#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i7a h ASN 3 N 0.00 0.98 -0.01 -3.46 -1.24 -2.06 -1.82 115.58 107.98 3i7a h ASN 3 Ca 0.00 -0.33 -0.07 0.00 0.71 0.00 0.00 56.30 56.61 3i7a h ASN 3 Cb 0.00 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.77 3i7a h ASN 3 CO 0.00 1.11 -0.17 -0.33 -1.29 0.00 0.00 177.43 176.75 3i7a h GLU 4 N 0.87 0.35 -0.34 6.67 3.07 -2.02 -1.95 114.58 121.22 3i7a h GLU 4 Ca 0.13 -0.10 -0.05 0.00 -0.50 0.00 0.00 59.36 58.83 3i7a h GLU 4 Cb 0.69 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.55 3i7a h GLU 4 CO 0.05 0.52 0.00 1.25 -1.40 0.00 0.00 179.01 179.44 3i7a h HIS 5 N 0.33 0.65 -0.20 4.33 -0.00 -1.96 -1.35 115.15 116.95 3i7a h HIS 5 Ca 0.06 -0.11 -0.07 0.00 -0.00 0.00 0.00 60.37 60.25 3i7a h HIS 5 Cb 0.50 -0.17 -0.01 0.00 -0.00 0.00 0.00 27.41 27.73 3i7a h HIS 5 CO 0.01 0.71 -0.17 1.96 -0.00 0.00 0.00 177.93 180.44 3i7a h GLN 6 N 0.41 0.33 -0.51 5.26 1.08 -1.08 -0.70 115.11 119.90 3i7a h GLN 6 Ca 0.10 -0.09 -0.12 0.00 -1.45 0.00 0.00 58.65 57.08 3i7a h GLN 6 Cb 0.44 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 27.82 3i7a h GLN 6 CO 0.02 0.50 -0.15 -0.07 -0.95 0.00 0.00 178.83 178.18 3i7a h LEU 7 N 0.31 1.01 -0.51 1.46 3.38 -1.12 -0.81 115.31 119.03 3i7a h LEU 7 Ca 0.06 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.66 3i7a h LEU 7 Cb 0.49 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 3i7a h LEU 7 CO 0.03 1.15 0.34 0.25 0.09 0.00 0.00 178.44 180.30 3i7a h LEU 8 N 0.86 0.59 -0.62 1.67 6.46 -0.80 -2.09 115.31 121.37 3i7a h LEU 8 Ca 0.13 -0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.84 3i7a h LEU 8 Cb 0.72 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.48 3i7a h LEU 8 CO 0.06 0.43 0.29 0.58 -0.62 0.00 0.00 178.44 179.17 3i7a h VAL 9 N 0.69 1.22 -0.44 1.05 2.07 -0.90 -1.10 116.25 118.84 3i7a h VAL 9 Ca 0.19 -0.64 -0.07 0.00 0.82 0.00 0.00 66.70 67.00 3i7a h VAL 9 Cb -0.07 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 3i7a h VAL 9 CO -0.04 0.26 -0.01 1.23 0.02 0.00 0.00 177.57 179.02 3i7a h GLY 10 N 0.86 0.85 0.99 2.17 0.00 -1.02 -1.41 103.07 105.50 3i7a h GLY 10 Ca 0.21 -0.63 0.01 0.00 0.00 0.00 0.00 47.33 46.92 3i7a h GLY 10 CO -0.02 0.58 0.46 -2.00 0.00 0.00 0.00 176.54 175.56 3i7a h LEU 11 N 0.62 0.80 -0.97 3.11 5.85 -1.10 -2.31 115.31 121.31 3i7a h LEU 11 Ca 0.12 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.81 3i7a h LEU 11 Cb 0.51 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 3i7a h LEU 11 CO 0.03 0.58 0.46 0.25 -0.34 0.00 0.00 178.44 179.41 3i7a h LEU 12 N 0.94 1.06 -0.65 2.25 5.85 -0.99 -0.83 115.31 122.95 3i7a h LEU 12 Ca 0.26 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.82 3i7a h LEU 12 Cb -0.10 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.63 3i7a h LEU 12 CO -0.06 0.85 0.16 0.50 -0.34 0.00 0.00 178.44 179.56 3i7a h LYS 13 N 1.19 1.03 -0.41 1.25 3.64 -0.94 0.22 116.57 122.55 3i7a h LYS 13 Ca 0.30 -0.25 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 3i7a h LYS 13 Cb 0.03 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 3i7a h LYS 13 CO -0.05 0.93 -0.13 0.87 -2.27 0.00 0.00 179.45 178.80 3i7a h LYS 14 N 0.96 0.74 0.25 1.90 1.57 -0.95 0.10 116.57 121.13 3i7a h LYS 14 Ca 0.20 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3i7a h LYS 14 Cb 0.35 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3i7a h LYS 14 CO 0.00 0.84 -0.12 1.25 -0.57 0.00 0.00 179.45 180.85 3i7a h LEU 15 N 0.67 -0.28 -1.10 2.94 5.85 -0.77 0.16 115.31 122.78 3i7a h LEU 15 Ca 0.11 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 3i7a h LEU 15 Cb 0.60 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.68 3i7a h LEU 15 CO 0.04 -0.13 0.27 0.11 -0.34 0.00 0.00 178.44 178.38 3i7a h LYS 16 N -0.41 0.90 0.00 1.25 1.57 -0.34 -1.72 116.57 117.81 3i7a h LYS 16 Ca -0.03 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.61 3i7a h LYS 16 Cb 0.31 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3i7a h LYS 16 CO 0.06 0.72 0.00 -0.25 -0.57 0.00 0.00 179.45 179.41 3i7a n ASP 17 N -4.33 0.00 -3.86 0.86 8.00 0.33 -4.91 116.55 112.65 3i7a n ASP 17 Ca 0.05 -0.90 -0.27 0.00 0.71 0.00 0.00 54.79 54.38 3i7a n ASP 17 Cb 0.16 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.28 3i7a n ASP 17 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3i7a n ASP 18 N -0.97 -3.43 -0.59 -2.24 2.03 -0.65 -4.90 116.55 105.80 3i7a n ASP 18 Ca 0.19 -0.81 0.09 0.00 0.52 0.00 0.00 54.79 54.78 3i7a n ASP 18 Cb 0.09 -3.88 0.04 0.00 -0.72 0.00 0.00 41.12 36.66 3i7a n ASP 18 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3i7a n ALA 19 N -4.54 2.79 -1.96 -1.67 0.00 0.48 -4.97 120.51 110.63 3i7a n ALA 19 Ca -0.08 -0.61 -0.30 0.00 0.00 0.00 0.00 53.44 52.46 3i7a n ALA 19 Cb 0.58 -0.61 0.02 0.00 0.00 0.00 0.00 19.45 19.44 3i7a n ALA 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3i7a s LEU 20 N -1.76 3.22 -0.45 0.00 1.43 -1.22 -4.98 118.68 114.92 3i7a s LEU 20 Ca 0.18 1.19 -0.16 0.00 -1.03 0.00 0.00 54.13 54.32 3i7a s LEU 20 Cb 0.15 -4.14 0.05 0.00 0.03 0.00 0.00 46.19 42.27 3i7a s LEU 20 CO 0.31 -0.96 0.39 -0.63 0.23 0.00 0.00 176.35 175.70 3i7a s ILE 21 N -3.13 5.19 -0.01 -0.59 -1.09 -1.26 -5.04 121.20 115.27 3i7a s ILE 21 Ca 0.54 -0.77 -0.18 0.00 -2.23 0.00 0.00 60.65 58.01 3i7a s ILE 21 Cb -0.11 -4.07 -0.06 0.00 -1.58 0.00 0.00 42.46 36.65 3i7a s ILE 21 CO 0.51 -0.49 0.51 -0.76 -1.23 0.00 0.00 174.94 173.48 3i7a s LEU 22 N 1.83 4.43 0.44 2.97 1.43 -1.26 -4.36 118.68 124.15 3i7a s LEU 22 Ca 0.07 1.06 -0.25 0.00 -1.03 0.00 0.00 54.13 53.97 3i7a s LEU 22 Cb -0.21 -2.77 -0.08 0.00 0.03 0.00 0.00 46.19 43.16 3i7a s LEU 22 CO 0.09 0.19 1.38 -2.16 0.23 0.00 0.00 176.35 176.07 3i7a s PRO 23 N -0.49 3.74 0.17 1.29 0.04 -1.26 -4.98 135.00 133.52 3i7a s PRO 23 Ca 0.27 2.30 -0.30 0.00 0.04 0.00 0.00 61.00 63.32 3i7a s PRO 23 Cb -0.17 -2.66 -0.07 0.00 0.04 0.00 0.00 34.50 31.64 3i7a s PRO 23 CO 0.15 -0.73 1.09 0.99 0.04 0.00 0.00 177.00 178.54 3i7a s THR 24 N -1.24 3.90 0.14 1.26 2.01 -1.26 -5.01 115.64 115.44 3i7a s THR 24 Ca 0.60 1.63 -0.31 0.00 0.31 0.00 0.00 61.69 63.92 3i7a s THR 24 Cb -0.41 -4.04 -0.09 0.00 0.01 0.00 0.00 72.50 67.96 3i7a s THR 24 CO 0.53 0.28 1.57 -0.22 -0.69 0.00 0.00 174.62 176.09 3i7a s LEU 25 N -0.33 4.37 0.45 4.42 2.96 -1.26 -4.91 118.68 124.38 3i7a s LEU 25 Ca 0.49 2.56 -0.25 0.00 -0.22 0.00 0.00 54.13 56.71 3i7a s LEU 25 Cb -0.29 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 42.73 3i7a s LEU 25 CO 0.35 -0.83 1.43 -2.65 -1.32 0.00 0.00 176.35 173.33 3i7a n PRO 26 N 4.39 2.26 -0.34 0.98 -0.02 -1.26 -4.86 135.00 136.15 3i7a n PRO 26 Ca 0.14 0.81 0.19 0.00 -2.02 0.00 0.00 63.50 62.61 3i7a n PRO 26 Cb 0.39 -2.63 0.41 0.00 -0.02 0.00 0.00 33.50 31.66 3i7a n PRO 26 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3i7a h GLU 27 N 2.30 0.53 -0.36 -0.52 4.57 -1.99 0.10 114.58 119.22 3i7a h GLU 27 Ca -0.51 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 57.60 3i7a h GLU 27 Cb 1.27 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.72 3i7a h GLU 27 CO 0.61 0.35 0.06 -0.24 -1.18 0.00 0.00 179.01 178.61 3i7a h VAL 28 N 0.55 1.18 0.00 0.32 3.04 -2.00 0.18 116.25 119.51 3i7a h VAL 28 Ca 0.62 -0.65 0.00 0.00 -1.01 0.00 0.00 66.70 65.66 3i7a h VAL 28 Cb 1.27 0.84 0.00 0.00 -2.01 0.00 0.00 31.29 31.39 3i7a h VAL 28 CO -0.41 0.23 0.00 0.00 -1.01 0.00 0.00 177.57 176.38 3i7a n ALA 29 N -2.48 1.42 0.00 3.17 0.00 0.35 -1.97 120.51 121.00 3i7a n ALA 29 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3i7a n ALA 29 Cb 0.20 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3i7a n ALA 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3i7a n ARG 31 N 0.42 0.00 -0.08 0.00 1.74 0.62 -1.31 116.66 118.05 3i7a n ARG 31 Ca 0.00 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.97 3i7a n ARG 31 Cb 0.07 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.47 3i7a n ARG 31 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3i7a h VAL 32 N 0.00 1.26 -0.98 1.55 2.07 -1.65 -1.52 116.25 116.99 3i7a h VAL 32 Ca 0.00 -0.92 0.11 0.00 0.82 0.00 0.00 66.70 66.71 3i7a h VAL 32 Cb 0.00 1.40 -0.08 0.00 -1.52 0.00 0.00 31.29 31.09 3i7a h VAL 32 CO 0.00 0.29 0.62 1.56 0.02 0.00 0.00 177.57 180.06 3i7a h GLN 33 N 0.19 0.95 -0.44 1.57 7.50 -1.46 -0.25 115.11 123.18 3i7a h GLN 33 Ca 0.07 -0.06 -0.05 0.00 0.50 0.00 0.00 58.65 59.11 3i7a h GLN 33 Cb 0.43 -0.21 -0.02 0.00 0.05 0.00 0.00 27.48 27.72 3i7a h GLN 33 CO 0.01 0.63 0.09 0.93 -1.50 0.00 0.00 178.83 179.00 3i7a h GLU 34 N 0.98 0.71 0.02 1.46 5.08 -1.75 -2.47 114.58 118.61 3i7a h GLU 34 Ca 0.47 -0.18 -0.25 0.00 -1.00 0.00 0.00 59.36 58.40 3i7a h GLU 34 Cb 0.46 -0.09 0.02 0.00 0.50 0.00 0.00 28.75 29.64 3i7a h GLU 34 CO -0.24 0.73 -0.99 0.28 -1.00 0.00 0.00 179.01 177.79 3i7a h VAL 35 N 0.58 1.31 0.00 3.13 2.07 -0.68 -3.24 116.25 119.42 3i7a h VAL 35 Ca 0.14 -2.25 -0.07 0.00 0.82 0.00 0.00 66.70 65.33 3i7a h VAL 35 Cb 0.34 2.48 -0.01 0.00 -1.52 0.00 0.00 31.29 32.58 3i7a h VAL 35 CO 0.00 0.69 -0.35 0.58 0.02 0.00 0.00 177.57 178.51 3i7a h VAL 36 N 0.27 1.25 0.00 2.57 2.07 -1.11 -2.60 116.25 118.70 3i7a h VAL 36 Ca -0.13 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.18 3i7a h VAL 36 Cb 1.66 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.08 3i7a h VAL 36 CO 0.19 0.35 0.00 1.23 0.02 0.00 0.00 177.57 179.36 3i7a h GLY 37 N 1.06 0.00 -2.68 2.17 0.00 -1.46 -3.45 103.07 98.71 3i7a h GLY 37 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 3i7a h GLY 37 CO 0.05 0.00 0.54 0.50 0.00 0.00 0.00 176.54 177.62 3i7a s ARG 38 N -3.53 3.39 0.20 4.80 0.52 -0.98 -4.94 118.95 118.42 3i7a s ARG 38 Ca 0.03 1.99 0.25 0.00 -0.52 0.00 0.00 55.73 57.47 3i7a s ARG 38 Cb 0.08 -2.29 0.90 0.00 0.52 0.00 0.00 34.95 34.17 3i7a s ARG 38 CO 0.56 -0.91 1.74 -0.35 0.02 0.00 0.00 175.30 176.36 3i7a n PRO 39 N -0.85 0.20 -0.21 3.54 -0.04 -1.26 -3.33 135.00 133.04 3i7a n PRO 39 Ca 0.09 0.28 0.06 0.00 -0.04 0.00 0.00 63.50 63.90 3i7a n PRO 39 Cb 0.47 -1.79 0.16 0.00 -0.04 0.00 0.00 33.50 32.30 3i7a n PRO 39 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3i7a n ASP 40 N -2.14 2.97 -4.74 3.54 5.75 -1.26 -5.04 116.55 115.62 3i7a n ASP 40 Ca 0.04 -2.52 -0.41 0.00 -0.01 0.00 0.00 54.79 51.90 3i7a n ASP 40 Cb 0.33 -0.32 -0.04 0.00 -1.03 0.00 0.00 41.12 40.05 3i7a n ASP 40 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3i7a s SER 41 N -1.62 7.34 0.28 -1.12 1.04 -1.21 -5.04 113.70 113.36 3i7a s SER 41 Ca 0.27 2.06 0.09 0.00 0.48 0.00 0.00 55.95 58.85 3i7a s SER 41 Cb 0.20 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.67 3i7a s SER 41 CO 0.08 -0.15 