#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fd6 s PHE 7 N 0.00 2.10 -0.05 0.00 5.36 -1.26 -5.11 117.98 119.02 3fd6 s PHE 7 Ca 0.00 -0.40 -0.02 0.00 -0.96 0.00 0.00 56.93 55.55 3fd6 s PHE 7 Cb 0.00 -1.33 0.03 0.00 -0.34 0.00 0.00 43.02 41.39 3fd6 s PHE 7 CO 0.00 0.01 0.09 0.54 -1.46 0.00 0.00 175.22 174.39 3fd6 s ASN 8 N -0.74 0.87 0.34 6.13 4.22 -1.26 -5.01 114.94 119.49 3fd6 s ASN 8 Ca 0.09 0.15 0.24 0.00 -2.14 0.00 0.00 52.86 51.20 3fd6 s ASN 8 Cb -0.09 -0.01 1.23 0.00 1.28 0.00 0.00 41.25 43.65 3fd6 s ASN 8 CO -0.00 -0.23 1.73 -0.65 -2.04 0.00 0.00 177.10 175.91 3fd6 h PRO 9 N 8.25 0.00 -0.17 3.55 0.11 -1.84 -3.28 132.00 138.61 3fd6 h PRO 9 Ca -0.17 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.96 3fd6 h PRO 9 Cb 1.12 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 3fd6 h PRO 9 CO 0.20 0.00 -0.27 1.05 -0.21 0.00 0.00 178.00 178.77 3fd6 h GLU 10 N 0.00 -0.20 0.00 1.05 9.09 -1.82 -2.88 114.58 119.82 3fd6 h GLU 10 Ca 0.00 0.01 -0.20 0.00 0.05 0.00 0.00 59.36 59.22 3fd6 h GLU 10 Cb 0.09 0.05 0.10 0.00 -1.65 0.00 0.00 28.75 27.34 3fd6 h GLU 10 CO 0.00 -0.14 0.06 -1.13 0.05 0.00 0.00 179.01 177.85 3fd6 n SER 11 N -3.98 -1.57 0.00 3.06 3.41 -1.24 -3.93 113.62 109.37 3fd6 n SER 11 Ca -0.02 -0.83 0.00 0.00 -0.26 0.00 0.00 58.87 57.76 3fd6 n SER 11 Cb 0.17 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.61 3fd6 n SER 11 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3fd6 n TYR 12 N -3.70 0.00 0.00 7.33 4.01 -1.26 -5.04 117.16 118.50 3fd6 n TYR 12 Ca 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 3fd6 n TYR 12 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 3fd6 n TYR 12 CO 0.00 0.00 0.00 1.47 -0.46 0.00 0.00 176.86 177.87 3fd6 n LEU 14 N 0.00 0.00 -4.57 7.72 -0.00 -1.09 -4.98 117.00 114.09 3fd6 n LEU 14 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 56.01 55.49 3fd6 n LEU 14 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 3fd6 n LEU 14 CO 0.00 0.00 0.77 0.47 -0.00 0.00 0.00 177.39 178.63 3fd6 n ASP 15 N 0.00 1.24 0.26 1.45 8.00 -1.26 -4.36 116.55 121.88 3fd6 n ASP 15 Ca 0.00 1.13 0.18 0.00 0.71 0.00 0.00 54.79 56.81 3fd6 n ASP 15 Cb 0.00 -1.15 0.89 0.00 -0.02 0.00 0.00 41.12 40.84 3fd6 n ASP 15 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 3fd6 h LYS 16 N 3.89 0.00 -0.00 -1.24 2.10 -1.94 0.53 116.57 119.91 3fd6 h LYS 16 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 3fd6 h LYS 16 Cb 1.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.68 3fd6 h LYS 16 CO 0.73 0.00 -0.04 -1.13 -2.00 0.00 0.00 179.45 177.01 3fd6 n SER 17 N -3.32 0.53 -4.70 7.07 3.41 -1.26 -4.76 113.62 110.58 3fd6 n SER 17 Ca 0.00 -0.91 -0.42 0.00 -0.26 0.00 0.00 58.87 57.28 3fd6 n SER 17 Cb 0.33 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.21 3fd6 n SER 17 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3fd6 s PHE 18 N -2.21 2.75 -0.01 7.33 5.36 0.19 -5.01 117.98 126.37 3fd6 s PHE 18 Ca 0.37 0.50 0.03 0.00 -0.96 0.00 0.00 56.93 56.88 3fd6 s PHE 18 Cb 0.21 -3.92 -0.01 0.00 -0.34 0.00 0.00 43.02 38.97 3fd6 s PHE 18 CO 0.41 -3.53 -0.11 1.03 -1.46 0.00 0.00 175.22 171.55 3fd6 s ARG 19 N 1.94 1.00 0.17 10.12 1.81 -1.26 -4.72 118.95 128.01 3fd6 s ARG 19 Ca 0.71 -0.40 0.09 0.00 -1.72 0.00 0.00 55.73 54.41 3fd6 s ARG 19 Cb -0.41 -0.95 -0.09 0.00 -0.45 0.00 0.00 34.95 33.06 3fd6 s ARG 19 CO 0.31 0.22 1.35 1.25 -0.68 0.00 0.00 175.30 177.76 3fd6 h LEU 20 N 5.99 0.00 0.00 2.53 5.85 -1.86 -3.21 115.31 124.60 3fd6 h LEU 20 Ca -0.33 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.39 3fd6 h LEU 20 Cb 1.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 3fd6 h LEU 20 CO 0.49 0.86 0.00 0.35 -0.34 0.00 0.00 178.44 179.80 3fd6 n THR 21 N -3.37 0.04 0.20 1.05 -2.24 -1.26 -2.72 114.28 105.97 3fd6 n THR 21 Ca 0.00 0.01 0.07 0.00 -2.27 0.00 0.00 64.05 61.86 3fd6 n THR 21 Cb 0.86 -0.55 0.37 0.00 -2.10 0.00 0.00 70.33 68.91 3fd6 n THR 21 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 3fd6 h ARG 22 N 0.00 0.00 -1.32 -0.78 2.43 -1.91 -3.31 114.38 109.49 3fd6 h ARG 22 Ca 0.00 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.84 3fd6 h ARG 22 Cb 0.15 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 29.54 3fd6 h ARG 22 CO 0.00 0.34 0.42 1.19 -1.51 0.00 0.00 179.97 180.41 3fd6 n PHE 23 N -3.52 1.65 -3.16 2.20 3.72 -1.10 -4.78 117.46 112.47 3fd6 n PHE 23 Ca -0.00 -1.78 -0.02 0.00 -0.05 0.00 0.00 57.45 55.60 3fd6 n PHE 23 Cb 0.48 -0.87 0.01 0.00 -0.94 0.00 0.00 39.48 38.16 3fd6 n PHE 23 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 3fd6 n THR 24 N 0.05 0.00 -3.81 4.37 5.66 -1.25 -1.36 114.28 117.95 3fd6 n THR 24 Ca 0.32 -0.19 -0.25 0.00 -3.05 0.00 0.00 64.05 60.89 3fd6 n THR 24 Cb 0.75 0.18 -0.17 0.00 -1.55 0.00 0.00 70.33 69.55 3fd6 n THR 24 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 3fd6 s GLU 25 N -2.02 0.90 0.01 1.09 0.41 -1.26 -5.07 118.70 112.76 3fd6 s GLU 25 Ca 0.03 -0.07 -0.24 0.00 -0.41 0.00 0.00 54.97 54.28 3fd6 s GLU 25 Cb -0.01 -1.30 -0.05 0.00 -1.78 0.00 0.00 34.13 30.99 3fd6 s GLU 25 CO 0.02 -0.33 0.73 -1.17 -0.49 0.00 0.00 175.26 174.02 3fd6 s LEU 26 N 1.87 4.41 -0.00 1.80 2.96 -1.26 -4.93 118.68 123.53 3fd6 s LEU 26 Ca 0.04 1.34 0.03 0.00 -0.22 0.00 0.00 54.13 55.32 3fd6 s LEU 26 Cb -0.13 -3.15 -0.01 0.00 0.50 0.00 0.00 46.19 43.40 3fd6 s LEU 26 CO -0.06 -0.01 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.33 3fd6 s LYS 27 N 0.14 0.71 0.54 1.98 1.02 -1.26 -5.03 119.74 117.83 3fd6 s LYS 27 Ca 0.37 -0.33 0.21 0.00 0.02 0.00 0.00 55.97 56.24 3fd6 s LYS 27 Cb -0.19 -0.68 1.40 0.00 -0.52 0.00 0.00 37.83 37.83 3fd6 s LYS 27 CO 0.21 0.19 2.11 0.78 -0.92 0.00 0.00 175.35 177.72 3fd6 h GLY 28 N 5.88 0.00 -2.94 -3.33 0.00 -1.95 0.11 103.07 100.84 3fd6 h GLY 28 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.02 3fd6 h GLY 28 CO 0.49 0.00 0.00 -0.37 0.00 0.00 0.00 176.54 176.66 3fd6 n THR 29 N -4.35 1.76 -3.23 4.70 5.66 -1.25 -4.53 114.28 113.04 3fd6 n THR 29 Ca 0.01 -1.20 0.06 0.00 -3.05 0.00 0.00 64.05 59.87 3fd6 n THR 29 Cb 0.25 0.16 -0.02 0.00 -1.55 0.00 0.00 70.33 69.18 3fd6 n THR 29 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3fd6 n GLY 30 N 1.11 -1.54 0.75 1.09 0.00 0.39 -4.58 105.19 102.41 3fd6 n GLY 30 Ca 0.25 -1.16 0.09 0.00 0.00 0.00 0.00 46.02 45.20 3fd6 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fd6 s LYS 32 N -1.38 3.97 0.10 0.00 1.02 -1.26 -4.96 119.74 117.23 3fd6 s LYS 32 Ca 0.23 1.83 -0.31 0.00 0.02 0.00 0.00 55.97 57.74 3fd6 s LYS 32 Cb 0.15 -2.60 -0.10 0.00 -0.52 0.00 0.00 37.83 34.77 3fd6 s LYS 32 CO 0.22 -0.39 1.81 0.08 -0.92 0.00 0.00 175.35 176.15 3fd6 s VAL 33 N -1.45 2.72 0.55 3.17 1.01 -1.26 -4.89 120.40 120.25 3fd6 s VAL 33 Ca 0.59 0.14 -0.20 0.00 0.00 0.00 0.00 61.98 62.51 3fd6 s VAL 33 Cb -0.30 -3.09 -0.06 0.00 0.00 0.00 0.00 36.38 32.93 3fd6 s VAL 33 CO 0.38 -0.00 1.09 -2.65 0.00 0.00 0.00 175.10 173.92 3fd6 n PRO 34 N 5.95 1.21 -0.30 2.72 -0.02 -1.26 -4.61 135.00 138.69 3fd6 n PRO 34 Ca 0.18 0.45 -0.07 0.00 -2.02 0.00 0.00 63.50 62.04 3fd6 n PRO 34 Cb 0.39 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 3fd6 n PRO 34 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3fd6 h GLN 35 N 0.95 -0.11 -0.13 -0.52 4.15 -1.98 -0.38 115.11 117.09 3fd6 h GLN 35 Ca -0.48 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 58.94 3fd6 h GLN 35 Cb 1.34 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.05 3fd6 h GLN 35 CO 0.54 -0.07 0.07 0.38 -1.93 0.00 0.00 178.83 177.81 3fd6 h ASP 36 N -0.11 0.16 -0.32 -0.69 2.03 -2.01 -1.24 116.42 114.24 3fd6 h ASP 36 Ca 0.23 -0.09 0.06 0.00 -0.73 0.00 0.00 57.03 56.50 3fd6 h ASP 36 Cb 0.54 -0.04 -0.06 0.00 -0.83 0.00 0.00 39.33 38.94 3fd6 h ASP 36 CO -0.83 0.20 -0.05 0.58 -1.03 0.00 0.00 179.24 178.11 3fd6 h VAL 37 N 0.10 0.71 -0.49 4.15 2.07 -1.80 -2.45 116.25 118.54 3fd6 h VAL 37 Ca 0.04 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.65 3fd6 h VAL 37 Cb 0.08 0.67 -0.09 0.00 -1.52 0.00 0.00 31.29 30.44 3fd6 h VAL 37 CO -0.01 0.01 -0.07 0.25 0.02 0.00 0.00 177.57 177.77 3fd6 h LEU 38 N 0.03 -0.35 -0.96 2.57 5.85 -0.51 -2.69 115.31 119.26 3fd6 h LEU 38 Ca 0.16 0.13 0.02 0.00 0.84 0.00 0.00 57.88 59.03 3fd6 h LEU 38 Cb 0.23 0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 3fd6 h LEU 38 CO -0.31 -0.12 0.63 1.56 -0.34 0.00 0.00 178.44 179.86 3fd6 h GLN 39 N 0.05 1.22 -0.00 1.25 7.50 -0.75 -1.53 115.11 122.85 3fd6 h GLN 39 Ca 0.24 -0.07 0.00 0.00 0.50 0.00 0.00 58.65 59.32 3fd6 h GLN 39 Cb 0.37 -0.28 0.00 0.00 0.05 0.00 0.00 27.48 27.62 3fd6 h GLN 39 CO -0.46 0.81 -0.01 1.63 -1.50 0.00 0.00 178.83 179.29 3fd6 n LYS 40 N -4.45 1.00 0.01 1.46 5.02 -1.03 -2.72 118.16 117.46 3fd6 n LYS 40 Ca 0.12 -0.18 -0.02 0.00 -2.02 0.00 0.00 58.31 56.21 3fd6 n LYS 40 Cb 0.06 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.47 3fd6 n LYS 40 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3fd6 n LEU 41 N -0.84 0.81 -0.00 -0.35 4.77 -0.59 -4.34 117.00 116.46 3fd6 n LEU 41 Ca 0.21 0.36 0.11 0.00 -0.03 0.00 0.00 56.01 56.67 3fd6 n LEU 41 Cb 0.18 0.11 0.14 0.00 -2.33 0.00 0.00 43.42 41.52 3fd6 n LEU 41 CO 0.19 0.21 0.30 0.18 -1.33 0.00 0.00 177.39 176.95 3fd6 n LEU 42 N -2.91 0.66 -0.35 2.23 4.77 -1.10 -4.54 117.00 115.75 3fd6 n LEU 42 Ca -0.12 -0.15 0.09 0.00 -0.03 0.00 0.00 56.01 55.79 3fd6 n LEU 42 Cb 0.90 -0.17 0.19 0.00 -2.33 0.00 0.00 43.42 42.00 3fd6 n LEU 42 CO 0.43 0.16 0.70 -0.62 -1.33 0.00 0.00 177.39 176.73 3fd6 n GLU 43 N -1.50 -0.09 0.00 3.23 1.02 -1.15 -1.56 120.64 120.59 3fd6 n GLU 43 Ca 0.05 1.53 0.00 0.00 -0.02 0.00 0.00 57.16 58.72 3fd6 n GLU 43 Cb 0.33 -2.32 0.00 0.00 -0.02 0.00 0.00 31.44 29.43 3fd6 n GLU 43 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 3fd6 n SER 44 N -5.57 0.00 -3.69 1.62 3.41 -1.26 -5.16 113.62 102.97 3fd6 n SER 44 Ca 0.18 0.94 -0.35 0.00 -0.26 0.00 0.00 58.87 59.38 3fd6 n SER 44 Cb 0.58 -0.44 0.03 0.00 -0.26 0.00 0.00 64.21 64.12 3fd6 n SER 44 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3fd6 n LEU 45 N -2.35 -3.47 0.00 1.04 4.77 -0.60 -5.25 117.00 111.14 3fd6 n LEU 45 Ca 0.00 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3fd6 n LEU 45 Cb 0.00 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.57 3fd6 n LEU 45 CO 0.00 -3.12 0.00 1.33 -1.33 0.00 0.00 177.39 174.27 3fd6 n VAL 60 N -3.00 0.00 -3.12 4.08 0.24 -1.26 -5.04 118.33 110.24 3fd6 n VAL 60 Ca -0.02 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 61.89 3fd6 n VAL 60 Cb 0.65 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.97 3fd6 n VAL 60 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3fd6 s MET 61 N -3.21 4.39 0.43 7.34 1.00 -1.26 -5.05 119.30 122.94 3fd6 s MET 61 Ca 0.00 0.92 -0.26 0.00 0.00 0.00 0.00 55.69 56.36 3fd6 s MET 61 Cb 0.00 -3.29 -0.08 0.00 0.00 0.00 0.00 34.83 31.46 3fd6 s MET 61 CO 0.00 0.50 1.38 -2.14 0.00 0.00 0.00 175.02 174.76 3fd6 s PRO 62 N -0.75 3.81 0.10 2.03 0.02 -1.26 -4.97 135.00 133.98 3fd6 s PRO 62 Ca 0.33 2.32 0.05 0.00 0.02 0.00 0.00 61.00 63.72 3fd6 s PRO 62 Cb -0.21 -2.70 -0.03 0.00 0.02 0.00 0.00 34.50 31.58 3fd6 s PRO 62 CO 0.22 -0.68 -0.12 0.50 -0.33 0.00 0.00 177.00 176.58 3fd6 s ARG 63 N -2.36 0.89 -0.14 5.54 3.52 -1.26 -4.70 118.95 120.44 3fd6 s ARG 63 Ca 0.59 -1.12 -0.05 0.00 -0.13 0.00 0.00 55.73 55.02 3fd6 s ARG 63 Cb -0.42 -0.73 0.07 0.00 -1.56 0.00 0.00 34.95 32.32 3fd6 s ARG 63 CO 0.54 0.14 0.26 -1.17 -0.81 0.00 0.00 175.30 174.26 3fd6 s LEU 64 N -2.25 -0.30 0.00 -0.88 2.96 -0.96 -4.92 118.68 112.34 3fd6 s LEU 64 Ca 0.04 0.51 0.00 0.00 -0.22 0.00 0.00 54.13 54.46 3fd6 s LEU 64 Cb -0.06 0.69 0.00 0.00 0.50 0.00 0.00 46.19 47.33 3fd6 s LEU 64 CO 0.02 -0.25 0.00 0.61 -1.32 0.00 0.00 176.35 175.41 3fd6 n GLY 65 N 5.35 2.54 3.75 7.98 0.00 -1.26 -0.76 105.19 122.79 3fd6 n GLY 65 Ca -0.06 -1.18 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 3fd6 n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fd6 s ILE 66 N 4.43 