0.13 0.28 -1.40 0.00 0.00 179.01 178.51 1umc h VAL 217 N 1.03 1.23 -0.43 3.13 2.07 -0.88 -0.72 116.25 121.68 1umc h VAL 217 Ca 0.25 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 1umc h VAL 217 Cb 0.11 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1umc h VAL 217 CO -0.03 0.29 0.12 -0.07 0.02 0.00 0.00 177.57 177.90 1umc h LEU 218 N 0.64 0.63 -1.08 2.57 3.38 -0.83 -2.04 115.31 118.58 1umc h LEU 218 Ca 0.15 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1umc h LEU 218 Cb 0.31 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1umc h LEU 218 CO -0.00 0.68 -0.13 -0.61 0.09 0.00 0.00 178.44 178.48 1umc h GLN 219 N 0.55 0.50 -0.69 1.13 5.75 -1.28 -2.08 115.11 118.99 1umc h GLN 219 Ca 0.14 -0.14 -0.05 0.00 -0.15 0.00 0.00 58.65 58.44 1umc h GLN 219 Cb 0.29 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.75 1umc h GLN 219 CO -0.00 0.62 0.24 0.00 -2.65 0.00 0.00 178.83 177.04 1umc h ALA 220 N 1.41 1.11 -0.79 3.38 0.00 -0.80 -0.28 119.26 123.29 1umc h ALA 220 Ca 0.08 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1umc h ALA 220 Cb 0.50 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1umc h ALA 220 CO 0.03 0.62 0.31 0.00 0.00 0.00 0.00 179.25 180.21 1umc h ALA 221 N 1.24 1.04 -0.43 0.00 0.00 -0.85 -0.45 119.26 119.81 1umc h ALA 221 Ca 0.23 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1umc h ALA 221 Cb 0.25 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1umc h ALA 221 CO -0.01 0.67 0.22 0.00 0.00 0.00 0.00 179.25 180.13 1umc h ALA 222 N 1.17 0.55 -0.32 0.00 0.00 -0.68 -0.26 119.26 119.72 1umc h ALA 222 Ca 0.26 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1umc h ALA 222 Cb 0.23 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1umc h ALA 222 CO -0.02 0.10 0.20 0.93 0.00 0.00 0.00 179.25 180.46 1umc h GLU 223 N 0.56 0.43 -0.95 0.00 4.39 -0.68 -1.92 114.58 116.41 1umc h GLU 223 Ca 0.15 -0.03 0.07 0.00 0.34 0.00 0.00 59.36 59.89 1umc h GLU 223 Cb 0.09 -0.09 -0.06 0.00 -0.10 0.00 0.00 28.75 28.59 1umc h GLU 223 CO -0.02 0.31 0.61 -0.07 -1.16 0.00 0.00 179.01 178.68 1umc h LEU 224 N 0.42 0.94 -1.17 1.33 3.38 -0.69 -0.90 115.31 118.63 1umc h LEU 224 Ca 0.12 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1umc h LEU 224 Cb -0.02 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 1umc h LEU 224 CO -0.02 0.59 0.49 0.00 0.09 0.00 0.00 178.44 179.58 1umc h ALA 225 N 1.50 1.38 0.00 1.53 0.00 -0.28 -0.02 119.26 123.36 1umc h ALA 225 Ca 0.42 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1umc h ALA 225 Cb 0.24 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1umc h ALA 225 CO -0.17 0.55 -0.02 0.87 0.00 0.00 0.00 179.25 180.47 1umc h LYS 226 N 1.08 0.00 -0.67 0.00 1.57 -0.67 -0.80 116.57 117.08 1umc h LYS 226 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1umc h LYS 226 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1umc h LYS 226 CO -0.06 0.02 0.00 0.00 -0.57 0.00 0.00 179.45 178.85 1umc n ALA 227 N -2.30 3.06 -1.01 3.86 0.00 -0.16 -4.93 120.51 119.04 1umc n ALA 227 Ca -0.03 -1.56 -0.00 0.00 0.00 0.00 0.00 53.44 51.85 1umc n ALA 227 Cb 0.11 -1.03 -0.00 0.00 0.00 0.00 0.00 19.45 18.53 1umc n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1umc n GLY 228 N 1.19 0.47 3.50 0.00 0.00 -0.31 -5.03 105.19 105.02 1umc n GLY 228 Ca 0.26 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1umc n GLY 228 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1umc s VAL 229 N -1.98 4.38 -0.38 1.61 1.01 -0.42 -4.99 120.40 119.63 1umc s VAL 229 Ca 0.00 -0.16 -0.16 0.00 0.00 0.00 0.00 61.98 61.66 1umc s VAL 229 Cb 0.00 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1umc s VAL 229 CO 0.00 0.39 0.38 -0.94 0.00 0.00 0.00 175.10 174.93 1umc s SER 230 N 1.13 6.17 -0.10 3.32 1.04 -1.26 -2.71 113.70 121.28 1umc s SER 230 