0.06 -0.94 0.98 0.00 0.00 173.24 173.27 3i7a s SER 42 N -0.32 4.72 0.17 7.02 1.04 -1.26 -5.04 113.70 120.04 3i7a s SER 42 Ca 0.47 -0.61 -0.20 0.00 0.48 0.00 0.00 55.95 56.10 3i7a s SER 42 Cb -0.29 -0.91 0.11 0.00 0.10 0.00 0.00 66.02 65.03 3i7a s SER 42 CO 0.35 -0.06 1.62 -0.07 0.98 0.00 0.00 173.24 176.05 3i7a h LEU 43 N 1.76 -0.82 -0.56 2.42 3.38 -1.97 -1.98 115.31 117.53 3i7a h LEU 43 Ca -0.45 0.17 0.08 0.00 0.09 0.00 0.00 57.88 57.78 3i7a h LEU 43 Cb 1.25 0.43 -0.07 0.00 0.09 0.00 0.00 40.66 42.36 3i7a h LEU 43 CO 0.61 -0.26 0.20 0.50 0.09 0.00 0.00 178.44 179.57 3i7a h LYS 44 N -0.16 0.36 -0.88 1.13 3.64 -1.96 -0.43 116.57 118.27 3i7a h LYS 44 Ca 0.20 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 3i7a h LYS 44 Cb 0.48 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.17 3i7a h LYS 44 CO -0.53 0.24 0.51 1.96 -2.27 0.00 0.00 179.45 179.35 3i7a h GLN 45 N 0.37 1.21 -0.10 1.90 4.20 -1.87 0.07 115.11 120.89 3i7a h GLN 45 Ca 0.28 -0.13 -0.02 0.00 0.06 0.00 0.00 58.65 58.84 3i7a h GLN 45 Cb 0.33 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 3i7a h GLN 45 CO -0.29 0.87 -0.03 0.28 -0.67 0.00 0.00 178.83 178.99 3i7a h VAL 46 N 1.23 1.30 -0.65 -0.54 2.07 -0.56 -2.75 116.25 116.35 3i7a h VAL 46 Ca 0.31 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.88 3i7a h VAL 46 Cb -0.01 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 3i7a h VAL 46 CO -0.05 0.28 0.43 0.00 0.02 0.00 0.00 177.57 178.24 3i7a h ALA 47 N 0.68 1.57 -0.75 1.67 0.00 -0.85 -0.83 119.26 120.75 3i7a h ALA 47 Ca 0.03 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 3i7a h ALA 47 Cb 0.45 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3i7a h ALA 47 CO 0.01 0.39 0.22 0.93 0.00 0.00 0.00 179.25 180.81 3i7a h GLU 48 N 0.85 1.17 -0.13 0.00 5.08 -0.93 0.51 114.58 121.12 3i7a h GLU 48 Ca 0.24 -0.26 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 3i7a h GLU 48 Cb -0.05 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.03 3i7a h GLU 48 CO -0.06 0.99 -0.19 0.82 -1.00 0.00 0.00 179.01 179.58 3i7a h ILE 49 N 1.12 1.37 -0.60 3.13 1.08 -1.12 -3.05 117.51 119.43 3i7a h ILE 49 Ca 0.24 -1.42 -0.01 0.00 -0.39 0.00 0.00 64.86 63.28 3i7a h ILE 49 Cb 0.32 2.00 -0.03 0.00 -3.07 0.00 0.00 36.82 36.04 3i7a h ILE 49 CO -0.01 0.41 0.34 0.40 -0.69 0.00 0.00 178.15 178.61 3i7a h ILE 50 N -0.06 1.18 -0.41 -0.67 2.04 -1.03 -2.68 117.51 115.88 3i7a h ILE 50 Ca 0.01 -0.43 0.12 0.00 1.00 0.00 0.00 64.86 65.56 3i7a h ILE 50 Cb 0.75 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 3i7a h ILE 50 CO 0.04 0.19 0.34 1.23 0.00 0.00 0.00 178.15 179.96 3i7a h GLY 51 N 0.89 0.00 2.00 5.37 0.00 0.13 -1.66 103.07 109.80 3i7a h GLY 51 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 3i7a h GLY 51 CO -0.04 0.00 0.00 1.46 0.00 0.00 0.00 176.54 177.96 3i7a h GLN 52 N 0.00 0.00 -4.64 4.80 4.20 -1.46 -3.39 115.11 114.62 3i7a h GLN 52 Ca 0.20 0.00 -0.69 0.00 0.06 0.00 0.00 58.65 58.22 3i7a h GLN 52 Cb 0.87 0.00 -0.34 0.00 0.30 0.00 0.00 27.48 28.31 3i7a h GLN 52 CO -0.00 0.00 -0.64 0.34 -0.67 0.00 0.00 178.83 177.86 3i7a s ASP 53 N -4.65 5.03 0.19 1.46 -1.08 -0.63 -5.00 116.67 111.99 3i7a s ASP 53 Ca 0.01 -1.70 -0.12 0.00 -0.52 0.00 0.00 52.55 50.22 3i7a s ASP 53 Cb 0.09 -1.75 0.17 0.00 -1.46 0.00 0.00 42.92 39.97 3i7a s ASP 53 CO 0.39 -0.39 1.77 0.00 0.52 0.00 0.00 175.17 177.46 3i7a h ALA 54 N 7.97 0.68 -0.15 3.66 0.00 -1.84 0.21 119.26 129.79 3i7a h ALA 54 Ca -0.16 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3i7a h ALA 54 Cb 1.05 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3i7a h ALA 54 CO 0.60 -0.12 -0.05 0.00 0.00 0.00 0.00 179.25 179.67 3i7a h ALA 55 N 1.31 0.21 -0.14 0.00 0.00 -1.95 -1.27 119.26 117.41 3i7a h ALA 55 Ca 0.24 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 3i7a h ALA 55 Cb 0.20 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3i7a h ALA 55 CO -0.20 -0.02 0.08 0.82 0.00 0.00 0.00 179.25 179.93 3i7a h ILE 56 N -0.02 1.09 -0.12 0.00 1.08 -1.82 -2.21 117.51 115.50 3i7a h ILE 56 Ca 0.04 -0.25 0.03 0.00 -0.39 0.00 0.00 64.86 64.29 3i7a h ILE 56 Cb 0.50 1.00 -0.03 0.00 -3.07 0.00 0.00 36.82 35.22 3i7a h ILE 56 CO 0.02 0.08 -0.08 0.28 -0.69 0.00 0.00 178.15 177.77 3i7a h SER 57 N 0.14 -0.24 -0.79 1.72 0.02 -0.95 -1.24 113.55 112.20 3i7a h SER 57 Ca 0.05 0.06 0.14 0.00 -0.84 0.00 0.00 61.79 61.20 3i7a h SER 57 Cb 0.07 0.13 -0.09 0.00 0.14 0.00 0.00 62.40 62.64 3i7a h SER 57 CO -0.01 -0.10 0.37 0.00 -1.14 0.00 0.00 176.83 175.94 3i7a h ALA 58 N 1.03 1.14 -0.31 3.77 0.00 -1.13 -2.00 119.26 121.76 3i7a h ALA 58 Ca 0.07 0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.91 3i7a h ALA 58 Cb 0.18 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3i7a h ALA 58 CO -0.17 -0.14 -0.45 -0.09 0.00 0.00 0.00 179.25 178.39 3i7a h ARG 59 N 0.54 0.86 -0.56 0.00 9.65 -0.90 -2.35 114.38 121.62 3i7a h ARG 59 Ca 0.43 -0.51 -0.06 0.00 -1.10 0.00 0.00 59.98 58.74 3i7a h ARG 59 Cb 0.61 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.21 3i7a h ARG 59 CO -0.37 1.15 0.12 0.82 2.80 0.00 0.00 179.97 184.49 3i7a h ILE 60 N 0.65 1.23 -0.41 1.20 2.04 -0.96 0.24 117.51 121.50 3i7a h ILE 60 Ca 0.03 -0.86 0.02 0.00 1.00 0.00 0.00 64.86 65.05 3i7a h ILE 60 Cb 1.06 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 3i7a