#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x8k n LEU 7 N 0.00 0.00 -4.76 -2.67 4.77 -1.26 -4.89 117.00 108.19 1x8k n LEU 7 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.59 1x8k n LEU 7 Cb 0.00 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1x8k n LEU 7 CO 0.00 0.00 0.94 -2.16 -1.33 0.00 0.00 177.39 174.84 1x8k s PRO 8 N 0.00 3.67 -0.44 3.23 0.04 -1.26 -4.91 135.00 135.33 1x8k s PRO 8 Ca 0.00 2.09 -0.28 0.00 0.04 0.00 0.00 61.00 62.85 1x8k s PRO 8 Cb 0.00 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1x8k s PRO 8 CO 0.00 -0.71 1.50 0.12 0.04 0.00 0.00 177.00 177.95 1x8k s PHE 9 N -1.35 2.23 -2.00 0.56 5.36 -1.26 -4.91 117.98 116.62 1x8k s PHE 9 Ca 0.63 0.63 0.12 0.00 -0.96 0.00 0.00 56.93 57.34 1x8k s PHE 9 Cb -0.36 -4.29 0.70 0.00 -0.34 0.00 0.00 43.02 38.73 1x8k s PHE 9 CO 0.45 -2.16 1.17 -0.35 -1.46 0.00 0.00 175.22 172.87 1x8k n PRO 10 N 8.33 0.59 -4.61 10.12 -0.04 -1.26 -4.82 135.00 143.30 1x8k n PRO 10 Ca 0.17 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.29 1x8k n PRO 10 Cb 0.48 -1.31 -0.11 0.00 -0.04 0.00 0.00 33.50 32.52 1x8k n PRO 10 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1x8k s TYR 11 N -2.00 2.91 0.45 0.54 4.12 -1.26 -5.03 117.35 117.07 1x8k s TYR 11 Ca 0.18 -0.00 0.03 0.00 0.02 0.00 0.00 57.07 57.30 1x8k s TYR 11 Cb 0.08 -1.68 0.01 0.00 -1.52 0.00 0.00 41.96 38.85 1x8k s TYR 11 CO 0.14 0.33 0.64 -1.21 0.02 0.00 0.00 175.55 175.46 1x8k s GLU 12 N -0.93 2.90 0.14 -0.62 0.41 -1.26 -4.90 118.70 114.44 1x8k s GLU 12 Ca 0.13 -0.80 0.07 0.00 -0.41 0.00 0.00 54.97 53.96 1x8k s GLU 12 Cb -0.11 -2.63 -0.04 0.00 -1.78 0.00 0.00 34.13 29.57 1x8k s GLU 12 CO 0.03 -0.31 -0.17 -0.59 -0.49 0.00 0.00 175.26 173.73 1x8k s PHE 13 N -2.49 1.64 0.04 1.61 -0.12 -1.26 -1.59 117.98 115.80 1x8k s PHE 13 Ca 0.51 -0.50 0.04 0.00 -0.05 0.00 0.00 56.93 56.93 1x8k s PHE 13 Cb -0.10 -0.84 -0.02 0.00 -0.63 0.00 0.00 43.02 41.43 1x8k s PHE 13 CO 0.36 0.24 -0.13 -0.98 -0.05 0.00 0.00 175.22 174.66 1x8k s ARG 14 N -2.67 0.87 0.88 1.99 1.70 -0.63 -4.99 118.95 116.10 1x8k s ARG 14 Ca 0.12 -0.72 -0.11 0.00 -0.47 0.00 0.00 55.73 54.55 1x8k s ARG 14 Cb -0.06 -0.86 0.12 0.00 -0.57 0.00 0.00 34.95 33.59 1x8k s ARG 14 CO 0.05 0.21 1.09 -1.21 -1.08 0.00 0.00 175.30 174.36 1x8k s GLU 15 N -1.10 1.38 0.46 3.89 0.41 -1.26 -1.21 118.70 121.26 1x8k s GLU 15 Ca 0.01 1.02 -0.21 0.00 -0.41 0.00 0.00 54.97 55.37 1x8k s GLU 15 Cb -0.08 -1.81 -0.09 0.00 -1.78 0.00 0.00 34.13 30.38 1x8k s GLU 15 CO 0.01 -2.21 1.04 -0.51 -0.49 0.00 0.00 175.26 173.10 1x8k s LEU 16 N -6.25 3.94 0.80 1.80 1.43 -1.26 -4.81 118.68 114.33 1x8k s LEU 16 Ca 0.63 1.96 -0.11 0.00 -1.03 0.00 0.00 54.13 55.58 1x8k s LEU 16 Cb -0.19 -4.44 0.09 0.00 0.03 0.00 0.00 46.19 41.68 1x8k s LEU 16 CO 0.57 -0.68 1.16 0.54 0.23 0.00 0.00 176.35 178.17 1x8k s ASN 17 N -1.85 4.39 0.34 2.29 2.20 -1.26 -4.73 114.94 116.32 1x8k s ASN 17 Ca 0.64 0.62 0.15 0.00 -0.94 0.00 0.00 52.86 53.33 1x8k s ASN 17 Cb -0.18 -1.09 1.11 0.00 -2.00 0.00 0.00 41.25 39.10 1x8k s ASN 17 CO 0.22 -1.95 1.64 -0.65 -2.94 0.00 0.00 177.10 173.42 1x8k h PRO 18 N -1.02 0.22 0.02 3.55 0.11 -1.98 0.22 132.00 133.12 1x8k h PRO 18 Ca -0.45 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 1x8k h PRO 18 Cb 1.31 -0.05 0.01 0.00 0.11 0.00 0.00 31.00 32.38 1x8k h PRO 18 CO 0.61 0.15 -0.39 0.93 -0.21 0.00 0.00 178.00 179.09 1x8k h GLU 19 N 0.23 0.23 -0.55 1.05 5.08 -1.99 -1.73 114.58 116.90 1x8k h GLU 19 Ca 0.74 -0.27 0.02 0.00 -1.00 0.00 0.00 59.36 58.85 1x8k h GLU 19 Cb 1.75 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 31.06 1x8k h GLU 19 CO -0.66 1.02 0.35 0.93 -1.00 0.00 0.00 179.01 179.65 1x8k h GLU 20 N -0.44 0.67 0.21 2.33 5.08 -1.86 -2.12 114.58 118.45 1x8k h GLU 20 Ca -0.05 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 1x8k h GLU 20 Cb 1.17 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1x8k h GLU 20 CO 0.08 0.45 -0.10 0.22 -1.00 0.00 0.00 179.01 178.65 1x8k h ASP 21 N 0.69 -0.24 -0.86 1.42 3.58 -1.00 -1.92 116.42 118.09 1x8k h ASP 21 Ca 0.21 -0.02 0.21 0.00 0.42 0.00 0.00 57.03 57.85 1x8k h ASP 21 Cb -0.02 0.06 -0.16 0.00 1.72 0.00 0.00 39.33 40.93 1x8k h ASP 21 CO -0.07 -0.14 -0.01 0.50 -2.88 0.00 0.00 179.24 176.64 1x8k h LYS 22 N -0.31 0.06 0.09 0.28 3.64 -1.10 0.22 116.57 119.44 1x8k h LYS 22 Ca -0.03 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1x8k h LYS 22 Cb 0.24 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1x8k h LYS 22 CO 0.05 0.04 -0.04 1.25 -2.27 0.00 0.00 179.45 178.48 1x8k h LEU 23 N 0.06 -0.10 0.44 5.20 5.85 -1.14 -2.50 115.31 123.12 1x8k h LEU 23 Ca 0.48 -0.45 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1x8k h LEU 23 Cb 0.90 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 1x8k h LEU 23 CO -0.79 0.44 -0.25 0.58 -0.34 0.00 0.00 178.44 178.07 1x8k h VAL 24 N -0.68 0.48 -0.98 1.05 2.07 -1.03 -2.41 116.25 114.75 1x8k h VAL 24 Ca -0.01 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.74 1x8k h VAL 24 Cb 0.54 0.48 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 1x8k h VAL 24 CO 0.02 0.00 0.64 0.11 0.02 0.00 0.00 177.57 178.36 1x8k h LYS 25 N -0.65 0.40 -0.52 1.57 1.79 -0.66 0.15 116.57 118.65 1x8k h LYS 25 Ca -0.05 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.37 1x8k h LYS 25 Cb 0.52 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 31.06 1x8k h LYS 25 CO 0.06 0.27 0.23 0.00 -1.08 0.00 0.00 179.45 178.93 1x8k h ALA 26 N 1.61 1.43 0.00 3.86 0.00 -0.96 -2.42 119.26 122.78 1x8k h ALA 26 Ca 0.53 -0.12 -0.28 0.00 0.00 0.00 0.00 54.91 55.04 1x8k h ALA 26 Cb 1.33 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 1x8k h ALA 26 CO -0.24 0.45 -2.11 0.09 0.00 0.00 0.00 179.25 177.44 1x8k n ASN 27 N -4.36 0.96 -0.02 0.00 5.03 0.28 -4.67 115.26 112.47 1x8k n ASN 27 Ca 0.04 0.00 0.01 0.00 0.87 0.00 0.00 54.58 55.50 1x8k n ASN 27 Cb 0.14 0.95 0.02 0.00 -1.02 0.00 0.00 39.78 39.87 1x8k n ASN 27 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1x8k n LEU 28 N -2.58 1.62 -0.32 3.41 4.77 0.20 -0.26 117.00 123.85 1x8k n LEU 28 Ca -0.25 -1.73 0.03 0.00 -0.03 0.00 0.00 56.01 54.02 1x8k n LEU 28 Cb 1.00 -0.05 0.17 0.00 -2.33 0.00 0.00 43.42 42.21 1x8k n LEU 28 CO 0.35 0.43 1.19 1.23 -1.33 0.00 0.00 177.39 179.26 1x8k h GLY 29 N 0.00 1.37 1.21 -0.72 0.00 -1.53 -1.73 103.07 101.67 1x8k h GLY 29 Ca 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 47.33 46.96 1x8k h GLY 29 CO 0.00 0.21 0.52 0.00 0.00 0.00 0.00 176.54 177.28 1x8k h ALA 30 N 1.45 1.45 -2.38 3.60 0.00 -1.89 -3.41 119.26 118.08 1x8k h ALA 30 Ca 0.41 -0.05 -0.53 0.00 0.00 0.00 0.00 54.91 54.73 1x8k h ALA 30 Cb 0.28 -0.32 0.02 0.00 0.00 0.00 0.00 17.79 17.77 1x8k h ALA 30 CO -0.21 0.51 1.12 0.12 0.00 0.00 0.00 179.25 180.79 1x8k s PHE 31 N -5.89 1.87 0.40 0.00 5.36 -0.65 -4.90 117.98 114.17 1x8k s PHE 31 Ca -0.11 -0.04 0.09 0.00 -0.96 0.00 0.00 56.93 55.90 1x8k s PHE 31 Cb 0.18 -4.09 0.87 0.00 -0.34 0.00 0.00 43.02 39.64 1x8k s PHE 31 CO 0.79 -4.63 2.01 -1.35 -1.46 0.00 0.00 175.22 170.58 1x8k h PRO 32 N 9.45 0.56 -6.40 10.12 0.11 -1.85 -3.43 132.00 140.57 1x8k h PRO 32 Ca -0.45 -0.03 -0.54 0.00 0.11 0.00 0.00 66.00 65.09 1x8k h PRO 32 Cb 1.21 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 1x8k h PRO 32 CO 0.94 0.37 0.41 0.99 -0.21 0.00 0.00 178.00 180.50 1x8k s THR 33 N -5.52 4.78 0.29 -1.15 2.01 -1.26 -5.04 115.64 109.75 1x8k s THR 33 Ca -0.09 2.00 0.08 0.00 0.31 0.00 0.00 61.69 63.99 1x8k s THR 33 Cb 0.19 -4.28 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 1x8k s THR 33 CO 0.75 0.14 0.19 0.42 -0.69 0.00 0.00 174.62 175.43 1x8k s THR 34 N 1.12 3.86 0.32 -0.82 -4.23 -1.26 -4.98 115.64 109.65 1x8k s THR 34 Ca 0.52 -1.49 0.07 0.00 -1.18 0.00 0.00 61.69 59.61 1x8k s THR 34 Cb -0.22 -3.21 -0.02 0.00 1.34 0.00 0.00 72.50 70.39 1x8k s THR 34 CO 0.27 -0.28 0.32 -0.31 -0.54 0.00 0.00 174.62 174.08 1x8k s TYR 35 N -2.25 3.02 -0.02 3.99 1.51 -1.26 -0.70 117.35 121.63 1x8k s TYR 35 Ca 0.36 -0.24 -0.08 0.00 -1.01 0.00 0.00 57.07 56.10 1x8k s TYR 35 Cb -0.06 -1.77 0.01 0.00 -0.11 0.00 0.00 41.96 40.03 1x8k s TYR 35 CO 0.25 0.21 0.17 0.08 -1.11 0.00 0.00 175.55 175.14 1x8k s VAL 36 N -2.23 0.05 -0.09 0.71 1.01 -0.04 -4.71 120.40 115.10 1x8k s VAL 36 Ca 0.40 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.75 1x8k s VAL 36 Cb -0.07 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 1x8k s VAL 36 CO 0.27 -0.24 0.53 -0.54 0.00 0.00 0.00 175.10 175.13 1x8k s LYS 37 N -0.87 4.34 -0.13 2.72 -0.14 -0.35 -1.40 119.74 123.92 1x8k s LYS 37 Ca -0.10 0.57 0.02 0.00 -1.36 0.00 0.00 55.97 55.10 1x8k s LYS 37 Cb -0.05 -3.42 0.01 0.00 -1.68 0.00 0.00 37.83 32.69 1x8k s LYS 37 CO 0.01 0.18 -0.18 -1.17 -0.76 0.00 0.00 175.35 173.43 1x8k s LEU 38 N 0.51 1.89 0.00 3.17 2.96 0.94 -1.61 118.68 126.54 1x8k s LEU 38 Ca 0.29 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.69 1x8k s LEU 38 Cb -0.16 -1.25 0.00 0.00 0.50 0.00 0.00 46.19 45.28 1x8k s LEU 38 CO 0.13 0.03 0.00 0.61 -1.32 0.00 0.00 176.35 175.80 1x8k n GLY 39 N 4.22 -2.80 0.17 7.98 0.00 -0.62 -1.96 105.19 112.18 1x8k n GLY 39 Ca -0.19 -1.69 0.13 0.00 0.00 0.00 0.00 46.02 44.27 1x8k n GLY 39 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x8k h PRO 40 N 0.00 0.00 -0.00 1.61 0.13 -1.96 -2.55 132.00 129.23 1x8k h PRO 40 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1x8k h PRO 40 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1x8k h PRO 40 CO 0.00 0.00 -0.75 1.63 -0.23 0.00 0.00 178.00 178.65 1x8k n LYS 41 N -2.48 0.05 -2.75 0.86 5.02 -1.26 -5.01 118.16 112.60 1x8k n LYS 41 Ca 0.02 -0.04 -0.08 0.00 -2.02 0.00 0.00 58.31 56.19 1x8k n LYS 41 Cb 0.29 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.83 1x8k n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x8k n GLY 42 N 1.49 0.20 3.73 0.72 0.00 -0.96 -4.63 105.19 105.74 1x8k n GLY 42 Ca 0.05 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1x8k n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x8k s TYR 43 N -3.14 3.35 -0.20 1.61 1.51 -0.83 -4.31 117.35 115.35 1x8k s TYR 43 Ca 0.10 1.24 -0.29 0.00 -1.01 0.00 0.00 57.07 57.11 1x8k s TYR 43 Cb -0.04 -3.52 -0.01 0.00 -0.11 0.00 0.00 41.96 38.27 1x8k s TYR 43 CO 0.30 -1.63 1.32 -1.64 -1.11 0.00 0.00 175.55 172.79 1x8k s MET 44 N 0.42 4.12 0.21 -0.62 -1.94 0.10 -0.04 119.30 121.55 1x8k s MET 44 Ca 0.58 1.59 0.09 0.00 -1.71 0.00 0.00 55.69 56.24 1x8k s MET 44 Cb -0.34 -3.82 -0.05 0.00 2.01 0.00 0.00 34.83 32.64 1x8k s MET 44 CO 0.34 -0.85 -0.18 0.14 -0.01 0.00 0.00 175.02 174.45 1x8k s VAL 45 N 3.85 1.98 0.34 -6.03 -7.23 -0.49 -0.01 120.40 112.82 1x8k s VAL 45 Ca 0.57 -2.14 -0.26 0.00 -1.81 0.00 0.00 61.98 58.34 1x8k s VAL 45 Cb -0.21 -2.04 -0.09 0.00 0.56 0.00 0.00 36.38 34.60 1x8k s VAL 45 CO 0.18 -0.41 1.03 -0.31 -0.31 0.00 0.00 175.10 175.28 1x8k s TYR 46 N -2.44 3.49 0.29 2.82 1.51 -1.26 -0.86 117.35 120.91 1x8k s TYR 46 Ca 0.22 1.71 0.03 0.00 -1.01 0.00 0.00 57.07 58.02 1x8k s TYR 46 Cb -0.04 -3.10 0.64 0.00 -0.11 0.00 0.00 41.96 39.35 1x8k s TYR 46 CO 0.09 -0.32 1.81 -0.09 -1.11 0.00 0.00 175.55 175.93 1x8k h ARG 47 N 3.07 0.87 0.00 -0.62 2.43 -1.17 0.46 114.38 119.43 1x8k h ARG 47 Ca -0.47 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1x8k h ARG 47 Cb 1.21 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 1x8k h ARG 47 CO 0.64 0.58 0.14 -1.35 -1.51 0.00 0.00 179.97 178.47 1x8k h PRO 48 N 0.90 0.00 0.00 0.20 0.11 -1.85 -1.62 132.00 129.74 1x8k h PRO 48 Ca 0.53 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.60 1x8k h PRO 48 Cb 0.66 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.76 1x8k h PRO 48 CO -0.31 0.00 -0.18 -0.92 -0.21 0.00 0.00 178.00 176.39 1x8k h TYR 49 N 0.00 0.00 -0.80 0.65 3.20 -0.26 -3.15 116.97 116.61 1x8k h TYR 49 Ca 0.00 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 1x8k h TYR 49 Cb 0.28 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.51 1x8k h TYR 49 CO 0.00 0.18 0.35 -0.07 -1.64 0.00 0.00 178.16 176.97 1x8k h LEU 50 N 0.00 1.09 -2.11 2.82 3.38 -1.46 -2.32 115.31 116.72 1x8k h LEU 50 Ca -0.00 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 57.88 1x8k h LEU 50 Cb 0.38 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1x8k h LEU 50 CO 0.02 0.94 0.18 0.07 0.09 0.00 0.00 178.44 179.74 1x8k h LYS 51 N 1.16 0.00 -0.26 1.13 2.10 -1.75 -2.35 116.57 116.59 1x8k h LYS 51 Ca 0.27 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.92 1x8k h LYS 51 Cb 0.