3.28 0.00 -0.61 1.01 -1.26 -4.43 121.20 123.62 3fd6 s ILE 66 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 60.65 61.81 3fd6 s ILE 66 Cb 0.00 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.73 3fd6 s ILE 66 CO 0.00 0.22 0.00 0.61 0.00 0.00 0.00 174.94 175.77 3fd6 n GLY 67 N 1.68 1.93 0.00 6.18 0.00 -1.26 -5.11 105.19 108.62 3fd6 n GLY 67 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.68 3fd6 n GLY 67 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3fd6 n MET 68 N 0.00 3.38 -0.05 1.61 2.81 -1.26 -5.01 117.12 118.59 3fd6 n MET 68 Ca 0.00 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.68 3fd6 n MET 68 Cb 0.00 0.00 -0.13 0.00 -0.71 0.00 0.00 33.22 32.38 3fd6 n MET 68 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3fd6 n ASP 69 N 0.00 2.05 -4.43 7.83 8.00 -1.26 -4.98 116.55 123.76 3fd6 n ASP 69 Ca 0.00 0.14 -0.21 0.00 0.71 0.00 0.00 54.79 55.43 3fd6 n ASP 69 Cb 0.00 -0.75 -0.10 0.00 -0.02 0.00 0.00 41.12 40.24 3fd6 n ASP 69 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3fd6 s THR 70 N -2.53 1.39 0.54 -3.53 -4.23 -1.26 -4.81 115.64 101.21 3fd6 s THR 70 Ca -0.27 -2.05 -0.12 0.00 -1.18 0.00 0.00 61.69 58.06 3fd6 s THR 70 Cb 0.08 -2.60 -0.06 0.00 1.34 0.00 0.00 72.50 71.26 3fd6 s THR 70 CO 0.69 -0.17 0.95 0.00 -0.54 0.00 0.00 174.62 175.55 3fd6 s VAL 72 N -2.84 0.50 -0.32 0.00 1.01 0.06 -3.78 120.40 115.02 3fd6 s VAL 72 Ca 0.55 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.42 3fd6 s VAL 72 Cb -0.10 -1.35 0.06 0.00 0.00 0.00 0.00 36.38 34.98 3fd6 s VAL 72 CO 0.42 -0.65 0.05 -0.63 0.00 0.00 0.00 175.10 174.30 3fd6 s ILE 73 N 1.82 3.21 0.12 2.22 -1.09 -0.33 -2.26 121.20 124.89 3fd6 s ILE 73 Ca 0.08 -1.42 -0.31 0.00 -2.23 0.00 0.00 60.65 56.77 3fd6 s ILE 73 Cb -0.17 -2.89 -0.10 0.00 -1.58 0.00 0.00 42.46 37.72 3fd6 s ILE 73 CO -0.28 -0.20 1.78 -2.84 -1.23 0.00 0.00 174.94 172.17 3fd6 s PRO 74 N 1.27 4.15 -0.01 2.79 0.02 -1.26 -0.39 135.00 141.57 3fd6 s PRO 74 Ca -0.03 2.54 -0.02 0.00 0.02 0.00 0.00 61.00 63.52 3fd6 s PRO 74 Cb -0.20 -3.54 -0.04 0.00 0.02 0.00 0.00 34.50 30.74 3fd6 s PRO 74 CO -0.01 -0.81 0.12 -0.51 -0.33 0.00 0.00 177.00 175.47 3fd6 s LEU 75 N 2.55 4.11 -1.10 -5.54 1.43 -0.67 -4.93 118.68 114.53 3fd6 s LEU 75 Ca 0.79 0.24 -0.18 0.00 -1.03 0.00 0.00 54.13 53.94 3fd6 s LEU 75 Cb -0.45 -2.40 -0.06 0.00 0.03 0.00 0.00 46.19 43.30 3fd6 s LEU 75 CO 0.35 0.27 2.05 0.54 0.23 0.00 0.00 176.35 179.79 3fd6 n ARG 76 N 1.11 2.15 -3.15 1.70 1.74 -1.26 -4.46 116.66 114.50 3fd6 n ARG 76 Ca -0.12 -2.25 0.05 0.00 -0.77 0.00 0.00 57.85 54.75 3fd6 n ARG 76 Cb 0.53 -3.13 -0.01 0.00 -1.02 0.00 0.00 32.46 28.82 3fd6 n ARG 76 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3fd6 s HIS 77 N 4.44 -0.79 -1.70 -1.55 4.02 -1.26 -5.05 115.29 113.40 3fd6 s HIS 77 Ca 0.53 0.74 -0.14 0.00 1.02 0.00 0.00 55.06 57.20 3fd6 s HIS 77 Cb 0.13 0.24 0.14 0.00 -1.02 0.00 0.00 32.58 32.08 3fd6 s HIS 77 CO 0.03 -0.44 0.36 0.41 1.02 0.00 0.00 174.74 176.12 3fd6 n GLY 78 N 5.40 -0.28 2.41 -2.22 0.00 -1.26 -1.13 105.19 108.10 3fd6 n GLY 78 Ca -0.02 0.11 -0.19 0.00 0.00 0.00 0.00 46.02 45.91 3fd6 n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fd6 n GLY 79 N -1.61 0.10 3.92 -0.02 0.00 -1.26 -5.01 105.19 101.31 3fd6 n GLY 79 Ca -0.05 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 3fd6 n GLY 79 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fd6 s LEU 80 N -5.27 3.72 -0.02 0.99 1.43 -0.29 -4.32 118.68 114.94 3fd6 s LEU 80 Ca 0.00 0.78 -0.05 0.00 -1.03 0.00 0.00 54.13 53.83 3fd6 s LEU 80 Cb 0.00 -3.71 0.00 0.00 0.03 0.00 0.00 46.19 42.52 3fd6 s LEU 80 CO 0.00 -0.52 0.11 -0.44 0.23 0.00 0.00 176.35 175.74 3fd6 s SER 81 N -4.10 -0.02 -0.15 2.29 0.01 -1.06 -1.67 113.70 109.01 3fd6 s SER 81 Ca 0.46 -0.04 -0.24 0.00 1.31 0.00 0.00 55.95 57.43 3fd6 s SER 81 Cb -0.10 0.22 -0.02 0.00 0.21 0.00 0.00 66.02 66.33 3fd6 s SER 81 CO 0.42 -0.22 0.77 -0.22 0.41 0.00 0.00 173.24 174.40 3fd6 s LEU 82 N -0.78 4.20 -0.22 2.44 2.96 0.48 -1.83 118.68 125.93 3fd6 s LEU 82 Ca -0.09 1.13 -0.00 0.00 -0.22 0.00 0.00 54.13 54.95 3fd6 s LEU 82 Cb -0.05 -3.15 0.03 0.00 0.50 0.00 0.00 46.19 43.52 3fd6 s LEU 82 CO 0.01 -0.31 -0.11 -0.69 -1.32 0.00 0.00 176.35 173.92 3fd6 s VAL 83 N 1.79 2.53 0.33 1.68 1.01 0.29 -1.19 120.40 126.85 3fd6 s VAL 83 Ca 0.37 -1.04 -0.08 0.00 0.00 0.00 0.00 61.98 61.23 3fd6 s VAL 83 Cb -0.17 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 33.99 3fd6 s VAL 83 CO 0.14 0.30 0.53 0.00 0.00 0.00 0.00 175.10 176.07 3fd6 s GLN 84 N 1.29 1.88 -0.11 2.72 -2.07 -1.25 0.47 119.66 122.59 3fd6 s GLN 84 Ca 0.01 -1.56 -0.30 0.00 -1.82 0.00 0.00 55.36 51.68 3fd6 s GLN 84 Cb -0.16 0.49 0.12 0.00 -1.09 0.00 0.00 33.01 32.37 3fd6 s GLN 84 CO -0.07 -0.80 1.00 -0.08 -1.32 0.00 0.00 175.29 174.01 3fd6 s THR 85 N -3.17 0.00 0.14 3.63 -1.32 -0.24 -2.91 115.64 111.77 3fd6 s THR 85 Ca 0.26 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.72 3fd6 s THR 85 Cb -0.01 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.94 3fd6 s THR 85 CO 0.16 0.00 0.07 0.28 -2.21 0.00 0.00 174.62 172.92 3fd6 s THR 86 N -2.03 0.10 -0.17 5.08 -1.32 -1.26 -0.89 115.64 115.15 3fd6 s THR 86 Ca 0.03 -1.89 -0.29 0.00 -1.21 0.00 0.00 61.69 58.32 3fd6 s THR 86 Cb -0.01 -2.06 0.11 0.00 -1.51 0.00 0.00 72.50 69.04 3fd6 s THR 86 CO -0.03 -0.43 0.94 -0.62 -2.21 0.00 0.00 174.62 172.26 3fd6 s ASP 87 N -3.05 -0.45 0.01 8.08 2.15 -0.99 -5.00 116.67 117.42 3fd6 s ASP 87 Ca 0.25 0.58 -0.06 0.00 0.43 0.00 0.00 52.55 53.75 3fd6 s ASP 87 Cb 0.07 0.49 -0.00 0.00 -0.30 0.00 0.00 42.92 43.18 3fd6 s ASP 87 CO 0.02 -0.35 0.11 -0.72 -0.17 0.00 0.00 175.17 174.05 3fd6 s TYR 88 N -0.83 0.09 0.29 -5.34 -0.85 -1.26 -1.35 117.35 108.10 3fd6 s TYR 88 Ca -0.03 -0.22 0.02 0.00 -0.52 0.00 0.00 57.07 56.33 3fd6 s TYR 88 Cb -0.01 -0.08 -0.01 0.00 0.38 0.00 0.00 41.96 42.24 3fd6 s TYR 88 CO 0.02 -0.27 0.33 0.44 -1.52 0.00 0.00 175.55 174.55 3fd6 n ILE 89 N 1.44 0.00 -4.41 -3.49 -5.35 0.59 -4.97 119.36 103.17 3fd6 n ILE 89 Ca -0.23 -1.77 -0.21 0.00 -0.27 0.00 0.00 62.75 60.27 3fd6 n ILE 89 Cb 0.55 0.98 -0.10 0.00 -1.74 0.00 0.00 39.64 39.33 3fd6 n ILE 89 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 3fd6 s TYR 90 N -3.18 1.91 0.04 4.28 2.02 -1.26 -1.63 117.35 119.52 3fd6 s TYR 90 Ca 0.29 -0.67 -0.32 0.00 -0.37 0.00 0.00 57.07 56.00 3fd6 s TYR 90 Cb 0.00 -1.05 -0.11 0.00 -0.40 0.00 0.00 41.96 40.40 3fd6 s TYR 90 CO 0.21 0.30 1.84 -2.30 -1.57 0.00 0.00 175.55 174.03 3fd6 n PRO 91 N -0.54 2.49 0.00 -1.71 -0.02 -1.26 -4.86 135.00 129.09 3fd6 n PRO 91 Ca -0.06 0.91 0.03 0.00 -2.02 0.00 0.00 63.50 62.36 3fd6 n PRO 91 Cb 0.63 -2.78 0.01 0.00 -0.02 0.00 0.00 33.50 31.34 3fd6 n PRO 91 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3fd6 n ILE 92 N 4.82 0.00 -4.11 4.25 -5.35 -1.26 -4.67 119.36 113.03 3fd6 n ILE 92 Ca 0.20 -0.47 -0.15 0.00 -0.27 0.00 0.00 62.75 62.06 3fd6 n ILE 92 Cb 0.34 1.10 -0.11 0.00 -1.74 0.00 0.00 39.64 39.23 3fd6 n ILE 92 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 3fd6 s VAL 93 N -0.75 0.78 -1.57 7.28 -7.23 -1.26 -4.79 120.40 112.85 3fd6 s VAL 93 Ca 0.06 -1.26 0.27 0.00 -1.81 0.00 0.00 61.98 59.25 3fd6 s VAL 93 Cb 0.05 -0.89 0.27 0.00 0.56 0.00 0.00 36.38 36.37 3fd6 s VAL 93 CO 0.11 -0.37 1.62 0.47 -0.31 0.00 0.00 175.10 176.62 3fd6 n ASP 94 N 1.23 0.76 -4.63 4.85 8.00 -1.26 -4.47 116.55 121.03 3fd6 n ASP 94 Ca -0.21 -0.65 -0.43 0.00 0.71 0.00 0.00 54.79 54.21 3fd6 n ASP 94 Cb 0.55 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.70 3fd6 n ASP 94 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3fd6 s ASP 95 N -2.60 6.88 -0.02 -2.24 -1.08 -1.26 -4.57 116.67 111.78 3fd6 s ASP 95 Ca 0.23 0.97 -0.24 0.00 -0.52 0.00 0.00 52.55 52.99 3fd6 s ASP 95 Cb 0.19 -2.51 -0.18 0.00 -1.46 0.00 0.00 42.92 38.96 3fd6 s ASP 95 CO 0.54 -0.81 1.14 -0.65 0.52 0.00 0.00 175.17 175.91 3fd6 h PRO 96 N 8.07 -0.17 -0.97 4.34 0.11 -1.93 -0.91 132.00 140.54 3fd6 h PRO 96 Ca -0.21 0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.98 3fd6 h PRO 96 Cb 1.07 0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.15 3fd6 h PRO 96 CO 1.00 0.25 0.63 -0.92 -0.21 0.00 0.00 178.00 178.74 3fd6 h TYR 97 N -0.68 1.13 0.00 0.65 3.20 -1.90 0.14 116.97 119.52 3fd6 h TYR 97 Ca -0.02 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 3fd6 h TYR 97 Cb 0.50 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.39 3fd6 h TYR 97 CO 0.07 0.57 -0.34 0.52 -1.64 0.00 0.00 178.16 177.34 3fd6 h MET 98 N 1.09 0.00 -0.12 1.82 2.86 -1.85 -1.72 114.93 117.00 3fd6 h MET 98 Ca 0.43 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.89 3fd6 h MET 98 Cb 0.23 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.89 3fd6 h MET 98 CO -0.18 0.34 -0.65 1.98 1.06 0.00 0.00 176.91 179.47 3fd6 h MET 99 N 0.00 0.48 0.00 1.72 1.85 0.52 -1.62 114.93 117.88 3fd6 h MET 99 Ca -0.00 -0.35 0.01 0.00 -0.61 0.00 0.00 59.70 58.75 3fd6 h MET 99 Cb 0.91 0.06 -0.02 0.00 0.43 0.00 0.00 31.60 32.98 3fd6 h MET 99 CO 0.04 0.97 -0.08 0.78 -0.40 0.00 0.00 176.91 178.23 3fd6 h GLY 100 N 1.15 -0.09 0.80 1.39 0.00 -0.41 -1.76 103.07 104.15 3fd6 h GLY 100 Ca -0.02 0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.45 3fd6 h GLY 100 CO 0.12 -0.09 0.44 3.21 0.00 0.00 0.00 176.54 180.23 3fd6 h ARG 101 N -0.14 0.82 -0.39 4.80 3.08 -1.24 -2.87 114.38 118.44 3fd6 h ARG 101 Ca 0.03 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 3fd6 h ARG 101 Cb 0.18 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 3fd6 h ARG 101 CO -0.08 0.54 -0.31 0.82 -1.07 0.00 0.00 179.97 179.88 3fd6 h ILE 102 N 0.85 1.28 -0.22 2.04 2.04 -1.23 -1.49 117.51 120.77 3fd6 h ILE 102 Ca 0.30 -1.48 -0.03 0.00 1.00 0.00 0.00 64.86 64.66 3fd6 h ILE 102 Cb 0.08 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 3fd6 h ILE 102 CO -0.14 0.49 -0.00 0.00 0.00 0.00 0.00 178.15 178.51 3fd6 h ALA 103 N 0.79 1.59 -0.02 1.87 0.00 -1.20 -1.87 119.26 120.41 3fd6 h ALA 103 Ca 0.07 -0.14 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 3fd6 h ALA 103 Cb 0.89 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.59 3fd6 h ALA 103 CO 0.08 0.31 -0.69 0.00 0.00 0.00 0.00 179.25 178.95 3fd6 h ALA 105 N 0.37 1.57 -0.24 0.00 0.00 -0.96 -2.37 119.26 117.63 3fd6 h ALA 105 Ca -0.08 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 3fd6 h ALA 105 Cb 1.37 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3fd6 h ALA 105 CO 0.14 0.28 -0.45 -0.97 0.00 0.00 0.00 179.25 178.25 3fd6 h ASN 106 N 0.96 0.64 -0.52 0.00 -1.24 -1.41 0.61 115.58 114.63 3fd6 h ASN 106 Ca 0.39 -0.30 -0.02 0.00 0.71 0.00 0.00 56.30 57.08 3fd6 h ASN 106 Cb 0.27 -0.18 -0.02 0.00 0.73 0.00 0.00 38.32 39.11 3fd6 h ASN 106 CO -0.15 1.00 0.25 0.58 -1.29 0.00 0.00 177.43 177.82 3fd6 h VAL 107 N 0.48 1.19 -0.13 2.57 2.07 -1.33 -3.13 116.25 117.97 3fd6 h VAL 107 Ca 0.03 -0.54 -0.19 0.00 0.82 0.00 0.00 66.70 66.82 3fd6 h VAL 107 Cb 0.97 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.34 3fd6 h VAL 107 CO 0.09 0.22 -0.69 -0.07 0.02 0.00 0.00 177.57 177.13 3fd6 h LEU 108 N 0.69 0.63 -1.74 2.57 3.38 -1.35 -3.25 115.31 116.25 3fd6 h LEU 108 Ca 0.18 -0.39 0.49 0.00 0.09 0.00 0.00 57.88 58.24 3fd6 h LEU 108 Cb 0.11 -0.19 -0.10 0.00 0.09 0.00 0.00 40.66 40.58 3fd6 h LEU 108 CO -0.02 1.14 1.11 -1.28 0.09 0.00 0.00 178.44 179.48 3fd6 h SER 109 N 0.38 0.10 -0.07 -0.43 0.87 -0.81 0.50 113.55 114.09 3fd6 h SER 109 Ca -0.02 0.06 -0.19 0.00 -1.23 0.00 0.00 61.79 60.41 3fd6 h SER 109 Cb 1.27 0.06 0.01 0.00 -0.44 0.00 0.00 62.40 63.30 3fd6 h SER 109 CO 0.13 -0.08 -0.69 0.44 -0.53 0.00 0.00 176.83 176.10 3fd6 h ASP 110 N 0.03 0.73 -0.76 6.23 3.32 -1.68 -2.97 116.42 121.33 3fd6 h ASP 110 Ca 0.85 -0.68 0.07 0.00 0.02 0.00 0.00 57.03 57.28 3fd6 h ASP 110 Cb 3.09 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 42.36 3fd6 h ASP 110 CO -0.19 1.31 0.44 0.25 -1.72 0.00 0.00 179.24 179.32 3fd6 h LEU 111 N 0.22 0.65 -1.07 1.55 5.85 -0.21 -2.09 115.31 120.22 3fd6 h LEU 111 Ca -0.06 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 3fd6 h LEU 111 Cb 1.34 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.28 3fd6 h LEU 111 CO 0.14 0.41 0.00 1.88 -0.34 0.00 0.00 178.44 180.53 3fd6 h TYR 112 N 0.78 0.00 0.00 1.25 0.05 -1.35 -2.51 116.97 115.20 3fd6 h TYR 112 Ca 0.34 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 59.06 3fd6 h TYR 112 Cb 0.23 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 3fd6 h TYR 112 CO -0.06 0.00 -0.31 0.00 -1.05 0.00 0.00 178.16 176.74 3fd6 h ALA 113 N 2.16 1.30 -0.47 3.88 0.00 -1.21 -2.94 119.26 121.99 3fd6 h ALA 113 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3fd6 h ALA 113 Cb 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3fd6 h ALA 113 CO 0.00 0.39 0.00 -1.33 0.00 0.00 0.00 179.25 178.31 3fd6 n MET 114 N -3.90 2.51 -1.41 0.00 2.81 -0.95 -4.25 117.12 111.93 3fd6 n MET 114 Ca -0.02 -1.85 -0.12 0.00 -1.81 0.00 0.00 57.70 53.90 3fd6 n MET 114 Cb 0.38 -1.54 -0.05 0.00 -0.71 0.00 0.00 33.22 31.30 3fd6 n MET 114 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3fd6 n GLY 115 N 1.07 1.23 3.45 3.03 0.00 -1.11 0.33 105.19 113.19 3fd6 n GLY 115 Ca 0.17 -0.46 -0.44 0.00 0.00 0.00 0.00 46.02 45.30 3fd6 n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fd6 s VAL 116 N -2.46 4.88 -0.22 1.61 1.01 -1.16 -4.57 120.40 119.48 3fd6 s VAL 116 Ca 0.00 -0.43 0.18 0.00 0.00 0.00 0.00 61.98 61.73 3fd6 s VAL 116 Cb 0.00 -4.28 0.08 0.00 0.00 0.00 0.00 36.38 32.18 3fd6 s VAL 116 CO 0.00 -0.77 1.31 0.71 0.00 0.00 0.00 175.10 176.35 3fd6 h THR 117 N 5.86 0.49 -3.04 3.92 1.35 -1.88 -3.37 112.91 116.25 3fd6 h THR 117 Ca -0.27 -1.75 -0.60 0.00 -0.55 0.00 0.00 66.41 63.24 3fd6 h THR 117 Cb 1.10 2.14 -0.04 0.00 -1.73 0.00 0.00 68.15 69.61 3fd6 h THR 117 CO 0.95 0.28 -0.35 -1.61 -0.25 0.00 0.00 175.52 174.54 3fd6 s GLU 118 N -3.06 3.60 -0.16 4.72 0.41 -1.26 -5.03 118.70 117.92 3fd6 s GLU 118 Ca 0.03 -0.10 -0.01 0.00 -0.41 0.00 0.00 54.97 54.49 3fd6 s GLU 118 Cb 0.07 -2.97 0.04 0.00 -1.78 0.00 0.00 34.13 29.50 3fd6 s GLU 118 CO 0.75 0.56 -0.05 0.00 -0.49 0.00 0.00 175.26 176.02 3fd6 h ASP 120 N 8.12 0.00 -3.86 0.00 3.32 -1.76 -3.41 116.42 118.84 3fd6 h ASP 120 Ca -0.24 -0.01 0.14 0.00 0.02 0.00 0.00 57.03 56.94 3fd6 h ASP 120 Cb 1.11 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.42 3fd6 h ASP 120 CO 0.40 0.00 0.67 0.21 -1.72 0.00 0.00 179.24 178.81 3fd6 s ASN 121 N -5.53 -0.27 0.12 6.45 2.47 -1.16 -4.89 114.94 112.13 3fd6 s ASN 121 Ca 0.08 0.27 0.09 0.00 0.42 0.00 0.00 52.86 53.72 3fd6 s ASN 121 Cb 0.08 0.22 -0.04 0.00 -1.45 0.00 0.00 41.25 40.06 3fd6 s ASN 121 CO 0.65 -0.26 -0.23 -0.04 -3.72 0.00 0.00 177.10 173.50 3fd6 s MET 122 N -1.21 1.24 0.15 0.43 -1.94 -0.19 -2.94 119.30 114.84 3fd6 s MET 122 Ca 0.02 -1.25 0.11 0.00 -1.71 0.00 0.00 55.69 52.86 3fd6 s MET 122 Cb -0.01 -1.58 -0.04 0.00 2.01 0.00 0.00 34.83 35.21 3fd6 s MET 122 CO -0.02 0.37 -0.26 -0.51 -0.01 0.00 0.00 175.02 174.59 3fd6 s LEU 123 N -2.02 2.36 -0.02 -0.03 1.43 -1.03 -1.26 118.68 118.11 3fd6 s LEU 123 Ca 0.10 -0.79 -0.00 0.00 -1.03 0.00 0.00 54.13 52.41 3fd6 s LEU 123 Cb -0.10 -1.19 -0.04 0.00 0.03 0.00 0.00 46.19 44.90 3fd6 s LEU 123 CO 0.05 0.15 0.04 -0.32 0.23 0.00 0.00 176.35 176.51 3fd6 s MET 124 N -2.28 2.95 -0.19 1.70 -2.45 -0.17 -1.27 119.30 117.59 3fd6 s MET 124 Ca 0.16 -0.51 -0.02 0.00 -1.25 0.00 0.00 55.69 54.07 3fd6 s MET 124 Cb -0.09 -2.78 0.00 0.00 1.25 0.00 0.00 34.83 33.20 3fd6 s MET 124 CO 0.07 0.65 -0.11 -0.51 1.05 0.00 0.00 175.02 176.17 3fd6 s LEU 125 N -1.53 2.60 -0.05 4.11 1.43 0.23 -2.00 118.68 123.47 3fd6 s LEU 125 Ca 0.20 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.83 3fd6 s LEU 125 Cb -0.12 -1.63 0.02 0.00 0.03 0.00 0.00 46.19 44.50 3fd6 s LEU 125 CO 0.11 0.02 -0.04 -0.76 0.23 0.00 0.00 176.35 175.90 3fd6 s LEU 126 N 1.24 1.24 -0.07 1.79 1.43 -0.40 -0.88 118.68 123.03 3fd6 s LEU 126 Ca 0.03 -0.13 0.05 0.00 -1.03 0.00 0.00 54.13 53.05 3fd6 s LEU 126 Cb -0.14 -0.47 -0.01 0.00 0.03 0.00 0.00 46.19 45.61 3fd6 s LEU 126 CO -0.05 -0.07 -0.23 -0.83 0.23 0.00 0.00 176.35 175.40 3fd6 s GLY 127 N 1.06 1.22 -0.16 -3.19 0.00 -0.36 -1.77 107.32 104.12 3fd6 s GLY 127 Ca -0.09 -0.94 -0.09 0.00 0.00 0.00 0.00 44.72 43.60 3fd6 s GLY 127 CO -0.01 -0.49 0.14 0.14 0.00 0.00 0.00 173.10 172.89 3fd6 s VAL 128 N 0.03 5.45 0.19 1.40 1.01 -0.60 -1.33 120.40 126.55 3fd6 s VAL 128 Ca -0.08 0.22 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 3fd6 s VAL 128 Cb -0.14 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.70 3fd6 s VAL 128 CO 0.05 0.52 1.37 -0.55 0.00 0.00 0.00 175.10 176.49 3fd6 s SER 129 N -0.28 6.81 0.00 3.32 0.15 -1.22 -1.19 113.70 121.30 3fd6 s SER 129 Ca 0.12 2.46 0.16 0.00 0.70 0.00 0.00 55.95 59.38 3fd6 s SER 129 Cb -0.12 -2.61 0.95 0.00 -1.71 0.00 0.00 66.02 62.54 3fd6 s SER 129 CO 0.01 -0.61 1.38 -0.46 1.20 0.00 0.00 173.24 174.76 3fd6 n ASN 130 N 2.88 0.00 -0.12 5.45 0.23 0.38 -2.37 115.26 121.71 3fd6 n ASN 130 Ca 0.08 -0.66 0.11 0.00 -0.53 0.00 0.00 54.58 53.57 3fd6 n ASN 130 Cb 0.42 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.12 3fd6 n ASN 130 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3fd6 n LYS 131 N -0.93 0.30 -3.58 -3.83 5.02 -1.26 -4.90 118.16 108.98 3fd6 n LYS 131 Ca 0.12 -0.23 -0.40 0.00 -2.02 0.00 0.00 58.31 55.78 3fd6 n LYS 131 Cb 0.05 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.46 3fd6 n LYS 131 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fd6 s MET 132 N -2.86 3.42 0.99 1.97 0.23 -1.00 -5.07 119.30 116.97 3fd6 s MET 132 Ca 0.12 -0.69 -0.16 0.00 -1.03 0.00 0.00 55.69 53.93 3fd6 s MET 132 Cb 0.17 -3.72 -0.05 0.00 -1.53 0.00 0.00 34.83 29.70 3fd6 s MET 132 CO 0.76 -0.44 -0.27 0.25 -2.03 0.00 0.00 175.02 173.29 3fd6 n THR 133 N 5.06 0.00 -0.32 3.16 -2.24 -1.26 -4.61 114.28 114.07 3fd6 n THR 133 Ca -0.13 -0.31 -0.03 0.00 -2.27 0.00 0.00 64.05 61.32 3fd6 n THR 133 Cb 0.49 -0.33 0.12 0.00 -2.10 0.00 0.00 70.33 68.52 3fd6 n THR 133 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3fd6 h ASP 134 N -1.35 1.08 -0.09 3.42 3.32 -1.99 -2.11 116.42 118.68 3fd6 h ASP 134 Ca -0.44 -0.07 0.02 0.00 0.02 0.00 0.00 57.03 56.55 3fd6 h ASP 134 Cb 1.31 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 3fd6 h ASP 134 CO 0.29 0.84 -0.02 0.03 -1.72 0.00 0.00 179.24 178.66 3fd6 h ARG 135 N 1.23 0.00 -0.82 3.56 -0.00 -1.99 -2.24 114.38 114.12 3fd6 h ARG 135 Ca 0.32 -0.00 0.06 0.00 -0.50 0.00 0.00 59.98 59.86 3fd6 h ARG 135 Cb -0.02 -0.00 -0.05 0.00 0.00 0.00 0.00 29.97 29.89 3fd6 h ARG 135 CO -0.06 0.00 0.54 0.93 0.00 0.00 0.00 179.97 181.38 3fd6 h GLU 136 N 0.00 0.88 0.79 0.04 5.08 -1.82 -2.52 114.58 117.03 3fd6 h GLU 136 Ca 0.05 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 3fd6 h GLU 136 Cb 0.07 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.13 3fd6 h GLU 136 CO -0.10 0.58 -0.38 -0.09 -1.00 0.00 0.00 179.01 178.03 3fd6 h ARG 137 N 0.91 -1.02 0.00 2.33 2.43 -0.97 0.14 114.38 118.20 3fd6 h ARG 137 Ca 0.35 0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 3fd6 h ARG 137 Cb 0.21 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 3fd6 h ARG 137 CO -0.12 -0.68 0.00 -0.25 -1.51 0.00 0.00 179.97 177.41 3fd6 n ASP 138 N -5.48 0.00 -0.07 -3.80 8.00 -0.88 -0.75 116.55 113.56 3fd6 n ASP 138 Ca -0.13 -0.27 -0.08 0.00 0.71 0.00 0.00 54.79 55.01 3fd6 n ASP 138 Cb 0.42 -0.14 -0.09 0.00 -0.02 0.00 0.00 41.12 41.29 3fd6 n ASP 138 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3fd6 n LYS 139 N -1.14 1.25 -0.06 -1.24 4.01 -0.96 -4.66 118.16 115.36 3fd6 n LYS 139 Ca 0.11 0.04 -0.22 0.00 -0.51 0.00 0.00 58.31 57.73 3fd6 n LYS 139 Cb 0.10 -1.32 -0.13 0.00 -0.51 0.00 0.00 35.03 33.17 3fd6 n LYS 139 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 3fd6 n VAL 140 N -2.69 1.64 0.15 -0.18 0.31 0.50 -4.23 118.33 113.83 3fd6 n VAL 140 Ca -0.24 -0.49 0.02 0.00 -0.01 0.00 0.00 64.34 63.63 3fd6 n VAL 140 Cb 0.86 -1.73 0.39 0.00 -0.91 0.00 0.00 33.84 32.44 3fd6 n VAL 140 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 3fd6 h MET 141 N -0.27 0.13 -0.22 5.55 2.86 -1.11 -2.21 114.93 119.66 3fd6 h MET 141 Ca -0.48 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.14 3fd6 h MET 141 Cb 1.82 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 33.45 3fd6 h MET 141 CO -0.07 0.36 0.11 -1.35 1.06 0.00 0.00 176.91 177.02 3fd6 h PRO 142 N 0.12 0.23 -0.69 -0.22 0.11 -1.77 -2.19 132.00 127.59 3fd6 h PRO 142 Ca 0.02 -0.01 0.14 0.00 0.11 0.00 0.00 66.00 66.26 3fd6 h PRO 142 Cb 0.48 -0.05 -0.10 0.00 0.11 0.00 0.00 31.00 31.43 3fd6 h PRO 142 CO 0.03 0.15 0.15 -0.07 -0.21 0.00 0.00 178.00 178.05 3fd6 h LEU 143 N 0.24 -0.02 -0.44 2.35 3.38 -1.58 0.12 115.31 119.36 3fd6 h LEU 143 Ca 0.09 0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 3fd6 h LEU 143 Cb 0.02 0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 3fd6 h LEU 143 CO -0.06 -0.03 0.03 0.40 0.09 0.00 0.00 178.44 178.87 3fd6 h ILE 144 N 0.25 1.26 -0.28 1.22 2.04 -1.35 -2.27 117.51 118.38 3fd6 h ILE 144 Ca 0.38 -0.98 -0.02 0.00 1.00 0.00 0.00 64.86 65.24 3fd6 h ILE 144 Cb 0.63 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3fd6 h ILE 144 CO -0.49 0.34 0.09 0.40 0.00 0.00 0.00 178.15 178.49 3fd6 h ILE 145 N 0.60 1.20 -0.65 -0.67 2.04 -0.70 -0.97 117.51 118.36 3fd6 h ILE 145 Ca 0.13 -0.63 -0.07 0.00 1.00 0.00 0.00 64.86 65.28 3fd6 h ILE 145 Cb 0.45 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 3fd6 h ILE 145 CO 0.02 0.21 0.11 -0.61 0.00 0.00 0.00 178.15 177.88 3fd6 h GLN 146 N 0.29 1.06 0.10 2.37 5.75 -0.82 0.11 115.11 123.97 3fd6 h GLN 146 Ca 0.09 -0.27 0.01 0.00 -0.15 0.00 0.00 58.65 58.33 3fd6 h GLN 146 Cb 0.24 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.64 3fd6 h GLN 146 CO -0.00 0.97 -0.16 0.78 -2.65 0.00 0.00 178.83 177.77 3fd6 h GLY 147 N 1.05 -0.29 0.43 2.39 0.00 -1.30 0.31 103.07 105.67 3fd6 h GLY 147 Ca 0.20 0.18 0.07 0.00 0.00 0.00 0.00 47.33 47.78 3fd6 h GLY 147 CO 0.01 -0.16 0.05 -2.75 0.00 0.00 0.00 176.54 173.69 3fd6 h PHE 148 N -0.31 0.07 -0.98 5.60 3.57 -0.92 -0.73 116.94 123.24 3fd6 h PHE 148 Ca 0.02 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.58 3fd6 h PHE 148 Cb 0.33 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.04 3fd6 h PHE 148 CO -0.16 -0.03 0.64 -0.22 -2.23 0.00 0.00 178.31 176.31 3fd6 h LYS 149 N 0.17 1.21 -0.33 1.11 3.64 -0.50 -1.81 116.57 120.05 3fd6 h LYS 149 Ca 0.20 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.41 3fd6 h LYS 149 Cb 0.26 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 3fd6 h LYS 149 CO -0.29 0.80 -0.19 -0.44 -2.27 0.00 0.00 179.45 177.06 3fd6 h ASP 150 N 1.25 0.62 -0.09 4.20 3.32 0.40 -2.28 116.42 123.84 3fd6 h ASP 150 Ca 0.38 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3fd6 h ASP 150 Cb -0.02 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.36 3fd6 h ASP 150 CO -0.11 0.81 -0.03 0.00 -1.72 0.00 0.00 179.24 178.19 3fd6 h ALA 151 N 1.24 0.12 -0.64 3.45 0.00 -0.79 -2.65 119.26 120.00 3fd6 h ALA 151 Ca 0.09 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 54.86 3fd6 h ALA 151 Cb 0.63 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 3fd6 h ALA 151 CO 0.04 -0.13 0.43 0.00 0.00 0.00 0.00 179.25 179.59 3fd6 h ALA 152 N 0.66 1.93 -0.14 0.00 0.00 -1.30 -2.05 119.26 118.35 3fd6 h ALA 152 Ca 0.02 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 3fd6 h ALA 152 Cb 0.45 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.13 3fd6 h ALA 152 CO 0.01 -0.06 -0.50 1.49 0.00 0.00 0.00 179.25 180.19 3fd6 h GLU 153 N 0.51 0.59 -0.92 0.00 4.81 -1.33 0.24 114.58 118.48 3fd6 h GLU 153 Ca 0.29 -0.45 0.19 0.00 -0.13 0.00 0.00 59.36 59.27 3fd6 h GLU 153 Cb 0.48 0.08 -0.11 0.00 0.63 0.00 0.00 28.75 29.83 3fd6 h GLU 153 CO -0.09 1.07 0.49 1.49 -0.73 0.00 0.00 179.01 181.23 3fd6 h GLU 154 N 0.24 0.56 -0.01 1.92 4.81 -1.12 0.12 114.58 121.10 3fd6 h GLU 154 Ca -0.02 