h ILE 60 CO 0.11 0.32 0.24 0.40 0.00 0.00 0.00 178.15 179.21 3i7a h ILE 61 N 0.83 1.04 -0.77 -0.67 2.04 -1.31 0.15 117.51 118.82 3i7a h ILE 61 Ca 0.18 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.88 3i7a h ILE 61 Cb 0.33 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 3i7a h ILE 61 CO 0.00 0.09 0.51 0.11 0.00 0.00 0.00 178.15 178.86 3i7a h LYS 62 N 0.48 1.02 -0.47 2.37 1.57 -0.79 -1.35 116.57 119.40 3i7a h LYS 62 Ca 0.16 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3i7a h LYS 62 Cb 0.01 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.08 3i7a h LYS 62 CO -0.08 0.68 0.02 0.28 -0.57 0.00 0.00 179.45 179.78 3i7a h VAL 63 N 1.05 1.26 -0.21 0.50 2.07 -0.54 -1.44 116.25 118.93 3i7a h VAL 63 Ca 0.28 -1.02 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 3i7a h VAL 63 Cb -0.11 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3i7a h VAL 63 CO -0.06 0.35 0.04 0.00 0.02 0.00 0.00 177.57 177.93 3i7a h ALA 64 N 0.93 1.68 -0.01 1.67 0.00 -0.47 -1.77 119.26 121.29 3i7a h ALA 64 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3i7a h ALA 64 Cb 0.47 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3i7a h ALA 64 CO 0.02 0.25 -0.17 0.09 0.00 0.00 0.00 179.25 179.44 3i7a n ASN 65 N -4.41 1.10 -4.78 0.00 3.02 -0.53 -3.81 115.26 105.86 3i7a n ASN 65 Ca 0.00 -1.04 -0.30 0.00 -0.03 0.00 0.00 54.58 53.22 3i7a n ASN 65 Cb 0.15 0.08 0.11 0.00 -0.61 0.00 0.00 39.78 39.51 3i7a n ASN 65 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3i7a s SER 66 N -2.35 4.04 0.59 6.41 1.04 -0.57 -4.67 113.70 118.19 3i7a s SER 66 Ca 0.29 1.26 0.29 0.00 0.48 0.00 0.00 55.95 58.27 3i7a s SER 66 Cb 0.20 -1.96 1.40 0.00 0.10 0.00 0.00 66.02 65.76 3i7a s SER 66 CO 0.46 -2.25 1.79 0.00 0.98 0.00 0.00 173.24 174.23 3i7a h ALA 67 N -1.28 2.34 -0.08 5.32 0.00 -1.84 -0.52 119.26 123.20 3i7a h ALA 67 Ca -0.48 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 3i7a h ALA 67 Cb 1.29 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 3i7a h ALA 67 CO 0.59 -0.92 -0.27 1.25 0.00 0.00 0.00 179.25 179.90 3i7a h LEU 68 N 0.00 0.14 -0.15 0.00 5.85 -1.89 -3.35 115.31 115.91 3i7a h LEU 68 Ca 0.28 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.96 3i7a h LEU 68 Cb 1.52 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.51 3i7a h LEU 68 CO -0.00 0.41 0.00 -1.22 -0.34 0.00 0.00 178.44 177.29 3i7a n TYR 69 N -4.17 0.00 -3.79 1.25 4.01 -0.71 -5.07 117.16 108.69 3i7a n TYR 69 Ca -0.01 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.59 3i7a n TYR 69 Cb 0.35 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.24 3i7a n TYR 69 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3i7a s SER 70 N -0.56 -0.08 -0.12 7.72 0.15 -0.28 -4.94 113.70 115.59 3i7a s SER 70 Ca 0.00 0.23 0.17 0.00 0.70 0.00 0.00 55.95 57.05 3i7a s SER 70 Cb 0.00 0.16 0.26 0.00 -1.71 0.00 0.00 66.02 64.73 3i7a s SER 70 CO 0.00 -0.10 1.14 0.54 1.20 0.00 0.00 173.24 176.01 3i7a n ARG 71 N 3.75 1.39 0.00 5.44 1.74 -1.26 -4.23 116.66 123.49 3i7a n ARG 71 Ca -0.21 -2.47 0.00 0.00 -0.77 0.00 0.00 57.85 54.40 3i7a n ARG 71 Cb 0.54 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.54 3i7a n ARG 71 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i7a n GLY 72 N -1.35 5.46 3.76 -0.13 0.00 -1.26 -5.12 105.19 106.55 3i7a n GLY 72 Ca 0.15 -1.16 -0.41 0.00 0.00 0.00 0.00 46.02 44.60 3i7a n GLY 72 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i7a s VAL 73 N 1.35 3.16 0.33 1.61 -7.23 -1.26 -4.97 120.40 113.40 3i7a s VAL 73 Ca 0.00 1.16 -0.29 0.00 -1.81 0.00 0.00 61.98 61.04 3i7a s VAL 73 Cb 0.00 -3.74 -0.11 0.00 0.56 0.00 0.00 36.38 33.10 3i7a s VAL 73 CO 0.00 0.27 1.45 -2.84 -0.31 0.00 0.00 175.10 173.67 3i7a s PRO 74 N -1.51 4.21 0.28 4.82 0.02 -1.26 -4.99 135.00 136.57 3i7a s PRO 74 Ca 0.47 2.43 -0.30 0.00 0.02 0.00 0.00 61.00 63.62 3i7a s PRO 74 Cb -0.35 -3.03 -0.10 0.00 0.02 0.00 0.00 34.50 31.03 3i7a s PRO 74 CO 0.46 -0.44 1.41 0.00 -0.33 0.00 0.00 177.00 178.11 3i7a s ALA 75 N -0.75 3.59 -1.31 -1.55 0.00 -1.26 -4.94 121.76 115.55 3i7a s ALA 75 Ca 0.55 1.34 0.11 0.00 0.00 0.00 0.00 51.96 53.95 3i7a s ALA 75 Cb -0.44 -3.54 0.11 0.00 0.00 0.00 0.00 23.12 19.25 3i7a s ALA 75 CO 0.54 -0.75 0.89 0.39 0.00 0.00 0.00 175.76 176.84 3i7a n GLU 76 N 1.80 0.77 -3.90 0.00 1.02 -1.26 -4.94 120.64 114.13 3i7a n GLU 76 Ca 0.05 -1.25 -0.08 0.00 -0.02 0.00 0.00 57.16 55.86 3i7a n GLU 76 Cb 0.40 -1.21 -0.03 0.00 -0.02 0.00 0.00 31.44 30.58 3i7a n GLU 76 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3i7a s ASN 77 N -0.92 -0.19 0.26 1.62 2.20 -1.26 -5.06 114.94 111.59 3i7a s ASN 77 Ca 0.14 -0.73 0.02 0.00 -0.94 0.00 0.00 52.86 51.34 3i7a s ASN 77 Cb 0.09 0.69 0.33 0.00 -2.00 0.00 0.00 41.25 40.37 3i7a s ASN 77 CO 0.14 -1.31 1.65 -0.29 -2.94 0.00 0.00 177.10 174.35 3i7a h ILE 78 N 2.07 1.30 -0.40 0.54 6.09 -1.95 -2.23 117.51 122.94 3i7a h ILE 78 Ca -0.22 -1.49 -0.05 0.00 -1.37 0.00 0.00 64.86 61.73 3i7a h ILE 78 Cb 1.25 1.55 -0.02 0.00 0.47 0.00 0.00 36.82 40.08 3i7a h ILE 78 CO 0.27 0.46 0.05 -1.13 -3.07 0.00 0.00 178.15 174.74 3i7a h ASN 79 N 0.37 0.64 -0.68 2.19 -1.24 -1.96 0.14 115.58 115.03 3i7a h ASN 79 Ca 0.04 -0.27 0.03 0.00 0.71 0.00 0.00 56.30 56.81 3i7a h ASN 79 Cb 0.83 -0.17 -0.04 0.00 0.73 0.00 0.00 38.32 39.66 3i7a h ASN 79 CO 0.07 