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 1x8k h LYS 51 CO -0.03 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 173.95 1x8k n ASP 52 N -4.21 2.69 -0.07 7.07 2.03 -1.03 -4.72 116.55 118.32 1x8k n ASP 52 Ca 0.02 -1.97 -0.11 0.00 0.52 0.00 0.00 54.79 53.25 1x8k n ASP 52 Cb 0.32 -0.18 -0.05 0.00 -0.72 0.00 0.00 41.12 40.49 1x8k n ASP 52 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x8k h ALA 53 N 1.61 0.28 0.00 -1.67 0.00 -0.87 -2.60 119.26 116.01 1x8k h ALA 53 Ca 0.00 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1x8k h ALA 53 Cb 0.67 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1x8k h ALA 53 CO 0.00 -0.03 -0.28 0.00 0.00 0.00 0.00 179.25 178.94 1x8k h ALA 54 N 0.82 1.36 -0.08 0.00 0.00 -1.84 -2.80 119.26 116.71 1x8k h ALA 54 Ca 0.06 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 1x8k h ALA 54 Cb 0.35 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1x8k h ALA 54 CO 0.01 0.35 -0.39 -0.91 0.00 0.00 0.00 179.25 178.30 1x8k h ASN 55 N 0.00 0.48 -0.58 0.00 2.35 -1.80 -3.00 115.58 113.04 1x8k h ASN 55 Ca -0.00 -0.65 -0.01 0.00 -0.55 0.00 0.00 56.30 55.09 1x8k h ASN 55 Cb 0.55 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 1x8k h ASN 55 CO 0.04 1.05 0.32 0.40 -1.65 0.00 0.00 177.43 177.59 1x8k h ILE 56 N -0.05 1.19 -0.87 2.81 2.04 -1.52 0.18 117.51 121.28 1x8k h ILE 56 Ca -0.03 -0.47 0.13 0.00 1.00 0.00 0.00 64.86 65.49 1x8k h ILE 56 Cb 1.04 0.45 -0.07 0.00 -0.74 0.00 0.00 36.82 37.50 1x8k h ILE 56 CO 0.08 0.20 0.56 0.22 0.00 0.00 0.00 178.15 179.22 1x8k h TYR 57 N 0.78 0.82 -0.44 1.37 3.20 -1.56 -2.21 116.97 118.94 1x8k h TYR 57 Ca 0.20 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.95 1x8k h TYR 57 Cb 0.04 -0.26 -0.09 0.00 1.54 0.00 0.00 36.73 37.96 1x8k h TYR 57 CO -0.01 0.33 0.07 0.09 -1.64 0.00 0.00 178.16 177.00 1x8k n ASN 58 N -4.55 3.55 -4.71 -2.11 3.02 -0.84 -2.87 115.26 106.76 1x8k n ASN 58 Ca 0.16 -3.38 -0.42 0.00 -0.03 0.00 0.00 54.58 50.92 1x8k n ASN 58 Cb 0.42 -0.64 -0.03 0.00 -0.61 0.00 0.00 39.78 38.93 1x8k n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x8k s MET 59 N -3.05 4.27 0.16 3.52 0.23 0.57 -4.97 119.30 120.03 1x8k s MET 59 Ca 0.47 2.18 -0.32 0.00 -1.03 0.00 0.00 55.69 56.99 1x8k s MET 59 Cb 0.40 -3.28 -0.11 0.00 -1.53 0.00 0.00 34.83 30.31 1x8k s MET 59 CO 0.07 -0.53 1.70 -2.14 -2.03 0.00 0.00 175.02 172.09 1x8k s PRO 60 N 1.37 4.16 0.23 3.16 0.02 -1.26 -4.91 135.00 137.76 1x8k s PRO 60 Ca 0.67 2.51 0.10 0.00 0.02 0.00 0.00 61.00 64.30 1x8k s PRO 60 Cb -0.39 -3.27 -0.04 0.00 0.02 0.00 0.00 34.50 30.82 1x8k s PRO 60 CO 0.30 -0.73 -0.08 -0.51 -0.33 0.00 0.00 177.00 175.65 1x8k s LEU 61 N 1.69 2.98 0.06 -5.54 1.43 -1.26 -4.98 118.68 113.06 1x8k s LEU 61 Ca 0.75 -0.68 0.05 0.00 -1.03 0.00 0.00 54.13 53.22 1x8k s LEU 61 Cb -0.46 -1.58 -0.03 0.00 0.03 0.00 0.00 46.19 44.15 1x8k s LEU 61 CO 0.33 0.05 -0.15 -0.13 0.23 0.00 0.00 176.35 176.69 1x8k s ARG 62 N -3.25 0.91 0.16 1.70 0.52 -1.26 -5.04 118.95 112.69 1x8k s ARG 62 Ca 0.28 -0.87 0.14 0.00 -0.52 0.00 0.00 55.73 54.76 1x8k s ARG 62 Cb -0.07 -0.94 0.68 0.00 0.52 0.00 0.00 34.95 35.14 1x8k s ARG 62 CO 0.17 0.22 1.42 -2.30 0.02 0.00 0.00 175.30 174.83 1x8k n PRO 63 N 1.60 0.08 0.00 3.54 -0.02 -1.26 -1.04 135.00 137.90 1x8k n PRO 63 Ca -0.19 0.51 0.10 0.00 -2.02 0.00 0.00 63.50 61.90 1x8k n PRO 63 Cb 0.54 -1.73 0.06 0.00 -0.02 0.00 0.00 33.50 32.35 1x8k n PRO 63 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1x8k n THR 64 N -1.90 0.00 -1.74 3.45 -2.24 -1.26 -4.80 114.28 105.79 1x8k n THR 64 Ca 0.00 -0.44 -0.42 0.00 -2.27 0.00 0.00 64.05 60.92 1x8k n THR 64 Cb 0.07 1.37 -0.03 0.00 -2.10 0.00 0.00 70.33 69.65 1x8k n THR 64 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1x8k s ASP 65 N -1.86 6.37 -0.10 3.42 1.11 -0.21 -4.52 116.67 120.88 1x8k s ASP 65 Ca 0.22 2.90 0.03 0.00 0.18 0.00 0.00 52.55 55.87 1x8k s ASP 65 Cb 0.17 -2.61 -0.01 0.00 1.07 0.00 0.00 42.92 41.54 1x8k s ASP 65 CO 0.33 -0.96 -0.20 -0.69 1.18 0.00 0.00 175.17 174.83 1x8k s VAL 66 N 0.86 2.48 -0.07 -1.27 1.01 -1.03 -2.71 120.40 119.67 1x8k s VAL 66 Ca 0.72 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1x8k s VAL 66 Cb -0.49 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 1x8k s VAL 66 CO 0.36 0.55 -0.07 -0.36 0.00 0.00 0.00 175.10 175.59 1x8k s PHE 67 N 0.15 2.94 -0.23 5.22 0.40 0.13 -1.16 117.98 125.43 1x8k s PHE 67 Ca -0.10 -0.01 -0.02 0.00 -0.60 0.00 0.00 56.93 56.20 1x8k s PHE 67 Cb -0.16 -1.73 0.01 0.00 0.51 0.00 0.00 43.02 41.66 1x8k s PHE 67 CO 0.06 0.30 -0.08 0.08 0.70 0.00 0.00 175.22 176.28 1x8k s VAL 68 N -0.72 2.89 0.34 -0.44 1.01 0.18 -0.39 120.40 123.27 1x8k s VAL 68 Ca 0.11 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.33 1x8k s VAL 68 Cb -0.11 -2.37 -0.07 0.00 0.00 0.00 0.00 36.38 33.83 1x8k s VAL 68 CO 0.02 0.34 -0.01 0.00 0.00 0.00 0.00 175.10 175.45 1x8k s ALA 69 N 1.37 2.70 0.00 5.51 0.00 0.03 -2.28 121.76 129.09 1x8k s ALA 69 Ca 0.03 -2.11 0.00 0.00 0.00 0.00 0.00 51.96 49.89 1x8k s ALA 69 Cb -0.15 0.28 0.00 0.00 0.00 0.00 0.00 23.12 23.25 1x8k s ALA 69 CO -0.06 -0.13 0.00 -1.13 0.00 0.00 0.00 175.76 174.44 1x8k n SER 70 N -0.77 0.00 -4.76 0.00 3.41 -1.22 -1.22 113.62 109.07 1x8k n SER 70 Ca -0.04 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.18 1x8k n SER 70 Cb 0.65 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.62 1x8k n SER 70 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1x8k s TYR 71 N -1.95 2.58 0.77 7.33 5.04 -1.26 -4.27 117.35 125.59 1x8k s TYR 71 Ca 0.00 1.38 -0.15 0.00 -2.44 0.00 0.00 57.07 55.86 1x8k s TYR 71 Cb 0.00 -3.73 -0.00 0.00 0.35 0.00 0.00 41.96 38.57 1x8k s TYR 71 CO 0.00 -2.47 0.65 0.00 -1.34 0.00 0.00 175.55 172.39 1x8k n GLN 72 N -0.38 0.21 -2.12 4.97 10.64 -1.26 -3.49 117.38 125.95 1x8k n GLN 72 Ca 0.06 0.12 -0.17 0.00 -1.83 0.00 0.00 57.00 55.18 1x8k n GLN 72 Cb 0.44 -1.96 -0.02 0.00 -0.86 0.00 0.00 30.24 27.84 1x8k n GLN 72 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.06 175.77 1x8k n ARG 73 N -1.36 -1.33 0.00 2.61 5.12 -1.26 -4.91 116.66 115.54 1x8k n ARG 73 Ca 0.10 0.90 0.08 0.00 -1.93 0.00 0.00 57.85 57.01 1x8k n ARG 73 Cb 0.51 -5.30 -0.05 0.00 -1.16 0.00 0.00 32.46 26.46 1x8k n ARG 73 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1x8k n SER 74 N -1.15 1.32 0.00 0.55 7.64 -1.23 -4.71 113.62 116.05 1x8k n SER 74 Ca -0.20 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.52 1x8k n SER 74 Cb 0.63 0.71 0.00 0.00 -1.01 0.00 0.00 64.21 64.54 1x8k n SER 74 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x8k n GLY 75 N 1.31 1.53 0.37 0.23 0.00 -1.26 -4.18 105.19 103.19 1x8k n GLY 75 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 1x8k n GLY 75 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1x8k h THR 76 N 0.00 0.25 -0.24 2.61 2.02 -1.92 -2.19 112.91 113.44 1x8k h THR 76 Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1x8k h THR 76 Cb 0.00 0.25 -0.04 0.00 -1.74 0.00 0.00 68.15 66.62 1x8k h THR 76 CO 0.00 0.00 -0.05 0.74 0.37 0.00 0.00 175.52 176.58 1x8k h THR 77 N -0.61 0.77 -0.20 3.16 2.02 -1.99 0.21 112.91 116.28 1x8k h THR 77 Ca 0.02 -0.01 0.05 0.00 0.77 0.00 0.00 66.41 67.25 1x8k h THR 77 Cb 0.62 0.76 -0.07 0.00 -1.74 0.00 0.00 68.15 67.72 1x8k h THR 77 CO -0.19 0.00 -0.39 0.24 0.37 0.00 0.00 175.52 175.55 1x8k h MET 78 N 0.02 -0.41 0.83 6.66 2.86 -1.99 -1.79 114.93 121.11 1x8k h MET 78 Ca 0.12 0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.75 1x8k h MET 78 Cb 0.17 0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.92 1x8k h MET 78 CO -0.24 -0.27 -0.47 1.15 1.06 0.00 0.00 176.91 178.14 1x8k h THR 79 N -0.42 0.06 -0.94 2.22 2.02 -0.68 -0.85 112.91 114.31 1x8k h THR 79 Ca 0.10 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.45 1x8k h THR 79 Cb 0.60 0.06 -0.17 0.00 -1.74 0.00 0.00 68.15 66.89 1x8k h THR 79 CO -0.43 0.00 -0.28 0.00 0.37 0.00 0.00 175.52 175.18 1x8k n GLN 80 N -5.62 -0.13 0.05 6.66 6.02 0.65 0.03 117.38 125.05 1x8k n GLN 80 Ca -0.15 1.46 -0.12 0.00 -0.01 0.00 0.00 57.00 58.17 1x8k n GLN 80 Cb 0.49 -2.17 -0.07 0.00 1.02 0.00 0.00 30.24 29.51 1x8k n GLN 80 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 1x8k h GLU 81 N 0.00 -0.04 0.24 -1.09 4.57 -0.97 -0.04 114.58 117.25 1x8k h GLU 81 Ca 0.41 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.60 1x8k h GLU 81 Cb 0.65 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.22 1x8k h GLU 81 CO -0.96 -0.02 -0.29 -0.07 -1.18 0.00 0.00 179.01 176.49 1x8k h LEU 82 N -0.05 -0.79 -0.55 1.64 3.38 0.80 -1.21 115.31 118.54 1x8k h LEU 82 Ca -0.00 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.10 1x8k h LEU 82 Cb 0.04 0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.01 1x8k h LEU 82 CO 0.01 -0.40 0.26 0.58 0.09 0.00 0.00 178.44 178.98 1x8k h VAL 83 N -0.58 0.92 0.01 1.22 2.07 -0.35 -0.34 116.25 119.20 1x8k h VAL 83 Ca 0.00 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.35 1x8k h VAL 83 Cb 0.55 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1x8k h VAL 83 CO -0.09 0.09 -0.00 -0.25 0.02 0.00 0.00 177.57 177.34 1x8k h TRP 84 N 0.50 -0.01 -0.55 1.57 7.01 -0.83 -1.73 115.95 121.92 1x8k h TRP 84 Ca 0.25 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.24 1x8k h TRP 84 Cb 0.19 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 27.23 1x8k h TRP 84 CO -0.11 0.16 0.32 -0.07 -2.79 0.00 0.00 178.44 175.95 1x8k h LEU 85 N -0.18 0.66 0.19 0.65 3.38 -1.00 -1.80 115.31 117.22 1x8k h LEU 85 Ca -0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1x8k h LEU 85 Cb 0.17 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1x8k h LEU 85 CO 0.00 0.53 -0.10 0.40 0.09 0.00 0.00 178.44 179.36 1x8k h ILE 86 N 0.74 0.78 0.00 1.22 2.04 -0.98 0.72 117.51 122.03 1x8k h ILE 86 Ca 0.20 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.05 1x8k h ILE 86 Cb -0.00 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1x8k h ILE 86 CO -0.04 0.00 -0.02 -0.33 0.00 0.00 0.00 178.15 177.77 1x8k h GLU 87 N -0.28 0.00 -0.56 2.37 4.39 -1.28 -2.90 114.58 116.32 1x8k h GLU 87 Ca -0.02 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.42 1x8k h GLU 87 Cb 0.22 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 28.72 1x8k h GLU 87 CO 0.03 0.02 0.17 0.09 -1.16 0.00 0.00 179.01 178.15 1x8k n ASN 88 N -3.37 3.22 -3.73 1.42 3.02 -0.65 -4.95 115.26 110.22 1x8k n ASN 88 Ca -0.02 -3.59 -0.24 0.00 -0.03 0.00 0.00 54.58 50.69 1x8k n ASN 88 Cb 0.12 -0.69 0.02 0.00 -0.61 0.00 0.00 39.78 38.62 1x8k n ASN 88 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1x8k n ASP 89 N -0.96 -2.14 -3.79 6.41 8.00 -0.98 -2.41 116.55 120.69 1x8k n ASP 89 Ca 0.40 -0.90 -0.28 0.00 0.71 0.00 0.00 54.79 54.71 1x8k n ASP 89 Cb 1.23 -3.72 -0.03 0.00 -0.02 0.00 0.00 41.12 38.58 1x8k n ASP 89 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1x8k n LEU 90 N -4.23 -1.05 -4.56 0.64 4.32 0.15 -4.81 117.00 107.46 1x8k n LEU 90 Ca -0.25 -0.65 -0.39 0.00 -0.02 0.00 0.00 56.01 54.70 1x8k n LEU 90 Cb 0.66 -1.73 -0.02 0.00 -1.62 0.00 0.00 43.42 40.71 1x8k n LEU 90 CO 0.69 0.13 1.87 -3.20 -1.22 0.00 0.00 177.39 175.67 1x8k n ASN 91 N -2.27 4.44 -0.06 -1.43 2.85 -1.01 -4.83 115.26 112.94 1x8k n ASN 91 Ca 0.05 -2.86 -0.08 0.00 -0.11 0.00 0.00 54.58 51.59 1x8k n ASN 91 Cb 0.49 -1.74 -0.01 0.00 1.24 0.00 0.00 39.78 39.75 1x8k n ASN 91 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1x8k h PHE 92 N 8.09 -0.05 -0.83 1.20 -1.00 -1.90 -2.78 116.94 119.66 1x8k h PHE 92 Ca 0.39 0.02 0.19 0.00 2.81 0.00 0.00 57.97 61.38 1x8k h PHE 92 Cb 0.88 0.06 -0.15 0.00 3.61 0.00 0.00 35.95 40.35 1x8k h PHE 92 CO 1.37 -0.06 -0.09 1.49 -1.61 0.00 0.00 178.31 179.41 1x8k h GLU 93 N 0.05 0.04 0.00 1.51 4.57 -2.01 0.73 114.58 119.46 1x8k h GLU 93 Ca 0.12 -0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.27 1x8k h GLU 93 Cb 0.16 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1x8k h GLU 93 CO -0.22 0.03 -0.15 0.00 -1.18 0.00 0.00 179.01 177.49 1x8k h ALA 94 N 1.81 0.96 0.00 2.92 0.00 -1.92 -2.85 119.26 120.19 1x8k h ALA 94 Ca 0.44 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1x8k h ALA 94 Cb 0.