Ca 0.04 -0.45 -0.05 0.00 0.48 0.00 0.00 55.95 55.97 1umc s SER 230 Cb -0.14 -2.20 -0.04 0.00 0.10 0.00 0.00 66.02 63.74 1umc s SER 230 CO 0.03 -0.43 0.10 0.00 0.98 0.00 0.00 173.24 173.92 1umc s ALA 231 N 2.02 3.69 -0.34 5.32 0.00 -1.26 -1.23 121.76 129.95 1umc s ALA 231 Ca 0.11 -0.70 -0.13 0.00 0.00 0.00 0.00 51.96 51.24 1umc s ALA 231 Cb -0.17 -1.80 -0.01 0.00 0.00 0.00 0.00 23.12 21.14 1umc s ALA 231 CO 0.12 0.62 0.24 -2.00 0.00 0.00 0.00 175.76 174.74 1umc s GLU 232 N -1.04 3.43 -0.27 0.00 2.12 0.24 -3.79 118.70 119.39 1umc s GLU 232 Ca 0.15 -0.69 -0.16 0.00 0.36 0.00 0.00 54.97 54.63 1umc s GLU 232 Cb -0.12 -3.81 -0.03 0.00 0.26 0.00 0.00 34.13 30.44 1umc s GLU 232 CO 0.04 -0.47 0.44 0.08 -0.54 0.00 0.00 175.26 174.81 1umc s VAL 233 N 1.71 5.12 -0.27 3.70 1.01 -0.13 -0.15 120.40 131.40 1umc s VAL 233 Ca 0.06 0.70 0.01 0.00 0.00 0.00 0.00 61.98 62.75 1umc s VAL 233 Cb -0.18 -3.76 0.05 0.00 0.00 0.00 0.00 36.38 32.50 1umc s VAL 233 CO 0.10 0.12 -0.08 -0.22 0.00 0.00 0.00 175.10 175.02 1umc s LEU 234 N 2.18 3.50 -0.55 3.92 2.96 -0.06 -1.30 118.68 129.35 1umc s LEU 234 Ca 0.18 -1.29 -0.23 0.00 -0.22 0.00 0.00 54.13 52.57 1umc s LEU 234 Cb -0.16 -1.60 0.05 0.00 0.50 0.00 0.00 46.19 44.98 1umc s LEU 234 CO 0.10 -0.20 0.85 -0.62 -1.32 0.00 0.00 176.35 175.16 1umc s ASP 235 N 1.17 6.30 0.24 3.68 2.15 -0.30 -1.42 116.67 128.50 1umc s ASP 235 Ca -0.07 -0.56 -0.05 0.00 0.43 0.00 0.00 52.55 52.31 1umc s ASP 235 Cb -0.19 -2.39 0.35 0.00 -0.30 0.00 0.00 42.92 40.38 1umc s ASP 235 CO -0.04 -1.15 1.84 -0.07 -0.17 0.00 0.00 175.17 175.59 1umc h LEU 236 N 10.63 0.82 0.00 -1.34 3.38 -1.25 0.23 115.31 127.77 1umc h LEU 236 Ca -0.27 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1umc h LEU 236 Cb 1.08 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1umc h LEU 236 CO 1.06 0.51 0.00 0.54 0.09 0.00 0.00 178.44 180.64 1umc n ARG 237 N -4.64 0.00 -3.43 1.13 1.74 -1.26 -3.60 116.66 106.60 1umc n ARG 237 Ca 0.13 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.82 1umc n ARG 237 Cb 0.20 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.54 1umc n ARG 237 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1umc s THR 238 N 0.00 5.21 -0.36 0.55 2.01 -1.26 -0.22 115.64 121.56 1umc s THR 238 Ca 0.00 0.49 0.23 0.00 0.31 0.00 0.00 61.69 62.72 1umc s THR 238 Cb 0.00 -3.66 0.04 0.00 0.01 0.00 0.00 72.50 68.89 1umc s THR 238 CO 0.00 0.18 1.17 -0.07 -0.69 0.00 0.00 174.62 175.21 1umc h LEU 239 N 8.50 0.00 -6.29 4.42 3.38 -0.71 -3.35 115.31 121.26 1umc h LEU 239 Ca -0.33 -0.06 0.08 0.00 0.09 0.00 0.00 57.88 57.66 1umc h LEU 239 Cb 1.17 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.71 1umc h LEU 239 CO 0.63 0.03 -0.24 -0.32 0.09 0.00 0.00 178.44 178.62 1umc s MET 240 N -3.30 0.56 0.02 1.13 0.00 -1.08 -3.54 119.30 113.09 1umc s MET 240 Ca 0.02 1.10 -0.27 0.00 0.00 0.00 0.00 55.69 56.54 1umc s MET 240 Cb 0.10 0.60 -0.04 0.00 0.00 0.00 0.00 34.83 35.48 1umc s MET 240 CO 0.76 -0.51 0.86 -1.25 0.00 0.00 0.00 175.02 174.88 1umc s PRO 241 N 2.85 4.55 0.54 4.11 0.04 -1.26 -1.61 135.00 144.22 1umc s PRO 241 Ca 0.14 1.22 -0.14 0.00 0.04 0.00 0.00 61.00 62.25 1umc s PRO 241 Cb -0.14 -3.41 -0.06 0.00 0.04 0.00 0.00 34.50 30.92 1umc s PRO 241 CO -0.20 0.12 0.98 1.67 0.04 0.00 0.00 177.00 179.61 1umc s TRP 242 N 0.46 3.51 -1.17 0.56 1.48 -1.23 -4.18 118.94 118.37 1umc s TRP 242 Ca 0.44 1.37 -0.23 0.00 -1.06 0.00 0.00 56.10 56.62 1umc s TRP 242 Cb -0.21 -2.73 -0.09 0.00 -1.16 0.00 0.00 33.47 29.28 1umc s TRP 242 CO 0.25 -0.45 1.93 -3.47 -4.06 0.00 0.00 176.95 171.15 1umc n ASP 243 N -1.95 3.08 -0.09 -2.66 -0.08 -1.19 -4.80 116.55 108.86 1umc n ASP 243 Ca 0.06 -2.70 -0.06 0.00 -1.51 0.00 0.00 54.79 50.58 1umc n ASP 243 Cb 0.54 -1.72 -0.00 0.00 2.34 0.00 0.00 41.12 42.28 1umc n ASP 243 