0.75 0.42 0.28 -1.29 0.00 0.00 177.43 177.66 3i7a h SER 80 N 0.51 0.69 -0.32 1.15 0.02 -1.95 -1.06 113.55 112.59 3i7a h SER 80 Ca 0.12 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.04 3i7a h SER 80 Cb 0.39 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 3i7a h SER 80 CO 0.01 0.48 0.09 0.00 -1.14 0.00 0.00 176.83 176.27 3i7a h ALA 81 N 1.29 0.42 -0.50 3.77 0.00 -0.97 -0.92 119.26 122.35 3i7a h ALA 81 Ca 0.27 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3i7a h ALA 81 Cb 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3i7a h ALA 81 CO -0.11 0.06 0.05 0.28 0.00 0.00 0.00 179.25 179.53 3i7a h VAL 82 N 0.36 1.24 -0.43 0.00 2.07 -0.70 -1.42 116.25 117.37 3i7a h VAL 82 Ca 0.10 -0.93 -0.06 0.00 0.82 0.00 0.00 66.70 66.63 3i7a h VAL 82 Cb 0.26 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 3i7a h VAL 82 CO -0.00 0.33 0.04 0.74 0.02 0.00 0.00 177.57 178.70 3i7a h THR 83 N 0.77 1.25 -0.58 2.57 2.02 -0.81 -0.50 112.91 117.63 3i7a h THR 83 Ca 0.16 -0.95 -0.09 0.00 0.77 0.00 0.00 66.41 66.30 3i7a h THR 83 Cb 0.39 1.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 3i7a h THR 83 CO 0.01 0.33 0.02 -0.09 0.37 0.00 0.00 175.52 176.16 3i7a h ARG 84 N 0.59 0.98 -0.19 6.66 2.43 -0.88 -3.09 114.38 120.88 3i7a h ARG 84 Ca 0.13 -0.29 -0.09 0.00 -0.81 0.00 0.00 59.98 58.92 3i7a h ARG 84 Cb 0.43 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3i7a h ARG 84 CO 0.01 0.96 -0.25 0.82 -1.51 0.00 0.00 179.97 180.00 3i7a h ILE 85 N 0.91 1.34 0.00 1.20 2.04 -1.07 -3.50 117.51 118.43 3i7a h ILE 85 Ca 0.17 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.58 3i7a h ILE 85 Cb 0.50 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.42 3i7a h ILE 85 CO 0.02 0.44 0.00 0.61 0.00 0.00 0.00 178.15 179.22 3i7a n GLY 86 N 0.28 1.45 0.29 5.37 0.00 -0.21 -4.37 105.19 107.99 3i7a n GLY 86 Ca -0.06 -1.70 0.14 0.00 0.00 0.00 0.00 46.02 44.40 3i7a n GLY 86 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3i7a h LEU 87 N 0.00 0.00 0.00 0.99 5.85 -1.88 -0.24 115.31 120.03 3i7a h LEU 87 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3i7a h LEU 87 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3i7a h LEU 87 CO 0.00 0.01 -0.67 0.71 -0.34 0.00 0.00 178.44 178.15 3i7a h THR 88 N 0.00 0.00 0.00 1.05 1.35 -1.98 -3.37 112.91 109.96 3i7a h THR 88 Ca -0.00 -0.87 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 3i7a h THR 88 Cb 0.02 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 3i7a h THR 88 CO 0.00 0.00 -1.13 0.00 -0.25 0.00 0.00 175.52 174.15 3i7a n GLN 89 N -2.62 1.53 0.02 4.72 6.02 -0.76 -4.69 117.38 121.59 3i7a n GLN 89 Ca 0.02 -0.06 -0.03 0.00 -0.01 0.00 0.00 57.00 56.91 3i7a n GLN 89 Cb 0.52 -1.17 0.20 0.00 1.02 0.00 0.00 30.24 30.81 3i7a n GLN 89 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 3i7a h ILE 90 N 0.00 1.27 0.03 5.09 6.09 -1.23 -2.66 117.51 126.09 3i7a h ILE 90 Ca 0.00 -1.28 0.01 0.00 -1.37 0.00 0.00 64.86 62.23 3i7a h ILE 90 Cb 0.41 1.36 -0.02 0.00 0.47 0.00 0.00 36.82 39.05 3i7a h ILE 90 CO 0.00 0.40 -0.10 0.50 -3.07 0.00 0.00 178.15 175.89 3i7a h LYS 91 N 0.42 -0.18 -0.01 2.19 3.64 -1.84 0.17 116.57 120.97 3i7a h LYS 91 Ca 0.06 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.32 3i7a h LYS 91 Cb 0.68 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.52 3i7a h LYS 91 CO 0.05 -0.12 -0.62 0.77 -2.27 0.00 0.00 179.45 177.26 3i7a h SER 92 N -0.18 0.05 -0.28 4.20 0.02 -1.87 -0.96 113.55 114.52 3i7a h SER 92 Ca 0.03 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 3i7a h SER 92 Cb 0.21 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 3i7a h SER 92 CO -0.08 0.66 0.00 0.40 -1.14 0.00 0.00 176.83 176.67 3i7a h ILE 93 N 0.03 1.25 -0.43 3.27 1.08 -1.11 0.48 117.51 122.09 3i7a h ILE 93 Ca -0.01 -0.91 -0.02 0.00 -0.39 0.00 0.00 64.86 63.53 3i7a h ILE 93 Cb 1.11 1.30 -0.02 0.00 -3.07 0.00 0.00 36.82 36.14 3i7a h ILE 93 CO 0.08 0.29 0.18 0.00 -0.69 0.00 0.00 178.15 178.02 3i7a h ALA 94 N 0.83 0.56 -0.44 1.87 0.00 -0.56 -1.51 119.26 120.00 3i7a h ALA 94 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3i7a h ALA 94 Cb 0.42 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 3i7a h ALA 94 CO 0.01 0.15 0.28 1.15 0.00 0.00 0.00 179.25 180.85 3i7a h THR 95 N 0.55 1.12 -0.48 0.00 2.02 -1.11 -1.06 112.91 113.95 3i7a h THR 95 Ca 0.14 -0.24 0.08 0.00 0.77 0.00 0.00 66.41 67.16 3i7a h THR 95 Cb 0.17 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 67.01 3i7a h THR 95 CO -0.01 0.12 0.09 0.28 0.37 0.00 0.00 175.52 176.37 3i7a h SER 96 N 0.60 -0.01 0.69 4.18 0.02 -0.69 -2.09 113.55 116.25 3i7a h SER 96 Ca 0.16 0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 61.13 3i7a h SER 96 Cb -0.05 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 3i7a h SER 96 CO -0.03 0.03 -0.33 0.58 -1.14 0.00 0.00 176.83 175.93 3i7a h VAL 97 N 0.23 0.88 0.00 2.27 2.07 -0.93 -3.38 116.25 117.39 3i7a h VAL 97 Ca 0.24 -1.31 -0.20 0.00 0.82 0.00 0.00 66.70 66.25 3i7a h VAL 97 Cb 0.32 1.