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3fd6 h GLU 154 Cb 1.13 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.38 3fd6 h GLU 154 CO 0.11 0.37 0.00 0.00 -0.73 0.00 0.00 179.01 178.76 3fd6 n ALA 155 N -2.41 2.64 -2.21 2.92 0.00 -0.80 -4.89 120.51 115.76 3fd6 n ALA 155 Ca 0.21 -0.19 -0.14 0.00 0.00 0.00 0.00 53.44 53.33 3fd6 n ALA 155 Cb 0.58 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.63 3fd6 n ALA 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fd6 n GLY 156 N 0.92 -0.09 1.11 0.00 0.00 0.43 -4.61 105.19 102.95 3fd6 n GLY 156 Ca 0.19 -0.31 -0.09 0.00 0.00 0.00 0.00 46.02 45.81 3fd6 n GLY 156 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3fd6 n THR 157 N -3.92 0.00 -3.95 2.61 5.66 0.79 -4.83 114.28 110.64 3fd6 n THR 157 Ca -0.16 -0.78 -0.09 0.00 -3.05 0.00 0.00 64.05 59.97 3fd6 n THR 157 Cb 0.61 0.27 -0.05 0.00 -1.55 0.00 0.00 70.33 69.61 3fd6 n THR 157 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3fd6 s SER 158 N -1.83 -0.11 -0.27 1.09 1.04 -1.26 -3.63 113.70 108.72 3fd6 s SER 158 Ca 0.06 -0.84 -0.10 0.00 0.48 0.00 0.00 55.95 55.56 3fd6 s SER 158 Cb 0.00 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 3fd6 s SER 158 CO 0.04 -1.11 0.16 -0.69 0.98 0.00 0.00 173.24 172.62 3fd6 s VAL 159 N -3.98 5.06 -0.01 5.02 1.01 -1.26 -1.03 120.40 125.21 3fd6 s VAL 159 Ca 0.19 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.27 3fd6 s VAL 159 Cb -0.01 -3.40 0.01 0.00 0.00 0.00 0.00 36.38 32.99 3fd6 s VAL 159 CO 0.06 0.28 0.89 0.35 0.00 0.00 0.00 175.10 176.69 3fd6 n THR 160 N 4.94 0.80 -3.59 3.92 -2.24 -0.39 -4.99 114.28 112.74 3fd6 n THR 160 Ca -0.15 -0.82 0.02 0.00 -2.27 0.00 0.00 64.05 60.83 3fd6 n THR 160 Cb 0.52 0.58 -0.01 0.00 -2.10 0.00 0.00 70.33 69.32 3fd6 n THR 160 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3fd6 s GLY 161 N -0.87 -0.40 0.00 3.38 0.00 -1.25 -5.05 107.32 103.13 3fd6 s GLY 161 Ca 0.02 1.26 0.00 0.00 0.00 0.00 0.00 44.72 46.00 3fd6 s GLY 161 CO 0.00 0.33 0.00 0.61 0.00 0.00 0.00 173.10 174.04 3fd6 n GLY 162 N -0.34 -0.62 3.37 0.20 0.00 -1.26 -1.00 105.19 105.55 3fd6 n GLY 162 Ca -0.05 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 3fd6 n GLY 162 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3fd6 s GLN 163 N -0.91 0.54 -0.10 1.61 2.00 -0.85 -4.96 119.66 117.00 3fd6 s GLN 163 Ca 0.00 0.71 -0.03 0.00 -2.00 0.00 0.00 55.36 54.04 3fd6 s GLN 163 Cb 0.00 0.23 0.04 0.00 0.80 0.00 0.00 33.01 34.08 3fd6 s GLN 163 CO 0.00 -0.08 0.06 0.99 -0.50 0.00 0.00 175.29 175.75 3fd6 s THR 164 N 0.47 0.04 0.07 -0.34 2.01 -1.25 -1.28 115.64 115.37 3fd6 s THR 164 Ca -0.02 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.12 3fd6 s THR 164 Cb -0.04 -0.42 -0.03 0.00 0.01 0.00 0.00 72.50 72.02 3fd6 s THR 164 CO -0.02 0.03 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.17 3fd6 s VAL 165 N 2.10 0.68 0.35 3.82 1.01 -0.73 -5.02 120.40 122.62 3fd6 s VAL 165 Ca 0.04 -1.48 -0.25 0.00 0.00 0.00 0.00 61.98 60.28 3fd6 s VAL 165 Cb -0.14 -1.13 -0.09 0.00 0.00 0.00 0.00 36.38 35.02 3fd6 s VAL 165 CO -0.06 -0.58 1.01 -0.76 0.00 0.00 0.00 175.10 174.71 3fd6 s LEU 166 N -2.25 4.27 0.06 3.92 2.01 -1.26 -1.55 118.68 123.88 3fd6 s LEU 166 Ca 0.01 1.97 -0.16 0.00 0.01 0.00 0.00 54.13 55.96 3fd6 s LEU 166 Cb -0.03 -4.05 0.03 0.00 0.01 0.00 0.00 46.19 42.14 3fd6 s LEU 166 CO -0.01 -0.27 0.37 0.21 1.01 0.00 0.00 176.35 177.66 3fd6 s ASN 167 N -1.52 -0.22 0.53 2.29 2.47 -0.33 -4.88 114.94 113.28 3fd6 s ASN 167 Ca 0.53 -0.13 0.19 0.00 0.42 0.00 0.00 52.86 53.87 3fd6 s ASN 167 Cb -0.21 0.41 1.33 0.00 -1.45 0.00 0.00 41.25 41.33 3fd6 s ASN 167 CO 0.27 -0.69 2.12 -0.65 -3.72 0.00 0.00 177.10 174.43 3fd6 h PRO 168 N 2.93 0.00 -6.19 0.43 0.11 -1.95 0.11 132.00 127.44 3fd6 h PRO 168 Ca -0.32 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.28 3fd6 h PRO 168 Cb 1.21 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.27 3fd6 h PRO 168 CO 0.45 0.00 -0.52 -1.58 -0.21 0.00 0.00 178.00 176.14 3fd6 s TRP 169 N -5.03 2.98 -0.04 0.65 0.51 -1.26 -4.21 118.94 112.54 3fd6 s TRP 169 Ca -0.05 -0.19 -0.30 0.00 -2.12 0.00 0.00 56.10 53.44 3fd6 s TRP 169 Cb 0.17 -1.50 -0.02 0.00 -0.81 0.00 0.00 33.47 31.31 3fd6 s TRP 169 CO 0.67 0.43 0.99 0.42 -0.51 0.00 0.00 176.95 178.95 3fd6 s ILE 170 N -2.22 4.84 -0.03 2.03 1.01 -0.46 -3.37 121.20 122.99 3fd6 s ILE 170 Ca 0.35 2.05 0.07 0.00 0.00 0.00 0.00 60.65 63.12 3fd6 s ILE 170 Cb -0.07 -4.32 -0.01 0.00 0.01 0.00 0.00 42.46 38.07 3fd6 s ILE 170 CO 0.25 0.10 -0.24 -0.69 0.00 0.00 0.00 174.94 174.36 3fd6 s VAL 171 N 1.37 1.89 -0.04 2.92 1.01 -0.44 -4.24 120.40 122.87 3fd6 s VAL 171 Ca 0.51 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.47 3fd6 s VAL 171 Cb -0.20 -1.59 0.03 0.00 0.00 0.00 0.00 36.38 34.62 3fd6 s VAL 171 CO 0.24 0.53 0.03 -0.76 0.00 0.00 0.00 175.10 175.15 3fd6 s LEU 172 N -0.37 0.55 0.00 3.92 1.02 -0.65 -1.22 118.68 121.93 3fd6 s LEU 172 Ca 0.04 0.02 0.00 0.00 0.02 0.00 0.00 54.13 54.21 3fd6 s LEU 172 Cb -0.11 -0.21 0.00 0.00 0.02 0.00 0.00 46.19 45.89 3fd6 s LEU 172 CO 0.01 -0.19 0.00 0.61 0.02 0.00 0.00 176.35 176.80 3fd6 n GLY 173 N 4.90 2.14 0.00 -3.19 0.00 -0.06 -0.30 105.19 108.68 3fd6 n GLY 173 Ca -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.31 3fd6 n GLY 173 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fd6 n GLY 174 N 0.00 -0.97 2.91 -0.02 0.00 -0.45 -0.60 105.19 106.07 3fd6 n GLY 174 Ca 0.00 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 3fd6 n GLY 174 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fd6 s VAL 175 N -3.00 0.24 -0.06 1.61 1.01 -0.40 -2.34 120.40 117.47 3fd6 s VAL 175 Ca 0.00 -0.12 0.04 0.00 0.00 0.00 0.00 61.98 61.90 3fd6 s VAL 175 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 36.38 36.17 3fd6 s VAL 175 CO 0.00 0.07 -0.17 0.00 0.00 0.00 0.00 175.10 175.01 3fd6 s ALA 176 N 0.01 1.54 -0.04 5.51 0.00 -0.07 -2.47 121.76 126.24 3fd6 s ALA 176 Ca 0.00 -0.65 -0.00 0.00 0.00 0.00 0.00 51.96 51.32 3fd6 s ALA 176 Cb -0.02 -0.57 0.03 0.00 0.00 0.00 0.00 23.12 22.56 3fd6 s ALA 176 CO -0.00 0.23 0.00 0.99 0.00 0.00 0.00 175.76 176.98 3fd6 s THR 177 N 0.28 0.20 0.03 0.00 2.01 -1.15 -1.08 115.64 115.93 3fd6 s THR 177 Ca -0.09 0.11 0.05 0.00 0.31 0.00 0.00 61.69 62.07 3fd6 s THR 177 Cb -0.14 -0.31 -0.02 0.00 0.01 0.00 0.00 72.50 72.04 3fd6 s THR 177 CO 0.04 0.17 -0.15 0.28 -0.69 0.00 0.00 174.62 174.27 3fd6 s THR 178 N 1.26 1.19 -0.41 -0.82 -1.32 0.18 -1.92 115.64 113.79 3fd6 s THR 178 Ca -0.06 -0.99 -0.09 0.00 -1.21 0.00 0.00 61.69 59.34 3fd6 s THR 178 Cb -0.13 -1.06 0.07 0.00 -1.51 0.00 0.00 72.50 69.87 3fd6 s THR 178 CO -0.02 0.06 0.25 -0.69 -2.21 0.00 0.00 174.62 172.01 3fd6 s VAL 179 N -0.79 4.19 -0.09 5.08 1.01 -1.26 -0.54 120.40 128.00 3fd6 s VAL 179 Ca 0.03 -1.38 -0.02 0.00 0.00 0.00 0.00 61.98 60.61 3fd6 s VAL 179 Cb -0.08 -3.56 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 3fd6 s VAL 179 CO 0.01 -0.48 0.01 0.00 0.00 0.00 0.00 175.10 174.64 3fd6 s GLN 181 N -0.90 4.08 0.39 0.00 -0.21 -1.26 -2.56 119.66 119.20 3fd6 s GLN 181 Ca 0.13 1.23 0.19 0.00 0.02 0.00 0.00 55.36 56.94 3fd6 s GLN 181 Cb -0.11 -2.18 1.15 0.00 1.00 0.00 0.00 33.01 32.87 3fd6 s GLN 181 CO 0.02 -0.17 1.71 -1.35 -2.12 0.00 0.00 175.29 173.38 3fd6 h PRO 182 N 1.84 0.32 -0.64 2.91 0.11 -1.98 -0.67 132.00 133.89 3fd6 h PRO 182 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3fd6 h PRO 182 Cb 1.20 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3fd6 h PRO 182 CO 0.60 0.21 0.00 0.27 -0.21 0.00 0.00 178.00 178.88 3fd6 n ASN 183 N -4.74 3.92 0.20 -2.05 2.04 -1.26 -4.08 115.26 109.29 3fd6 n ASN 183 Ca 0.29 -2.23 0.09 0.00 -0.44 0.00 0.00 54.58 52.30 3fd6 n ASN 183 Cb 1.01 -0.50 0.23 0.00 -2.53 0.00 0.00 39.78 37.99 3fd6 n ASN 183 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 3fd6 h GLU 184 N 3.68 0.00 -5.88 -3.83 5.08 -1.49 -3.46 114.58 108.67 3fd6 h GLU 184 Ca 0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 3fd6 h GLU 184 Cb 1.13 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.24 3fd6 h GLU 184 CO 0.12 0.19 -0.70 -0.59 -1.00 0.00 0.00 179.01 177.03 3fd6 s PHE 185 N -3.25 2.23 -0.22 4.33 -0.12 -1.26 -4.05 117.98 115.64 3fd6 s PHE 185 Ca 0.04 -0.51 0.01 0.00 -0.05 0.00 0.00 56.93 56.42 3fd6 s PHE 185 Cb 0.07 -1.19 0.05 0.00 -0.63 0.00 0.00 43.02 41.32 3fd6 s PHE 185 CO 0.67 0.54 -0.06 0.42 -0.05 0.00 0.00 175.22 176.73 3fd6 s ILE 186 N -2.70 1.53 0.13 -4.49 1.01 0.15 -4.98 121.20 111.84 3fd6 s ILE 186 Ca 0.31 -1.13 -0.31 0.00 0.00 0.00 0.00 60.65 59.51 3fd6 s ILE 186 Cb 0.01 -1.74 -0.10 0.00 0.01 0.00 0.00 42.46 40.63 3fd6 s ILE 186 CO 0.14 -0.02 1.81 -0.04 0.00 0.00 0.00 174.94 176.83 3fd6 s MET 187 N 1.41 4.14 0.00 2.79 -1.94 -1.26 -4.68 119.30 119.76 3fd6 s MET 187 Ca -0.04 2.58 -0.04 0.00 -1.71 0.00 0.00 55.69 56.48 3fd6 s MET 187 Cb -0.18 -3.56 -0.18 0.00 2.01 0.00 0.00 34.83 32.93 3fd6 s MET 187 CO -0.07 -0.83 2.99 -0.35 -0.01 0.00 0.00 175.02 176.75 3fd6 n PRO 188 N 5.55 1.61 0.00 2.03 -0.04 -1.26 -4.19 135.00 138.69 3fd6 n PRO 188 Ca 0.17 -0.65 0.00 0.00 -0.04 0.00 0.00 63.50 62.99 3fd6 n PRO 188 Cb 0.38 -1.67 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 3fd6 n PRO 188 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3fd6 n ASP 189 N 2.20 0.61 -1.70 3.54 5.68 -1.25 -4.53 116.55 121.10 3fd6 n ASP 189 Ca 0.28 -1.24 -0.18 0.00 -0.50 0.00 0.00 54.79 53.15 3fd6 n ASP 189 Cb 0.75 0.00 0.10 0.00 -1.14 0.00 0.00 41.12 40.83 3fd6 n ASP 189 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 3fd6 n ASN 190 N -0.12 4.39 -4.80 -1.12 5.15 -1.10 0.51 115.26 118.16 3fd6 n ASN 190 Ca 0.00 -3.79 -0.35 0.00 -0.60 0.00 0.00 54.58 49.85 3fd6 n ASN 190 Cb 0.32 -0.54 -0.04 0.00 -0.53 0.00 0.00 39.78 38.99 3fd6 n ASN 190 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3fd6 s ALA 191 N -3.51 2.98 0.06 5.20 0.00 -1.26 -4.78 121.76 120.45 3fd6 s ALA 191 Ca 0.50 0.59 0.02 0.00 0.00 0.00 0.00 51.96 53.07 3fd6 s ALA 191 Cb 0.42 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 20.28 3fd6 s ALA 191 CO 0.01 -0.17 -0.07 0.14 0.00 0.00 0.00 175.76 175.67 3fd6 s VAL 192 N -1.90 0.51 0.29 0.00 -7.23 -1.26 -4.46 120.40 106.35 3fd6 s VAL 192 Ca 0.63 -1.37 -0.29 0.00 -1.81 0.00 0.00 61.98 59.13 3fd6 s VAL 192 Cb -0.17 -0.96 -0.13 0.00 0.56 0.00 0.00 36.38 35.68 3fd6 s VAL 192 CO 0.21 -0.59 1.23 -2.65 -0.31 0.00 0.00 175.10 172.99 3fd6 n PRO 193 N 0.92 1.83 0.00 4.82 -0.02 -1.26 -1.67 135.00 139.62 3fd6 n PRO 193 Ca -0.19 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 3fd6 n PRO 193 Cb 0.57 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 3fd6 n PRO 193 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fd6 n GLY 194 N 1.32 3.24 3.67 -1.23 0.00 -0.49 -4.96 105.19 106.73 3fd6 n GLY 194 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 3fd6 n GLY 194 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fd6 n ASP 195 N 0.07 0.98 -4.64 1.61 8.00 -0.67 -3.64 116.55 118.26 3fd6 n ASP 195 Ca 0.00 0.62 -0.28 0.00 0.71 0.00 0.00 54.79 55.84 3fd6 n ASP 195 Cb 0.00 -1.49 -0.10 0.00 -0.02 0.00 0.00 41.12 39.51 3fd6 n ASP 195 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3fd6 s VAL 196 N -1.98 1.97 -0.20 2.53 -7.23 -0.35 -0.42 120.40 114.71 3fd6 s VAL 196 Ca 0.74 -1.98 -0.00 0.00 -1.81 0.00 0.00 61.98 58.93 3fd6 s VAL 196 Cb -0.31 -2.94 0.01 0.00 0.56 0.00 0.00 36.38 33.70 3fd6 s VAL 196 CO 0.50 0.00 -0.14 -0.76 -0.31 0.00 0.00 175.10 174.38 3fd6 s LEU 197 N -3.74 2.47 -0.13 1.32 1.43 0.01 -1.75 118.68 118.29 3fd6 s LEU 197 Ca 0.33 -0.63 -0.06 0.00 -1.03 0.00 0.00 54.13 52.75 3fd6 s LEU 197 Cb 0.09 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 3fd6 s LEU 197 CO 0.17 -0.02 0.07 -0.69 0.23 0.00 0.00 176.35 176.11 3fd6 s VAL 198 N 1.33 4.88 -0.12 -1.59 1.01 -0.53 0.20 120.40 125.58 3fd6 s VAL 198 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 3fd6 s VAL 198 Cb -0.14 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 