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1x8k h ALA 94 CO -0.80 0.19 0.00 0.00 0.00 0.00 0.00 179.25 178.64 1x8k n ALA 95 N -2.16 2.12 0.65 0.00 0.00 0.24 -3.31 120.51 118.04 1x8k n ALA 95 Ca 0.01 -0.10 0.10 0.00 0.00 0.00 0.00 53.44 53.45 1x8k n ALA 95 Cb 0.47 -1.37 0.42 0.00 0.00 0.00 0.00 19.45 18.97 1x8k n ALA 95 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1x8k n LYS 96 N -1.36 0.02 -1.69 0.00 5.02 -1.08 -4.75 118.16 114.33 1x8k n LYS 96 Ca 0.09 0.18 -0.32 0.00 -2.02 0.00 0.00 58.31 56.25 1x8k n LYS 96 Cb 0.21 -1.53 0.04 0.00 -0.02 0.00 0.00 35.03 33.73 1x8k n LYS 96 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1x8k s THR 97 N -3.02 3.84 0.05 -0.18 -4.23 -1.21 -4.56 115.64 106.34 1x8k s THR 97 Ca 0.09 0.69 -0.34 0.00 -1.18 0.00 0.00 61.69 60.95 1x8k s THR 97 Cb 0.12 -3.32 -0.13 0.00 1.34 0.00 0.00 72.50 70.51 1x8k s THR 97 CO 0.36 -0.69 1.68 -1.22 -0.54 0.00 0.00 174.62 174.21 1x8k n TYR 98 N -2.80 2.24 -0.29 3.99 0.53 -1.26 -4.81 117.16 114.75 1x8k n TYR 98 Ca 0.08 0.20 0.11 0.00 -1.02 0.00 0.00 57.90 57.27 1x8k n TYR 98 Cb 0.53 -2.57 0.22 0.00 -1.03 0.00 0.00 39.34 36.49 1x8k n TYR 98 CO 0.00 0.00 0.00 -0.12 -1.02 0.00 0.00 176.86 175.72 1x8k n MET 99 N 4.57 -0.07 0.29 -0.72 0.00 -0.74 -0.42 117.12 120.04 1x8k n MET 99 Ca 0.19 1.27 0.15 0.00 -0.00 0.00 0.00 57.70 59.31 1x8k n MET 99 Cb 0.28 -1.99 0.90 0.00 0.00 0.00 0.00 33.22 32.41 1x8k n MET 99 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1x8k h SER 100 N 0.00 0.00 0.43 6.12 4.64 -1.84 0.38 113.55 123.28 1x8k h SER 100 Ca 0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1x8k h SER 100 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1x8k h SER 100 CO -0.81 0.00 -1.17 0.18 -0.87 0.00 0.00 176.83 174.16 1x8k n LEU 101 N -3.89 0.57 -0.03 5.97 4.32 0.44 -4.27 117.00 120.11 1x8k n LEU 101 Ca -0.03 0.02 -0.05 0.00 -0.02 0.00 0.00 56.01 55.94 1x8k n LEU 101 Cb 0.10 -0.07 -0.13 0.00 -1.62 0.00 0.00 43.42 41.69 1x8k n LEU 101 CO 0.28 0.01 -0.71 0.54 -1.22 0.00 0.00 177.39 176.29 1x8k n ARG 102 N -2.10 0.65 -4.34 3.23 1.74 0.10 -4.94 116.66 111.01 1x8k n ARG 102 Ca 0.01 0.11 -0.26 0.00 -0.77 0.00 0.00 57.85 56.94 1x8k n ARG 102 Cb 0.47 -1.67 -0.10 0.00 -1.02 0.00 0.00 32.46 30.14 1x8k n ARG 102 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1x8k s TYR 103 N -2.75 2.53 -0.12 -1.55 1.51 0.39 -4.38 117.35 112.97 1x8k s TYR 103 Ca -0.06 -0.27 -0.12 0.00 -1.01 0.00 0.00 57.07 55.61 1x8k s TYR 103 Cb 0.08 -1.23 -0.05 0.00 -0.11 0.00 0.00 41.96 40.66 1x8k s TYR 103 CO 0.83 0.52 0.27 0.42 -1.11 0.00 0.00 175.55 176.49 1x8k s ILE 104 N -1.76 5.30 -1.05 2.71 1.01 0.13 -4.70 121.20 122.84 1x8k s ILE 104 Ca 0.24 0.51 -0.13 0.00 0.00 0.00 0.00 60.65 61.27 1x8k s ILE 104 Cb -0.08 -3.59 0.21 0.00 0.01 0.00 0.00 42.46 39.01 1x8k s ILE 104 CO 0.14 0.48 1.13 -0.47 0.00 0.00 0.00 174.94 176.22 1x8k s TYR 105 N -0.14 3.74 0.23 3.97 6.04 -1.26 0.10 117.35 130.03 1x8k s TYR 105 Ca 0.17 -2.16 -0.07 0.00 0.04 0.00 0.00 57.07 55.05 1x8k s TYR 105 Cb -0.13 -4.05 0.37 0.00 -1.04 0.00 0.00 41.96 37.11 1x8k s TYR 105 CO 0.05 -1.18 1.30 -0.11 -1.54 0.00 0.00 175.55 174.07 1x8k n LEU 106 N 4.49 -0.32 -0.64 6.97 7.94 -0.31 -1.62 117.00 133.51 1x8k n LEU 106 Ca 0.25 1.44 0.06 0.00 -1.11 0.00 0.00 56.01 56.65 1x8k n LEU 106 Cb 0.44 -0.43 0.17 0.00 0.53 0.00 0.00 43.42 44.13 1x8k n LEU 106 CO 0.49 -1.37 0.64 -0.90 -1.11 0.00 0.00 177.39 175.14 1x8k n ASP 107 N -5.35 3.10 0.18 1.96 5.75 -1.26 -3.66 116.55 117.27 1x8k n ASP 107 Ca 0.13 -2.32 0.04 0.00 -0.01 0.00 0.00 54.79 52.63 1x8k n ASP 107 Cb 0.41 -0.31 0.44 0.00 -1.03 0.00 0.00 41.12 40.63 1x8k n ASP 107 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 1x8k h GLY 108 N 1.74 0.09 1.58 6.12 0.00 -1.67 -3.06 103.07 107.86 1x8k h GLY 108 Ca 0.00 -0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.33 1x8k h GLY 108 CO 0.06 0.05 0.16 0.27 0.00 0.00 0.00 176.54 177.09 1x8k h PHE 109 N 0.08 0.07 0.00 5.60 -5.15 -1.80 -3.17 116.94 112.57 1x8k h PHE 109 Ca 0.01 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 1x8k h PHE 109 Cb 0.39 -0.02 0.00 0.00 0.22 0.00 0.00 35.95 36.54 1x8k h PHE 109 CO 0.00 0.04 0.00 0.00 -2.00 0.00 0.00 178.31 176.35 1x8k h MET 110 N 0.07 0.00 0.00 6.09 -0.00 -1.81 -2.74 114.93 116.54 1x8k h MET 110 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.81 1x8k h MET 110 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.94 1x8k h MET 110 CO -0.01 0.00 0.00 0.97 -0.00 0.00 0.00 176.91 177.87 1x8k h ILE 111 N 0.00 0.00 -3.36 -0.10 2.10 -1.80 -3.37 117.51 110.98 1x8k h ILE 111 Ca 0.00 -0.47 -0.67 0.00 1.08 0.00 0.00 64.86 64.80 1x8k h ILE 111 Cb 0.30 1.39 -0.31 0.00 -1.09 0.00 0.00 36.82 37.12 1x8k h ILE 111 CO 0.00 0.00 -0.84 -0.47 -1.08 0.00 0.00 178.15 175.76 1x8k s TYR 112 N -3.22 2.65 -0.39 2.19 5.04 -1.04 -4.73 117.35 117.84 1x8k s TYR 112 Ca 0.08 -0.89 -0.04 0.00 -2.44 0.00 0.00 57.07 53.78 1x8k s TYR 112 Cb 0.10 -1.75 0.09 0.00 0.35 0.00 0.00 41.96 40.75 1x8k s TYR 112 CO 0.54 -0.33 0.18 0.34 -1.34 0.00 0.00 175.55 174.94 1x8k s ASP 113 N 0.32 5.28 0.59 4.32 3.68 -1.26 -4.87 116.67 124.73 1x8k s ASP 113 Ca -0.15 -1.77 0.32 0.00 2.13 0.00 0.00 52.55 53.08 1x8k s ASP 113 Cb -0.17 -1.85 1.76 0.00 -1.45 0.00 0.00 42.92 41.21 1x8k s ASP 113 CO 0.08 -0.49 1.98 -0.65 0.13 0.00 0.00 175.17 176.21 1x8k h PRO 114 N 8.13 0.00 0.00 4.34 0.11 -1.96 0.44 132.00 143.05 1x8k h PRO 114 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 1x8k h PRO 114 Cb 1.06 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1x8k h PRO 114 CO 0.68 0.00 0.00 1.49 -0.21 0.00 0.00 178.00 179.96 1x8k h GLU 115 N 0.00 0.00 -0.03 1.05 4.81 -2.04 -3.04 114.58 115.32 1x8k h GLU 115 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1x8k h GLU 115 Cb 0.36 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1x8k h GLU 115 CO 0.00 0.00 -0.17 1.63 -0.73 0.00 0.00 179.01 179.74 1x8k n LYS 116 N -2.81 1.51 -0.31 1.92 5.02 0.15 -4.82 118.16 118.83 1x8k n LYS 116 Ca 0.00 -2.87 0.16 0.00 -2.02 0.00 0.00 58.31 53.59 1x8k n LYS 116 Cb 0.24 -1.58 0.34 0.00 -0.02 0.00 0.00 35.03 34.01 1x8k n LYS 116 CO 0.00 0.00 0.00 0.37 -0.52 0.00 0.00 177.40 177.25 1x8k h GLN 117 N 0.49 0.17 -0.13 1.97 4.15 -1.57 0.84 115.11 121.02 1x8k h GLN 117 Ca 0.01 -0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.46 1x8k h GLN 117 Cb 1.06 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.71 1x8k h GLN 117 CO 0.03 0.11 0.26 0.93 -1.93 0.00 0.00 178.83 178.24 1x8k h GLU 118 N 0.17 0.00 0.00 1.69 3.07 -1.88 -3.09 114.58 114.54 1x8k h GLU 118 Ca 0.61 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 59.28 1x8k h GLU 118 Cb 1.30 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.18 1x8k h GLU 118 CO -0.70 0.00 -1.57 0.39 -1.40 0.00 0.00 179.01 175.73 1x8k n GLU 119 N -3.36 0.63 0.17 2.33 1.02 0.29 -4.42 120.64 117.29 1x8k n GLU 119 Ca 0.01 0.18 0.02 0.00 -0.02 0.00 0.00 57.16 57.35 1x8k n GLU 119 Cb 0.36 -1.76 0.28 0.00 -0.02 0.00 0.00 31.44 30.30 1x8k n GLU 119 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1x8k h TYR 120 N 0.00 0.00 0.00 -0.32 -1.99 -1.63 -2.35 116.97 110.68 1x8k h TYR 120 Ca -0.20 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.53 1x8k h TYR 120 Cb 1.65 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.38 1x8k h TYR 120 CO 0.00 0.48 0.00 0.27 -0.00 0.00 0.00 178.16 178.91 1x8k n ASN 121 N -3.80 0.59 0.26 3.88 0.23 -1.26 -3.07 115.26 112.09 1x8k n ASN 121 Ca -0.01 0.58 0.15 0.00 -0.53 0.00 0.00 54.58 54.76 1x8k n ASN 121 Cb 0.52 -0.73 0.60 0.00 -2.08 0.00 0.00 39.78 38.09 1x8k n ASN 121 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1x8k h ASP 122 N 0.00 0.00 0.88 0.53 5.19 -1.66 -2.14 116.42 119.22 1x8k h ASP 122 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1x8k h ASP 122 Cb 0.59 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.10 1x8k h ASP 122 CO 0.00 0.06 0.00 2.30 -3.12 0.00 0.00 179.24 178.48 1x8k n ILE 123 N -3.19 0.27 -3.53 0.35 -5.35 -1.17 -4.82 119.36 101.92 1x8k n ILE 123 Ca 0.01 0.06 -0.38 0.00 -0.27 0.00 0.00 62.75 62.17 1x8k n ILE 123 Cb 0.35 -0.63 -0.06 0.00 -1.74 0.00 0.00 39.64 37.55 1x8k n ILE 123 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1x8k s LEU 124 N -3.04 4.46 0.22 7.28 1.43 -0.80 -4.99 118.68 123.23 1x8k s LEU 124 Ca 0.12 0.91 -0.12 0.00 -1.03 0.00 0.00 54.13 54.01 1x8k s LEU 124 Cb 0.16 -2.54 0.29 0.00 0.03 0.00 0.00 46.19 44.13 1x8k s LEU 124 CO 0.46 0.31 1.63 -0.65 0.23 0.00 0.00 176.35 178.34 1x8k h PRO 125 N 4.86 0.04 -2.97 1.29 0.11 -1.88 -3.34 132.00 130.12 1x8k h PRO 125 Ca -0.51 -0.00 -0.61 0.00 0.11 0.00 0.00 66.00 64.98 1x8k h PRO 125 Cb 1.22 -0.01 -0.40 0.00 0.11 0.00 0.00 31.00 31.91 1x8k h PRO 125 CO 0.62 0.03 -0.71 -0.80 -0.21 0.00 0.00 178.00 176.93 1x8k s ASN 126 N -5.22 3.73 0.55 -2.05 0.02 -1.26 -4.94 114.94 105.77 1x8k s ASN 126 Ca -0.14 -3.12 0.23 0.00 -1.02 0.00 0.00 52.86 48.80 1x8k s ASN 126 Cb 0.20 -1.20 1.50 0.00 0.02 0.00 0.00 41.25 41.77 1x8k s ASN 126 CO 0.74 -0.19 2.17 -0.65 0.02 0.00 0.00 177.10 179.19 1x8k h PRO 127 N 6.12 0.00 -0.75 -0.60 0.11 -1.77 -2.66 132.00 132.45 1x8k h PRO 127 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1x8k h PRO 127 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1x8k h PRO 127 CO 0.56 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.50 1x8k n GLU 128 N -4.22 1.32 0.00 1.05 0.00 -1.26 -3.11 120.64 114.41 1x8k n GLU 128 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 57.16 56.86 1x8k n GLU 128 Cb 0.15 -1.45 0.00 0.00 0.00 0.00 0.00 31.44 30.14 1x8k n GLU 128 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1x8k n ASN 129 N -0.02 1.51 -4.57 -1.84 4.13 -1.00 -5.07 115.26 108.40 1x8k n ASN 129 Ca 0.03 -0.28 -0.37 0.00 1.68 0.00 0.00 54.58 55.64 1x8k n ASN 129 Cb 0.27 0.85 0.07 0.00 -1.54 0.00 0.00 39.78 39.43 1x8k n ASN 129 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1x8k n LEU 130 N -1.00 2.72 -4.48 3.41 4.77 -1.18 -4.87 117.00 116.37 1x8k n LEU 130 Ca 0.00 0.70 -0.43 0.00 -0.03 0.00 0.00 56.01 56.25 1x8k n LEU 130 Cb 0.00 -1.33 -0.06 0.00 -2.33 0.00 0.00 43.42 39.70 1x8k n LEU 130 CO 0.00 -2.33 0.40 -0.62 -1.33 0.00 0.00 177.39 173.52 1x8k s ASP 131 N -1.42 6.26 0.16 -1.43 -1.08 -0.71 -4.96 116.67 113.50 1x8k s ASP 131 Ca 0.72 -0.69 -0.01 0.00 -0.52 0.00 0.00 52.55 52.05 1x8k s ASP 131 Cb -0.38 -2.32 0.01 0.00 -1.46 0.00 0.00 42.92 38.77 1x8k s ASP 131 CO 0.51 -0.91 1.39 0.24 0.52 0.00 0.00 175.17 176.92 1x8k h MET 132 N 9.01 0.36 -0.51 4.34 2.86 -1.92 0.29 114.93 129.35 1x8k h MET 132 Ca -0.27 -0.33 0.06 0.00 -2.06 0.00 0.00 59.70 57.09 1x8k h MET 132 Cb 1.09 0.08 -0.05 0.00 0.06 0.00 0.00 31.60 32.78 1x8k h MET 132 CO 0.96 1.00 0.23 1.49 1.06 0.00 0.00 176.91 181.65 1x8k h GLU 133 N 0.23 0.43 -0.05 1.72 4.81 -1.99 0.15 114.58 119.88 1x8k h GLU 133 Ca -0.05 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 1x8k h GLU 133 Cb 1.41 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.70 1x8k h GLU 133 CO 0.14 0.29 -0.35 0.00 -0.73 0.00 0.00 179.01 178.35 1x8k h ARG 134 N 0.45 0.33 -0.50 1.92 3.08 -1.93 -2.52 114.38 115.21 1x8k h ARG 134 Ca 0.24 -0.29 -0.04 0.00 0.07 0.00 0.00 59.98 59.96 1x8k h ARG 134 Cb 0.20 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1x8k h ARG 134 CO -0.20 0.94 0.14 -0.92 -1.07 0.00 0.00 179.97 178.87 1x8k h TYR 135 N -0.18 0.81 -0.14 3.04 3.20 -0.31 -1.23 116.97 122.16 1x8k h TYR 135 Ca -0.03 -0.09 -0.10 0.00 3.14 0.00 0.00 58.73 61.66 1x8k h TYR 135 Cb 1.02 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 1x8k h TYR 135 CO 0.14 