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 3i7a h VAL 97 CO -0.32 0.32 0.72 0.00 0.02 0.00 0.00 177.57 178.32 3i7a n ALA 98 N -2.32 4.47 0.00 1.67 0.00 -0.43 -4.61 120.51 119.30 3i7a n ALA 98 Ca -0.01 -1.40 0.00 0.00 0.00 0.00 0.00 53.44 52.04 3i7a n ALA 98 Cb 0.45 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.40 3i7a n ALA 98 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3i7a n GLU 100 N 3.09 0.00 0.22 0.00 2.13 -1.26 -4.36 120.64 120.46 3i7a n GLU 100 Ca 0.32 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.29 3i7a n GLU 100 Cb 0.44 -0.08 0.74 0.00 0.27 0.00 0.00 31.44 32.81 3i7a n GLU 100 CO 0.00 0.00 0.00 -0.56 -0.41 0.00 0.00 177.13 176.16 3i7a h GLN 101 N 0.00 0.00 0.00 5.31 3.07 -1.96 -1.92 115.11 119.61 3i7a h GLN 101 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.69 3i7a h GLN 101 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.55 3i7a h GLN 101 CO 0.00 0.00 -0.46 -0.07 0.09 0.00 0.00 178.83 178.39 3i7a h LEU 102 N 0.00 0.00 -5.60 0.06 3.38 -1.98 -3.38 115.31 107.79 3i7a h LEU 102 Ca 0.00 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 57.25 3i7a h LEU 102 Cb 0.17 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 3i7a h LEU 102 CO 0.00 0.20 2.91 0.49 0.09 0.00 0.00 178.44 182.14 3i7a n PHE 103 N -3.04 2.70 -4.80 1.13 3.01 -0.72 -4.88 117.46 110.85 3i7a n PHE 103 Ca 0.01 -2.92 -0.26 0.00 1.01 0.00 0.00 57.45 55.29 3i7a n PHE 103 Cb 0.62 -2.15 -0.16 0.00 -0.01 0.00 0.00 39.48 37.78 3i7a n PHE 103 CO 0.00 0.00 0.00 -1.50 1.01 0.00 0.00 176.76 176.27 3i7a s ILE 104 N 0.67 1.40 -0.02 4.37 2.07 -1.26 -4.93 121.20 123.49 3i7a s ILE 104 Ca 0.56 -0.69 0.00 0.00 -1.41 0.00 0.00 60.65 59.12 3i7a s ILE 104 Cb 0.16 -1.21 0.02 0.00 0.13 0.00 0.00 42.46 41.56 3i7a s ILE 104 CO -0.07 0.41 -0.00 -0.55 -1.91 0.00 0.00 174.94 172.82 3i7a s SER 105 N 0.15 0.32 -0.03 4.50 0.15 -1.26 -5.03 113.70 112.50 3i7a s SER 105 Ca -0.06 -0.02 0.18 0.00 0.70 0.00 0.00 55.95 56.75 3i7a s SER 105 Cb -0.12 -0.15 0.58 0.00 -1.71 0.00 0.00 66.02 64.61 3i7a s SER 105 CO 0.03 -0.07 1.48 0.35 1.20 0.00 0.00 173.24 176.22 3i7a n THR 106 N 3.86 1.09 -3.76 6.45 -2.24 -1.26 -4.75 114.28 113.68 3i7a n THR 106 Ca -0.24 -0.89 -0.37 0.00 -2.27 0.00 0.00 64.05 60.28 3i7a n THR 106 Cb 0.52 0.29 -0.13 0.00 -2.10 0.00 0.00 70.33 68.92 3i7a n THR 106 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3i7a s ASN 107 N -0.94 5.15 0.00 3.42 3.84 -1.26 -5.04 114.94 120.11 3i7a s ASN 107 Ca 0.42 -0.77 -0.00 0.00 0.21 0.00 0.00 52.86 52.72 3i7a s ASN 107 Cb 0.24 -1.88 -0.02 0.00 -0.55 0.00 0.00 41.25 39.04 3i7a s ASN 107 CO 0.26 -0.21 0.64 1.21 -2.79 0.00 0.00 177.10 176.21 3i7a n GLU 108 N 4.86 0.14 0.00 0.43 2.13 -1.26 -0.84 120.64 126.10 3i7a n GLU 108 Ca -0.14 -0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.61 3i7a n GLU 108 Cb 0.47 -1.53 0.00 0.00 0.27 0.00 0.00 31.44 30.66 3i7a n GLU 108 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3i7a n VAL 110 N 2.79 0.00 0.31 6.31 0.31 -1.26 -4.55 118.33 122.24 3i7a n VAL 110 Ca 0.03 0.00 0.20 0.00 -0.01 0.00 0.00 64.34 64.56 3i7a n VAL 110 Cb 0.07 0.00 0.96 0.00 -0.91 0.00 0.00 33.84 33.96 3i7a n VAL 110 CO 0.00 0.00 0.00 4.11 -1.32 0.00 0.00 176.83 179.62 3i7a h TRP 111 N 0.00 0.00 -0.26 3.52 0.09 -1.28 -1.48 115.95 116.53 3i7a h TRP 111 Ca 0.00 0.00 -0.07 0.00 0.09 0.00 0.00 58.89 58.91 3i7a h TRP 111 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.16 29.23 3i7a h TRP 111 CO 0.00 0.00 -0.10 1.49 0.09 0.00 0.00 178.44 179.92 3i7a h GLU 112 N 0.00 0.53 -1.70 0.12 4.81 -1.86 0.04 114.58 116.53 3i7a h GLU 112 Ca 0.00 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 3i7a h GLU 112 Cb 0.21 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.57 3i7a h GLU 112 CO 0.00 0.77 0.00 0.28 -0.73 0.00 0.00 179.01 179.33 3i7a n VAL 113 N -4.49 0.35 0.00 0.32 0.31 -0.56 -1.53 118.33 112.73 3i7a n VAL 113 Ca -0.04 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 3i7a n VAL 113 Cb 0.34 -0.70 0.00 0.00 -0.91 0.00 0.00 33.84 32.57 3i7a n VAL 113 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3i7a n ASP 115 N 0.91 0.00 -0.09 4.52 2.03 -0.00 -1.26 116.55 122.66 3i7a n ASP 115 Ca 0.00 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.20 3i7a n ASP 115 Cb 0.16 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.53 3i7a n ASP 115 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 3i7a h GLU 116 N 0.00 0.48 -0.30 -0.67 5.08 -1.54 -0.64 114.58 116.99 3i7a h GLU 116 Ca 0.00 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 58.08 3i7a h GLU 116 Cb 0.00 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3i7a h GLU 116 CO 0.00 0.61 -0.39 -0.39 -1.00 0.00 0.00 179.01 177.84 3i7a h VAL 117 N 0.28 1.29 -0.16 3.13 -1.51 -1.46 -0.78 116.25 117.04 3i7a h VAL 117 Ca 0.08 -1.56 -0.01 0.00 -1.23 0.00 0.00 66.70 63.99 3i7a h VAL 117 Cb 0.38 1.47 -0.01 0.00 -2.13 0.00 0.00 31.29 31.00 3i7a h VAL 117 CO 0.01 0.50 0.07 -0.25 -1.23 0.00 0.00 177.57 176.67 3i7a h TRP 118 N 0.59 0.23 -0.62 5.19 2.91 -1.80 -1.30 115.95 121.15 3i7a h TRP 118 Ca 0.05 -0.01 0.10 0.00 1.13 0.00 0.00 58.89 60.15 3i7a h TRP 118 Cb 0.93 -0.07 -0.07 0.00 -0.51 0.00 0.00 29.16 29.43 3i7a h TRP 118 CO 0.05 0.28 0.23 0.00 -1.03 0.00 0.00 178.44 177.97 3i7a h ARG 119 N 0.11 0.39 0.00 2.65 3.08 -0.87 -2.23 114.38 117.51 3i7a h ARG 119 Ca 0.05 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 59.92 3i7a h ARG 119 Cb 0.14 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 3i7a h ARG 119 CO -0.01 0.26 -0.76 1.79 -1.07 0.00 0.00 179.97 180.18 3i7a h THR 120 N 