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 1umc h TYR 244 N 9.58 -0.20 0.13 -0.67 3.20 -1.92 -2.25 116.97 124.85 1umc h TYR 244 Ca 0.23 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.15 1umc h TYR 244 Cb 0.92 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 39.30 1umc h TYR 244 CO 1.21 -0.15 -0.30 0.93 -1.64 0.00 0.00 178.16 178.21 1umc h GLU 245 N -0.01 -0.51 -0.58 1.82 4.39 -1.97 -1.35 114.58 116.36 1umc h GLU 245 Ca 0.16 0.03 0.10 0.00 0.34 0.00 0.00 59.36 59.99 1umc h GLU 245 Cb 0.25 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 28.94 1umc h GLU 245 CO -0.34 -0.34 0.17 0.00 -1.16 0.00 0.00 179.01 177.33 1umc h ALA 246 N 0.14 0.71 0.93 3.43 0.00 -1.92 0.65 119.26 123.21 1umc h ALA 246 Ca 0.03 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1umc h ALA 246 Cb 0.55 0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.46 1umc h ALA 246 CO -0.17 -0.26 -0.45 0.28 0.00 0.00 0.00 179.25 178.65 1umc h VAL 247 N 0.32 0.00 -0.66 0.00 2.07 -1.11 -2.48 116.25 114.39 1umc h VAL 247 Ca 0.30 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.88 1umc h VAL 247 Cb 0.40 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 1umc h VAL 247 CO -0.34 0.00 0.44 0.24 0.02 0.00 0.00 177.57 177.93 1umc h MET 248 N -1.26 0.64 -0.31 1.57 2.07 -1.01 -1.24 114.93 115.40 1umc h MET 248 Ca -0.13 -0.04 -0.11 0.00 -2.07 0.00 0.00 59.70 57.35 1umc h MET 248 Cb 0.97 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 30.54 1umc h MET 248 CO 0.21 0.43 -0.26 -0.91 1.07 0.00 0.00 176.91 177.44 1umc h ASN 249 N 0.66 0.63 -0.03 1.22 2.35 -0.82 -0.67 115.58 118.92 1umc h ASN 249 Ca 0.29 -0.23 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1umc h ASN 249 Cb 0.27 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1umc h ASN 249 CO -0.09 0.87 -0.09 -1.28 -1.65 0.00 0.00 177.43 175.19 1umc h SER 250 N 0.54 0.14 -0.58 5.81 0.87 -0.87 -2.62 113.55 116.83 1umc h SER 250 Ca 0.07 -0.60 -0.02 0.00 -1.23 0.00 0.00 61.79 60.01 1umc h SER 250 Cb 0.73 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.62 1umc h SER 250 CO 0.06 0.71 0.28 0.58 -0.53 0.00 0.00 176.83 177.93 1umc h VAL 251 N -0.43 1.21 -0.79 2.23 2.07 -1.24 -1.24 116.25 118.06 1umc h VAL 251 Ca -0.00 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 66.93 1umc h VAL 251 Cb 0.69 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 1umc h VAL 251 CO 0.02 0.25 0.52 0.00 0.02 0.00 0.00 177.57 178.37 1umc h ALA 252 N 1.44 1.00 0.56 1.67 0.00 -1.12 0.44 119.26 123.25 1umc h ALA 252 Ca 0.21 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1umc h ALA 252 Cb 0.11 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.60 1umc h ALA 252 CO -0.03 0.40 -0.27 -0.22 0.00 0.00 0.00 179.25 179.13 1umc h LYS 253 N 1.05 -0.73 -0.12 0.00 3.64 -0.96 -3.35 116.57 116.11 1umc h LYS 253 Ca 0.29 0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.57 1umc h LYS 253 Cb -0.11 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1umc h LYS 253 CO -0.07 -0.49 -0.58 1.79 -2.27 0.00 0.00 179.45 177.84 1umc h THR 254 N -0.98 1.35 0.00 1.00 1.35 -1.25 -3.48 112.91 110.91 1umc h THR 254 Ca -0.08 -1.89 0.00 0.00 -0.55 0.00 0.00 66.41 63.89 1umc h THR 254 Cb 0.58 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1umc h THR 254 CO 0.13 0.57 0.00 0.61 -0.25 0.00 0.00 175.52 176.58 1umc n GLY 255 N 0.26 2.86 2.87 5.82 0.00 0.15 -4.72 105.19 112.42 1umc n GLY 255 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 1umc n GLY 255 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1umc s ARG 256 N -0.05 0.03 0.02 1.61 1.70 -1.26 0.56 118.95 121.56 1umc s ARG 256 Ca 0.00 0.15 0.01 0.00 -0.47 0.00 0.00 55.73 55.42 1umc s ARG 256 Cb 0.00 -0.10 -0.01 0.00 -0.57 0.00 0.00 34.95 34.27 1umc s ARG 256 CO 0.00 -0.08 -0.05 0.54 -1.08 0.00 0.00 175.30 174.63 1umc