3fd6 s VAL 198 CO -0.09 0.56 -0.09 -0.22 0.00 0.00 0.00 175.10 175.25 3fd6 s LEU 199 N -0.48 2.96 0.00 3.92 2.96 0.12 -1.63 118.68 126.53 3fd6 s LEU 199 Ca 0.10 -0.20 0.23 0.00 -0.22 0.00 0.00 54.13 54.04 3fd6 s LEU 199 Cb -0.12 -1.67 0.21 0.00 0.50 0.00 0.00 46.19 45.11 3fd6 s LEU 199 CO 0.02 0.22 1.25 0.35 -1.32 0.00 0.00 176.35 176.87 3fd6 n THR 200 N 3.14 0.06 -3.77 3.68 -2.24 -1.09 -0.31 114.28 113.76 3fd6 n THR 200 Ca -0.18 -0.53 -0.13 0.00 -2.27 0.00 0.00 64.05 60.94 3fd6 n THR 200 Cb 0.53 1.42 -0.08 0.00 -2.10 0.00 0.00 70.33 70.09 3fd6 n THR 200 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3fd6 s LYS 201 N -1.86 0.68 0.56 -0.78 1.02 -1.26 -4.71 119.74 113.39 3fd6 s LYS 201 Ca 0.28 -0.27 -0.16 0.00 0.02 0.00 0.00 55.97 55.84 3fd6 s LYS 201 Cb 0.20 0.30 -0.05 0.00 -0.52 0.00 0.00 37.83 37.75 3fd6 s LYS 201 CO 0.29 -0.19 1.03 -1.25 -0.92 0.00 0.00 175.35 174.30 3fd6 s PRO 202 N -1.58 3.58 0.70 -1.68 0.04 -1.26 -4.61 135.00 130.19 3fd6 s PRO 202 Ca -0.12 1.09 -0.04 0.00 0.04 0.00 0.00 61.00 61.97 3fd6 s PRO 202 Cb -0.04 -2.08 0.09 0.00 0.04 0.00 0.00 34.50 32.51 3fd6 s PRO 202 CO 0.03 -0.59 0.99 -0.51 0.04 0.00 0.00 177.00 176.95 3fd6 s LEU 203 N -4.35 2.96 0.00 -3.56 1.43 -0.15 -4.76 118.68 110.25 3fd6 s LEU 203 Ca 0.61 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.80 3fd6 s LEU 203 Cb -0.13 -2.64 0.00 0.00 0.03 0.00 0.00 46.19 43.44 3fd6 s LEU 203 CO 0.35 -1.69 0.00 0.61 0.23 0.00 0.00 176.35 175.85 3fd6 n GLY 204 N -2.85 1.08 0.30 -3.19 0.00 -1.26 -1.58 105.19 97.69 3fd6 n GLY 204 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.24 3fd6 n GLY 204 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3fd6 h THR 205 N 0.00 0.91 0.00 2.61 1.35 -1.86 -2.13 112.91 113.78 3fd6 h THR 205 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3fd6 h THR 205 Cb 0.00 0.92 0.00 0.00 -1.73 0.00 0.00 68.15 67.34 3fd6 h THR 205 CO 0.00 0.00 0.00 -0.61 -0.25 0.00 0.00 175.52 174.66 3fd6 h GLN 206 N 0.00 0.00 0.03 4.72 5.75 -1.95 -1.69 115.11 121.98 3fd6 h GLN 206 Ca 0.07 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.52 3fd6 h GLN 206 Cb 0.29 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.84 3fd6 h GLN 206 CO -0.00 0.00 -0.22 0.28 -2.65 0.00 0.00 178.83 176.24 3fd6 h VAL 207 N 0.00 1.71 -0.36 2.39 2.07 -1.72 -3.13 116.25 117.21 3fd6 h VAL 207 Ca 0.00 -2.38 0.02 0.00 0.82 0.00 0.00 66.70 65.16 3fd6 h VAL 207 Cb 0.85 3.31 -0.02 0.00 -1.52 0.00 0.00 31.29 33.91 3fd6 h VAL 207 CO 0.00 0.62 0.20 0.00 0.02 0.00 0.00 177.57 178.41 3fd6 h ALA 208 N -0.00 0.44 -0.43 1.67 0.00 -1.21 -0.37 119.26 119.36 3fd6 h ALA 208 Ca -0.04 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 3fd6 h ALA 208 Cb 1.14 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3fd6 h ALA 208 CO 0.02 -0.15 -0.10 -0.39 0.00 0.00 0.00 179.25 178.63 3fd6 h VAL 209 N 0.41 1.27 0.10 0.00 -1.51 -1.48 -2.76 116.25 112.29 3fd6 h VAL 209 Ca 0.14 -1.20 0.02 0.00 -1.23 0.00 0.00 66.70 64.43 3fd6 h VAL 209 Cb 0.01 1.17 -0.04 0.00 -2.13 0.00 0.00 31.29 30.31 3fd6 h VAL 209 CO -0.07 0.41 -0.27 0.00 -1.23 0.00 0.00 177.57 176.41 3fd6 h ALA 210 N 0.86 -0.44 0.00 5.19 0.00 -1.43 -2.55 119.26 120.88 3fd6 h ALA 210 Ca 0.11 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3fd6 h ALA 210 Cb 0.63 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 3fd6 h ALA 210 CO 0.04 -0.80 -0.07 -0.39 0.00 0.00 0.00 179.25 178.03 3fd6 h VAL 211 N -0.47 0.42 0.00 0.00 -1.51 -1.04 0.26 116.25 113.90 3fd6 h VAL 211 Ca 0.03 -0.36 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 3fd6 h VAL 211 Cb 0.50 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.91 3fd6 h VAL 211 CO -0.17 0.07 0.00 -0.74 -1.23 0.00 0.00 177.57 175.50 3fd6 h HIS 212 N 0.00 0.00 0.00 5.19 6.17 -1.16 -2.96 115.15 122.39 3fd6 h HIS 212 Ca -0.00 0.00 -0.06 0.00 0.71 0.00 0.00 60.37 61.02 3fd6 h HIS 212 Cb 0.24 0.00 -0.01 0.00 2.52 0.00 0.00 27.41 30.16 3fd6 h HIS 212 CO 0.00 0.00 -1.01 1.96 0.71 0.00 0.00 177.93 179.59 3fd6 h GLN 213 N 0.00 0.00 0.00 5.26 4.20 -0.24 -3.35 115.11 120.98 3fd6 h GLN 213 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3fd6 h GLN 213 Cb 0.81 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.59 3fd6 h GLN 213 CO 0.00 0.13 -0.15 0.91 -0.67 0.00 0.00 178.83 179.05 3fd6 n TRP 214 N -2.83 0.02 -0.24 2.96 8.01 -0.23 -3.11 117.44 122.03 3fd6 n TRP 214 Ca -0.03 0.01 -0.02 0.00 -1.31 0.00 0.00 57.50 56.14 3fd6 n TRP 214 Cb 0.66 -0.43 0.09 0.00 -2.01 0.00 0.00 31.31 29.61 3fd6 n TRP 214 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.69 176.61 3fd6 h LEU 215 N 0.00 0.65 -0.40 -0.99 3.38 -1.67 -2.67 115.31 113.59 3fd6 h LEU 215 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3fd6 h LEU 215 Cb 0.51 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3fd6 h LEU 215 CO 0.00 0.43 0.00 0.47 0.09 0.00 0.00 178.44 179.43 3fd6 n ASP 216 N -4.72 0.60 -4.02 -0.43 8.00 -1.18 -4.63 116.55 110.18 3fd6 n ASP 216 Ca 0.08 -1.78 -0.31 0.00 0.71 0.00 0.00 54.79 53.49 3fd6 n ASP 216 Cb 0.13 -0.06 -0.15 0.00 -0.02 0.00 0.00 41.12 41.02 3fd6 n ASP 216 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fd6 s ILE 217 N -1.88 1.96 0.28 0.53 1.01 -1.01 -5.02 121.20 117.07 3fd6 s ILE 217 Ca 0.18 -1.61 0.01 0.00 0.00 0.00 0.00 60.65 59.23 3fd6 s ILE 217 Cb 0.09 -2.18 0.27 0.00 0.01 0.00 0.00 42.46 40.65 3fd6 s ILE 217 CO 0.14 -0.15 1.82 1.55 0.00 0.00 0.00 174.94 178.30 3fd6 h PRO 218 N 7.81 0.89 -0.01 2.79 0.13 -1.83 -0.09 132.00 141.69 3fd6 h PRO 218 Ca -0.16 -0.05 -0.15 0.00 -0.87 0.00 0.00 66.00 64.76 3fd6 h PRO 218 Cb 1.05 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.96 3fd6 h PRO 218 CO 0.45 0.59 -0.68 0.93 -0.23 0.00 0.00 178.00 179.06 3fd6 h GLU 219 N 0.92 0.06 0.19 0.86 3.07 -1.95 -2.18 114.58 115.55 3fd6 h GLU 219 Ca 0.49 -0.05 -0.31 0.00 -0.50 0.00 0.00 59.36 58.99 3fd6 h GLU 219 Cb 0.53 0.01 0.02 0.00 -0.84 0.00 0.00 28.75 28.47 3fd6 h GLU 219 CO -0.28 0.72 -1.46 0.87 -1.40 0.00 0.00 179.01 177.45 3fd6 h LYS 220 N 0.04 0.40 -0.30 2.33 1.79 -1.70 -3.35 116.57 115.78 3fd6 h LYS 220 Ca -0.01 -0.68 -0.01 0.00 -2.18 0.00 0.00 60.65 57.77 3fd6 h LYS 220 Cb 1.21 0.25 -0.01 0.00 -1.58 0.00 0.00 32.23 32.10 3fd6 h LYS 220 CO 0.09 1.33 0.16 2.35 -1.08 0.00 0.00 179.45 182.30 3fd6 h TRP 221 N -0.04 0.42 -1.16 -1.35 2.91 -1.06 -2.35 115.95 113.33 3fd6 h TRP 221 Ca -0.28 -0.01 0.33 0.00 1.13 0.00 0.00 58.89 60.06 3fd6 h TRP 221 Cb 1.99 -0.13 -0.05 0.00 -0.51 0.00 0.00 29.16 30.45 3fd6 h TRP 221 CO 0.13 0.35 0.83 -0.91 -1.03 0.00 0.00 178.44 177.81 3fd6 h ASN 222 N 0.37 0.03 0.00 2.65 2.35 -1.54 0.01 115.58 119.45 3fd6 h ASN 222 Ca 0.11 0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.72 3fd6 h ASN 222 Cb 0.07 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 3fd6 h ASN 222 CO -0.02 0.00 -0.91 0.50 -1.65 0.00 0.00 177.43 175.36 3fd6 h LYS 223 N 0.02 0.00 0.00 0.81 3.64 -1.60 -3.38 116.57 116.07 3fd6 h LYS 223 Ca 0.56 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.92 3fd6 h LYS 223 Cb 2.18 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 34.00 3fd6 h LYS 223 CO -0.02 0.68 -0.05 -0.84 -2.27 0.00 0.00 179.45 176.95 3fd6 h ILE 224 N -1.00 0.36 -0.13 2.00 3.07 -1.21 -2.93 117.51 117.66 3fd6 h ILE 224 Ca -0.21 -0.28 0.04 0.00 1.55 0.00 0.00 64.86 65.96 3fd6 h ILE 224 Cb 1.01 1.20 -0.01 0.00 -0.27 0.00 0.00 36.82 38.75 3fd6 h ILE 224 CO -0.13 0.05 0.30 0.50 -1.05 0.00 0.00 178.15 177.82 3fd6 h LYS 225 N 0.00 0.00 0.00 0.16 3.64 -1.17 -0.59 116.57 118.61 3fd6 h LYS 225 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3fd6 h LYS 225 Cb 0.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3fd6 h LYS 225 CO 0.01 0.00 0.00 1.28 -2.27 0.00 0.00 179.45 178.47 3fd6 n LEU 226 N -3.29 0.00 0.00 5.20 4.77 -1.11 -3.92 117.00 118.66 3fd6 n LEU 226 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 3fd6 n LEU 226 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 3fd6 n LEU 226 CO 0.20 0.00 0.00 0.52 -1.33 0.00 0.00 177.39 176.78 3fd6 n VAL 227 N -0.51 0.00 -3.52 4.08 0.31 -0.23 -5.13 118.33 113.32 3fd6 n VAL 227 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.21 3fd6 n VAL 227 Cb 0.00 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 32.89 3fd6 n VAL 227 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3fd6 s VAL 228 N -0.62 0.02 0.58 2.52 0.11 -1.19 -4.94 120.40 116.89 3fd6 s VAL 228 Ca 0.00 -0.20 0.04 0.00 -2.93 0.00 0.00 61.98 58.89 3fd6 s VAL 228 Cb 0.00 -1.03 0.07 0.00 -1.53 0.00 0.00 36.38 33.89 3fd6 s VAL 228 CO 0.00 -0.11 0.80 0.42 -3.33 0.00 0.00 175.10 172.88 3fd6 s THR 229 N -3.14 2.43 0.16 5.04 -4.23 -1.26 -4.59 115.64 110.05 3fd6 s THR 229 Ca -0.02 -0.80 -0.16 0.00 -1.18 0.00 0.00 61.69 59.54 3fd6 s THR 229 Cb -0.00 -2.64 0.03 0.00 1.34 0.00 0.00 72.50 71.23 3fd6 s THR 229 CO -0.07 0.00 1.81 -0.61 -0.54 0.00 0.00 174.62 175.21 3fd6 h GLN 230 N 0.03 0.52 -0.68 3.99 4.15 -1.99 -2.43 115.11 118.71 3fd6 h GLN 230 Ca -0.37 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 58.96 3fd6 h GLN 230 Cb 1.28 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.83 3fd6 h GLN 230 CO 0.44 0.35 0.17 0.93 -1.93 0.00 0.00 178.83 178.79 3fd6 h GLU 231 N 0.54 1.08 -0.87 1.69 5.08 -1.98 0.14 114.58 120.26 3fd6 h GLU 231 Ca 0.16 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3fd6 h GLU 231 Cb -0.03 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.03 3fd6 h GLU 231 CO -0.05 0.96 0.58 -0.44 -1.00 0.00 0.00 179.01 179.06 3fd6 h ASP 232 N 1.02 0.99 -0.06 1.42 5.19 -1.94 0.14 116.42 123.18 3fd6 h ASP 232 Ca 0.21 -0.02 -0.12 0.00 -0.62 0.00 0.00 57.03 56.47 3fd6 h ASP 232 Cb 0.36 -0.25 0.01 0.00 0.18 0.00 0.00 39.33 39.63 3fd6 h ASP 232 CO 0.00 0.72 -0.45 0.58 -3.12 0.00 0.00 179.24 176.97 3fd6 h VAL 233 N 1.17 1.41 -0.95 -1.35 2.07 -1.04 -0.46 116.25 117.11 3fd6 h VAL 233 Ca 0.32 -1.86 0.17 0.00 0.82 0.00 0.00 66.70 66.15 3fd6 h VAL 233 Cb -0.12 2.38 -0.10 0.00 -1.52 0.00 0.00 31.29 31.93 3fd6 h VAL 233 CO -0.07 0.54 0.55 -0.08 0.02 0.00 0.00 177.57 178.53 3fd6 h GLU 234 N -0.07 0.72 -0.04 1.57 4.57 -0.57 -1.94 114.58 118.81 3fd6 h GLU 234 Ca -0.04 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.08 3fd6 h GLU 234 Cb 1.12 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.55 3fd6 h GLU 234 CO 0.09 0.48 -0.06 -0.07 -1.18 0.00 0.00 179.01 178.27 3fd6 h LEU 235 N 0.74 0.12 -1.59 1.64 3.38 -0.56 -2.12 115.31 116.93 3fd6 h LEU 235 Ca 0.53 -0.53 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3fd6 h LEU 235 Cb 0.76 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3fd6 h LEU 235 CO -0.36 0.63 -0.22 0.00 0.09 0.00 0.00 178.44 178.58 3fd6 h ALA 236 N 0.49 1.33 0.10 1.53 0.00 -0.89 -1.06 119.26 120.77 3fd6 h ALA 236 Ca 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3fd6 h ALA 236 Cb 0.61 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3fd6 h ALA 236 CO 0.01 0.27 -0.05 -0.92 0.00 0.00 0.00 179.25 178.57 3fd6 h TYR 237 N 0.00 -0.13 -0.92 0.00 3.20 -1.36 -1.48 116.97 116.29 3fd6 h TYR 237 Ca -0.00 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3fd6 h TYR 237 Cb 0.48 0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 3fd6 h TYR 237 CO 0.00 0.33 0.58 1.96 -1.64 0.00 0.00 178.16 179.39 3fd6 h GLN 238 N -0.65 1.23 0.26 1.82 1.08 -0.93 -0.38 115.11 117.53 3fd6 h GLN 238 Ca -0.01 -0.09 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 3fd6 h GLN 238 Cb 0.51 -0.27 0.00 0.00 -0.05 0.00 0.00 27.48 27.68 3fd6 h GLN 238 CO 0.02 0.83 -0.12 1.49 -0.95 0.00 0.00 178.83 180.10 3fd6 h GLU 239 N 1.25 -0.33 -0.74 1.46 4.57 -1.27 -2.67 114.58 116.86 3fd6 h GLU 239 Ca 0.33 0.02 0.14 0.00 -1.18 0.00 0.00 59.36 58.68 3fd6 h GLU 239 Cb -0.10 0.08 -0.10 0.00 -0.16 0.00 0.00 28.75 28.47 3fd6 h GLU 239 CO -0.07 -0.15 0.27 0.00 -1.18 0.00 0.00 179.01 177.88 3fd6 h ALA 240 N 0.27 1.01 -0.23 2.92 0.00 -1.01 -1.84 119.26 120.39 3fd6 h ALA 240 Ca -0.04 