0.72 -0.33 -0.07 -1.64 0.00 0.00 178.16 176.97 1x8k h LEU 136 N 0.67 0.29 -0.57 2.82 3.38 -1.06 -1.81 115.31 119.03 1x8k h LEU 136 Ca 0.16 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1x8k h LEU 136 Cb 0.30 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 1x8k h LEU 136 CO -0.00 0.61 0.35 1.23 0.09 0.00 0.00 178.44 180.72 1x8k h GLY 137 N 1.10 0.81 1.02 0.83 0.00 -1.11 -0.95 103.07 104.76 1x8k h GLY 137 Ca 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 1x8k h GLY 137 CO 0.05 0.23 0.54 -2.00 0.00 0.00 0.00 176.54 175.36 1x8k h LEU 138 N 0.69 1.06 -0.75 3.11 7.12 -0.51 -0.52 115.31 125.52 1x8k h LEU 138 Ca 0.23 -0.06 -0.13 0.00 0.13 0.00 0.00 57.88 58.05 1x8k h LEU 138 Cb 0.01 -0.27 -0.01 0.00 -0.53 0.00 0.00 40.66 39.86 1x8k h LEU 138 CO -0.09 0.81 -0.40 -0.07 -0.13 0.00 0.00 178.44 178.56 1x8k h LEU 139 N 1.22 0.50 -0.43 2.25 3.38 -1.11 -0.96 115.31 120.16 1x8k h LEU 139 Ca 0.32 -0.22 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 1x8k h LEU 139 Cb -0.06 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1x8k h LEU 139 CO -0.06 0.85 -0.41 -0.08 0.09 0.00 0.00 178.44 178.83 1x8k h GLU 140 N 0.40 0.87 -0.07 1.13 4.81 -0.69 -2.59 114.58 118.43 1x8k h GLU 140 Ca 0.04 -0.47 -0.01 0.00 -0.13 0.00 0.00 59.36 58.79 1x8k h GLU 140 Cb 0.88 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 30.28 1x8k h GLU 140 CO 0.07 1.11 0.00 -0.92 -0.73 0.00 0.00 179.01 178.55 1x8k h TYR 141 N 0.70 0.14 0.00 0.92 3.20 -0.87 -2.65 116.97 118.42 1x8k h TYR 141 Ca 0.05 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1x8k h TYR 141 Cb 0.99 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.23 1x8k h TYR 141 CO 0.06 0.37 0.27 0.77 -1.64 0.00 0.00 178.16 177.99 1x8k h SER 142 N -0.14 0.00 0.40 -2.11 0.02 -1.16 -1.50 113.55 109.06 1x8k h SER 142 Ca 0.02 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.77 1x8k h SER 142 Cb 0.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1x8k h SER 142 CO 0.00 0.00 -0.83 0.28 -1.14 0.00 0.00 176.83 175.14 1x8k h SER 143 N 0.00 0.40 -2.71 3.07 0.02 -1.08 -3.41 113.55 109.84 1x8k h SER 143 Ca 0.00 -0.30 -0.56 0.00 -0.84 0.00 0.00 61.79 60.09 1x8k h SER 143 Cb 0.54 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 1x8k h SER 143 CO 0.00 1.07 1.06 -0.13 -1.14 0.00 0.00 176.83 177.69 1x8k s ARG 144 N -3.39 4.10 0.90 3.45 0.52 -0.56 -4.99 118.95 118.97 1x8k s ARG 144 Ca -0.05 1.94 -0.12 0.00 -0.52 0.00 0.00 55.73 56.98 1x8k s ARG 144 Cb 0.10 -3.95 0.07 0.00 0.52 0.00 0.00 34.95 31.69 1x8k s ARG 144 CO 0.84 -0.92 0.74 -0.35 0.02 0.00 0.00 175.30 175.62 1x8k n PRO 145 N 7.14 -0.20 -0.05 3.54 -0.04 -1.26 -4.76 135.00 139.37 1x8k n PRO 145 Ca 0.17 -0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.46 1x8k n PRO 145 Cb 0.44 -2.08 -0.06 0.00 -0.04 0.00 0.00 33.50 31.76 1x8k n PRO 145 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1x8k h GLY 146 N -1.43 0.92 0.53 0.55 0.00 -1.89 -3.05 103.07 98.70 1x8k h GLY 146 Ca -0.44 -1.19 0.15 0.00 0.00 0.00 0.00 47.33 45.85 1x8k h GLY 146 CO 0.39 1.06 0.56 1.48 0.00 0.00 0.00 176.54 180.03 1x8k h SER 147 N 0.60 0.58 -0.09 0.19 4.64 -1.92 -0.15 113.55 117.38 1x8k h SER 147 Ca -0.02 0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.23 1x8k h SER 147 Cb 1.29 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1x8k h SER 147 CO 0.14 0.28 -0.29 0.28 -0.87 0.00 0.00 176.83 176.38 1x8k h SER 148 N 0.61 0.57 -0.33 4.97 0.02 -1.91 -2.12 113.55 115.35 1x8k h SER 148 Ca 0.44 -0.21 -0.15 0.00 -0.84 0.00 0.00 61.79 61.02 1x8k h SER 148 Cb 0.80 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 1x8k h SER 148 CO -0.19 0.83 -0.39 -0.07 -1.14 0.00 0.00 176.83 175.87 1x8k h LEU 149 N 0.48 0.92 0.25 5.07 3.38 -1.02 -1.23 115.31 123.17 1x8k h LEU 149 Ca 0.06 -0.49 -0.01 0.00 0.09 0.00 0.00 57.88 57.54 1x8k h LEU 149 Cb 0.75 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1x8k h LEU 149 CO 0.06 1.22 -0.12 -0.07 0.09 0.00 0.00 178.44 179.62 1x8k h LEU 150 N 0.64 -0.28 -1.34 1.67 3.38 -1.41 -3.03 115.31 114.94 1x8k h LEU 150 Ca 0.05 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.06 1x8k h LEU 150 Cb 0.99 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.76 1x8k h LEU 150 CO 0.09 -0.16 0.50 0.00 0.09 0.00 0.00 178.44 178.97 1x8k h ALA 151 N 0.37 1.69 -0.74 1.53 0.00 -1.27 -2.22 119.26 118.62 1x8k h ALA 151 Ca -0.03 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1x8k h ALA 151 Cb 0.29 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1x8k h ALA 151 CO 0.06 0.18 0.49 0.00 0.00 0.00 0.00 179.25 179.97 1x8k h ALA 152 N 1.59 1.56 -2.37 0.00 0.00 -1.10 -3.42 119.26 115.52 1x8k h ALA 152 Ca 0.34 -0.04 -0.54 0.00 0.00 0.00 0.00 54.91 54.67 1x8k h ALA 152 Cb 0.29 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1x8k h ALA 152 CO -0.12 0.37 1.10 0.08 0.00 0.00 0.00 179.25 180.68 1x8k s VAL 153 N -5.78 3.15 0.64 0.00 1.01 -0.84 -4.99 120.40 113.60 1x8k s VAL 153 Ca -0.10 0.39 -0.17 0.00 0.00 0.00 0.00 61.98 62.09 1x8k s VAL 153 Cb 0.18 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.30 1x8k s VAL 153 CO 0.78 -0.02 1.20 -2.84 0.00 0.00 0.00 175.10 174.22 1x8k s PRO 154 N 3.55 2.72 0.33 2.72 0.02 -1.26 -4.93 135.00 138.15 1x8k s PRO 154 Ca 0.78 1.76 0.23 0.00 0.02 0.00 0.00 61.00 63.80 1x8k s PRO 154 Cb -0.39 -1.90 1.22 0.00 0.02 0.00 0.00 34.50 33.44 1x8k s PRO 154 CO 0.34 -1.39 1.71 -1.35 -0.33 0.00 0.00 177.00 175.99 1x8k h PRO 155 N 0.46 0.00 -0.13 5.54 0.11 -1.94 -2.32 132.00 133.72 1x8k h PRO 155 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1x8k h PRO 155 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1x8k h PRO 155 CO 0.53 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.57 1x8k n THR 156 N -2.31 0.15 -4.80 -1.15 -2.24 -1.26 -4.76 114.28 97.91 1x8k n THR 156 Ca -0.01 -0.34 -0.33 0.00 -2.27 0.00 0.00 64.05 61.10 1x8k n THR 156 Cb 0.07 0.46 -0.14 0.00 -2.10 0.00 0.00 70.33 68.62 1x8k n THR 156 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1x8k s GLU 157 N -1.85 3.37 0.07 -0.78 2.12 -0.88 -5.09 118.70 115.67 1x8k s GLU 157 Ca 0.34 -0.69 -0.31 0.00 0.36 0.00 0.00 54.97 54.67 1x8k s GLU 157 Cb 0.19 -2.62 -0.07 0.00 0.26 0.00 0.00 34.13 31.89 1x8k s GLU 157 CO 0.29 0.21 1.36 0.21 -0.54 0.00 0.00 175.26 176.79 1x8k s LYS 158 N 0.35 4.33 -0.12 4.30 2.20 -1.26 -4.80 119.74 124.74 1x8k s LYS 158 Ca -0.11 1.99 -0.25 0.00 -0.36 0.00 0.00 55.97 57.24 1x8k s LYS 158 Cb -0.16 -3.36 -0.02 0.00 -1.51 0.00 0.00 37.83 32.78 1x8k s LYS 158 CO 0.06 -0.44 0.78 1.03 -0.36 0.00 0.00 175.35 176.41 1x8k s ARG 159 N 1.45 4.36 -0.27 4.03 0.52 -1.26 -5.05 118.95 122.73 1x8k s ARG 159 Ca 0.63 0.96 -0.05 0.00 -0.52 0.00 0.00 55.73 56.75 1x8k s ARG 159 Cb -0.34 -3.52 0.01 0.00 0.52 0.00 0.00 34.95 31.62 1x8k s ARG 159 CO 0.29 -0.16 0.02 -0.06 0.02 0.00 0.00 175.30 175.42 1x8k s PHE 160 N 1.55 3.09 -0.15 -0.53 0.40 -1.26 -2.46 117.98 118.61 1x8k s PHE 160 Ca 0.38 -1.06 -0.04 0.00 -0.60 0.00 0.00 56.93 55.61 1x8k s PHE 160 Cb -0.17 -2.18 -0.03 0.00 0.51 0.00 0.00 43.02 41.15 1x8k s PHE 160 CO 0.15 -0.59 -0.02 0.08 0.70 0.00 0.00 175.22 175.55 1x8k s VAL 161 N 1.46 4.10 0.01 -0.44 1.01 -0.31 -0.70 120.40 125.54 1x8k s VAL 161 Ca 0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.72 1x8k s VAL 161 Cb -0.16 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1x8k s VAL 161 CO -0.00 0.50 0.10 -0.75 0.00 0.00 0.00 175.10 174.95 1x8k s LYS 162 N 0.20 3.10 -0.21 2.72 2.20 0.28 -0.65 119.74 127.38 1x8k s LYS 162 Ca -0.01 -0.50 -0.28 0.00 -0.36 0.00 0.00 55.97 54.83 1x8k s LYS 162 Cb -0.13 -2.87 0.12 0.00 -1.51 0.00 0.00 37.83 33.43 1x8k s LYS 162 CO 0.02 0.64 0.99 -0.08 -0.36 0.00 0.00 175.35 176.56 1x8k s THR 163 N -1.25 0.00 -0.62 3.43 -1.32 -0.97 -1.16 115.64 113.74 1x8k s THR 163 Ca 0.25 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.86 1x8k s THR 163 Cb -0.12 -1.00 0.43 0.00 -1.51 0.00 0.00 72.50 70.29 1x8k s THR 163 CO 0.16 0.00 1.35 1.41 -2.21 0.00 0.00 174.62 175.33 1x8k n HIS 164 N 1.43 0.73 -2.49 9.09 8.25 -1.26 -3.37 115.22 127.60 1x8k n HIS 164 Ca -0.12 -0.66 -0.40 0.00 -0.26 0.00 0.00 57.72 56.27 1x8k n HIS 164 Cb 0.57 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.47 1x8k n HIS 164 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1x8k s LEU 165 N -1.82 4.54 0.80 2.41 1.43 -1.26 -4.74 118.68 120.04 1x8k s LEU 165 Ca 0.33 2.21 -0.12 0.00 -1.03 0.00 0.00 54.13 55.52 1x8k s LEU 165 Cb 0.23 -3.62 0.08 0.00 0.03 0.00 0.00 46.19 42.90 1x8k s LEU 165 CO 0.13 -0.15 1.15 -2.84 0.23 0.00 0.00 176.35 174.87 1x8k s PRO 166 N -1.14 1.84 0.41 1.29 0.02 -1.26 -4.80 135.00 131.36 1x8k s PRO 166 Ca 0.46 1.52 0.13 0.00 0.02 0.00 0.00 61.00 63.13 1x8k s PRO 166 Cb -0.31 -1.82 0.85 0.00 0.02 0.00 0.00 34.50 33.23 1x8k s PRO 166 CO 0.39 -2.01 1.91 -0.07 -0.33 0.00 0.00 177.00 176.89 1x8k h LEU 167 N -0.99 0.02 0.00 -5.54 3.38 -1.94 -2.93 115.31 107.32 1x8k h LEU 167 Ca -0.45 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1x8k h LEU 167 Cb 1.27 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1x8k h LEU 167 CO 0.48 0.29 0.00 -1.54 0.09 0.00 0.00 178.44 177.76 1x8k n SER 168 N -4.21 0.00 -0.76 -0.43 3.41 -1.26 -1.63 113.62 108.74 1x8k n SER 168 Ca -0.02 -0.48 0.11 0.00 -0.26 0.00 0.00 58.87 58.22 1x8k n SER 168 Cb 0.32 -0.12 0.06 0.00 -0.26 0.00 0.00 64.21 64.22 1x8k n SER 168 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1x8k n LEU 169 N -1.12 2.57 -4.66 1.04 4.77 -1.11 -4.98 117.00 113.52 1x8k n LEU 169 Ca 0.15 -0.93 -0.28 0.00 -0.03 0.00 0.00 56.01 54.93 1x8k n LEU 169 Cb 0.13 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 1x8k n LEU 169 CO 0.15 0.44 -0.26 -0.04 -1.33 0.00 0.00 177.39 176.36 1x8k s MET 170 N -2.00 2.04 0.08 3.23 -1.94 -0.64 -3.68 119.30 116.38 1x8k s MET 170 Ca 0.23 -2.09 -0.34 0.00 -1.71 0.00 0.00 55.69 51.78 1x8k s MET 170 Cb 0.18 -1.70 -0.14 0.00 2.01 0.00 0.00 34.83 35.18 1x8k s MET 170 CO 0.36 -0.10 1.63 -2.30 -0.01 0.00 0.00 175.02 174.60 1x8k n PRO 171 N -1.06 2.03 -2.14 2.03 -0.02 -1.14 -4.86 135.00 129.84 1x8k n PRO 171 Ca -0.06 0.74 -0.33 0.00 -2.02 0.00 0.00 63.50 61.83 1x8k n PRO 171 Cb 0.67 -2.51 -0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1x8k n PRO 171 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1x8k s PRO 172 N 1.72 3.45 -2.00 0.52 0.05 -1.26 -2.20 135.00 135.28 1x8k s PRO 172 Ca 0.83 1.18 0.00 0.00 0.05 0.00 0.00 61.00 63.07 1x8k s PRO 172 Cb -0.72 -2.05 0.00 0.00 0.05 0.00 0.00 34.50 31.78 1x8k s PRO 172 CO 0.43 -0.70 0.00 0.09 0.05 0.00 0.00 177.00 176.87 1x8k n ASN 173 N -1.87 -5.34 -0.28 6.66 5.03 -1.26 -4.89 115.26 113.31 1x8k n ASN 173 Ca 0.08 0.43 -0.04 0.00 0.87 0.00 0.00 54.58 55.92 1x8k n ASN 173 Cb 0.53 -4.52 0.07 0.00 -1.02 0.00 0.00 39.78 34.84 1x8k n ASN 173 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1x8k h MET 174 N 0.00 1.01 0.00 3.52 -0.00 -1.82 -1.62 114.93 116.02 1x8k h MET 174 Ca -0.40 -0.06 0.00 0.00 -0.00 0.00 0.00 59.70 59.24 1x8k h MET 174 Cb 1.26 -0.23 0.00 0.00 -0.00 0.00 0.00 31.60 32.63 1x8k h MET 174 CO 0.57 0.67 0.00 1.28 -0.00 0.00 0.00 176.91 179.43 1x8k n LEU 175 N -4.55 0.00 0.11 -0.10 4.77 -1.26 0.26 117.00 116.23 1x8k n LEU 175 Ca 0.08 0.16 -0.02 0.00 -0.03 0.00 0.00 56.01 56.20 1x8k n LEU 175 Cb 0.02 -0.16 0.20 0.00 -2.33 0.00 0.00 43.42 41.15 1x8k n LEU 175 CO 0.36 -0.16 0.58 0.44 -1.33 0.00 0.00 177.39 177.28 1x8k h ASP 176 N 0.00 0.17 0.00 -1.43 3.32 -1.68 -3.39 116.42 113.41 1x8k h ASP 176 Ca 0.00 -0.08 -0.23 0.00 0.02 0.00 0.00 57.03 56.74 1x8k h ASP 176 Cb 0.01 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 1x8k h ASP 176 CO 0.00 0.64 -1.86 0.41 -1.72 0.00 0.00 179.24 176.71 1x8k n THR 177 N -3.95 0.86 -4.33 0.35 -1.04 0.14 -5.07 114.28 101.25 1x8k n THR 177 Ca -0.02 -0.31 -0.24 0.00 -2.04 0.00 0.00 64.05 61.44 1x8k n THR 177 Cb 0.53 -1.13 -0.08 0.00 -1.82 0.00 0.00 70.33 67.84 1x8k n THR 177 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1x8k s VAL 178 N -2.30 3.19 -0.01 12.58 -7.23 -0.33 -4.24 120.40 122.07 1x8k s VAL 178 Ca -0.21 -1.94 -0.05 0.00 -1.81 0.00 0.00 61.98 57.98 1x8k s VAL 178 Cb 0.06 -2.67 -0.04 0.00 0.56 0.00 0.00 36.38 34.28 1x8k s VAL 178 CO 0.34 -0.31 0.22 -0.54 -0.31 0.00 0.00 175.10 174.51 1x8k s LYS 179 N -3.41 3.51 -0.01 4.82 1.02 -1.10 -4.41 119.74 120.16 1x8k s LYS 179 Ca 0.29 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.11 1x8k s LYS 179 Cb -0.07 -3.09 0.02 0.00 -0.52 0.00 0.00 37.83 34.16 1x8k s LYS 179 CO 0.18 0.67 0.01 1.41 -0.92 0.00 0.00 175.35 176.70 1x8k s MET 180 N -1.77 0.02 -0.21 1.68 -2.45 0.06 0.19 119.30 116.82 1x8k s MET 180 Ca 0.26 0.08 -0.06 0.00 -1.25 0.00 0.00 55.69 54.73 1x8k s MET 180 Cb -0.13 -0.16 -0.03 0.00 1.25 0.00 0.00 34.83 35.77 1x8k s MET 180 CO 0.16 -0.08 0.02 0.08 1.05 0.00 0.00 175.02 176.25 1x8k s VAL 181 N 0.55 4.10 -0.11 10.11 1.01 0.48 -0.54 120.40 135.99 1x8k s VAL 181 Ca -0.05 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1x8k s VAL 181 Cb -0.07 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1x8k s VAL 181 CO -0.01 0.41 -0.13 -0.47 0.00 0.00 0.00 175.10 174.89 1x8k s TYR 182 N 1.09 2.79 -0.11 5.22 5.04 0.58 -0.79 117.35 131.16 1x8k s TYR 182 Ca 0.03 -0.53 -0.05 0.00 -2.44 0.00 0.00 57.07 54.08 1x8k s TYR 182 Cb -0.14 -1.80 -0.04 0.00 0.35 0.00 0.00 41.96 40.33 1x8k s TYR 182 CO 0.02 -0.12 0.08 -0.51 -1.34 0.00 0.00 175.55 173.68 1x8k s LEU 183 N 0.10 4.01 0.31 6.97 2.01 -0.36 -1.19 118.68 130.54 1x8k s LEU 183 Ca -0.06 0.30 0.07 0.00 0.01 0.00 0.00 54.13 54.45 1x8k s LEU 183 Cb -0.15 -1.96 -0.06 0.00 0.01 0.00 0.00 46.19 44.03 1x8k s LEU 183 CO 0.05 0.37 -0.05 0.00 1.01 0.00 0.00 176.35 177.72 1x8k s ALA 184 N -0.80 2.54 -0.18 4.21 0.00 0.55 -4.12 121.76 123.98 1x8k s ALA 184 Ca 0.13 -1.99 -0.28 0.00 0.00 0.00 0.00 51.96 49.82 1x8k s ALA 184 Cb -0.12 0.17 0.08 0.00 0.00 0.00 0.00 23.12 23.26 1x8k s ALA 184 CO 0.03 -0.06 0.78 0.50 0.00 0.00 0.00 175.76 177.01 1x8k s ARG 185 N -3.71 0.84 -0.39 0.00 3.52 -1.26 -0.16 118.95 117.79 1x8k s ARG 185 Ca 0.31 0.57 -0.45 0.00 -0.13 0.00 0.00 55.73 56.03 1x8k s ARG 185 Cb 0.04 0.40 -0.20 0.00 -1.56 0.00 0.00 34.95 33.64 1x8k s ARG 185 CO 0.14 -0.19 1.48 -3.47 -0.81 0.00 0.00 175.30 172.44 1x8k n ASP 186 N 1.73 0.93 -0.29 -2.12 -0.08 -1.26 -4.75 116.55 110.72 1x8k n ASP 186 Ca -0.15 1.18 0.03 0.00 -1.51 0.00 0.00 54.79 54.34 1x8k n ASP 186 Cb 0.56 -0.89 0.24 0.00 2.34 0.00 0.00 41.12 43.37 1x8k n ASP 186 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1x8k h PRO 187 N 4.54 1.00 -0.65 -0.67 0.11 -1.99 -1.36 132.00 132.98 1x8k h PRO 187 Ca -0.45 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1x8k h PRO 187 Cb 1.38 -0.23 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1x8k h PRO 187 CO 0.90 0.66 0.38 0.00 -0.21 0.00 0.00 178.00 179.73 1x8k h ARG 188 N 1.03 0.89 0.01 1.05 3.08 -2.00 0.19 114.38 118.63 1x8k h ARG 188 Ca 0.37 -0.08 -0.23 0.00 0.07 0.00 0.00 59.98 60.10 1x8k h ARG 188 Cb 0.14 -0.19 0.01 0.00 0.08 0.00 0.00 29.97 30.01 1x8k h ARG 188 CO -0.13 0.64 -0.97 -0.44 -1.07 0.00 0.00 179.97 178.00 1x8k h ASP 189 N 0.90 0.58 -0.41 7.04 3.32 -1.70 -2.85 116.42 123.30 1x8k h ASP 189 Ca 0.23 -0.47 -0.06 0.00 0.02 0.00 0.00 57.03 56.76 1x8k h ASP 189 Cb -0.01 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 1x8k h ASP 189 CO -0.04 1.27 0.07 0.58 -1.72 0.00 0.00 179.24 179.40 1x8k h VAL 190 N 0.25 1.22 0.32 -1.35 2.07 -0.64 0.55 116.25 118.67 1x8k h VAL 190 Ca -0.09 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 1x8k h VAL 190 Cb 1.61 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1x8k h VAL 190 CO 0.17 0.31 -0.25 0.00 0.02 0.00 0.00 177.57 177.81 1x8k h ALA 191 N 1.36 -0.57 -0.03 1.67 0.00 -0.64 0.33 119.26 121.38 1x8k h ALA 191 Ca 0.15 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1x8k h ALA 191 Cb 0.34 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1x8k h ALA 191 CO 0.01 -0.84 0.02 0.28 0.00 0.00 0.00 179.25 178.71 1x8k h VAL 192 N -0.58 1.08 -0.37 0.00 2.07 -1.24 0.12 116.25 117.33 1x8k h VAL 192 Ca -0.02 -0.22 0.05 0.00 0.82 0.00 0.00 66.70 67.33 1x8k h VAL 192 Cb 0.51 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 1x8k h VAL 192 CO -0.02 0.06 0.10 -1.28 0.02 0.00 0.00 177.57 176.46 1x8k h SER 193 N -0.04 0.08 -0.56 0.57 0.87 -0.86 -2.06 113.55 111.55 1x8k h SER 193 Ca 0.01 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1x8k h SER 193 Cb 0.09 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 1x8k h SER 193 CO -0.00 0.08 0.35 0.28 -0.53 0.00 0.00 176.83 177.01 1x8k h SER 194 N 0.24 0.67 -0.00 6.23 0.02 -0.07 -1.25 113.55 119.39 1x8k h SER 194 Ca 0.17 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1x8k h SER 194 Cb 0.18 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 1x8k h SER 194 CO -0.20 0.51 0.00 0.15 -1.14 0.00 0.00 176.83 176.15 1x8k h PHE 195 N 0.78 0.00 -0.70 3.45 3.57 -0.08 -0.98 116.94 122.98 1x8k h PHE 195 Ca 0.21 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1x8k h PHE 195 Cb -0.04 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 1x8k h PHE 195 CO 0.00 0.09 0.32 0.45 -2.23 0.00 0.00 178.31 176.94 1x8k h HIS 196 N -0.08 1.03 -0.85 0.41 3.86 -1.04 -1.75 115.15 116.72 1x8k h HIS 196 Ca 0.00 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 1x8k h HIS 196 Cb 0.08 -0.31 -0.04 0.00 1.06 0.00 0.00 27.41 28.20 1x8k h HIS 196 CO -0.05 0.77 0.48 1.25 0.86 0.00 0.00 177.93 181.24 1x8k h HIS 197 N 0.98 1.16 -0.81 2.45 -0.00 -1.03 0.57 115.15 118.46 1x8k h HIS 197 Ca 0.24 -0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.57 1x8k h HIS 197 Cb 0.14 -0.37 -0.04 0.00 -0.00 0.00 0.00 27.41 27.14 1x8k h HIS 197 CO 0.01 0.79 0.44 0.00 -0.00 0.00 0.00 177.93 179.17 1x8k h ALA 198 N 1.34 1.04 -0.68 5.26 0.00 -0.82 -2.00 119.26 123.40 1x8k h ALA 198 Ca 0.30 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 1x8k h ALA 198 Cb 0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 1x8k h ALA 198 CO -0.05 0.56 0.23 0.00 0.00 0.00 0.00 179.25 179.99 1x8k h ARG 199 N 1.13 1.05 -0.20 0.00 2.47 -0.07 0.28 114.38 119.04 1x8k h ARG 199 Ca 0.29 -0.22 0.06 0.00 -1.26 0.00 0.00 59.98 58.84 1x8k h ARG 199 Cb 0.04 -0.16 -0.07 0.00 -1.65 0.00 0.00 29.97 28.14 1x8k h ARG 199 CO -0.05 0.90 -0.27 1.25 0.56 0.00 0.00 179.97 182.36 1x8k h LEU 200 N 0.99 -0.87 -0.44 3.04 5.85 0.72 -2.76 115.31 121.85 1x8k h LEU 200 Ca 0.22 0.14 0.00 0.00 0.84 0.00 0.00 57.88 59.08 1x8k h LEU 200 Cb 0.27 0.39 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1x8k h LEU 200 CO -0.01 -0.31 -0.23 0.18 -0.34 0.00 0.00 178.44 177.73 1x8k n LEU 201 N -5.39 0.92 -1.05 2.25 4.77 -0.86 -0.98 117.00 116.66 1x8k n LEU 201 Ca -0.02 -0.21 -0.05 0.00 -0.03 0.00 0.00 56.01 55.70 1x8k n LEU 201 Cb 0.31 -0.14 0.01 0.00 -2.33 0.00 0.00 43.42 41.27 1x8k n LEU 201 CO 0.15 0.17 0.03 -1.22 -1.33 0.00 0.00 177.39 175.19 1x8k n TYR 202 N -0.71 -0.55 0.15 -1.77 4.02 -0.84 -4.96 117.16 112.49 1x8k n TYR 202 Ca 0.12 0.18 0.07 0.00 -0.01 0.00 0.00 57.90 58.26 1x8k n TYR 202 Cb 0.34 -1.85 0.05 0.00 -0.02 0.00 0.00 39.34 37.86 1x8k n TYR 202 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1x8k h LEU 203 N -0.47 0.00 -9.28 7.72 3.38 -0.73 -3.44 115.31 112.48 1x8k h LEU 203 Ca -0.12 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.18 1x8k h LEU 203 Cb 1.08 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.68 1x8k h LEU 203 CO 0.13 0.27 -0.67 -0.22 0.09 0.00 0.00 178.44 178.04 1x8k s LEU 204 N -6.11 3.37 0.02 1.67 2.96 -1.22 -4.51 118.68 114.87 1x8k s LEU 204 Ca 0.03 -0.05 -0.30 0.00 -0.22 0.00 0.00 54.13 53.59 1x8k s LEU 204 Cb 0.07 -1.91 -0.08 0.00 0.50 0.00 0.00 46.19 44.78 1x8k s LEU 204 CO 0.74 0.29 1.74 0.20 -1.32 0.00 0.00 176.35 178.00 1x8k s ASN 205 N -1.41 6.58 0.30 3.68 -0.87 0.64 -4.85 114.94 119.01 1x8k s ASN 205 Ca 0.18 2.46 0.18 0.00 -1.57 0.00 0.00 52.86 54.11 1x8k s ASN 205 Cb -0.11 -2.55 0.96 0.00 -0.02 0.00 0.00 41.25 39.54 1x8k s ASN 205 CO 0.08 -0.95 1.51 2.29 -2.57 0.00 0.00 177.10 177.46 1x8k n LYS 206 N 6.57 0.12 0.01 -0.60 0.00 -1.26 -0.37 118.16 122.63 1x8k n LYS 206 Ca 0.17 0.61 0.13 0.00 -0.00 0.00 0.00 58.31 59.21 1x8k n LYS 206 Cb 0.41 -1.98 0.34 0.00 -0.00 0.00 0.00 35.03 33.80 1x8k n LYS 206 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1x8k n GLN 207 N -2.15 0.06 -2.16 -1.58 6.02 -1.26 -4.90 117.38 111.41 1x8k n GLN 207 Ca -0.01 0.02 -0.30 0.00 -0.01 0.00 0.00 57.00 56.70 1x8k n GLN 207 Cb 0.13 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 29.84 1x8k n GLN 207 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1x8k s SER 208 N -3.26 6.28 0.41 1.08 0.01 0.50 -5.11 113.70 113.63 1x8k s SER 208 Ca 0.11 1.29 0.03 0.00 1.31 0.00 0.00 55.95 58.69 1x8k s SER 208 Cb 0.17 -2.41 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 1x8k s SER 208 CO 0.66 -0.75 0.06 0.54 0.41 0.00 0.00 173.24 174.16 1x8k s ASN 209 N -4.03 3.17 0.37 2.44 2.20 -1.26 -4.98 114.94 112.85 1x8k s ASN 209 Ca 0.53 -1.56 0.07 0.00 -0.94 0.00 0.00 52.86 50.96 1x8k s ASN 209 Cb -0.11 0.25 0.77 0.00 -2.00 0.00 0.00 41.25 40.16 1x8k s ASN 209 CO 0.49 -0.77 1.96 0.15 -2.94 0.00 0.00 177.10 175.99 1x8k h PHE 210 N 1.75 0.73 0.40 1.54 3.57 -1.99 -1.40 116.94 121.55 1x8k h PHE 210 Ca -0.40 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.11 1x8k h PHE 210 Cb 1.27 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.75 1x8k h PHE 210 CO 1.18 0.38 -0.44 -0.22 -2.23 0.00 0.00 178.31 176.99 1x8k h LYS 211 N 0.72 -0.83 -0.76 1.11 3.64 -1.97 0.44 116.57 118.93 1x8k h LYS 211 Ca 0.31 0.06 0.11 0.00 -1.27 0.00 0.00 60.65 59.85 1x8k h LYS 211 Cb 0.28 0.19 -0.13 0.00 -0.41 0.00 0.00 32.23 32.16 1x8k h LYS 211 CO -0.10 -0.55 -0.43 -0.44 -2.27 0.00 0.00 179.45 175.66 1x8k h ASP 212 N -0.86 -1.51 -0.53 4.20 3.32 -1.82 0.80 116.42 120.02 1x8k h ASP 212 Ca -0.04 0.27 0.08 0.00 0.02 0.00 0.00 57.03 57.37 1x8k h ASP 212 Cb 0.77 0.72 -0.07 0.00 0.22 0.00 0.00 39.33 40.98 1x8k h ASP 212 CO -0.09 -0.30 0.17 0.15 -1.72 0.00 0.00 179.24 177.45 1x8k h PHE 213 N -0.12 0.29 -0.70 4.55 3.57 -0.66 -1.08 116.94 122.78 1x8k h PHE 213 Ca 0.24 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.81 1x8k h PHE 213 Cb 0.55 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.20 1x8k h PHE 213 CO -0.79 0.07 0.46 2.35 -2.23 0.00 0.00 178.31 178.17 1x8k h TRP 214 N 0.33 0.77 0.74 0.41 2.91 0.20 0.11 115.95 121.42 1x8k h TRP 214 Ca 0.26 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.27 1x8k h TRP 214 Cb 0.31 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 28.71 1x8k h TRP 214 CO -0.18 0.43 -0.38 0.93 -1.03 0.00 0.00 178.44 178.20 1x8k h GLU 215 N 0.78 -0.99 -0.90 2.65 4.39 0.35 -1.67 114.58 119.20 1x8k h GLU 215 Ca 0.29 0.07 0.25 0.00 0.34 0.00 0.00 59.36 60.31 1x8k h GLU 215 Cb 0.17 0.22 -0.15 0.00 -0.10 0.00 0.00 28.75 28.90 1x8k h GLU 215 CO -0.09 -0.66 0.24 1.98 -1.16 0.00 0.00 179.01 179.32 1x8k h MET 216 N -1.02 0.18 0.30 2.33 4.05 -1.17 -2.64 114.93 116.95 1x8k h MET 216 Ca -0.10 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.29 1x8k h MET 216 Cb 0.79 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.56 1x8k h MET 216 CO 0.15 0.12 -0.14 0.35 0.23 0.00 0.00 176.91 177.61 1x8k h PHE 217 N 0.18 -0.37 0.00 1.39 3.57 -0.48 0.48 116.94 121.70 1x8k h PHE 217 Ca 0.58 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 62.07 1x8k h PHE 217 Cb 1.20 0.12 0.00 0.00 2.79 0.00 0.00 35.95 40.06 1x8k h PHE 217 CO -0.27 -0.23 0.00 1.12 -2.23 0.00 0.00 178.31 176.70 1x8k h HIS 218 N -0.52 0.00 -0.00 0.41 2.07 -1.33 -1.67 115.15 114.12 1x8k h HIS 218 Ca -0.04 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.48 1x8k h HIS 218 Cb 0.