s VAL 257 N 0.55 0.32 -0.10 4.99 0.11 -1.26 -1.18 120.40 123.83 1umc s VAL 257 Ca -0.04 -0.69 0.02 0.00 -2.93 0.00 0.00 61.98 58.34 1umc s VAL 257 Cb -0.06 -0.37 0.02 0.00 -1.53 0.00 0.00 36.38 34.43 1umc s VAL 257 CO -0.02 -0.25 -0.13 -0.69 -3.33 0.00 0.00 175.10 170.68 1umc s VAL 258 N -0.92 1.34 -0.15 2.04 1.01 -0.30 -1.82 120.40 121.60 1umc s VAL 258 Ca -0.07 -0.55 -0.06 0.00 0.00 0.00 0.00 61.98 61.30 1umc s VAL 258 Cb -0.07 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1umc s VAL 258 CO -0.00 0.41 0.04 -0.76 0.00 0.00 0.00 175.10 174.78 1umc s LEU 259 N 0.98 3.70 -0.02 3.92 1.02 0.80 -1.39 118.68 127.68 1umc s LEU 259 Ca -0.08 0.08 0.05 0.00 0.02 0.00 0.00 54.13 54.20 1umc s LEU 259 Cb -0.15 -1.91 -0.01 0.00 0.02 0.00 0.00 46.19 44.14 1umc s LEU 259 CO -0.01 0.23 -0.18 -0.69 0.02 0.00 0.00 176.35 175.73 1umc s VAL 260 N 0.03 1.41 0.00 -1.59 1.01 0.05 0.07 120.40 121.39 1umc s VAL 260 Ca 0.04 -0.74 -0.28 0.00 0.00 0.00 0.00 61.98 61.00 1umc s VAL 260 Cb -0.12 -1.19 0.09 0.00 0.00 0.00 0.00 36.38 35.16 1umc s VAL 260 CO 0.01 0.40 0.81 -0.55 0.00 0.00 0.00 175.10 175.78 1umc s SER 261 N -0.25 -0.45 0.00 3.32 0.15 -0.65 -4.21 113.70 111.61 1umc s SER 261 Ca 0.03 0.15 0.24 0.00 0.70 0.00 0.00 55.95 57.07 1umc s SER 261 Cb -0.09 0.44 0.51 0.00 -1.71 0.00 0.00 66.02 65.18 1umc s SER 261 CO 0.00 -0.66 1.44 -0.90 1.20 0.00 0.00 173.24 174.32 1umc n ASP 262 N 0.02 2.68 -4.80 5.45 5.75 -1.26 -2.64 116.55 121.74 1umc n ASP 262 Ca -0.12 -1.87 -0.34 0.00 -0.01 0.00 0.00 54.79 52.45 1umc n ASP 262 Cb 0.61 -0.11 -0.03 0.00 -1.03 0.00 0.00 41.12 40.56 1umc n ASP 262 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1umc s ALA 263 N -1.77 2.87 0.46 2.12 0.00 -1.26 -3.78 121.76 120.40 1umc s ALA 263 Ca 0.34 0.52 -0.23 0.00 0.00 0.00 0.00 51.96 52.59 1umc s ALA 263 Cb 0.21 -3.23 -0.10 0.00 0.00 0.00 0.00 23.12 20.00 1umc s ALA 263 CO 0.30 -0.36 0.99 -2.30 0.00 0.00 0.00 175.76 174.38 1umc n PRO 264 N -1.18 1.26 0.30 0.00 -0.02 -1.26 -1.18 135.00 132.91 1umc n PRO 264 Ca 0.09 0.46 -0.12 0.00 -2.02 0.00 0.00 63.50 61.90 1umc n PRO 264 Cb 0.53 -2.05 -0.06 0.00 -0.02 0.00 0.00 33.50 31.89 1umc n PRO 264 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1umc h ARG 265 N 1.33 -0.75 -6.21 -0.52 2.43 -1.64 -3.38 114.38 105.64 1umc h ARG 265 Ca -0.45 0.05 -0.68 0.00 -0.81 0.00 0.00 59.98 58.09 1umc h ARG 265 Cb 1.34 0.17 0.02 0.00 -0.42 0.00 0.00 29.97 31.08 1umc h ARG 265 CO 0.55 -0.50 0.97 0.72 -1.51 0.00 0.00 179.97 180.21 1umc n HIS 266 N -4.18 2.16 -2.27 2.20 8.25 -1.26 -1.40 115.22 118.72 1umc n HIS 266 Ca -0.10 0.30 -0.21 0.00 -0.26 0.00 0.00 57.72 57.46 1umc n HIS 266 Cb 0.31 -2.55 -0.02 0.00 1.12 0.00 0.00 29.99 28.85 1umc n HIS 266 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1umc n ALA 267 N 5.81 -0.57 -1.78 -1.41 0.00 -1.26 -4.97 120.51 116.32 1umc n ALA 267 Ca 0.25 0.20 -0.29 0.00 0.00 0.00 0.00 53.44 53.59 1umc n ALA 267 Cb 0.20 -2.16 0.11 0.00 0.00 0.00 0.00 19.45 17.60 1umc n ALA 267 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1umc s SER 268 N -2.17 4.03 0.17 0.00 1.04 -0.49 -4.91 113.70 111.37 1umc s SER 268 Ca 0.00 0.79 -0.11 0.00 0.48 0.00 0.00 55.95 57.11 1umc s SER 268 Cb 0.00 -1.26 0.07 0.00 0.10 0.00 0.00 66.02 64.93 1umc s SER 268 CO 0.00 -2.20 1.69 0.15 0.98 0.00 0.00 173.24 173.86 1umc h PHE 269 N -1.26 0.99 0.00 5.02 3.57 -1.88 -2.29 116.94 121.09 1umc h PHE 269 Ca -0.47 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 60.90 1umc h PHE 269 Cb 1.32 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.78 1umc h PHE 269 CO 0.14 0.83 -0.11 -0.39 -2.23 0.00 0.00 178.31 176.55 1umc h VAL 270 N 0.86 0.83 -0.47 1.41 -1.51 -1.93 0.11 116.25 115.55 1umc h VAL 270 Ca 0.19 -0.42 -0.07 0.00 -1.23 0.00 0.00 66.70 65.17 1umc h VAL 270 Cb 0.32 1.24 -0.02 0.00 -2.13 0.00 0.00 31.29 30.70 1umc h VAL 270 CO -0.00 0.11 0.01 0.28 -1.23 0.00 0.00 177.57 176.74 1umc h SER 271 N 0.00 0.74 0.03 4.19 0.02 -1.72 0.54 113.55 117.36 1umc h SER 271 Ca -0.00 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1umc h SER 271 Cb 0.23 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1umc h SER 271 CO 0.01 0.81 -0.02 -0.08 -1.14 0.00 0.00 176.83 176.42 1umc h GLU 272 N 0.73 -0.04 -0.59 3.45 4.57 -0.78 -0.16 114.58 121.75 1umc h GLU 272 Ca 0.14 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.34 1umc h GLU 272 Cb 0.43 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 1umc h GLU 272 CO 0.02 0.18 0.39 0.28 -1.18 0.00 0.00 179.01 178.70 1umc h VAL 273 N -0.27 1.14 -0.26 0.32 2.07 -1.17 -0.88 116.25 117.20 1umc h VAL 273 Ca -0.00 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1umc h VAL 273 Cb 0.25 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1umc h VAL 273 CO 0.01 0.14 0.17 0.00 0.02 0.00 0.00 177.57 177.91 1umc h ALA 274 N 1.23 0.32 0.00 1.67 0.00 -0.75 -0.25 119.26 121.48 1umc h ALA 274 Ca 0.22 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1umc h ALA 274 Cb -0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1umc h ALA 274 CO -0.06 -0.20 -0.21 0.00 0.00 0.00 0.00 179.25 178.78 1umc h ALA 275 N 1.09 1.54 0.04 0.00 0.00 -0.70 -1.78 119.26 119.46 1umc h ALA 275 Ca 0.09 -0.19 -0.23 0.00 0.00 0.00 0.00 54.91 54.58 1umc h ALA 275 Cb -0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1umc h ALA 275 CO -0.02 0.27 -1.04 1.15 0.00 0.00 0.00 179.25 179.61 1umc h THR 276 N 0.00 1.59 -0.50 0.00 2.02 -0.54 -2.13 112.91 113.35 1umc h THR 276 Ca -0.00 -3.08 -0.13 0.00 0.77 0.00 0.00 66.41 63.97 1umc h THR 276 Cb 0.40 2.77 -0.01 0.00 -1.74 0.00 0.00 68.15 69.57 1umc h THR 276 CO 0.03 0.89 -0.20 0.40 0.37 0.00 0.00 175.52 177.00 1umc h ILE 277 N 0.05 1.27 -0.16 3.11 2.04 -0.60 -1.98 117.51 121.24 1umc h ILE 277 Ca -0.06 -1.37 -0.12 0.00 1.00 0.00 0.00 64.86 64.31 1umc h ILE 277 Cb 1.76 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 1umc h ILE 277 CO 0.15 0.48 -0.43 0.00 0.00 0.00 0.00 178.15 178.35 1umc h ALA 278 N 0.88 0.96 0.00 1.87 0.00 -1.32 0.38 119.26 122.03 1umc h ALA 278 Ca 0.12 -0.44 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 1umc h ALA 278 Cb 0.79 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1umc h ALA 278 CO 0.07 0.63 -0.54 1.49 0.00 0.00 0.00 179.25 180.90 1umc h GLU 279 N 0.31 0.00 0.00 0.00 4.81 -1.26 -3.28 114.58 115.16 1umc h GLU 279 Ca 0.02 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.11 1umc h GLU 279 Cb 0.89 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.25 1umc h GLU 279 CO 0.07 0.54 -1.59 -0.25 -0.73 0.00 0.00 179.01 177.05 1umc n ASP 280 N -3.33 2.79 -0.92 1.04 8.00 -0.76 -4.73 116.55 118.64 1umc n ASP 280 Ca 0.01 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.50 1umc n ASP 280 Cb 0.70 0.80 0.18 0.00 -0.02 0.00 0.00 41.12 42.78 1umc n ASP 280 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1umc n LEU 281 N -2.28 3.31 -0.23 0.64 4.77 0.13 -4.78 117.00 118.58 1umc n LEU 281 Ca -0.13 -4.03 0.02 0.00 -0.03 0.00 0.00 56.01 51.84 1umc n LEU 281 Cb 0.73 -0.52 0.14 0.00 -2.33 0.00 0.00 43.42 41.45 1umc n LEU 281 CO 0.19 1.50 0.99 0.25 -1.33 0.00 0.00 177.39 179.00 1umc h LEU 282 N 1.20 0.22 0.00 2.23 5.85 -1.63 0.14 115.31 123.31 1umc h LEU 282 Ca 0.10 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1umc h LEU 282 Cb 1.18 0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1umc h LEU 282 CO 0.19 0.11 0.00 -0.90 -0.34 0.00 0.00 178.44 177.50 1umc n ASP 283 N -5.02 0.00 -0.54 1.25 5.75 -1.26 -2.07 116.55 114.66 1umc n ASP 283 Ca 0.11 0.49 0.07 0.00 -0.01 0.00 0.00 54.79 55.45 1umc n ASP 283 Cb 0.34 -0.49 0.05 0.00 -1.03 0.00 0.00 41.12 39.99 