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3fd6 h ALA 240 Cb 0.34 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3fd6 h ALA 240 CO 0.06 -0.24 0.09 1.98 0.00 0.00 0.00 179.25 181.14 3fd6 h MET 241 N 0.40 0.20 -0.68 0.00 1.85 -0.96 -1.83 114.93 113.91 3fd6 h MET 241 Ca 0.41 -0.01 -0.08 0.00 -0.61 0.00 0.00 59.70 59.40 3fd6 h MET 241 Cb 0.63 -0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.59 3fd6 h MET 241 CO -0.42 0.14 0.12 0.52 -0.40 0.00 0.00 176.91 176.86 3fd6 h MET 242 N 0.21 1.13 -0.70 0.39 2.07 -1.09 -2.23 114.93 114.70 3fd6 h MET 242 Ca 0.10 -0.30 -0.04 0.00 -2.07 0.00 0.00 59.70 57.38 3fd6 h MET 242 Cb 0.05 -0.13 -0.03 0.00 -1.87 0.00 0.00 31.60 29.61 3fd6 h MET 242 CO -0.09 1.02 0.26 -0.91 1.07 0.00 0.00 176.91 178.27 3fd6 h ASN 243 N 1.05 0.99 1.21 1.22 4.21 -1.16 -2.57 115.58 120.52 3fd6 h ASN 243 Ca 0.21 -0.18 -0.03 0.00 1.21 0.00 0.00 56.30 57.51 3fd6 h ASN 243 Cb 0.44 -0.26 -0.00 0.00 -1.12 0.00 0.00 38.32 37.38 3fd6 h ASN 243 CO 0.01 0.90 -0.13 0.24 -1.29 0.00 0.00 177.43 177.16 3fd6 h MET 244 N 1.01 0.00 -0.02 0.81 2.86 -1.22 -1.98 114.93 116.40 3fd6 h MET 244 Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 3fd6 h MET 244 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 3fd6 h MET 244 CO -0.02 0.13 -0.02 0.00 1.06 0.00 0.00 176.91 178.07 3fd6 n ALA 245 N -2.16 2.60 -2.69 6.32 0.00 -0.85 -4.56 120.51 119.18 3fd6 n ALA 245 Ca 0.01 -0.47 -0.41 0.00 0.00 0.00 0.00 53.44 52.57 3fd6 n ALA 245 Cb 0.44 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.72 3fd6 n ALA 245 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3fd6 s ARG 246 N -2.04 4.34 0.67 0.00 3.52 -0.75 -4.87 118.95 119.83 3fd6 s ARG 246 Ca 0.36 0.90 -0.15 0.00 -0.13 0.00 0.00 55.73 56.72 3fd6 s ARG 246 Cb 0.21 -3.53 0.01 0.00 -1.56 0.00 0.00 34.95 30.08 3fd6 s ARG 246 CO 0.34 -0.17 1.12 -0.51 -0.81 0.00 0.00 175.30 175.27 3fd6 s LEU 247 N 1.60 3.36 -0.01 -0.88 1.43 -1.26 -4.97 118.68 117.95 3fd6 s LEU 247 Ca 0.37 2.01 0.14 0.00 -1.03 0.00 0.00 54.13 55.62 3fd6 s LEU 247 Cb -0.17 -4.55 0.44 0.00 0.03 0.00 0.00 46.19 41.94 3fd6 s LEU 247 CO 0.14 -1.71 1.35 0.59 0.23 0.00 0.00 176.35 176.96 3fd6 n ASN 248 N -2.52 2.72 -0.19 2.29 5.03 -1.26 -4.67 115.26 116.66 3fd6 n ASN 248 Ca 0.10 -2.05 -0.08 0.00 0.87 0.00 0.00 54.58 53.43 3fd6 n ASN 248 Cb 0.52 -0.35 0.02 0.00 -1.02 0.00 0.00 39.78 38.95 3fd6 n ASN 248 CO 0.00 0.00 0.00 -0.09 -1.83 0.00 0.00 177.26 175.34 3fd6 h ARG 249 N 2.81 0.78 -0.20 3.52 2.43 -1.94 -0.81 114.38 120.97 3fd6 h ARG 249 Ca 0.00 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3fd6 h ARG 249 Cb 0.72 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 3fd6 h ARG 249 CO 0.03 0.65 0.11 1.15 -1.51 0.00 0.00 179.97 180.40 3fd6 h THR 250 N 0.73 1.10 -0.96 0.20 2.02 -1.99 -0.31 112.91 113.69 3fd6 h THR 250 Ca 0.18 -0.27 0.12 0.00 0.77 0.00 0.00 66.41 67.22 3fd6 h THR 250 Cb 0.13 0.92 -0.09 0.00 -1.74 0.00 0.00 68.15 67.37 3fd6 h THR 250 CO -0.02 0.10 0.59 0.00 0.37 0.00 0.00 175.52 176.55 3fd6 h ALA 251 N 1.00 1.46 -0.04 6.16 0.00 -1.84 -1.26 119.26 124.74 3fd6 h ALA 251 Ca 0.07 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3fd6 h ALA 251 Cb 0.06 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 3fd6 h ALA 251 CO -0.01 0.16 0.03 0.00 0.00 0.00 0.00 179.25 179.42 3fd6 h ALA 252 N 1.54 0.05 -0.12 0.00 0.00 -0.43 -1.98 119.26 118.32 3fd6 h ALA 252 Ca 0.49 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.36 3fd6 h ALA 252 Cb 0.52 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3fd6 h ALA 252 CO -0.28 -0.45 -0.03 0.78 0.00 0.00 0.00 179.25 179.27 3fd6 h GLY 253 N 0.04 0.19 2.00 0.00 0.00 -0.36 -2.74 103.07 102.20 3fd6 h GLY 253 Ca 0.02 -0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.15 3fd6 h GLY 253 CO -0.00 0.09 -0.47 1.41 0.00 0.00 0.00 176.54 177.57 3fd6 h LEU 254 N 0.18 0.00 -1.49 3.11 3.38 -0.95 -3.03 115.31 116.52 3fd6 h LEU 254 Ca 0.04 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.20 3fd6 h LEU 254 Cb 0.18 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.87 3fd6 h LEU 254 CO 0.01 0.47 0.59 0.24 0.09 0.00 0.00 178.44 179.83 3fd6 h MET 255 N 0.00 0.43 0.03 1.13 2.86 -1.04 -0.84 114.93 117.49 3fd6 h MET 255 Ca -0.00 -0.03 -0.24 0.00 -2.06 0.00 0.00 59.70 57.37 3fd6 h MET 255 Cb 1.24 -0.10 0.02 0.00 0.06 0.00 0.00 31.60 32.82 3fd6 h MET 255 CO 0.06 0.28 -0.96 0.45 1.06 0.00 0.00 176.91 177.80 3fd6 h HIS 256 N 0.44 0.91 -0.51 -0.22 3.86 -1.63 0.22 115.15 118.21 3fd6 h HIS 256 Ca 0.46 -0.52 -0.08 0.00 -1.16 0.00 0.00 60.37 59.08 3fd6 h HIS 256 Cb 1.09 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.45 3fd6 h HIS 256 CO -0.00 1.35 0.01 1.15 0.86 0.00 0.00 177.93 181.30 3fd6 h THR 257 N 0.21 1.25 -0.28 2.45 2.02 -1.28 -3.21 112.91 114.06 3fd6 h THR 257 Ca -0.13 -1.03 -0.10 0.00 0.77 0.00 0.00 66.41 65.92 3fd6 h THR 257 Cb 1.64 0.84 -0.06 0.00 -1.74 0.00 0.00 68.15 68.83 3fd6 h THR 257 CO 0.19 0.37 -0.05 0.49 0.37 0.00 0.00 175.52 176.88 3fd6 n PHE 258 N -4.21 0.92 -3.46 3.16 3.72 -0.40 -4.98 117.46 112.21 3fd6 n PHE 258 Ca 0.03 -1.30 -0.18 0.00 -0.05 0.00 0.00 57.45 55.95 3fd6 n PHE 258 Cb 0.31 -0.40 0.08 0.00 -0.94 0.00 0.00 39.48 38.53 3fd6 n PHE 258 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3fd6 n ASN 259 N -0.94 -2.31 -4.76 4.37 4.13 -1.15 -4.67 115.26 109.94 3fd6 n ASN 259 Ca 0.27 -0.66 -0.39 0.00 1.68 0.00 0.00 54.58 55.48 3fd6 n ASN 259 Cb 0.95 -4.95 0.03 0.00 -1.54 0.00 0.00 39.78 34.27 3fd6 n ASN 259 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3fd6 s ALA 260 N -3.41 3.00 -0.06 5.41 0.00 0.75 -4.45 121.76 122.99 3fd6 s ALA 260 Ca 0.04 1.33 0.21 0.00 0.00 0.00 0.00 51.96 53.55 3fd6 s ALA 260 Cb -0.01 -3.55 -0.31 0.00 0.00 0.00 0.00 23.12 19.25 3fd6 s ALA 260 CO 0.75 -1.21 0.47 0.72 0.00 0.00 0.00 175.76 176.49 3fd6 n HIS 261 N -0.62 0.07 -3.65 0.00 8.25 -0.25 -4.97 115.22 114.04 3fd6 n HIS 261 Ca 0.08 0.02 -0.02 0.00 -0.26 0.00 0.00 57.72 57.54 3fd6 n HIS 261 Cb 0.44 -0.59 -0.07 0.00 1.12 0.00 0.00 29.99 30.90 3fd6 n HIS 261 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3fd6 s ALA 262 N -3.39 -2.24 0.03 -1.41 0.00 -1.24 -2.73 121.76 110.80 3fd6 s ALA 262 Ca -0.08 1.70 -0.07 0.00 0.00 0.00 0.00 51.96 53.51 3fd6 s ALA 262 Cb 0.13 -1.79 -0.01 0.00 0.00 0.00 0.00 23.12 21.45 3fd6 s ALA 262 CO 0.89 -0.11 0.13 0.00 0.00 0.00 0.00 175.76 176.67 3fd6 s ALA 263 N -0.15 -0.19 0.13 0.00 0.00 -1.26 -0.70 121.76 119.59 3fd6 s ALA 263 Ca 0.08 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.64 3fd6 s ALA 263 Cb -0.04 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 3fd6 s ALA 263 CO -0.16 -0.30 0.02 -0.08 0.00 0.00 0.00 175.76 175.24 3fd6 s THR 264 N -2.32 0.37 0.11 0.00 -1.32 -0.93 -4.76 115.64 106.79 3fd6 s THR 264 Ca -0.07 -1.92 0.04 0.00 -1.21 0.00 0.00 61.69 58.52 3fd6 s THR 264 Cb -0.03 -1.98 -0.04 0.00 -1.51 0.00 0.00 72.50 68.95 3fd6 s THR 264 CO -0.03 -0.57 0.09 1.51 -2.21 0.00 0.00 174.62 173.41 3fd6 s ASP 265 N -3.08 5.45 -0.52 8.08 -4.77 -1.26 -0.23 116.67 120.35 3fd6 s ASP 265 Ca 0.21 -0.08 -0.19 0.00 -3.30 0.00 0.00 52.55 49.19 3fd6 s ASP 265 Cb 0.07 -1.42 0.06 0.00 -1.09 0.00 0.00 42.92 40.54 3fd6 s ASP 265 CO 0.01 0.13 0.62 -0.63 0.70 0.00 0.00 175.17 176.00 3fd6 s ILE 266 N -1.52 4.89 0.00 2.11 -1.09 0.76 -4.93 121.20 121.42 3fd6 s ILE 266 Ca 0.29 -0.59 0.00 0.00 -2.23 0.00 0.00 60.65 58.12 3fd6 s ILE 266 Cb -0.11 -4.31 0.00 0.00 -1.58 0.00 0.00 42.46 36.45 3fd6 s ILE 266 CO 0.22 -0.83 0.00 0.35 -1.23 0.00 0.00 174.94 173.45 3fd6 n THR 267 N 5.58 0.00 0.04 2.92 -2.24 -1.26 -1.67 114.28 117.65 3fd6 n THR 267 Ca -0.07 0.00 0.22 0.00 -2.27 0.00 0.00 64.05 61.93 3fd6 n THR 267 Cb 0.45 0.00 0.68 0.00 -2.10 0.00 0.00 70.33 69.36 3fd6 n THR 267 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3fd6 h GLY 268 N 0.00 0.00 -2.48 3.38 0.00 -1.88 -1.71 103.07 100.39 3fd6 h GLY 268 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fd6 h GLY 268 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 3fd6 n PHE 269 N -3.56 0.81 0.00 5.60 3.72 -1.26 -4.40 117.46 118.36 3fd6 n PHE 269 Ca 0.10 -0.43 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 3fd6 n PHE 269 Cb 0.81 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.35 3fd6 n PHE 269 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fd6 n GLY 270 N 1.52 -0.88 0.26 1.37 0.00 -0.67 -2.60 105.19 104.19 3fd6 n GLY 270 Ca 0.22 -1.68 -0.07 0.00 0.00 0.00 0.00 46.02 44.49 3fd6 n GLY 270 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3fd6 h ILE 271 N 0.00 1.22 0.00 -0.61 6.09 -1.72 -3.04 117.51 119.45 3fd6 h ILE 271 Ca 0.00 -0.64 -0.01 0.00 -1.37 0.00 0.00 64.86 62.83 3fd6 h ILE 271 Cb 0.00 0.54 0.00 0.00 0.47 0.00 0.00 36.82 37.83 3fd6 h ILE 271 CO 0.00 0.26 -0.05 0.25 -3.07 0.00 0.00 178.15 175.53 3fd6 h LEU 272 N 0.81 0.05 -0.84 2.19 5.85 -1.57 -1.81 115.31 119.98 3fd6 h LEU 272 Ca 0.20 -0.80 0.21 0.00 0.84 0.00 0.00 57.88 58.34 3fd6 h LEU 272 Cb 0.15 -0.01 -0.14 0.00 0.37 0.00 0.00 40.66 41.03 3fd6 h LEU 272 CO -0.02 0.84 0.13 1.23 -0.34 0.00 0.00 178.44 180.28 3fd6 h GLY 273 N -0.74 1.15 1.67 3.75 0.00 -1.59 0.11 103.07 107.43 3fd6 h GLY 273 Ca -0.01 0.03 -0.25 0.00 0.00 0.00 0.00 47.33 47.11 3fd6 h GLY 273 CO 0.01 -0.35 -1.22 0.45 0.00 0.00 0.00 176.54 175.43 3fd6 h HIS 274 N 0.16 0.18 -0.36 5.60 3.86 -1.60 -1.89 115.15 121.09 3fd6 h HIS 274 Ca 0.50 -0.13 0.02 0.00 -1.16 0.00 0.00 60.37 59.60 3fd6 h HIS 274 Cb 0.97 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 29.41 3fd6 h HIS 274 CO -0.34 1.12 0.20 0.00 0.86 0.00 0.00 177.93 179.77 3fd6 h ALA 275 N 0.83 0.45 -0.05 2.45 0.00 -0.65 -1.41 119.26 120.88 3fd6 h ALA 275 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3fd6 h ALA 275 Cb 1.88 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 3fd6 h ALA 275 CO 0.15 -0.16 0.01 1.96 0.00 0.00 0.00 179.25 181.21 3fd6 h GLN 276 N 0.41 0.04 -0.68 0.00 4.20 -1.03 -0.53 115.11 117.52 3fd6 h GLN 276 Ca 0.15 -0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.99 3fd6 h GLN 276 Cb 0.03 -0.01 -0.10 0.00 0.30 0.00 0.00 27.48 27.69 3fd6 h GLN 276 CO -0.08 0.02 0.13 -0.97 -0.67 0.00 0.00 178.83 177.26 3fd6 h ASN 277 N 0.04 -0.05 0.07 1.46 -1.24 -1.14 -2.27 115.58 112.44 3fd6 h ASN 277 Ca 0.02 0.14 -0.17 0.00 0.71 0.00 0.00 56.30 57.00 3fd6 h ASN 277 Cb 0.01 0.20 -0.00 0.00 0.73 0.00 0.00 38.32 39.26 3fd6 h ASN 277 CO -0.02 -0.04 -0.60 0.25 -1.29 0.00 0.00 177.43 175.72 3fd6 h LEU 278 N 0.23 0.61 -2.45 0.34 5.85 -1.00 -2.86 115.31 116.02 3fd6 h LEU 278 Ca 0.37 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3fd6 h LEU 278 Cb 0.60 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.46 3fd6 h LEU 278 CO -0.49 1.07 0.00 0.00 -0.34 0.00 0.00 178.44 178.68 3fd6 h ALA 279 N 0.94 1.00 0.00 1.25 0.00 -0.55 -1.44 119.26 120.46 3fd6 h ALA 279 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 3fd6 h ALA 279 Cb 1.16 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 3fd6 h ALA 279 CO 0.11 0.00 -0.53 -0.22 0.00 0.00 0.00 179.25 178.61 3fd6 h LYS 280 N 0.00 0.00 0.00 0.00 3.11 -1.20 -3.30 116.57 115.18 3fd6 h LYS 280 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 3fd6 h LYS 280 Cb 0.16 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.39 3fd6 h LYS 280 CO 0.00 0.53 -0.11 0.37 -2.81 0.00 0.00 179.45 177.43 3fd6 h GLN 281 N 0.00 0.00 -6.72 1.90 5.75 -1.31 -3.48 115.11 111.26 3fd6 h GLN 281 Ca -0.01 0.00 -0.53 0.00 -0.15 0.00 0.00 58.65 57.97 3fd6 h GLN 281 Cb 1.09 0.00 0.05 0.00 1.07 0.00 0.00 27.48 29.69 3fd6 h GLN 281 CO 0.07 0.00 0.73 -0.65 -2.65 0.00 0.00 178.83 176.33 3fd6 s GLN 282 N -3.15 4.31 0.07 1.69 -1.52 -1.24 -4.63 119.66 115.18 3fd6 s GLN 282 Ca 0.09 2.22 -0.37 0.00 -1.95 0.00 0.00 55.36 55.35 3fd6 s GLN 282 Cb 0.10 -3.14 -0.20 0.00 -0.22 0.00 0.00 33.01 29.55 3fd6 s GLN 282 CO 0.64 -0.37 1.58 0.00 -0.25 0.00 0.00 175.29 176.89 3fd6 h ARG 283 N 5.21 -1.18 -7.17 2.91 