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.29 1x8k h HIS 218 CO 0.10 0.00 -0.12 -2.13 -3.07 0.00 0.00 177.93 172.71 1x8k n ARG 219 N -3.03 0.68 -0.94 5.12 0.63 -1.00 -4.94 116.66 113.18 1x8k n ARG 219 Ca 0.01 -0.24 0.00 0.00 -0.92 0.00 0.00 57.85 56.70 1x8k n ARG 219 Cb 0.29 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.70 1x8k n ARG 219 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1x8k n GLY 220 N 1.29 0.84 0.70 5.14 0.00 -0.63 -5.00 105.19 107.53 1x8k n GLY 220 Ca 0.14 -0.60 0.04 0.00 0.00 0.00 0.00 46.02 45.60 1x8k n GLY 220 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x8k n LEU 221 N 0.00 3.11 -4.62 0.99 4.77 0.15 -4.33 117.00 117.07 1x8k n LEU 221 Ca 0.00 -3.72 -0.24 0.00 -0.03 0.00 0.00 56.01 52.03 1x8k n LEU 221 Cb 0.17 -0.55 -0.08 0.00 -2.33 0.00 0.00 43.42 40.63 1x8k n LEU 221 CO 0.00 1.24 -0.34 -0.47 -1.33 0.00 0.00 177.39 176.49 1x8k s TYR 222 N -3.17 2.58 -0.49 -1.77 5.04 -1.19 -4.80 117.35 113.55 1x8k s TYR 222 Ca 0.39 -0.31 -0.45 0.00 -2.44 0.00 0.00 57.07 54.27 1x8k s TYR 222 Cb 0.37 -1.27 -0.19 0.00 0.35 0.00 0.00 41.96 41.22 1x8k s TYR 222 CO -0.03 0.58 1.77 2.41 -1.34 0.00 0.00 175.55 178.94 1x8k n THR 223 N -0.88 0.00 -1.30 4.34 -1.04 -1.26 -0.98 114.28 113.16 1x8k n THR 223 Ca -0.05 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.85 1x8k n THR 223 Cb 0.60 -0.49 -0.04 0.00 -1.82 0.00 0.00 70.33 68.58 1x8k n THR 223 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1x8k n LEU 224 N 5.27 -0.63 -4.93 -4.42 7.99 0.99 -4.94 117.00 116.33 1x8k n LEU 224 Ca 0.40 0.25 -0.28 0.00 -0.01 0.00 0.00 56.01 56.37 1x8k n LEU 224 Cb -0.05 -1.89 0.13 0.00 -0.11 0.00 0.00 43.42 41.50 1x8k n LEU 224 CO 0.87 -0.65 0.77 0.42 -1.51 0.00 0.00 177.39 177.29 1x8k s THR 225 N -2.27 2.06 0.31 -5.08 -4.23 -0.15 -4.64 115.64 101.65 1x8k s THR 225 Ca 0.00 -0.11 -0.29 0.00 -1.18 0.00 0.00 61.69 60.11 1x8k s THR 225 Cb 0.00 -2.95 -0.12 0.00 1.34 0.00 0.00 72.50 70.76 1x8k s THR 225 CO 0.00 0.00 1.37 -2.65 -0.54 0.00 0.00 174.62 172.80 1x8k n PRO 226 N -3.39 2.20 0.17 3.99 -0.02 -1.26 -0.72 135.00 135.97 1x8k n PRO 226 Ca 0.12 0.78 -0.14 0.00 -2.02 0.00 0.00 63.50 62.23 1x8k n PRO 226 Cb 0.60 -2.41 -0.07 0.00 -0.02 0.00 0.00 33.50 31.60 1x8k n PRO 226 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1x8k h TYR 227 N 3.31 -0.58 0.00 6.00 3.20 -1.85 -3.07 116.97 123.97 1x8k h TYR 227 Ca -0.46 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.39 1x8k h TYR 227 Cb 1.27 0.22 -0.00 0.00 1.54 0.00 0.00 36.73 39.76 1x8k h TYR 227 CO 0.53 -0.33 -0.08 0.74 -1.64 0.00 0.00 178.16 177.38 1x8k h PHE 228 N -0.49 0.00 -0.03 -3.82 -1.00 -1.98 -2.60 116.94 107.02 1x8k h PHE 228 Ca -0.01 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.72 1x8k h PHE 228 Cb 0.44 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.01 1x8k h PHE 228 CO -0.14 0.08 -0.18 0.93 -1.61 0.00 0.00 178.31 177.39 1x8k h GLU 229 N 0.00 0.18 -0.58 1.51 4.39 -1.98 0.43 114.58 118.53 1x8k h GLU 229 Ca -0.00 -0.15 0.07 0.00 0.34 0.00 0.00 59.36 59.62 1x8k h GLU 229 Cb 0.59 0.03 -0.10 0.00 -0.10 0.00 0.00 28.75 29.18 1x8k h GLU 229 CO 0.01 0.82 -0.53 1.25 -1.16 0.00 0.00 179.01 179.40 1x8k h HIS 230 N -0.42 -1.61 -0.83 4.33 2.76 -1.38 -1.35 115.15 116.64 1x8k h HIS 230 Ca -0.01 0.09 -0.02 0.00 -2.20 0.00 0.00 60.37 58.23 1x8k h HIS 230 Cb 0.86 0.78 -0.04 0.00 1.55 0.00 0.00 27.41 30.56 1x8k h HIS 230 CO 0.15 -0.45 0.45 0.28 -1.30 0.00 0.00 177.93 177.06 1x8k h VAL 231 N -0.27 1.25 -0.26 5.26 2.07 -1.50 -3.06 116.25 119.74 1x8k h VAL 231 Ca 0.12 -0.62 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 1x8k h VAL 231 Cb 0.55 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1x8k h VAL 231 CO -0.69 0.28 -0.04 0.11 0.02 0.00 0.00 177.57 177.24 1x8k h LYS 232 N 1.16 0.40 0.26 1.57 1.57 -0.22 0.76 116.57 122.07 1x8k h LYS 232 Ca 0.29 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1x8k h LYS 232 Cb 0.04 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1x8k h LYS 232 CO -0.05 0.46 -0.13 0.93 -0.57 0.00 0.00 179.45 180.10 1x8k h GLU 233 N 0.38 -0.34 -0.12 3.15 5.08 -1.17 -2.48 114.58 119.08 1x8k h GLU 233 Ca 0.08 0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.39 1x8k h GLU 233 Cb 0.32 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1x8k h GLU 233 CO 0.01 -0.22 -0.26 0.00 -1.00 0.00 0.00 179.01 177.54 1x8k h ALA 234 N 0.37 1.33 -0.56 3.43 0.00 -1.33 -3.02 119.26 119.47 1x8k h ALA 234 Ca -0.04 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1x8k h ALA 234 Cb 0.28 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1x8k h ALA 234 CO 0.06 0.46 0.03 2.35 0.00 0.00 0.00 179.25 182.16 1x8k h TRP 235 N 0.20 1.05 0.00 0.00 2.91 -0.80 -2.85 115.95 116.46 1x8k h TRP 235 Ca 0.03 -0.17 0.00 0.00 1.13 0.00 0.00 58.89 59.88 1x8k h TRP 235 Cb 0.58 -0.28 0.00 0.00 -0.51 0.00 0.00 29.16 28.95 1x8k h TRP 235 CO 0.01 0.94 0.00 0.00 -1.03 0.00 0.00 178.44 178.35 1x8k n ALA 236 N -2.45 1.51 -0.89 2.65 0.00 -0.94 -1.77 120.51 118.62 1x8k n ALA 236 Ca 0.02 0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.55 1x8k n ALA 236 Cb 0.31 -1.24 0.18 0.00 0.00 0.00 0.00 19.45 18.70 1x8k n ALA 236 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1x8k n LYS 237 N -1.73 2.19 0.30 0.00 4.76 -1.08 -4.81 118.16 117.79 1x8k n LYS 237 Ca 0.02 -2.56 0.19 0.00 -2.87 0.00 0.00 58.31 53.09 1x8k n LYS 237 Cb 0.15 -1.58 0.85 0.00 -1.84 0.00 0.00 35.03 32.60 1x8k n LYS 237 CO 0.00 0.00 0.00 0.07 -1.37 0.00 0.00 177.40 176.10 1x8k h ARG 238 N 0.87 0.00 0.00 1.97 0.11 -1.26 -2.84 114.38 113.23 1x8k h ARG 238 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1x8k h ARG 238 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 1x8k h ARG 238 CO 0.09 0.01 -1.05 -2.39 0.10 0.00 0.00 179.97 176.73 1x8k n HIS 239 N -3.10 0.14 -1.64 4.08 1.44 -1.26 -4.67 115.22 110.20 1x8k n HIS 239 Ca -0.01 0.04 -0.48 0.00 -2.01 0.00 0.00 57.72 55.27 1x8k n HIS 239 Cb 0.23 -0.30 -0.05 0.00 0.12 0.00 0.00 29.99 30.00 1x8k n HIS 239 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1x8k n ASP 240 N -1.81 2.56 0.23 4.39 -0.08 -1.07 -4.85 116.55 115.92 1x8k n ASP 240 Ca 0.02 1.10 0.18 0.00 -1.51 0.00 0.00 54.79 54.58 1x8k n ASP 240 Cb 0.41 -1.34 0.83 0.00 2.34 0.00 0.00 41.12 43.35 1x8k n ASP 240 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1x8k h PRO 241 N 5.31 0.00 -0.39 -0.67 0.11 -1.91 -1.11 132.00 133.34 1x8k h PRO 241 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1x8k h PRO 241 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1x8k h PRO 241 CO 0.84 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.72 1x8k n ASN 242 N -3.34 3.05 -4.24 -2.05 3.02 -1.26 -4.91 115.26 105.53 1x8k n ASN 242 Ca 0.02 -1.94 -0.29 0.00 -0.03 0.00 0.00 54.58 52.34 1x8k n ASN 242 Cb 0.42 -0.26 -0.16 0.00 -0.61 0.00 0.00 39.78 39.17 1x8k n ASN 242 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1x8k s MET 243 N -1.49 2.06 -0.22 3.52 1.75 -0.42 -0.76 119.30 123.73 1x8k s MET 243 Ca 0.38 -0.80 -0.01 0.00 -1.25 0.00 0.00 55.69 54.01 1x8k s MET 243 Cb 0.21 -1.86 0.06 0.00 2.84 0.00 0.00 34.83 36.08 1x8k s MET 243 CO 0.30 0.41 -0.01 -1.17 -0.65 0.00 0.00 175.02 173.89 1x8k s LEU 244 N -0.30 2.01 -0.37 4.11 2.96 0.29 -4.69 118.68 122.70 1x8k s LEU 244 Ca 0.02 -1.05 -0.14 0.00 -0.22 0.00 0.00 54.13 52.74 1x8k s LEU 244 Cb -0.11 -0.94 -0.00 0.00 0.50 0.00 0.00 46.19 45.64 1x8k s LEU 244 CO 0.01 -0.27 0.27 0.12 -1.32 0.00 0.00 176.35 175.16 1x8k s PHE 245 N 1.58 3.23 0.17 5.38 5.36 -1.26 -0.31 117.98 132.14 1x8k s PHE 245 Ca -0.03 -0.36 0.10 0.00 -0.96 0.00 0.00 56.93 55.67 1x8k s PHE 245 Cb -0.18 -2.54 -0.04 0.00 -0.34 0.00 0.00 43.02 39.92 1x8k s PHE 245 CO -0.07 -0.46 -0.21 -0.51 -1.46 0.00 0.00 175.22 172.51 1x8k s LEU 246 N 1.72 2.42 -0.09 6.12 1.43 -0.33 -5.01 118.68 124.95 1x8k s LEU 246 Ca 0.06 -0.85 -0.00 0.00 -1.03 0.00 0.00 54.13 52.31 1x8k s LEU 246 Cb -0.18 -0.97 -0.03 0.00 0.03 0.00 0.00 46.19 45.04 1x8k s LEU 246 CO 0.10 0.04 -0.07 -0.36 0.23 0.00 0.00 176.35 176.29 1x8k s PHE 247 N -1.81 2.95 0.25 0.29 0.40 -1.26 -0.33 117.98 118.47 1x8k s PHE 247 Ca 0.17 -0.11 -0.04 0.00 -0.60 0.00 0.00 56.93 56.35 1x8k s PHE 247 Cb -0.07 -1.78 0.50 0.00 0.51 0.00 0.00 43.02 42.18 1x8k s PHE 247 CO 0.08 0.20 1.68 -0.92 0.70 0.00 0.00 175.22 176.96 1x8k h TYR 248 N 5.72 0.31 -0.86 0.36 3.20 -0.72 -1.10 116.97 123.87 1x8k h TYR 248 Ca -0.42 0.04 0.10 0.00 3.14 0.00 0.00 58.73 61.59 1x8k h TYR 248 Cb 1.18 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 39.37 1x8k h TYR 248 CO 0.55 -0.09 0.56 0.93 -1.64 0.00 0.00 178.16 178.47 1x8k h GLU 249 N 0.28 0.80 -0.42 1.82 3.07 -1.91 -0.15 114.58 118.07 1x8k h GLU 249 Ca 0.44 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 59.22 1x8k h GLU 249 Cb 0.77 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.47 1x8k h GLU 249 CO -0.52 0.53 0.11 -0.44 -1.40 0.00 0.00 179.01 177.29 1x8k h ASP 250 N 0.82 0.56 -0.83 1.42 3.32 -1.59 -1.24 116.42 118.87 1x8k h ASP 250 Ca 0.40 -0.08 0.11 0.00 0.02 0.00 0.00 57.03 57.48 1x8k h ASP 250 Cb 0.45 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.79 1x8k h ASP 250 CO -0.17 0.56 0.54 1.88 -1.72 0.00 0.00 179.24 180.33 1x8k h TYR 251 N 0.60 0.82 -0.02 4.55 0.99 -1.00 0.84 116.97 123.74 1x8k h TYR 251 Ca 0.14 0.02 -0.21 0.00 2.00 0.00 0.00 58.73 60.68 1x8k h TYR 251 Cb 0.21 -0.26 0.02 0.00 1.00 0.00 0.00 36.73 37.69 1x8k h TYR 251 CO 0.01 0.36 -0.82 -0.07 -0.00 0.00 0.00 178.16 177.65 1x8k h LEU 252 N 0.75 0.75 -0.43 3.88 3.38 -1.30 -3.07 115.31 119.27 1x8k h LEU 252 Ca 0.39 -0.73 -0.10 0.00 0.09 0.00 0.00 57.88 57.53 1x8k h LEU 252 Cb 0.51 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1x8k h LEU 252 CO -0.16 1.38 -0.14 0.11 0.09 0.00 0.00 178.44 179.72 1x8k h LYS 253 N 0.20 0.85 -0.71 1.13 1.57 -0.92 -3.41 116.57 115.27 1x8k h LYS 253 Ca -0.10 -0.34 -0.33 0.00 -1.87 0.00 0.00 60.65 58.01 1x8k h LYS 253 Cb 1.49 -0.04 -0.22 0.00 0.08 0.00 0.00 32.23 33.54 1x8k h LYS 253 CO 0.16 0.98 -0.69 -3.47 -0.57 0.00 0.00 179.45 175.86 1x8k n ASP 254 N -4.26 -1.93 0.06 0.86 2.03 0.26 -5.02 116.55 108.54 1x8k n ASP 254 Ca -0.01 -3.08 -0.13 0.00 0.52 0.00 0.00 54.79 52.09 1x8k n ASP 254 Cb 0.40 1.02 -0.08 0.00 -0.72 0.00 0.00 41.12 41.74 1x8k n ASP 254 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1x8k h LEU 255 N 4.08 -0.08 -0.76 -2.67 5.85 -1.68 -1.06 115.31 118.99 1x8k h LEU 255 Ca -0.06 -0.10 0.17 0.00 0.84 0.00 0.00 57.88 58.72 1x8k h LEU 255 Cb 0.98 0.02 -0.11 0.00 0.37 0.00 0.00 40.66 41.92 1x8k h LEU 255 CO 0.36 0.05 0.19 -0.65 -0.34 0.00 0.00 178.44 178.05 1x8k h PRO 256 N -0.21 0.26 -0.66 5.25 0.11 -1.91 -1.83 132.00 133.00 1x8k h PRO 256 Ca -0.01 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 1x8k h PRO 256 Cb 0.18 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.20 1x8k h PRO 256 CO 0.02 0.17 0.27 0.78 -0.21 0.00 0.00 178.00 179.03 1x8k h GLY 257 N 0.27 1.04 1.99 -0.55 0.00 -1.85 -2.33 103.07 101.63 1x8k h GLY 257 Ca 0.44 -0.53 -0.17 0.00 0.00 0.00 0.00 47.33 47.06 1x8k h GLY 257 CO -0.53 0.51 -0.83 1.76 0.00 0.00 0.00 176.54 177.45 1x8k h SER 258 N 0.95 0.01 -0.21 0.19 0.02 -0.55 -2.96 113.55 111.00 1x8k h SER 258 Ca 0.23 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.14 1x8k h SER 258 Cb 0.17 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1x8k h SER 258 CO -0.02 0.83 0.03 0.40 -1.14 0.00 0.00 176.83 176.93 1x8k h ILE 259 N 0.01 1.23 -0.82 3.27 2.04 -1.11 -1.43 117.51 120.69 1x8k h ILE 259 Ca -0.01 -0.75 0.01 0.00 1.00 0.00 0.00 64.86 65.11 1x8k h ILE 259 Cb 1.46 1.32 -0.04 0.00 -0.74 0.00 0.00 36.82 38.82 1x8k h ILE 259 CO 0.11 0.23 0.55 0.00 0.00 0.00 0.00 178.15 179.04 1x8k h ALA 260 N 0.84 1.43 -0.21 1.87 0.00 -1.43 -0.76 119.26 120.99 1x8k h ALA 260 Ca 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1x8k h ALA 260 Cb 0.32 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1x8k h ALA 260 CO 0.00 0.52 0.12 0.00 0.00 0.00 0.00 179.25 179.89 1x8k h ARG 261 N 1.10 0.30 -0.39 0.00 3.08 -1.34 -1.43 114.38 115.70 1x8k h ARG 261 Ca 0.31 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1x8k h ARG 261 Cb -0.10 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1x8k h ARG 261 CO -0.07 0.28 0.26 0.82 -1.07 0.00 0.00 179.97 180.19 1x8k h ILE 262 N 0.24 1.10 -0.48 2.04 2.04 -0.11 -0.81 117.51 121.53 1x8k h ILE 262 Ca 0.08 -0.19 0.01 0.00 1.00 0.00 0.00 64.86 65.76 1x8k h ILE 262 Cb 0.07 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 1x8k h ILE 262 