1umc n ASP 283 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 1umc n MET 284 N -1.49 1.00 -3.11 0.11 2.81 0.45 -4.99 117.12 111.90 1umc n MET 284 Ca 0.02 -1.29 -0.39 0.00 -1.81 0.00 0.00 57.70 54.22 1umc n MET 284 Cb 0.09 -1.26 -0.05 0.00 -0.71 0.00 0.00 33.22 31.29 1umc n MET 284 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1umc s LEU 285 N -1.21 4.37 0.00 4.03 1.43 -0.88 -4.28 118.68 122.14 1umc s LEU 285 Ca 0.16 1.19 0.15 0.00 -1.03 0.00 0.00 54.13 54.60 1umc s LEU 285 Cb 0.12 -3.02 -0.11 0.00 0.03 0.00 0.00 46.19 43.21 1umc s LEU 285 CO 0.18 -0.01 0.70 0.18 0.23 0.00 0.00 176.35 177.64 1umc n LEU 286 N 3.24 1.01 -3.61 1.79 4.77 0.19 -4.99 117.00 119.41 1umc n LEU 286 Ca -0.04 -0.59 -0.11 0.00 -0.03 0.00 0.00 56.01 55.24 1umc n LEU 286 Cb 0.51 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.56 1umc n LEU 286 CO 0.46 0.22 0.22 0.00 -1.33 0.00 0.00 177.39 176.96 1umc s ALA 287 N -2.21 -1.05 0.34 -1.18 0.00 -1.22 -4.89 121.76 111.55 1umc s ALA 287 Ca 0.08 0.02 -0.28 0.00 0.00 0.00 0.00 51.96 51.79 1umc s ALA 287 Cb 0.12 0.76 -0.09 0.00 0.00 0.00 0.00 23.12 23.90 1umc s ALA 287 CO 0.53 -0.69 1.18 -2.14 0.00 0.00 0.00 175.76 174.64 1umc s PRO 288 N -3.80 4.34 -0.05 0.00 0.02 -1.26 -4.75 135.00 129.50 1umc s PRO 288 Ca 0.04 1.91 -0.30 0.00 0.02 0.00 0.00 61.00 62.67 1umc s PRO 288 Cb 0.01 -2.95 -0.06 0.00 0.02 0.00 0.00 34.50 31.52 1umc s PRO 288 CO -0.11 -0.09 1.69 -1.25 -0.33 0.00 0.00 177.00 176.91 1umc s PRO 289 N -1.88 4.16 -0.16 5.54 0.04 -1.26 -4.68 135.00 136.75 1umc s PRO 289 Ca 0.51 2.22 -0.07 0.00 0.04 0.00 0.00 61.00 63.69 1umc s PRO 289 Cb -0.33 -4.01 -0.04 0.00 0.04 0.00 0.00 34.50 30.16 1umc s PRO 289 CO 0.43 -0.88 0.08 0.42 0.04 0.00 0.00 177.00 177.08 1umc s ILE 290 N 4.14 4.94 -0.22 0.56 1.01 -0.75 -4.99 121.20 125.88 1umc s ILE 290 Ca 0.75 0.01 -0.06 0.00 0.00 0.00 0.00 60.65 61.35 1umc s ILE 290 Cb -0.34 -3.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.90 1umc s ILE 290 CO 0.31 0.50 0.03 -0.13 0.00 0.00 0.00 174.94 175.65 1umc s ARG 291 N 0.02 3.66 -0.34 2.79 0.52 -1.26 -0.14 118.95 124.20 1umc s ARG 291 Ca 0.07 -0.49 -0.06 0.00 -0.52 0.00 0.00 55.73 54.73 1umc s ARG 291 Cb -0.12 -3.18 0.04 0.00 0.52 0.00 0.00 34.95 32.21 1umc s ARG 291 CO 0.01 -0.04 0.10 0.08 0.02 0.00 0.00 175.30 175.47 1umc s VAL 292 N 1.18 3.76 0.36 3.52 1.01 0.11 -4.96 120.40 125.38 1umc s VAL 292 Ca 0.04 -1.15 0.05 0.00 0.00 0.00 0.00 61.98 60.93 1umc s VAL 292 Cb -0.14 -3.13 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 1umc s VAL 292 CO 0.02 -0.18 0.21 0.42 0.00 0.00 0.00 175.10 175.57 1umc s THR 293 N 1.40 0.25 0.64 3.92 -4.23 -1.25 -1.64 115.64 114.73 1umc s THR 293 Ca -0.02 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.34 1umc s THR 293 Cb -0.20 -2.42 -0.01 0.00 1.34 0.00 0.00 72.50 71.21 1umc s THR 293 CO 0.03 0.00 1.12 -0.83 -0.54 0.00 0.00 174.62 174.39 1umc s GLY 294 N -3.47 2.24 0.70 3.99 0.00 -0.33 -4.79 107.32 105.66 1umc s GLY 294 Ca 0.33 0.60 -0.11 0.00 0.00 0.00 0.00 44.72 45.55 1umc s GLY 294 CO 0.21 0.96 1.06 -1.36 0.00 0.00 0.00 173.10 173.98 1umc s PHE 295 N -2.24 3.07 -1.57 1.90 0.08 -1.26 -2.13 117.98 115.83 1umc s PHE 295 Ca 0.68 1.43 -0.10 0.00 0.12 0.00 0.00 56.93 59.05 1umc s PHE 295 Cb -0.21 -2.90 -0.04 0.00 -0.57 0.00 0.00 43.02 39.29 1umc s PHE 295 CO 0.39 -1.29 2.77 -0.25 -0.10 0.00 0.00 175.22 176.75 1umc n ASP 296 N -3.17 7.82 -4.05 1.36 8.00 -1.26 -4.43 116.55 120.81 1umc n ASP 296 Ca 0.08 -2.68 -0.09 0.00 0.71 0.00 0.00 54.79 52.81 1umc n ASP 296 Cb 0.54 -1.56 -0.09 0.00 -0.02 0.00 0.00 41.12 39.99 1umc n ASP 296 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1umc s THR 297 N 2.02 0.12 0.95 -3.53 -4.23 -1.26 -5.07 115.64 104.64 1umc s THR 297 Ca 0.64 -1.67 -0.11 0.00 -1.18 0.00 0.00 61.69 59.37 1umc s THR 