3.08 -0.28 -3.44 114.38 113.50 3fd6 h ARG 283 Ca -0.45 0.08 -0.54 0.00 0.07 0.00 0.00 59.98 59.14 3fd6 h ARG 283 Cb 1.22 0.27 0.16 0.00 0.08 0.00 0.00 29.97 31.69 3fd6 h ARG 283 CO 0.78 -0.79 0.40 -0.80 -1.07 0.00 0.00 179.97 178.49 3fd6 s ASN 284 N -4.13 4.18 -1.10 7.04 0.01 -1.26 -4.89 114.94 114.79 3fd6 s ASN 284 Ca -0.19 2.38 -0.22 0.00 -0.71 0.00 0.00 52.86 54.12 3fd6 s ASN 284 Cb 0.03 -2.59 -0.01 0.00 0.41 0.00 0.00 41.25 39.08 3fd6 s ASN 284 CO 0.60 -2.28 1.79 -1.61 -1.51 0.00 0.00 177.10 174.10 3fd6 s GLU 285 N -3.88 3.07 0.06 -0.60 2.02 -1.26 -4.86 118.70 113.25 3fd6 s GLU 285 Ca 0.75 -1.09 0.03 0.00 0.02 0.00 0.00 54.97 54.68 3fd6 s GLU 285 Cb -0.30 -5.28 -0.03 0.00 0.10 0.00 0.00 34.13 28.62 3fd6 s GLU 285 CO 0.45 -3.07 -0.10 0.14 0.02 0.00 0.00 175.26 172.70 3fd6 s VAL 286 N 8.01 0.80 0.22 2.63 -7.23 -1.04 -1.31 120.40 122.49 3fd6 s VAL 286 Ca 0.61 -1.28 0.07 0.00 -1.81 0.00 0.00 61.98 59.57 3fd6 s VAL 286 Cb -0.01 -0.93 -0.05 0.00 0.56 0.00 0.00 36.38 35.95 3fd6 s VAL 286 CO 0.03 -0.38 -0.11 -0.44 -0.31 0.00 0.00 175.10 173.89 3fd6 s SER 287 N -1.84 2.53 -0.10 4.85 0.01 -0.15 -1.48 113.70 117.53 3fd6 s SER 287 Ca -0.04 -1.08 -0.01 0.00 1.31 0.00 0.00 55.95 56.13 3fd6 s SER 287 Cb -0.08 -0.13 -0.03 0.00 0.21 0.00 0.00 66.02 65.99 3fd6 s SER 287 CO 0.01 -0.25 -0.05 -0.36 0.41 0.00 0.00 173.24 172.99 3fd6 s PHE 288 N -3.03 2.99 -0.11 2.43 0.08 -0.37 -2.14 117.98 117.82 3fd6 s PHE 288 Ca 0.24 -0.07 0.03 0.00 0.12 0.00 0.00 56.93 57.25 3fd6 s PHE 288 Cb 0.01 -1.79 0.01 0.00 -0.57 0.00 0.00 43.02 40.68 3fd6 s PHE 288 CO 0.08 0.23 -0.19 0.08 -0.10 0.00 0.00 175.22 175.32 3fd6 s VAL 289 N -0.46 1.80 -0.19 -0.44 1.01 -0.81 -2.20 120.40 119.11 3fd6 s VAL 289 Ca 0.07 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 3fd6 s VAL 289 Cb -0.12 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 3fd6 s VAL 289 CO 0.02 0.50 0.01 -0.63 0.00 0.00 0.00 175.10 175.00 3fd6 s ILE 290 N 0.73 4.14 -0.12 2.22 1.01 -0.42 -2.21 121.20 126.54 3fd6 s ILE 290 Ca -0.11 -0.26 0.10 0.00 0.00 0.00 0.00 60.65 60.39 3fd6 s ILE 290 Cb -0.16 -2.86 -0.15 0.00 0.01 0.00 0.00 42.46 39.30 3fd6 s ILE 290 CO 0.02 0.45 0.03 1.41 0.00 0.00 0.00 174.94 176.84 3fd6 n HIS 291 N 3.95 0.00 -4.19 3.97 8.25 -0.29 -1.42 115.22 125.49 3fd6 n HIS 291 Ca -0.17 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.18 3fd6 n HIS 291 Cb 0.52 -0.61 -0.10 0.00 1.12 0.00 0.00 29.99 30.92 3fd6 n HIS 291 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3fd6 s ASN 292 N -4.59 0.93 -0.07 0.41 2.20 -1.10 -1.57 114.94 111.16 3fd6 s ASN 292 Ca -0.07 -1.13 -0.02 0.00 -0.94 0.00 0.00 52.86 50.69 3fd6 s ASN 292 Cb 0.04 0.16 0.03 0.00 -2.00 0.00 0.00 41.25 39.48 3fd6 s ASN 292 CO 0.49 -0.59 0.05 -0.76 -2.94 0.00 0.00 177.10 173.35 3fd6 s LEU 293 N -3.10 0.33 0.04 3.54 1.43 -0.67 -4.78 118.68 115.48 3fd6 s LEU 293 Ca 0.20 -0.08 -0.29 0.00 -1.03 0.00 0.00 54.13 52.93 3fd6 s LEU 293 Cb 0.06 -0.26 -0.04 0.00 0.03 0.00 0.00 46.19 45.98 3fd6 s LEU 293 CO 0.00 -0.25 0.92 -2.16 0.23 0.00 0.00 176.35 175.09 3fd6 s PRO 294 N 2.10 4.59 -0.03 1.29 0.05 -1.26 -1.47 135.00 140.27 3fd6 s PRO 294 Ca 0.04 1.33 -0.02 0.00 0.05 0.00 0.00 61.00 62.41 3fd6 s PRO 294 Cb -0.13 -3.41 0.02 0.00 0.05 0.00 0.00 34.50 31.03 3fd6 s PRO 294 CO -0.04 0.11 0.07 0.08 0.05 0.00 0.00 177.00 177.26 3fd6 s VAL 295 N 0.46 -0.02 0.19 -0.36 1.01 -0.54 -0.98 120.40 120.15 3fd6 s VAL 295 Ca 0.47 0.08 -0.32 0.00 0.00 0.00 0.00 61.98 62.21 3fd6 s VAL 295 Cb -0.21 -0.11 -0.16 0.00 0.00 0.00 0.00 36.38 35.90 3fd6 s VAL 295 CO 0.27 0.03 1.09 0.18 0.00 0.00 0.00 175.10 176.68 3fd6 n LEU 296 N 3.52 1.33 -4.55 3.92 4.77 -0.61 -0.76 117.00 124.63 3fd6 n LEU 296 Ca -0.18 1.15 -0.53 0.00 -0.03 0.00 0.00 56.01 56.41 3fd6 n LEU 296 Cb 0.56 -1.20 -0.06 0.00 -2.33 0.00 0.00 43.42 40.39 3fd6 n LEU 296 CO 0.23 -1.45 0.70 0.00 -1.33 0.00 0.00 177.39 175.54 3fd6 n ALA 297 N 1.19 -1.79 0.00 -1.18 0.00 0.25 -2.50 120.51 116.48 3fd6 n ALA 297 Ca 0.14 0.52 0.00 0.00 0.00 0.00 0.00 53.44 54.11 3fd6 n ALA 297 Cb 0.25 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.76 3fd6 n ALA 297 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3fd6 n LYS 298 N 1.93 0.00 0.03 0.00 4.76 -1.26 -4.82 118.16 118.80 3fd6 n LYS 298 Ca 0.18 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.75 3fd6 n LYS 298 Cb 0.18 -0.31 0.60 0.00 -1.84 0.00 0.00 35.03 33.65 3fd6 n LYS 298 CO 0.00 0.00 0.00 0.52 -1.37 0.00 0.00 177.40 176.55 3fd6 h MET 299 N 0.38 0.17 0.00 1.97 2.86 -1.84 -0.89 114.93 117.58 3fd6 h MET 299 Ca 0.00 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.55 3fd6 h MET 299 Cb 0.00 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 3fd6 h MET 299 CO 0.00 0.11 -0.38 0.00 1.06 0.00 0.00 176.91 177.71 3fd6 h ALA 300 N 1.79 0.87 -0.19 6.32 0.00 -1.88 -1.11 119.26 125.06 3fd6 h ALA 300 Ca 0.19 -0.34 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 3fd6 h ALA 300 Cb 0.54 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3fd6 h ALA 300 CO -0.03 0.47 -0.49 0.00 0.00 0.00 0.00 179.25 179.20 3fd6 h ALA 301 N 1.62 0.31 -0.55 0.00 0.00 -1.58 -2.99 119.26 116.08 3fd6 h ALA 301 Ca -0.00 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.43 3fd6 h ALA 301 Cb 1.06 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.78 3fd6 h ALA 301 CO 0.05 0.48 0.34 0.28 0.00 0.00 0.00 179.25 180.40 3fd6 h VAL 302 N 0.35 1.08 -0.63 0.00 2.07 -1.19 -2.01 116.25 115.92 3fd6 h VAL 302 Ca -0.01 -0.23 0.12 0.00 0.82 0.00 0.00 66.70 67.40 3fd6 h VAL 302 Cb 1.11 0.34 -0.09 0.00 -1.52 0.00 0.00 31.29 31.13 3fd6 h VAL 302 CO 0.11 0.12 0.16 -1.28 0.02 0.00 0.00 177.57 176.70 3fd6 h SER 303 N 0.68 0.06 -0.16 0.57 0.87 -1.20 -2.10 113.55 112.25 3fd6 h SER 303 Ca 0.21 0.11 -0.13 0.00 -1.23 0.00 0.00 61.79 60.75 3fd6 h SER 303 Cb -0.01 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 3fd6 h SER 303 CO -0.08 0.03 -0.36 0.11 -0.53 0.00 0.00 176.83 176.00 3fd6 h LYS 304 N 0.30 0.68 0.00 2.24 6.56 -1.30 -2.15 116.57 122.89 3fd6 h LYS 304 Ca 0.34 -0.33 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 3fd6 h LYS 304 Cb 0.50 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.16 3fd6 h LYS 304 CO -0.40 0.94 0.00 0.00 -2.06 0.00 0.00 179.45 177.92 3fd6 n ALA 305 N -2.51 1.44 -1.04 3.86 0.00 -0.79 -2.92 120.51 118.54 3fd6 n ALA 305 Ca -0.01 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.47 3fd6 n ALA 305 Cb 0.50 -1.05 0.08 0.00 0.00 0.00 0.00 19.45 18.99 3fd6 n ALA 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fd6 n GLY 307 N -0.89 3.04 0.91 0.00 0.00 -1.15 -2.81 105.19 104.29 3fd6 n GLY 307 Ca 0.09 -0.34 0.02 0.00 0.00 0.00 0.00 46.02 45.80 3fd6 n GLY 307 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fd6 n ASN 308 N 1.30 2.41 -0.05 1.61 4.13 -1.26 -4.39 115.26 119.01 3fd6 n ASN 308 Ca 0.00 -2.27 -0.10 0.00 1.68 0.00 0.00 54.58 53.88 3fd6 n ASN 308 Cb 0.00 -0.54 -0.04 0.00 -1.54 0.00 0.00 39.78 37.66 3fd6 n ASN 308 CO 0.00 0.00 0.00 0.24 0.28 0.00 0.00 177.26 177.78 3fd6 h MET 309 N 1.25 0.28 0.00 3.52 2.86 -1.85 -3.39 114.93 117.60 3fd6 h MET 309 Ca 0.00 -0.04 -0.21 0.00 -2.06 0.00 0.00 59.70 57.39 3fd6 h MET 309 Cb 0.93 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.51 3fd6 h MET 309 CO 0.15 0.29 -1.61 1.19 1.06 0.00 0.00 176.91 177.98 3fd6 n PHE 310 N -4.88 0.00 -2.62 -0.22 3.72 -1.26 -3.95 117.46 108.25 3fd6 n PHE 310 Ca -0.04 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.31 3fd6 n PHE 310 Cb 0.09 -0.64 0.01 0.00 -0.94 0.00 0.00 39.48 38.00 3fd6 n PHE 310 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fd6 n GLY 311 N 1.66 0.53 0.19 1.37 0.00 -1.26 -3.77 105.19 103.91 3fd6 n GLY 311 Ca -0.30 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.35 3fd6 n GLY 311 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3fd6 h LEU 312 N -0.49 0.00 0.00 0.99 5.85 -1.93 -2.61 115.31 117.11 3fd6 h LEU 312 Ca -0.12 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.46 3fd6 h LEU 312 Cb 1.08 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 3fd6 h LEU 312 CO 0.13 0.00 -1.28 0.00 -0.34 0.00 0.00 178.44 176.95 3fd6 h MET 313 N 0.00 0.00 -0.01 1.25 -0.00 -1.95 -3.36 114.93 110.87 3fd6 h MET 313 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3fd6 h MET 313 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.99 3fd6 h MET 313 CO 0.00 0.25 -0.40 0.72 -0.00 0.00 0.00 176.91 177.48 3fd6 n HIS 314 N -2.88 0.00 -0.41 -0.10 8.25 -1.09 -4.95 115.22 114.05 3fd6 n HIS 314 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 3fd6 n HIS 314 Cb 0.78 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.84 3fd6 n HIS 314 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fd6 n GLY 315 N 1.39 0.78 0.86 -1.41 0.00 -1.08 -4.83 105.19 100.90 3fd6 n GLY 315 Ca 0.10 -0.18 0.08 0.00 0.00 0.00 0.00 46.02 46.03 3fd6 n GLY 315 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3fd6 n THR 316 N -2.41 2.11 -2.68 2.61 -2.24 -1.01 -1.76 114.28 108.90 3fd6 n THR 316 Ca 0.00 -1.75 -0.41 0.00 -2.27 0.00 0.00 64.05 59.61 3fd6 n THR 316 Cb 0.00 -0.15 -0.04 0.00 -2.10 0.00 0.00 70.33 68.04 3fd6 n THR 316 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fd6 s PRO 318 N 0.29 4.20 0.12 0.00 0.02 -1.26 -3.32 135.00 135.05 3fd6 s PRO 318 Ca 0.49 2.43 0.10 0.00 0.02 0.00 0.00 61.00 64.04 3fd6 s PRO 318 Cb -0.24 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 3fd6 s PRO 318 CO 0.30 -0.50 -0.24 -1.21 -0.33 0.00 0.00 177.00 175.02 3fd6 s GLU 319 N -0.66 1.54 -0.11 5.54 0.41 -1.05 -3.45 118.70 120.92 3fd6 s GLU 319 Ca 0.60 -1.28 0.03 0.00 -0.41 0.00 0.00 54.97 53.90 3fd6 s GLU 319 Cb -0.44 -1.98 0.01 0.00 -1.78 0.00 0.00 34.13 29.94 3fd6 s GLU 319 CO 0.47 0.46 -0.21 0.99 -0.49 0.00 0.00 175.26 176.48 3fd6 s THR 320 N -1.08 1.89 -1.43 3.63 2.01 -1.26 -2.59 115.64 116.81 3fd6 s THR 320 Ca 0.15 -0.91 -0.09 0.00 0.31 0.00 0.00 61.69 61.16 3fd6 s THR 320 Cb -0.10 -1.66 0.05 0.00 0.01 0.00 0.00 72.50 70.79 3fd6 s THR 320 CO 0.07 0.52 0.95 -0.24 -0.69 0.00 0.00 174.62 175.24 3fd6 n SER 321 N 3.78 -4.03 -2.65 3.53 2.88 -1.26 -4.76 113.62 111.11 3fd6 n SER 321 Ca -0.20 -0.74 0.00 0.00 -1.33 0.00 0.00 58.87 56.60 3fd6 n SER 321 Cb 0.52 -4.19 0.00 0.00 -0.75 0.00 0.00 64.21 59.79 3fd6 n SER 321 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3fd6 n GLY 322 N -1.69 -2.17 2.46 0.46 0.00 -0.67 -4.39 105.19 99.18 3fd6 n GLY 322 Ca -0.07 -1.47 -0.15 0.00 0.00 0.00 0.00 46.02 44.33 3fd6 n GLY 322 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fd6 n GLY 323 N 2.85 0.37 3.77 -0.02 0.00 -1.26 -4.59 105.19 106.31 3fd6 n GLY 323 Ca 0.00 -1.95 -0.38 0.00 0.00 0.00 0.00 46.02 43.68 3fd6 n GLY 323 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fd6 s LEU 324 N 0.00 4.40 -0.38 0.99 1.43 -1.26 -0.17 118.68 123.68 3fd6 s LEU 324 Ca 0.43 1.00 -0.12 0.00 -1.03 0.00 0.00 54.13 54.41 3fd6 s LEU 324 Cb -0.02 -2.75 0.03 0.00 0.03 0.00 0.00 46.19 43.47 3fd6 s LEU 324 CO 0.29 0.14 0.23 -0.22 0.23 0.00 0.00 176.35 177.02 3fd6 s LEU 325 N -0.23 4.82 -0.13 1.79 2.96 0.68 -2.67 118.68 125.90 3fd6 s LEU 325 Ca 0.27 -1.00 0.00 0.00 -0.22 0.00 0.00 54.13 53.18 3fd6 s LEU 325 Cb -0.17 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.46 3fd6 s LEU 325 CO 0.14 -0.41 -0.15 -0.63 -1.32 0.00 0.00 176.35 173.99 3fd6 s ILE 326 N 1.57 2.90 -0.28 6.68 1.01 -0.65 -2.20 121.20 130.24 3fd6 s ILE 326 Ca 0.02 -0.71 -0.22 0.00 0.00 0.00 0.00 60.65 59.74 3fd6 s ILE 326 Cb -0.19 -2.21 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 3fd6 s ILE 326 CO 0.07 0.53 0.70 0.00 0.00 0.00 0.00 174.94 176.24 3fd6 s LEU 328 N 2.71 2.22 0.23 0.00 1.43 -0.72 -1.09 118.68 123.46 3fd6 s LEU 328 Ca 0.29 -0.58 -0.31 0.00 -1.03 0.00 0.00 54.13 52.50 3fd6 s LEU 328 Cb -0.15 -0.86 -0.15 0.00 0.03 0.00 0.00 46.19 45.07 3fd6 s LEU 328 CO 0.10 0.09 1.16 -2.65 0.23 0.00 0.00 176.35 175.28 3fd6 n PRO 329 N 1.53 1.43 -0.23 1.29 -0.02 -1.26 -1.21 135.00 136.53 3fd6 n PRO 329 Ca -0.18 0.51 0.21 0.00 -2.02 0.00 0.00 63.50 62.01 3fd6 n PRO 329 Cb 0.54 -1.99 0.55 0.00 -0.02 0.00 0.00 33.50 32.58 3fd6 n PRO 329 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 3fd6 h ARG 330 N 3.02 0.32 0.00 -0.52 -0.00 -1.89 0.67 114.38 115.97 3fd6 h ARG 330 Ca -0.42 -0.02 0.00 0.00 -0.00 0.00 0.00 59.98 59.54 3fd6 h ARG 330 Cb 1.33 -0.07 0.00 0.00 -0.00 0.00 0.00 29.97 31.23 3fd6 h ARG 330 CO 0.68 0.21 0.00 1.05 -0.00 0.00 0.00 179.97 181.90 3fd6 h GLU 331 N 0.33 0.00 0.00 0.08 9.09 -1.90 -3.36 114.58 118.82 3fd6 h GLU 331 Ca 0.46 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.62 3fd6 h GLU 331 Cb 1.28 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 28.33 3fd6 h GLU 331 CO -0.15 0.00 -1.98 1.04 0.05 0.00 0.00 179.01 177.97 3fd6 n GLN 332 N -3.05 1.58 -0.35 1.06 1.13 0.16 -4.54 117.38 113.38 3fd6 n GLN 332 Ca 0.02 -0.01 0.26 0.00 -1.94 0.00 0.00 57.00 55.33 3fd6 n GLN 332 Cb 0.38 -1.37 0.53 0.00 0.11 0.00 0.00 30.24 29.89 3fd6 n GLN 332 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3fd6 h ALA 333 N 0.75 2.31 -0.49 -1.58 0.00 -1.54 -1.73 119.26 116.98 3fd6 h ALA 333 Ca -0.37 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 3fd6 h ALA 333 Cb 1.84 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.69 3fd6 h ALA 333 CO 0.02 -0.79 -0.16 0.00 0.00 0.00 0.00 179.25 178.32 3fd6 h ALA 334 N 1.64 0.79 -0.21 0.00 0.00 -1.81 -1.57 119.26 118.09 3fd6 h ALA 334 Ca 0.66 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 3fd6 h ALA 334 Cb 1.77 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.37 3fd6 h ALA 334 CO -0.36 0.66 0.03 0.00 0.00 0.00 0.00 179.25 179.58 3fd6 h ARG 335 N 0.84 0.35 -0.38 0.00 2.47 -1.61 -2.60 114.38 113.45 3fd6 h ARG 335 Ca 0.12 -0.09 0.07 0.00 -1.26 0.00 0.00 59.98 58.82 3fd6 h ARG 335 Cb 0.71 -0.04 -0.09 0.00 -1.65 0.00 0.00 29.97 28.90 3fd6 h ARG 335 CO 0.05 0.50 -0.41 0.35 0.56 0.00 0.00 179.97 181.02 3fd6 h PHE 336 N 0.14 -1.18 0.46 3.04 3.57 -1.18 0.17 116.94 121.96 3fd6 h PHE 336 Ca 0.06 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 3fd6 h PHE 336 Cb 0.32 0.57 0.00 0.00 2.79 0.00 0.00 35.95 39.64 3fd6 h PHE 336 CO 0.02 -0.43 -0.22 0.00 -2.23 0.00 0.00 178.31 175.44 3fd6 h ALA 338 N -0.08 -0.31 -0.37 0.00 0.00 -1.33 0.29 119.26 117.46 3fd6 h ALA 338 Ca -0.06 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3fd6 h ALA 338 Cb 0.48 1.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 3fd6 h ALA 338 CO 0.10 -0.84 0.24 1.49 0.00 0.00 0.00 179.25 180.24 3fd6 h GLU 339 N -0.11 0.48 0.00 0.00 4.57 -0.15 0.38 114.58 119.75 3fd6 h GLU 339 Ca 0.21 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.29 3fd6 h GLU 339 Cb 0.52 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 3fd6 h GLU 339 CO -0.84 0.32 -0.34 0.97 -1.18 0.00 0.00 179.01 177.93 3fd6 h ILE 340 N 0.49 1.00 0.00 2.32 2.10 0.04 -3.11 117.51 120.35 3fd6 h ILE 340 Ca 0.14 -1.29 -0.21 0.00 1.08 0.00 0.00 64.86 64.57 3fd6 h ILE 340 Cb -0.05 1.75 -0.03 0.00 -1.09 0.00 0.00 36.82 37.40 3fd6 h ILE 340 CO -0.03 0.34 -1.21 1.17 -1.08 0.00 0.00 178.15 177.33 3fd6 n LYS 341 N -3.77 0.55 0.31 2.19 4.81 0.03 -2.07 118.16 120.22 3fd6 n LYS 341 Ca -0.01 0.56 -0.12 0.00 -0.87 0.00 0.00 58.31 57.86 3fd6 n LYS 341 Cb 0.43 -1.73 -0.06 0.00 0.02 0.00 0.00 35.03 33.69 3fd6 n LYS 341 CO 0.00 0.00 0.00 0.77 1.17 0.00 0.00 177.40 179.34 3fd6 h SER 342 N -1.00 -0.68 0.00 3.14 0.02 -0.36 -3.36 113.55 111.31 3fd6 h SER 342 Ca -0.32 0.02 -0.58 0.00 -0.84 0.00 0.00 61.79 60.08 3fd6 h SER 342 Cb 1.21 0.18 0.06 0.00 0.14 0.00 0.00 62.40 63.98 3fd6 h SER 342 CO -0.19 -0.42 2.11 -2.65 -1.14 0.00 0.00 176.83 174.55 3fd6 n PRO 343 N -4.56 1.24 0.00 3.45 -0.02 -1.18 -4.99 135.00 128.94 3fd6 n PRO 343 Ca -0.10 -1.58 0.00 0.00 -2.02 0.00 0.00 63.50 59.80 3fd6 n PRO 343 Cb 0.32 -2.74 0.00 0.00 -0.02 0.00 0.00 33.50 31.06 3fd6 n PRO 343 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fd6 n GLY 348 N 4.49 2.26 2.94 -1.23 0.00 -1.26 -4.88 105.19 107.50 3fd6 n GLY 348 Ca 0.46 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 3fd6 n GLY 348 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3fd6 s HIS 349 N -1.94 0.27 0.64 1.61 3.76 -0.88 -4.93 115.29 113.82 3fd6 s HIS 349 Ca 0.00 -0.16 -0.16 0.00 -0.15 0.00 0.00 55.06 54.58 3fd6 s HIS 349 Cb 0.00 -0.17 -0.01 0.00 1.11 0.00 0.00 32.58 33.51 3fd6 s HIS 349 CO 0.00 -0.04 1.15 -1.14 -0.85 0.00 0.00 174.74 173.86 3fd6 s GLN 350 N -0.43 2.78 0.30 1.40 0.74 -1.26 -3.60 119.66 119.59 3fd6 s GLN 350 Ca -0.03 1.58 0.05 0.00 0.05 0.00 0.00 55.36 57.02 3fd6 s GLN 350 Cb -0.03 -1.93 -0.06 0.00 1.10 0.00 0.00 33.01 32.09 3fd6 s GLN 350 CO -0.00 -1.30 -0.01 0.00 -0.55 0.00 0.00 175.29 173.43 3fd6 s ALA 351 N -2.03 2.38 0.02 1.58 0.00 -1.26 -4.57 121.76 117.87 3fd6 s ALA 351 Ca 0.71 -1.99 0.02 0.00 0.00 0.00 0.00 51.96 50.71 3fd6 s ALA 351 Cb -0.25 0.38 -0.01 0.00 0.00 0.00 0.00 23.12 23.24 3fd6 s ALA 351 CO 0.38 -0.18 -0.07 -1.58 0.00 0.00 0.00 175.76 174.32 3fd6 s TRP 352 N -3.12 0.58 -0.51 0.00 0.51 0.58 -4.97 118.94 112.01 3fd6 s TRP 352 Ca 0.32 -0.27 -0.21 0.00 -2.12 0.00 0.00 56.10 53.82 3fd6 s TRP 352 Cb 0.06 -0.36 0.05 0.00 -0.81 0.00 0.00 33.47 32.41 3fd6 s TRP 352 CO 0.13 -0.04 0.72 0.42 -0.51 0.00 0.00 176.95 177.68 3fd6 s ILE 353 N -0.68 4.72 -1.03 2.03 1.01 -1.26 0.15 121.20 126.14 3fd6 s ILE 353 Ca -0.03 -0.20 0.21 0.00 0.00 0.00 0.00 60.65 60.62 3fd6 s ILE 353 Cb -0.06 -4.36 -0.21 0.00 0.01 0.00 0.00 42.46 37.84 3fd6 s ILE 353 CO 0.00 -0.88 0.89 2.30 0.00 0.00 0.00 174.94 177.25 3fd6 n ILE 354 N 5.81 0.00 -3.07 2.92 -5.35 0.13 -4.90 119.36 114.91 3fd6 n ILE 354 Ca -0.04 -0.03 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 3fd6 n ILE 354 Cb 0.46 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.38 3fd6 n ILE 354 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3fd6 n GLY 355 N 1.48 0.92 3.19 3.28 0.00 -1.21 -1.13 105.19 111.72 3fd6 n GLY 355 Ca 0.04 -0.66 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 3fd6 n GLY 355 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3fd6 s ILE 356 N -2.13 0.13 -0.13 -0.61 2.07 -0.94 -0.81 121.20 118.79 3fd6 s ILE 356 Ca 0.00 -1.61 -0.06 0.00 -1.41 0.00 0.00 60.65 57.57 3fd6 s ILE 356 Cb 0.00 -1.72 -0.04 0.00 0.13 0.00 0.00 42.46 40.83 3fd6 s ILE 356 CO 0.00 -0.59 0.10 -0.69 -1.91 0.00 0.00 174.94 171.84 3fd6 s VAL 357 N -3.96 5.13 0.18 4.00 1.01 0.44 -1.92 120.40 125.27 3fd6 s VAL 357 Ca 0.14 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 3fd6 s VAL 357 Cb 0.06 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 3fd6 s VAL 357 CO -0.04 0.58 0.11 -1.83 0.00 0.00 0.00 175.10 173.92 3fd6 s GLU 358 N -0.71 1.12 0.27 2.72 -1.05 -0.91 -1.40 118.70 118.73 3fd6 s GLU 358 Ca 0.13 -1.56 -0.30 0.00 -0.15 0.00 0.00 54.97 53.08 3fd6 s GLU 358 Cb -0.12 0.26 -0.13 0.00 -0.44 0.00 0.00 34.13 33.71 3fd6 s GLU 358 CO 0.03 -0.35 1.43 0.36 0.95 0.00 0.00 175.26 177.67 3fd6 n LYS 359 N -0.22 2.18 -0.26 -4.83 2.85 -1.26 -0.97 118.16 115.65 3fd6 n LYS 359 Ca -0.00 0.77 0.00 0.00 -1.05 0.00 0.00 58.31 58.03 3fd6 n LYS 359 Cb 0.65 -2.44 0.00 0.00 -0.65 0.00 0.00 35.03 32.59 3fd6 n LYS 359 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3fd6 n GLY 360 N 1.93 0.68 1.85 2.58 0.00 -0.42 -4.43 105.19 107.39 3fd6 n GLY 360 Ca 0.10 -0.62 -0.21 0.00 0.00 0.00 0.00 46.02 45.29 3fd6 n GLY 360 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3fd6 n ASN 361 N -0.00 4.85 -3.52 1.61 0.23 -1.26 -2.49 115.26 114.67 3fd6 n ASN 361 Ca 0.00 -3.78 -0.23 0.00 -0.53 0.00 0.00 54.58 50.04 3fd6 n ASN 361 Cb 0.00 -0.52 0.08 0.00 -2.08 0.00 0.00 39.78 37.26 3fd6 n ASN 361 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3fd6 n ARG 362 N -0.84 -7.77 -3.58 -3.83 1.74 -0.55 -4.97 116.66 96.86 3fd6 n ARG 362 Ca 0.44 0.81 -0.18 0.00 -0.77 0.00 0.00 57.85 58.15 3fd6 n ARG 362 Cb 0.90 -5.81 -0.04 0.00 -1.02 0.00 0.00 32.46 26.49 3fd6 n ARG 362 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3fd6 n THR 363 N -4.92 0.00 -3.59 0.55 -2.24 -1.26 -3.75 114.28 99.07 3fd6 n THR 363 Ca -0.00 -1.46 -0.16 0.00 -2.27 0.00 0.00 64.05 60.15 3fd6 n THR 363 Cb 0.56 0.37 -0.07 0.00 -2.10 0.00 0.00 70.33 69.10 3fd6 n THR 363 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fd6 s ALA 364 N -2.58 -1.66 0.11 6.98 0.00 -1.26 -1.23 121.76 122.12 3fd6 s ALA 364 Ca 0.04 1.47 -0.05 0.00 0.00 0.00 0.00 51.96 53.43 3fd6 s ALA 364 Cb 0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 3fd6 s ALA 364 CO 0.03 -0.34 0.12 -0.98 0.00 0.00 0.00 175.76 174.59 3fd6 s ARG 365 N -0.59 0.88 -0.17 0.00 1.70 -0.93 -4.80 118.95 115.03 3fd6 s ARG 365 Ca -0.07 -1.21 -0.09 0.00 -0.47 0.00 0.00 55.73 53.89 3fd6 s ARG 365 Cb -0.02 0.29 -0.05 0.00 -0.57 0.00 0.00 34.95 34.60 3fd6 s ARG 365 CO 0.06 -0.26 0.13 0.42 -1.08 0.00 0.00 175.30 174.57 3fd6 s ILE 366 N -3.95 5.43 0.82 4.99 -1.09 -1.26 -1.31 121.20 124.83 3fd6 s ILE 366 Ca 0.14 0.19 -0.14 0.00 -2.23 0.00 0.00 60.65 58.61 3fd6 s ILE 366 Cb 0.06 -3.43 0.04 0.00 -1.58 0.00 0.00 42.46 37.55 3fd6 s ILE 366 CO -0.05 0.51 0.81 2.30 -1.23 0.00 0.00 174.94 177.28 3fd6 n ILE 367 N 2.90 1.43 -0.17 2.92 -5.35 -0.51 -4.90 119.36 115.69 3fd6 n ILE 367 Ca -0.18 -0.26 -0.04 0.00 -0.27 0.00 0.00 62.75 62.01 3fd6 n ILE 367 Cb 0.53 -0.92 0.16 0.00 -1.74 0.00 0.00 39.64 37.67 3fd6 n ILE 367 CO 0.00 0.00 0.00 -0.78 -1.76 0.00 0.00 176.55 174.01 3fd6 h ASP 368 N -0.92 0.85 -2.42 7.28 3.58 -1.98 -3.27 116.42 119.54 3fd6 h ASP 368 Ca -0.45 -0.15 -0.62 0.00 0.42 0.00 0.00 57.03 56.23 3fd6 h ASP 368 Cb 1.31 -0.22 -0.41 0.00 1.72 0.00 0.00 39.33 41.73 3fd6 h ASP 368 CO 0.42 0.82 -0.51 1.17 -2.88 0.00 0.00 179.24 178.26 3fd6 n LYS 369 N -4.27 2.51 -2.19 0.28 4.81 -1.26 -5.09 118.16 112.96 3fd6 n LYS 369 Ca 0.04 -4.64 -0.37 0.00 -0.87 0.00 0.00 58.31 52.48 3fd6 n LYS 369 Cb 0.23 -2.28 -0.00 0.00 0.02 0.00 0.00 35.03 32.99 3fd6 n LYS 369 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 3fd6 s PRO 370 N -2.29 3.65 -0.15 1.64 0.04 -1.24 -4.95 135.00 131.70 3fd6 s PRO 370 Ca 0.36 1.84 -0.29 0.00 0.04 0.00 0.00 61.00 62.95 3fd6 s PRO 370 Cb 0.10 -2.37 -0.01 0.00 0.04 0.00 0.00 34.50 32.27 3fd6 s PRO 370 CO -0.04 -0.66 1.15 0.50 0.04 0.00 0.00 177.00 177.99 3fd6 s ARG 371 N -2.75 4.30 -0.26 4.56 3.52 -0.61 -4.93 118.95 122.78 3fd6 s ARG 371 Ca 0.65 1.54 -0.17 0.00 -0.13 0.00 0.00 55.73 57.62 3fd6 s ARG 371 Cb -0.30 -3.65 -0.03 0.00 -1.56 0.00 0.00 34.95 29.41 3fd6 s ARG 371 CO 0.36 -0.57 0.47 0.42 -0.81 0.00 0.00 175.30 175.18 3fd6 s ILE 372 N 2.90 5.11 -0.33 4.11 -1.09 -1.26 -1.67 121.20 128.96 3fd6 s ILE 372 Ca 0.51 0.79 -0.11 0.00 -2.23 0.00 0.00 60.65 59.61 3fd6 s ILE 372 Cb -0.20 -3.79 -0.00 0.00 -1.58 0.00 0.00 42.46 36.89 3fd6 s ILE 372 CO 0.14 0.12 0.19 -0.63 -1.23 0.00 0.00 174.94 173.53 3fd6 s ILE 373 N 2.17 4.82 -0.81 2.92 1.01 -0.54 -4.99 121.20 125.78 3fd6 s ILE 373 Ca 0.20 -0.44 -0.20 0.00 0.00 0.00 0.00 60.65 60.21 3fd6 s ILE 373 Cb -0.16 -3.51 0.10 0.00 0.01 0.00 0.00 42.46 38.91 3fd6 s ILE 373 CO 0.09 -0.01 1.05 -1.61 0.00 0.00 0.00 174.94 174.46 3fd6 s GLU 374 N 1.64 3.38 -0.36 2.79 0.41 -1.26 -1.47 118.70 123.82 3fd6 s GLU 374 Ca 0.05 -1.36 -0.29 0.00 -0.41 0.00 0.00 54.97 52.96 3fd6 s GLU 374 Cb -0.18 -4.63 0.01 0.00 -1.78 0.00 0.00 34.13 27.55 3fd6 s GLU 374 CO 0.08 -1.79 1.34 0.08 -0.49 0.00 0.00 175.26 174.48 3fd6 s VAL 375 N 3.29 4.03 0.34 2.63 1.01 0.06 -4.67 120.40 127.09 3fd6 s VAL 375 Ca 0.28 1.11 -0.10 0.00 0.00 0.00 0.00 61.98 63.27 3fd6 s VAL 375 Cb -0.10 -4.20 -0.07 0.00 0.00 0.00 0.00 36.38 32.01 3fd6 s VAL 375 CO -0.01 -0.64 0.68 0.00 0.00 0.00 0.00 175.10 175.13 3fd6 s ALA 376 N 4.88 3.44 -2.00 5.51 0.00 -1.26 0.88 121.76 133.20 3fd6 s ALA 376 Ca 0.58 -0.26 0.10 0.00 0.00 0.00 0.00 51.96 52.39 3fd6 s ALA 376 Cb -0.15 -2.58 0.60 0.00 0.00 0.00 0.00 23.12 20.99 3fd6 s ALA 376 CO 0.28 0.17 1.04 -2.30 0.00 0.00 0.00 175.76 174.96