CO -0.01 0.10 0.30 0.00 0.00 0.00 0.00 178.15 178.54 1x8k h ALA 263 N 1.14 0.61 -0.61 1.87 0.00 -1.15 0.73 119.26 121.85 1x8k h ALA 263 Ca 0.14 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1x8k h ALA 263 Cb -0.06 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.50 1x8k h ALA 263 CO -0.03 0.02 0.28 -0.44 0.00 0.00 0.00 179.25 179.08 1x8k h ASP 264 N 0.61 0.36 -0.20 0.00 5.19 -1.00 0.13 116.42 121.51 1x8k h ASP 264 Ca 0.18 0.05 0.02 0.00 -0.62 0.00 0.00 57.03 56.67 1x8k h ASP 264 Cb -0.03 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.45 1x8k h ASP 264 CO -0.06 0.23 0.06 0.15 -3.12 0.00 0.00 179.24 176.50 1x8k h PHE 265 N 0.52 0.12 -0.08 4.55 3.57 -0.68 -2.73 116.94 122.21 1x8k h PHE 265 Ca 0.29 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1x8k h PHE 265 Cb 0.28 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.99 1x8k h PHE 265 CO -0.12 0.06 0.00 1.28 -2.23 0.00 0.00 178.31 177.29 1x8k n LEU 266 N -5.05 0.72 -3.26 0.59 4.77 0.21 -4.89 117.00 110.09 1x8k n LEU 266 Ca -0.03 -0.36 -0.15 0.00 -0.03 0.00 0.00 56.01 55.44 1x8k n LEU 266 Cb 0.08 -0.17 0.08 0.00 -2.33 0.00 0.00 43.42 41.07 1x8k n LEU 266 CO 0.30 0.16 0.07 0.61 -1.33 0.00 0.00 177.39 177.19 1x8k n GLY 267 N 0.49 -0.68 2.95 -0.72 0.00 -0.57 -5.03 105.19 101.63 1x8k n GLY 267 Ca 0.03 0.30 -0.14 0.00 0.00 0.00 0.00 46.02 46.21 1x8k n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8k s LYS 268 N -4.84 0.31 -0.25 1.61 -0.14 0.34 -5.02 119.74 111.74 1x8k s LYS 268 Ca 0.21 -0.27 -0.14 0.00 -1.36 0.00 0.00 55.97 54.40 1x8k s LYS 268 Cb -0.03 -0.21 -0.04 0.00 -1.68 0.00 0.00 37.83 35.87 1x8k s LYS 268 CO 0.70 0.05 0.35 0.15 -0.76 0.00 0.00 175.35 175.84 1x8k s LYS 269 N -0.47 4.05 -0.09 1.68 -0.14 -1.26 -3.96 119.74 119.55 1x8k s LYS 269 Ca -0.03 0.02 0.01 0.00 -1.36 0.00 0.00 55.97 54.62 1x8k s LYS 269 Cb -0.04 -3.62 -0.02 0.00 -1.68 0.00 0.00 37.83 32.47 1x8k s LYS 269 CO -0.00 -0.19 -0.10 -0.51 -0.76 0.00 0.00 175.35 173.79 1x8k s LEU 270 N 1.80 2.94 0.53 3.17 1.43 -1.26 -5.12 118.68 122.17 1x8k s LEU 270 Ca 0.15 -0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 52.91 1x8k s LEU 270 Cb -0.15 -1.64 -0.07 0.00 0.03 0.00 0.00 46.19 44.35 1x8k s LEU 270 CO 0.09 0.28 1.01 -0.94 0.23 0.00 0.00 176.35 177.01 1x8k s SER 271 N -0.31 6.39 0.32 2.29 1.04 -1.26 -4.87 113.70 117.30 1x8k s SER 271 Ca 0.03 1.67 0.10 0.00 0.48 0.00 0.00 55.95 58.23 1x8k s SER 271 Cb -0.13 -2.52 0.95 0.00 0.10 0.00 0.00 66.02 64.42 1x8k s SER 271 CO 0.03 -0.75 1.65 -0.33 0.98 0.00 0.00 173.24 174.81 1x8k h GLU 272 N 0.88 0.24 -0.38 4.02 4.39 -1.99 -0.61 114.58 121.13 1x8k h GLU 272 Ca -0.47 -0.01 -0.16 0.00 0.34 0.00 0.00 59.36 59.05 1x8k h GLU 272 Cb 1.20 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 1x8k h GLU 272 CO 0.60 0.16 -0.39 0.93 -1.16 0.00 0.00 179.01 179.15 1x8k h GLU 273 N 0.25 0.94 -0.53 2.33 3.07 -1.98 -0.59 114.58 118.07 1x8k h GLU 273 Ca 0.67 -0.50 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1x8k h GLU 273 Cb 1.48 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 29.38 1x8k h GLU 273 CO -0.65 1.15 0.34 1.96 -1.40 0.00 0.00 179.01 180.41 1x8k h GLN 274 N 0.76 0.71 -0.39 2.33 4.20 -1.51 0.49 115.11 121.71 1x8k h GLN 274 Ca 0.06 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 1x8k h GLN 274 Cb 0.98 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.59 1x8k h GLN 274 CO 0.10 0.50 0.24 0.82 -0.67 0.00 0.00 178.83 179.81 1x8k h ILE 275 N 0.72 1.12 -0.13 2.54 2.04 -1.26 -0.42 117.51 122.12 1x8k h ILE 275 Ca 0.19 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.81 1x8k h ILE 275 Cb -0.05 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 1x8k h ILE 275 CO -0.04 0.12 0.02 -0.61 0.00 0.00 0.00 178.15 177.64 1x8k h GLN 276 N 0.51 0.07 -0.83 2.37 5.75 -0.24 0.40 115.11 123.15 1x8k h GLN 276 Ca 0.14 -0.00 0.10 0.00 -0.15 0.00 0.00 58.65 58.74 1x8k h GLN 276 Cb -0.02 -0.02 -0.08 0.00 1.07 0.00 0.00 27.48 28.44 1x8k h GLN 276 CO -0.03 0.05 0.47 -0.09 -2.65 0.00 0.00 178.83 176.58 1x8k h ARG 277 N 0.07 0.75 -0.32 1.69 2.43 0.07 0.02 114.38 119.09 1x8k h ARG 277 Ca 0.06 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 1x8k h ARG 277 Cb 0.05 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 1x8k h ARG 277 CO -0.08 0.49 -0.15 -0.07 -1.51 0.00 0.00 179.97 178.66 1x8k h LEU 278 N 0.77 0.54 -0.15 3.80 3.38 -0.41 -2.58 115.31 120.66 1x8k h LEU 278 Ca 0.41 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 1x8k h LEU 278 Cb 0.41 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1x8k h LEU 278 CO -0.27 0.72 0.03 0.28 0.09 0.00 0.00 178.44 179.30 1x8k h SER 279 N 0.51 0.24 -0.88 -0.43 0.02 0.13 -2.95 113.55 110.18 1x8k h SER 279 Ca 0.09 -0.24 0.04 0.00 -0.84 0.00 0.00 61.79 60.84 1x8k h SER 279 Cb 0.55 -0.06 -0.06 0.00 0.14 0.00 0.00 62.40 62.97 1x8k h SER 279 CO 0.04 0.41 0.56 -0.33 -1.14 0.00 0.00 176.83 176.37 1x8k h GLU 280 N 0.05 1.04 -0.19 3.45 5.08 -1.04 -2.60 114.58 120.37 1x8k h GLU 280 Ca 0.05 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1x8k h GLU 280 Cb 0.27 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1x8k h GLU 280 CO 0.00 0.69 0.14 1.25 -1.00 0.00 0.00 179.01 180.08 1x8k h HIS 281 N 1.07 0.00 -0.37 4.33 2.76 -1.30 -1.90 115.15 119.74 1x8k h HIS 281 Ca 0.36 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.53 1x8k h HIS 281 Cb 0.06 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.02 1x8k h HIS 281 CO -0.02 0.00 0.00 1.28 -1.30 0.00 0.00 177.93 177.89 1x8k n LEU 282 N -4.47 3.39 -4.52 0.26 7.99 -1.00 -4.21 117.00 114.44 1x8k n LEU 282 Ca 0.01 -1.50 -0.53 0.00 -0.01 0.00 0.00 56.01 53.98 1x8k n LEU 282 Cb 0.27 -0.24 -0.06 0.00 -0.11 0.00 0.00 43.42 43.29 1x8k n LEU 282 CO 0.35 0.73 0.59 -3.20 -1.51 0.00 0.00 177.39 174.35 1x8k n ASN 283 N 1.42 0.49 -0.09 -1.43 4.05 -0.72 -4.75 115.26 114.24 1x8k n ASN 283 Ca 0.18 1.14 -0.08 0.00 0.45 0.00 0.00 54.58 56.28 1x8k n ASN 283 Cb 0.59 -1.06 -0.01 0.00 1.23 0.00 0.00 39.78 40.53 1x8k n ASN 283 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 177.26 174.36 1x8k h PHE 284 N 3.09 0.30 -0.25 1.20 3.57 -1.92 -0.69 116.94 122.24 1x8k h PHE 284 Ca -0.45 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 60.93 1x8k h PHE 284 Cb 1.39 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 1x8k h PHE 284 CO 0.54 0.17 -0.39 0.93 -2.23 0.00 0.00 178.31 177.33 1x8k h GLU 285 N 0.33 0.58 0.49 1.11 4.39 -1.98 0.02 114.58 119.53 1x8k h GLU 285 Ca 0.12 -0.29 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 1x8k h GLU 285 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1x8k h GLU 285 CO -0.08 0.88 -0.23 -0.22 -1.16 0.00 0.00 179.01 178.20 1x8k h LYS 286 N 0.48 -0.63 -0.74 2.33 3.64 -1.85 -2.94 116.57 116.86 1x8k h LYS 286 Ca 0.04 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 59.60 1x8k h LYS 286 Cb 0.90 0.14 -0.14 0.00 -0.41 0.00 0.00 32.23 32.72 1x8k h LYS 286 CO 0.08 -0.42 -0.31 0.35 -2.27 0.00 0.00 179.45 176.88 1x8k h PHE 287 N -0.76 -0.82 -1.01 1.91 3.57 -1.11 -0.99 116.94 117.73 1x8k h PHE 287 Ca -0.07 0.08 0.28 0.00 3.53 0.00 0.00 57.97 61.79 1x8k h PHE 287 Cb 0.50 0.47 -0.06 0.00 2.79 0.00 0.00 35.95 39.65 1x8k h PHE 287 CO 0.08 -0.38 0.70 -0.22 -2.23 0.00 0.00 178.31 176.26 1x8k h LYS 288 N -0.08 0.15 -0.65 1.11 3.64 -1.04 0.16 116.57 119.87 1x8k h LYS 288 Ca 0.30 -0.01 -0.29 0.00 -1.27 0.00 0.00 60.65 59.38 1x8k h LYS 288 Cb 0.57 -0.03 -0.17 0.00 -0.41 0.00 0.00 32.23 32.18 1x8k h LYS 288 CO -0.79 0.10 0.26 0.09 -2.27 0.00 0.00 179.45 176.84 1x8k n ASN 289 N -4.37 3.53 -4.50 4.20 3.02 -0.40 -4.83 115.26 111.91 1x8k n ASN 289 Ca 0.22 -3.54 -0.42 0.00 -0.03 0.00 0.00 54.58 50.81 1x8k n ASN 289 Cb 0.98 -0.72 -0.09 0.00 -0.61 0.00 0.00 39.78 39.34 1x8k n ASN 289 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1x8k s ASN 290 N -1.75 6.15 0.53 6.41 3.84 0.55 -4.97 114.94 125.70 1x8k s ASN 290 Ca 0.51 -0.57 0.21 0.00 0.21 0.00 0.00 52.86 53.22 1x8k s ASN 290 Cb 0.43 -2.19 1.34 0.00 -0.55 0.00 0.00 41.25 40.28 1x8k s ASN 290 CO 0.07 -0.44 2.07 1.23 -2.79 0.00 0.00 177.10 177.24 1x8k h GLY 291 N 8.80 0.00 2.00 1.21 0.00 -1.90 -1.59 103.07 111.59 1x8k h GLY 291 Ca -0.28 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1x8k h GLY 291 CO 0.73 0.00 -0.35 0.00 0.00 0.00 0.00 176.54 176.92 1x8k h ALA 292 N 1.86 1.00 0.00 3.60 0.00 -1.87 -3.35 119.26 120.50 1x8k h ALA 292 Ca 0.13 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1x8k h ALA 292 Cb 0.53 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1x8k h ALA 292 CO -0.00 0.43 -0.12 1.33 0.00 0.00 0.00 179.25 180.89 1x8k n VAL 293 N -3.51 0.00 0.46 0.00 0.24 -0.99 -1.79 118.33 112.74 1x8k n VAL 293 Ca -0.00 -0.44 0.10 0.00 -2.04 0.00 0.00 64.34 61.95 1x8k n VAL 293 Cb 0.49 0.99 0.26 0.00 -1.47 0.00 0.00 33.84 34.11 1x8k n VAL 293 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1x8k n ASN 294 N -1.06 2.79 -2.64 -1.34 0.23 -0.63 -4.93 115.26 107.67 1x8k n ASN 294 Ca 0.00 -1.95 -0.07 0.00 -0.53 0.00 0.00 54.58 52.04 1x8k n ASN 294 Cb 0.03 -0.29 -0.01 0.00 -2.08 0.00 0.00 39.78 37.43 1x8k n ASN 294 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 1x8k n MET 295 N 1.03 -2.70 0.00 -3.83 2.81 -1.26 -4.43 117.12 108.75 1x8k n MET 295 Ca 0.18 0.20 0.14 0.00 -1.81 0.00 0.00 57.70 56.41 1x8k n MET 295 Cb 0.46 -4.74 0.75 0.00 -0.71 0.00 0.00 33.22 28.98 1x8k n MET 295 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1x8k n GLU 296 N -2.74 0.49 -0.13 0.03 -0.58 -1.26 -2.33 120.64 114.12 1x8k n GLU 296 Ca -0.03 0.01 -0.01 0.00 -0.42 0.00 0.00 57.16 56.71 1x8k n GLU 296 Cb 0.53 -1.50 0.23 0.00 -0.57 0.00 0.00 31.44 30.13 1x8k n GLU 296 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 1x8k h ASP 297 N 0.00 0.75 0.01 1.62 2.03 -1.86 -2.99 116.42 115.98 1x8k h ASP 297 Ca 0.00 -0.09 -0.06 0.00 -0.73 0.00 0.00 57.03 56.15 1x8k h ASP 297 Cb 0.22 -0.19 -0.01 0.00 -0.83 0.00 0.00 39.33 38.52 1x8k h ASP 297 CO 0.00 0.68 -0.15 1.88 -1.03 0.00 0.00 179.24 180.61 1x8k h TYR 298 N 0.82 0.31 -0.80 4.15 -1.99 -1.85 -3.02 116.97 114.59 1x8k h TYR 298 Ca 0.20 -0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.88 1x8k h TYR 298 Cb 0.15 -0.09 -0.04 0.00 2.00 0.00 0.00 36.73 38.76 1x8k h TYR 298 CO 0.01 0.44 0.47 -0.09 -0.00 0.00 0.00 178.16 178.99 1x8k h ARG 299 N 0.27 1.09 -0.59 4.88 2.43 -1.66 -0.51 114.38 120.30 1x8k h ARG 299 Ca 0.05 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1x8k h ARG 299 Cb 0.43 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 1x8k h ARG 299 CO 0.03 0.77 0.36 1.49 -1.51 0.00 0.00 179.97 181.10 1x8k h GLU 300 N 1.11 0.79 -0.39 0.20 4.57 -1.62 -2.26 114.58 116.98 1x8k h GLU 300 Ca 0.29 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.39 1x8k h GLU 300 Cb -0.03 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.37 1x8k h GLU 300 CO -0.05 0.55 0.20 0.82 -1.18 0.00 0.00 179.01 179.35 1x8k h ILE 301 N 0.81 1.16 0.00 2.32 2.04 -1.13 -3.42 117.51 119.28 1x8k h ILE 301 Ca 0.21 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1x8k h ILE 301 Cb -0.04 0.73 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1x8k h ILE 301 CO -0.04 0.17 0.00 0.61 0.00 0.00 0.00 178.15 178.89 1x8k n GLY 302 N -0.94 1.69 0.88 5.37 0.00 -0.80 -1.74 105.19 109.66 1x8k n GLY 302 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1x8k n GLY 302 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1x8k n ILE 303 N -0.25 1.44 -5.03 -0.61 -5.35 -1.20 -4.90 119.36 103.45 1x8k n ILE 303 Ca 0.00 -1.24 -0.32 0.00 -0.27 0.00 0.00 62.75 60.91 1x8k n ILE 303 Cb 0.00 0.26 -0.14 0.00 -1.74 0.00 0.00 39.64 38.02 1x8k n ILE 303 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1x8k s LEU 304 N -1.57 2.49 0.34 7.28 1.43 -1.26 -4.64 118.68 122.74 1x8k s LEU 304 Ca 0.34 -0.30 -0.26 0.00 -1.03 0.00 0.00 54.13 52.87 1x8k s LEU 304 Cb 0.21 -1.48 -0.09 0.00 0.03 0.00 0.00 46.19 44.86 1x8k s LEU 304 CO 0.16 0.32 1.02 0.00 0.23 0.00 0.00 176.35 178.09 1x8k s ALA 305 N -0.60 3.22 0.47 4.21 0.00 -0.15 -4.95 121.76 123.96 1x8k s ALA 305 Ca 0.09 0.70 -0.22 0.00 0.00 0.00 0.00 51.96 52.52 1x8k s ALA 305 Cb -0.11 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.66 1x8k s ALA 305 CO 0.01 -0.06 0.90 -0.25 0.00 0.00 0.00 175.76 176.35 1x8k n ASP 306 N 0.54 0.70 0.00 0.00 8.00 -1.26 -2.93 116.55 121.60 1x8k n ASP 306 Ca 0.02 0.94 0.00 0.00 0.71 0.00 0.00 54.79 56.46 1x8k n ASP 306 Cb 0.48 -1.32 0.00 0.00 -0.02 0.00 0.00 41.12 40.27 1x8k n ASP 306 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x8k n GLY 307 N 1.33 2.36 3.83 0.44 0.00 -1.26 -5.01 105.19 106.88 1x8k n GLY 307 Ca 0.11 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.36 1x8k n GLY 307 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x8k s GLU 308 N 0.00 3.20 -0.05 1.61 0.41 -1.15 -5.09 118.70 117.63 1x8k s GLU 308 Ca 0.00 0.98 -0.16 0.00 -0.41 0.00 0.00 54.97 55.38 1x8k s GLU 308 Cb 0.00 -2.02 0.03 0.00 -1.78 0.00 0.00 34.13 30.36 1x8k s GLU 308 CO 0.00 -0.89 0.36 -1.01 -0.49 0.00 0.00 175.26 173.23 1x8k s HIS 309 N -2.90 -0.29 0.23 1.61 3.76 -1.26 -4.83 115.29 111.61 1x8k s HIS 309 Ca 0.59 0.56 -0.04 0.00 -0.15 0.00 0.00 55.06 56.01 1x8k s HIS 309 Cb -0.14 0.14 0.23 0.00 1.11 0.00 0.00 32.58 33.92 1x8k s HIS 309 CO 0.49 -0.36 1.69 0.35 -0.85 0.00 0.00 174.74 176.06 1x8k h PHE 310 N 4.25 0.93 -3.66 1.40 3.57 -1.94 -3.37 116.94 118.12 1x8k h PHE 310 Ca -0.29 -0.16 -0.70 0.00 3.53 0.00 0.00 57.97 60.35 1x8k h PHE 310 Cb 1.18 -0.24 -0.28 0.00 2.79 0.00 0.00 35.95 39.39 1x8k h PHE 310 CO 0.48 0.88 -0.59 0.42 -2.23 0.00 0.00 178.31 177.27 1x8k s ILE 311 N -4.87 3.90 0.00 1.41 1.01 -1.26 -5.03 121.20 116.35 1x8k s ILE 311 Ca -0.10 -1.11 0.00 0.00 0.00 0.00 0.00 60.65 59.44 1x8k s ILE 311 Cb 0.14 -3.21 0.00 0.00 0.01 0.00 0.00 42.46 39.40 1x8k s ILE 311 CO 0.83 -0.20 0.00 -1.14 0.00 0.00 0.00 174.94 174.43 1x8k n ARG 312 N 4.84 0.00 -0.10 2.79 0.63 -1.26 -4.96 116.66 118.60 1x8k n ARG 312 Ca -0.12 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.69 1x8k n ARG 312 Cb 0.45 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 33.23 1x8k n ARG 312 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1x8k n LYS 313 N 0.00 0.88 -2.38 -0.14 5.02 -1.26 -5.03 118.16 115.24 1x8k n LYS 313 Ca 0.00 0.05 -0.13 0.00 -2.02 0.00 0.00 58.31 56.21 1x8k n LYS 313 Cb 0.00 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 1x8k n LYS 313 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x8k n GLY 314 N 2.13 -0.14 3.62 0.72 0.00 -1.26 -5.04 105.19 105.22 1x8k n GLY 314 Ca -0.34 -0.31 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 1x8k n GLY 314 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x8k s LYS 315 N -4.81 2.04 -0.02 1.61 -0.14 -1.26 -5.05 119.74 112.12 1x8k s LYS 315 Ca 0.05 -1.75 0.01 0.00 -1.36 0.00 0.00 55.97 52.93 1x8k s LYS 315 Cb -0.02 -1.91 -0.03 0.00 -1.68 0.00 0.00 37.83 34.18 1x8k s LYS 315 CO 0.06 0.16 -0.03 0.00 -0.76 0.00 0.00 175.35 174.78 1x8k s ALA 316 N -2.52 3.14 0.00 5.17 0.00 -1.26 -4.65 121.76 121.64 1x8k s ALA 316 Ca 0.34 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.36 1x8k s ALA 316 Cb -0.00 -1.27 0.00 0.00 0.00 0.00 0.00 23.12 21.84 1x8k s ALA 316 CO 0.19 0.61 0.00 0.41 0.00 0.00 0.00 175.76 176.97 1x8k n GLY 317 N 1.70 0.54 0.15 0.00 0.00 -1.26 -4.94 105.19 101.38 1x8k n GLY 317 Ca -0.16 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.55 1x8k n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x8k h TRP 319 N 0.67 0.00 0.00 0.00 5.08 -1.92 -2.31 115.95 117.47 1x8k h TRP 319 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1x8k h TRP 319 Cb 0.15 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.31 1x8k h TRP 319 CO 0.02 0.27 0.07 0.00 -1.28 0.00 0.00 178.44 177.52 1x8k h ARG 320 N 0.00 0.00 0.00 0.12 3.08 -1.90 0.48 114.38 116.15 1x8k h ARG 320 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1x8k h ARG 320 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1x8k h ARG 320 CO 0.04 0.00 -0.18 -0.25 -1.07 0.00 0.00 179.97 178.50 1x8k n ASP 321 N -3.03 0.50 -0.02 7.04 8.00 -0.87 -4.17 116.55 124.00 1x8k n ASP 321 Ca -0.03 0.36 -0.01 0.00 0.71 0.00 0.00 54.79 55.83 1x8k n ASP 321 Cb 0.14 -0.39 -0.04 0.00 -0.02 0.00 0.00 41.12 40.81 1x8k n ASP 321 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1x8k n TYR 322 N -1.90 0.00 -3.11 1.24 4.02 0.07 -5.01 117.16 112.46 1x8k n TYR 322 Ca 0.06 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.55 1x8k n TYR 322 Cb 0.39 -0.19 -0.05 0.00 -0.02 0.00 0.00 39.34 39.48 1x8k n TYR 322 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1x8k s PHE 323 N -2.18 3.64 0.69 -0.72 0.40 -0.66 -4.88 117.98 114.26 1x8k s PHE 323 Ca -0.02 1.24 -0.03 0.00 -0.60 0.00 0.00 56.93 57.52 1x8k s PHE 323 Cb 0.02 -2.72 0.09 0.00 0.51 0.00 0.00 43.02 40.92 1x8k s PHE 323 CO 0.19 0.22 0.96 0.16 0.70 0.00 0.00 175.22 177.45 1x8k s ASP 324 N 0.28 4.61 0.15 1.36 3.84 -1.26 -4.82 116.67 120.84 1x8k s ASP 324 Ca 0.34 -0.03 -0.30 0.00 -0.00 0.00 0.00 52.55 52.56 1x8k s ASP 324 Cb -0.18 -0.52 -0.04 0.00 -1.38 0.00 0.00 42.92 40.79 1x8k s ASP 324 CO 0.18 -1.67 1.56 -0.33 -0.00 0.00 0.00 175.17 174.91 1x8k h GLU 325 N -0.46 -0.30 -0.56 2.11 3.07 -1.99 0.18 114.58 116.64 1x8k h GLU 325 Ca -0.40 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 58.53 1x8k h GLU 325 Cb 1.28 0.07 -0.05 0.00 -0.84 0.00 0.00 28.75 29.21 1x8k h GLU 325 CO 0.48 -0.20 0.29 0.93 -1.40 0.00 0.00 179.01 179.11 1x8k h GLU 326 N -0.31 0.54 -0.93 2.33 5.08 -2.01 -2.36 114.58 116.93 1x8k h GLU 326 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1x8k h GLU 326 Cb 0.57 -0.12 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 1x8k h GLU 326 CO -0.65 0.36 0.58 0.52 -1.00 0.00 0.00 179.01 178.82 1x8k h MET 327 N 0.56 1.25 -0.44 2.33 2.86 -1.75 -2.75 114.93 116.99 1x8k h MET 327 Ca 0.25 -0.10 -0.06 0.00 -2.06 0.00 0.00 59.70 57.72 1x8k h MET 327 Cb 0.15 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 1x8k h MET 327 CO -0.16 0.86 0.01 1.15 1.06 0.00 0.00 176.91 179.83 1x8k h THR 328 N 1.28 1.23 0.02 2.22 2.02 -0.15 -1.46 112.91 118.07 1x8k h THR 328 Ca 0.34 -0.93 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 1x8k h THR 328 Cb -0.09 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1x8k h THR 328 CO -0.07 0.33 -0.01 0.11 0.37 0.00 0.00 175.52 176.25 1x8k h LYS 329 N 0.68 -0.03 -0.68 6.66 1.79 -1.32 -2.58 116.57 121.08 1x8k h LYS 329 Ca 0.14 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.75 1x8k h LYS 329 Cb 0.40 0.01 -0.12 0.00 -1.58 0.00 0.00 32.23 30.94 1x8k h LYS 329 CO 0.01 0.44 -0.09 0.37 -1.08 0.00 0.00 179.45 179.10 1x8k h GLN 330 N -0.51 0.05 -0.67 3.15 4.15 -1.34 -0.60 115.11 119.34 1x8k h GLN 330 Ca -0.00 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.36 1x8k h GLN 330 Cb 0.48 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.13 1x8k h GLN 330 CO 0.01 0.03 0.21 0.00 -1.93 0.00 0.00 178.83 177.15 1x8k h ALA 331 N 1.66 1.12 -0.31 3.38 0.00 -1.27 -1.06 119.26 122.78 1x8k h ALA 331 Ca 0.35 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1x8k h ALA 331 Cb 0.56 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1x8k h ALA 331 CO -0.65 0.61 -0.21 1.49 0.00 0.00 0.00 179.25 180.48 1x8k h GLU 332 N 0.98 0.58 -0.13 0.00 4.81 -0.74 -0.21 114.58 119.86 1x8k h GLU 332 Ca 0.22 -0.21 -0.20 0.00 -0.13 0.00 0.00 59.36 59.04 1x8k h GLU 332 Cb 0.27 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1x8k h GLU 332 CO -0.01 0.75 -0.73 -0.22 -0.73 0.00 0.00 179.01 178.07 1x8k h LYS 333 N 0.52 0.63 0.02 1.92 3.64 -0.96 -1.76 116.57 120.58 1x8k h LYS 333 Ca 0.08 -0.50 -0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1x8k h LYS 333 Cb 0.65 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1x8k h LYS 333 CO 0.05 1.12 -0.01 2.35 -2.27 0.00 0.00 179.45 180.69 1x8k h TRP 334 N 0.43 -0.02 -0.58 1.91 7.01 -0.87 -1.05 115.95 122.78 1x8k h TRP 334 Ca -0.04 -0.00 -0.03 0.00 2.11 0.00 0.00 58.89 60.94 1x8k h TRP 334 Cb 1.33 0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 28.37 1x8k h TRP 334 CO 0.07 0.38 0.25 0.82 -2.79 0.00 0.00 178.44 177.17 1x8k h ILE 335 N -0.43 1.20 -0.40 2.65 2.04 -1.16 -2.13 117.51 119.29 1x8k h ILE 335 Ca -0.00 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1x8k h ILE 335 Cb 0.41 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 1x8k h ILE 335 CO 0.00 0.24 0.27 0.50 0.00 0.00 0.00 178.15 179.16 1x8k h LYS 336 N 0.82 0.53 -0.24 2.37 1.63 -1.25 -2.52 116.57 117.91 1x8k h LYS 336 Ca 0.20 -0.03 -0.15 0.00 -0.85 0.00 0.00 60.65 59.81 1x8k h LYS 336 Cb 0.13 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 1x8k h LYS 336 CO -0.02 0.35 -0.48 -0.44 -3.45 0.00 0.00 179.45 175.40 1x8k h ASP 337 N 0.54 0.71 0.96 4.20 3.32 -0.96 -2.21 116.42 122.98 1x8k h ASP 337 Ca 0.15 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1x8k h ASP 337 Cb -0.06 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.29 1x8k h ASP 337 CO -0.03 1.07 -0.01 0.59 -1.72 0.00 0.00 179.24 179.13 1x8k n ASN 338 N -4.00 0.01 -0.00 6.45 3.02 -0.82 -3.35 115.26 116.57 1x8k n ASN 338 Ca -0.03 0.44 0.06 0.00 -0.03 0.00 0.00 54.58 55.02 1x8k n ASN 338 Cb 0.57 -0.47 -0.08 0.00 -0.61 0.00 0.00 39.78 39.20 1x8k n ASN 338 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1x8k n LEU 339 N -1.49 0.28 -4.57 3.41 4.77 -0.96 -4.91 117.00 113.54 1x8k n LEU 339 Ca 0.07 -0.25 -0.52 0.00 -0.03 0.00 0.00 56.01 55.28 1x8k n LEU 339 Cb 0.33 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.37 1x8k n LEU 339 CO 0.27 0.07 0.77 1.17 -1.33 0.00 0.00 177.39 178.34 1x8k n LYS 340 N -1.59 0.96 -3.83 3.23 3.00 -0.84 -2.90 118.16 116.18 1x8k n LYS 340 Ca 0.00 0.34 -0.28 0.00 -0.00 0.00 0.00 58.31 58.37 1x8k n LYS 340 Cb 0.25 -1.90 0.04 0.00 0.00 0.00 0.00 35.03 33.41 1x8k n LYS 340 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1x8k n ASP 341 N 2.20 -4.94 -3.75 3.14 8.00 -1.26 -5.00 116.55 114.94 1x8k n ASP 341 Ca 0.18 -0.73 -0.10 0.00 0.71 0.00 0.00 54.79 54.84 1x8k n ASP 341 Cb 0.19 -4.15 -0.06 0.00 -0.02 0.00 0.00 41.12 37.08 1x8k n ASP 341 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1x8k s THR 342 N -3.32 0.10 -2.74 -3.53 -1.32 -1.14 -5.07 115.64 98.61 1x8k s THR 342 Ca 0.61 -0.82 0.25 0.00 -1.21 0.00 0.00 61.69 60.52 1x8k s THR 342 Cb -0.30 -1.14 0.34 0.00 -1.51 0.00 0.00 72.50 69.89 1x8k s THR 342 CO 0.81 -0.45 1.43 -0.90 -2.21 0.00 0.00 174.62 173.29 1x8k n ASP 343 N 0.14 2.57 -4.68 8.08 5.75 -1.26 -4.94 116.55 122.21 1x8k n ASP 343 Ca -0.17 -1.85 -0.42 0.00 -0.01 0.00 0.00 54.79 52.35 1x8k n ASP 343 Cb 0.62 -0.04 -0.03 0.00 -1.03 0.00 0.00 41.12 40.63 1x8k n ASP 343 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1x8k s LEU 344 N -1.89 4.39 -0.01 -2.12 2.96 -1.26 -4.99 118.68 115.75 1x8k s LEU 344 Ca 0.32 2.61 0.01 0.00 -0.22 0.00 0.00 54.13 56.86 1x8k s LEU 344 Cb 0.20 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 43.34 1x8k s LEU 344 CO 0.31 -0.97 -0.04 -0.13 -1.32 0.00 0.00 176.35 174.20 1x8k s ARG 345 N 3.09 0.45 -0.13 1.98 1.81 -1.26 -4.95 118.95 119.94 1x8k s ARG 345 Ca 0.79 -0.12 -0.23 0.00 -1.72 0.00 0.00 55.73 54.45 1x8k s ARG 345 Cb -0.42 -0.47 -0.03 0.00 -0.45 0.00 0.00 34.95 33.58 1x8k s ARG 345 CO 0.35 0.03 0.73 0.71 -0.68 0.00 0.00 175.30 176.44 1x8k s TYR 346 N 0.26 3.49 0.60 -0.53 1.51 -1.26 -4.96 117.35 116.46 1x8k s TYR 346 Ca -0.03 1.18 0.34 0.00 -1.01 0.00 0.00 57.07 57.56 1x8k s TYR 346 Cb -0.06 -2.87 1.99 0.00 -0.11 0.00 0.00 41.96 40.91 1x8k s TYR 346 CO -0.00 -0.07 2.28 -1.00 -1.11 0.00 0.00 175.55 175.65 1x8k h PRO 347 N 7.09 0.00 -0.22 -1.71 0.13 -2.01 -2.48 132.00 132.80 1x8k h PRO 347 Ca -0.35 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.70 1x8k h PRO 347 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1x8k h PRO 347 CO 0.78 0.01 -0.15 -0.91 -0.23 0.00 0.00 178.00 177.50 1x8k h ASN 348 N 0.00 0.52 0.00 1.44 4.21 -1.99 -3.53 115.58 116.23 1x8k h ASN 348 Ca -0.00 -0.44 0.00 0.00 1.21 0.00 0.00 56.30 57.07 1x8k h ASN 348 Cb 0.03 -0.14 0.00 0.00 -1.12 0.00 0.00 38.32 37.08 1x8k h ASN 348 CO 0.00 0.85 0.00 0.23 -1.29 0.00 0.00 177.43 177.22