297 Cb 0.17 -1.81 0.16 0.00 1.34 0.00 0.00 72.50 72.36 1umc s THR 297 CO -0.07 -0.54 1.09 -2.84 -0.54 0.00 0.00 174.62 171.73 1umc s PRO 298 N -3.98 0.80 -0.25 3.99 0.02 -1.26 -4.86 135.00 129.45 1umc s PRO 298 Ca 0.17 1.04 -0.29 0.00 0.02 0.00 0.00 61.00 61.94 1umc s PRO 298 Cb 0.06 -1.74 -0.02 0.00 0.02 0.00 0.00 34.50 32.83 1umc s PRO 298 CO -0.02 -2.62 1.52 -0.47 -0.33 0.00 0.00 177.00 175.08 1umc s TYR 299 N -2.75 2.27 -0.06 6.54 6.14 -1.26 -4.97 117.35 123.26 1umc s TYR 299 Ca 0.65 0.64 -0.30 0.00 0.64 0.00 0.00 57.07 58.71 1umc s TYR 299 Cb -0.21 -3.98 -0.02 0.00 0.42 0.00 0.00 41.96 38.17 1umc s TYR 299 CO 0.59 -2.55 1.03 -1.25 0.64 0.00 0.00 175.55 174.00 1umc s PRO 300 N 4.57 4.46 -0.02 4.97 0.04 -1.26 -4.98 135.00 142.78 1umc s PRO 300 Ca 0.67 1.45 -0.25 0.00 0.04 0.00 0.00 61.00 62.91 1umc s PRO 300 Cb -0.22 -3.51 -0.20 0.00 0.04 0.00 0.00 34.50 30.62 1umc s PRO 300 CO 0.28 -0.24 1.24 -0.92 0.04 0.00 0.00 177.00 177.39 1umc h TYR 301 N 7.02 0.12 -0.38 0.56 3.20 -1.99 -2.93 116.97 122.57 1umc h TYR 301 Ca -0.35 -0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.45 1umc h TYR 301 Cb 1.17 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.41 1umc h TYR 301 CO 0.70 0.61 0.13 0.00 -1.64 0.00 0.00 178.16 177.97 1umc h ALA 302 N 0.48 0.50 -0.78 1.82 0.00 -2.04 -3.08 119.26 116.17 1umc h ALA 302 Ca 0.00 -0.15 -0.43 0.00 0.00 0.00 0.00 54.91 54.33 1umc h ALA 302 Cb 0.60 -0.15 -0.24 0.00 0.00 0.00 0.00 17.79 18.01 1umc h ALA 302 CO 0.01 0.12 0.55 1.04 0.00 0.00 0.00 179.25 180.98 1umc n GLN 303 N -4.64 2.05 -0.29 0.00 3.00 -1.25 -4.57 117.38 111.68 1umc n GLN 303 Ca -0.01 -2.38 0.04 0.00 -0.01 0.00 0.00 57.00 54.64 1umc n GLN 303 Cb 0.16 -1.93 0.18 0.00 0.00 0.00 0.00 30.24 28.64 1umc n GLN 303 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1umc h ASP 304 N 1.01 0.64 -0.72 1.08 3.58 -1.42 -0.25 116.42 120.34 1umc h ASP 304 Ca 0.49 0.06 0.11 0.00 0.42 0.00 0.00 57.03 58.11 1umc h ASP 304 Cb 2.08 -0.06 -0.05 0.00 1.72 0.00 0.00 39.33 43.02 1umc h ASP 304 CO 0.95 0.35 0.48 0.11 -2.88 0.00 0.00 179.24 178.24 1umc h LYS 305 N 0.75 0.54 0.11 0.28 1.57 -1.88 -2.50 116.57 115.44 1umc h LYS 305 Ca 0.41 -0.03 -0.32 0.00 -1.87 0.00 0.00 60.65 58.84 1umc h LYS 305 Cb 0.42 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1umc h LYS 305 CO -0.27 0.35 -1.67 -0.07 -0.57 0.00 0.00 179.45 177.23 1umc h LEU 306 N 0.55 0.36 0.13 2.94 3.38 -1.50 -3.39 115.31 117.78 1umc h LEU 306 Ca 0.34 -0.58 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1umc h LEU 306 Cb 0.57 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1umc h LEU 306 CO -0.12 1.49 -0.06 0.22 0.09 0.00 0.00 178.44 180.06 1umc h TYR 307 N 0.06 -0.16 -2.64 1.13 5.03 -0.84 -3.41 116.97 116.13 1umc h TYR 307 Ca -0.29 -0.00 -0.53 0.00 2.58 0.00 0.00 58.73 60.49 1umc h TYR 307 Cb 2.03 0.05 0.04 0.00 1.55 0.00 0.00 36.73 40.40 1umc h TYR 307 CO 0.06 0.09 1.03 -1.17 -1.32 0.00 0.00 178.16 176.85 1umc s LEU 308 N -9.73 4.38 0.19 2.82 2.96 -0.97 -4.55 118.68 113.78 1umc s LEU 308 Ca -0.15 2.68 -0.32 0.00 -0.22 0.00 0.00 54.13 56.12 1umc s LEU 308 Cb 0.04 -3.58 -0.15 0.00 0.50 0.00 0.00 46.19 43.00 1umc s LEU 308 CO 0.63 -0.94 1.25 -2.65 -1.32 0.00 0.00 176.35 173.32 1umc n PRO 309 N 5.12 1.43 -2.98 0.98 -0.02 -1.26 -4.91 135.00 133.36 1umc n PRO 309 Ca 0.16 0.51 -0.20 0.00 -2.02 0.00 0.00 63.50 61.95 1umc n PRO 309 Cb 0.38 -2.06 0.02 0.00 -0.02 0.00 0.00 33.50 31.82 1umc n PRO 309 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1umc s THR 310 N -0.12 3.34 0.23 3.45 -4.23 -1.26 -4.89 115.64 112.17 1umc s THR 310 Ca 0.72 -0.78 -0.07 0.00 -1.18 0.00 0.00 61.69 60.38 1umc s THR 310 Cb -0.79 -3.19 0.21 0.00 1.34 0.00 0.00 72.50 70.07 1umc s THR 310 CO 0.51 -0.11 1.88 0.58 -0.54 0.00 0.00 174.62 176.94 1umc h VAL 311 N 0.46 1.25 -0.32 2.29 2.07 -1.93 -1.47 116.25 118.59 1umc h VAL 311 Ca -0.43 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 66.54 1umc h VAL 311 Cb 1.27 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1umc h VAL 311 CO 0.52 0.26 0.18 0.74 0.02 0.00 0.00 177.57 179.29 1umc h THR 312 N 1.25 1.12 -0.73 2.57 2.02 -1.94 0.98 112.91 118.17 1umc h THR 312 Ca 0.32 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1umc h THR 312 Cb -0.05 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 1umc h THR 312 CO -0.06 0.13 0.38 -0.09 0.37 0.00 0.00 175.52 176.25 1umc h ARG 313 N 0.40 1.02 -0.33 6.66 2.43 -1.85 0.65 114.38 123.36 1umc h ARG 313 Ca 0.11 -0.12 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 1umc h ARG 313 Cb 0.04 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1umc h ARG 313 CO -0.02 0.76 -0.32 0.82 -1.51 0.00 0.00 179.97 179.70 1umc h ILE 314 N 1.02 1.29 -0.66 1.20 2.04 -0.88 -2.87 117.51 118.65 1umc h ILE 314 Ca 0.26 -1.49 -0.09 0.00 1.00 0.00 0.00 64.86 64.54 1umc h ILE 314 Cb 0.05 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 1umc h ILE 314 CO -0.04 0.49 0.07 -0.07 0.00 0.00 0.00 178.15 178.60 1umc h LEU 315 N 0.59 1.08 -1.53 1.44 3.38 -0.22 -1.17 115.31 118.87 1umc h LEU 315 Ca 0.05 -0.28 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1umc h LEU 315 Cb 0.90 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 1umc h LEU 315 CO 0.08 1.08 0.27 0.78 0.09 0.00 0.00 178.44 180.74 1umc h ASN 316 N 1.03 0.51 0.20 -0.43 2.35 -0.85 0.13 115.58 118.52 1umc h ASN 316 Ca 0.19 -0.02 -0.22 0.00 -0.55 0.00 0.00 56.30 55.70 1umc h ASN 316 Cb 0.49 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.74 1umc h ASN 316 CO 0.02 0.39 -0.89 0.00 -1.65 0.00 0.00 177.43 175.30 1umc h ALA 317 N 1.70 0.37 -0.37 -0.83 0.00 -1.25 -2.41 119.26 116.47 1umc h ALA 317 Ca 0.16 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1umc h ALA 317 Cb -0.04 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1umc h ALA 317 CO -0.03 0.77 0.14 0.00 0.00 0.00 0.00 179.25 180.13 1umc h ALA 318 N 0.71 0.49 -0.22 0.00 0.00 -0.19 -1.26 119.26 118.78 1umc h ALA 318 Ca -0.07 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.71 1umc h ALA 318 Cb 1.51 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 1umc h ALA 318 CO 0.16 0.10 0.09 -0.22 0.00 0.00 0.00 179.25 179.38 1umc h LYS 319 N 0.46 0.20 -0.94 0.00 3.64 -0.79 0.20 116.57 119.34 1umc h LYS 319 Ca 0.12 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.56 1umc h LYS 319 Cb 0.20 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 31.91 1umc h LYS 319 CO -0.01 0.14 0.61 -0.09 -2.27 0.00 0.00 179.45 177.83 1umc h ARG 320 N 0.21 1.05 -0.19 1.90 2.43 -1.21 0.39 114.38 118.95 1umc h ARG 320 Ca 0.09 -0.06 -0.18 0.00 -0.81 0.00 0.00 59.98 59.02 1umc h ARG 320 Cb 0.04 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.36 1umc h ARG 320 CO -0.08 0.69 -0.62 0.00 -1.51 0.00 0.00 179.97 178.46 1umc h ALA 321 N 1.49 0.55 -0.10 2.80 0.00 -0.38 -2.73 119.26 120.89 1umc h ALA 321 Ca 0.40 -0.54 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1umc h ALA 321 Cb 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1umc h ALA 321 CO -0.15 0.70 -0.39 -0.07 0.00 0.00 0.00 179.25 179.33 1umc h LEU 322 N 0.50 0.52 0.00 0.00 3.38 0.24 -3.22 115.31 116.72 1umc h LEU 322 Ca -0.01 -0.62 0.00 0.00 0.09 0.00 0.00 57.88 57.34 1umc h LEU 322 Cb 1.20 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1umc h LEU 322 CO 0.12 1.06 0.00 0.47 0.09 0.00 0.00 178.44 180.18 1umc n ASP 323 N -4.34 0.00 0.00 -0.43 8.00 0.13 -5.09 116.55 114.83 1umc n ASP 323 Ca -0.08 0.46 0.04 0.00 0.71 0.00 0.00 54.79 55.92 1umc n ASP 323 Cb 0.54 -0.48 0.25 0.00 -0.02 0.00 0.00 41.12 41.40 1umc n ASP 323 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81