0.41 1.39 -0.22 2.04 1.35 -1.15 -2.42 112.91 114.32 3i7a h THR 120 Ca 0.31 -2.75 0.04 0.00 -0.55 0.00 0.00 66.41 63.46 3i7a h THR 120 Cb 0.39 2.55 -0.04 0.00 -1.73 0.00 0.00 68.15 69.32 3i7a h THR 120 CO -0.32 0.75 -0.04 0.28 -0.25 0.00 0.00 175.52 175.94 3i7a h SER 121 N 0.00 -0.16 -0.26 5.36 0.02 -0.80 -0.58 113.55 117.14 3i7a h SER 121 Ca -0.01 0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 3i7a h SER 121 Cb 1.49 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 64.14 3i7a h SER 121 CO 0.10 -0.05 -0.08 0.40 -1.14 0.00 0.00 176.83 176.06 3i7a h ILE 122 N 0.02 1.29 -0.27 3.27 2.04 -1.36 -2.49 117.51 120.01 3i7a h ILE 122 Ca 0.10 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.86 3i7a h ILE 122 Cb 0.15 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 3i7a h ILE 122 CO -0.21 0.35 0.17 -0.78 0.00 0.00 0.00 178.15 177.68 3i7a h ASP 123 N 0.25 0.31 -0.40 1.72 3.58 -1.33 0.19 116.42 120.73 3i7a h ASP 123 Ca 0.06 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 3i7a h ASP 123 Cb 0.56 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.51 3i7a h ASP 123 CO 0.03 0.24 0.16 0.58 -2.88 0.00 0.00 179.24 177.37 3i7a h VAL 124 N 0.35 1.20 -0.50 2.25 2.07 -1.15 -1.75 116.25 118.73 3i7a h VAL 124 Ca 0.10 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.04 3i7a h VAL 124 Cb -0.02 0.85 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 3i7a h VAL 124 CO -0.02 0.22 0.28 0.74 0.02 0.00 0.00 177.57 178.81 3i7a h THR 125 N 0.50 1.02 0.02 2.57 2.02 -1.06 0.25 112.91 118.24 3i7a h THR 125 Ca 0.13 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 3i7a h THR 125 Cb 0.19 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.02 3i7a h THR 125 CO -0.01 0.10 -0.01 0.00 0.37 0.00 0.00 175.52 175.97 3i7a h ALA 126 N 1.24 -0.03 -0.65 6.16 0.00 -0.84 0.46 119.26 125.60 3i7a h ALA 126 Ca 0.21 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3i7a h ALA 126 Cb 0.06 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3i7a h ALA 126 CO -0.11 -0.45 0.13 0.00 0.00 0.00 0.00 179.25 178.82 3i7a h ALA 127 N 0.81 0.87 -0.16 0.00 0.00 -1.07 -1.33 119.26 118.38 3i7a h ALA 127 Ca -0.00 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3i7a h ALA 127 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3i7a h ALA 127 CO 0.00 0.61 0.07 0.00 0.00 0.00 0.00 179.25 179.93 3i7a h ALA 128 N 1.05 0.20 -0.80 0.00 0.00 -0.28 -0.84 119.26 118.60 3i7a h ALA 128 Ca 0.20 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3i7a h ALA 128 Cb 0.40 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 3i7a h ALA 128 CO 0.01 -0.22 0.37 0.00 0.00 0.00 0.00 179.25 179.40 3i7a h SER 130 N 1.13 1.14 -0.58 0.00 0.87 -0.85 -1.77 113.55 113.49 3i7a h SER 130 Ca 0.27 -0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.71 3i7a h SER 130 Cb 0.14 -0.29 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 3i7a h SER 130 CO -0.03 0.87 0.15 -0.07 -0.53 0.00 0.00 176.83 177.22 3i7a h LEU 131 N 1.31 0.90 -0.86 2.23 3.38 -0.60 -2.94 115.31 118.74 3i7a h LEU 131 Ca 0.34 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 3i7a h LEU 131 Cb -0.06 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 3i7a h LEU 131 CO -0.06 0.87 -0.21 0.25 0.09 0.00 0.00 178.44 179.38 3i7a h LEU 132 N 0.92 0.62 -0.24 1.67 5.85 -0.80 -0.53 115.31 122.79 3i7a h LEU 132 Ca 0.20 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.72 3i7a h LEU 132 Cb 0.32 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3i7a h LEU 132 CO -0.00 0.83 0.14 1.56 -0.34 0.00 0.00 178.44 180.62 3i7a h GLN 133 N 0.55 0.27 0.14 1.25 4.20 -1.20 0.23 115.11 120.55 3i7a h GLN 133 Ca 0.08 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 3i7a h GLN 133 Cb 0.66 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.38 3i7a h GLN 133 CO 0.05 0.18 -0.07 0.82 -0.67 0.00 0.00 178.83 179.14 3i7a h ILE 134 N 0.28 0.89 -0.48 2.54 2.04 -1.34 -2.62 117.51 118.82 3i7a h ILE 134 Ca 0.09 -0.10 0.04 0.00 1.00 0.00 0.00 64.86 65.89 3i7a h ILE 134 Cb -0.00 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 3i7a h ILE 134 CO -0.04 0.02 0.24 0.22 0.00 0.00 0.00 178.15 178.59 3i7a h TYR 135 N -0.24 0.44 0.00 1.37 5.03 -0.84 -2.01 116.97 120.72 3i7a h TYR 135 Ca -0.02 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 3i7a h TYR 135 Cb 0.19 -0.13 -0.00 0.00 1.55 0.00 0.00 36.73 38.33 3i7a h TYR 135 CO -0.05 0.22 -0.10 -0.91 -1.32 0.00 0.00 178.16 175.99 3i7a h ASN 136 N 0.47 0.00 -0.39 -2.11 2.35 -0.52 0.38 115.58 115.76 3i7a h ASN 136 Ca 0.21 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.85 3i7a h ASN 136 Cb 0.12 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 3i7a h ASN 136 CO -0.15 0.10 -0.19 0.50 -1.65 0.00 0.00 177.43 176.05 3i7a h LYS 137 N 0.00 0.81 0.00 0.81 3.64 -0.98 -1.91 116.57 118.93 3i7a h LYS 137 Ca -0.00 -0.35 -0.07 0.00 -1.27 0.00 0.00 60.65 58.95 3i7a h LYS 137 Cb 0.35 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3i7a h LYS 137 CO 0.01 0.98 -0.35 -0.22 -2.27 0.00 0.00 179.45 177.61 3i7a h LYS 138 N 0.61 0.00 -2.08 1.90 3.64 -0.95 -3.38 116.57 116.32 3i7a h LYS 138 Ca 0.09 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.95 3i7a h LYS 138 Cb 0.74 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 32.15 3i7a h LYS 138 CO 0.06 0.35 -1.04 0.72 -2.27 0.00 0.00 179.45 177.27 3i7a n HIS 139 N -3.23 1.20 -1.30 1.91 8.25 0.12 -5.10 115.22 117.07 3i7a n HIS 139 Ca 0.02 -3.86 -0.34 0.00 -0.26 0.00 0.00 57.72 53.28 3i7a n HIS 139 Cb 0.64 -0.44 0.11 0.00 1.12 0.00 0.00 29.99 31.42 3i7a n HIS 139 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3i7a s PRO 140 N -2.60 1.89 -0.14 -0.41 0.04 -0.73 -2.33 135.00 130.72 3i7a s PRO 140 Ca 0.42 1.86 0.00 0.00 0.04 0.00 0.00 61.00 63.32 3i7a s PRO 140 Cb 0.31 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 33.06 3i7a s PRO 140 CO -0.10 -2.05 0.00 0.41 0.04 0.00 0.00 177.00 175.31 3i7a n GLY 141 N 0.63 0.48 0.30 0.56 0.00 -1.26 -4.91 105.19 100.99 3i7a n GLY 141 Ca 0.14 -0.23 0.18 0.00 0.00 0.00 0.00 46.02 46.12 3i7a n GLY 141 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3i7a h SER 142 N 0.00 0.00 0.00 1.61 4.64 -1.82 -3.46 113.55 114.52 3i7a h SER 142 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3i7a h SER 142 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3i7a h SER 142 CO 0.04 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.64 3i7a n GLY 143 N -0.62 0.57 3.64 -0.77 0.00 -1.26 -4.99 105.19 101.75 3i7a n GLY 143 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3i7a n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i7a s LEU 144 N 0.00 4.07 -0.07 0.99 1.43 -1.26 -5.05 118.68 118.79 3i7a s LEU 144 Ca 0.00 0.89 -0.04 0.00 -1.03 0.00 0.00 54.13 53.95 3i7a s LEU 144 Cb 0.00 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 3i7a s LEU 144 CO 0.00 -0.45 0.10 0.20 0.23 0.00 0.00 176.35 176.42 3i7a s ASN 145 N 1.40 5.94 0.30 2.29 0.02 -1.26 -5.02 114.94 118.60 3i7a s ASN 145 Ca 0.31 0.30 -0.01 0.00 -1.02 0.00 0.00 52.86 52.44 3i7a s ASN 145 Cb -0.15 -1.81 0.46 0.00 0.02 0.00 0.00 41.25 39.77 3i7a s ASN 145 CO 0.08 0.35 1.90 1.88 0.02 0.00 0.00 177.10 181.33 3i7a h TYR 146 N 4.65 0.88 -0.35 2.20 0.05 -1.99 -2.14 116.97 120.28 3i7a h TYR 146 Ca -0.52 -0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.17 3i7a h TYR 146 Cb 1.20 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 38.65 3i7a h TYR 146 CO 0.69 0.66 0.01 0.38 -1.05 0.00 0.00 178.16 178.84 3i7a h ASP 147 N 0.89 0.59 -0.34 3.88 2.03 -1.95 -0.59 116.42 120.92 3i7a h ASP 147 Ca 0.22 -0.30 -0.01 0.00 -0.73 0.00 0.00 57.03 56.21 3i7a h ASP 147 Cb 0.11 -0.16 -0.02 0.00 -0.83 0.00 0.00 39.33 38.43 3i7a h ASP 147 CO -0.03 0.75 0.19 0.74 -1.03 0.00 0.00 179.24 179.86 3i7a h THR 148 N 0.42 1.14 -0.59 1.15 2.02 -1.90 -1.57 112.91 113.59 3i7a h THR 148 Ca 0.10 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.91 3i7a h THR 148 Cb 0.44 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 3i7a h THR 148 CO 0.02 0.14 0.37 0.25 0.37 0.00 0.00 175.52 176.67 3i7a h LEU 149 N 0.43 0.69 -0.30 2.58 5.85 -1.36 -1.27 115.31 121.94 3i7a h LEU 149 Ca 0.12 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.85 3i7a h LEU 149 Cb 0.06 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.87 3i7a h LEU 149 CO -0.02 0.52 0.01 0.74 -0.34 0.00 0.00 178.44 179.35 3i7a h THR 150 N 0.79 0.79 -0.33 1.05 2.02 -0.84 -0.89 112.91 115.50 3i7a h THR 150 Ca 0.21 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 67.36 3i7a h THR 150 Cb -0.05 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 3i7a h THR 150 CO -0.04 0.02 0.19 0.25 0.37 0.00 0.00 175.52 176.31 3i7a h LEU 151 N 0.10 0.40 -0.63 2.58 5.85 -0.99 0.24 115.31 122.86 3i7a h LEU 151 Ca 0.14 -0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.84 3i7a h LEU 151 Cb 0.19 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.07 3i7a h LEU 151 CO -0.23 0.34 0.36 0.00 -0.34 0.00 0.00 178.44 178.57 3i7a h ALA 152 N 1.07 0.82 -0.59 1.25 0.00 -1.10 -0.69 119.26 120.02 3i7a h ALA 152 Ca 0.12 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3i7a h ALA 152 Cb 0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3i7a h ALA 152 CO -0.02 0.07 0.16 0.78 0.00 0.00 0.00 179.25 180.24 3i7a h GLY 153 N 0.70 1.01 1.94 0.00 0.00 -0.81 -1.24 103.07 104.67 3i7a h GLY 153 Ca 0.27 -0.63 0.00 0.00 0.00 0.00 0.00 47.33 46.97 3i7a h GLY 153 CO -0.14 0.58 -0.04 1.04 0.00 0.00 0.00 176.54 177.99 3i7a n LEU 154 N -4.37 0.33 -0.56 3.11 4.77 0.04 -3.10 117.00 117.21 3i7a n LEU 154 Ca 0.03 0.50 0.07 0.00 -0.03 0.00 0.00 56.01 56.58 3i7a n LEU 154 Cb 0.23 -0.42 0.06 0.00 -2.33 0.00 0.00 43.42 40.96 3i7a n LEU 154 CO 0.41 -0.06 0.47 1.33 -1.33 0.00 0.00 177.39 178.21 3i7a n VAL 155 N -1.79 0.03 0.28 4.08 0.24 -0.35 -4.69 118.33 116.13 3i7a n VAL 155 Ca 0.06 -0.52 0.13 0.00 -2.04 0.00 0.00 64.34 61.97 3i7a n VAL 155 Cb 0.38 1.26 0.80 0.00 -1.47 0.00 0.00 33.84 34.81 3i7a n VAL 155 CO 0.00 0.00 0.00 1.12 -2.14 0.00 0.00 176.83 175.81 3i7a h HIS 156 N 2.71 0.00 -0.52 6.34 2.07 -1.16 0.53 115.15 125.12 3i7a h HIS 156 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3i7a h HIS 156 Cb 0.58 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.56 3i7a h HIS 156 CO 0.01 0.05 0.00 0.09 -3.07 0.00 0.00 177.93 175.00 3i7a n ASN 157 N -3.94 4.35 0.29 3.10 3.02 -1.26 -4.67 115.26 116.14 3i7a n ASN 157 Ca -0.03 -2.51 0.17 0.00 -0.03 0.00 0.00 54.58 52.19 3i7a n ASN 157 Cb 0.13 -0.52 0.96 0.00 -0.61 0.00 0.00 39.78 39.75 3i7a n ASN 157 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3i7a h ILE 158 N 3.29 0.37 0.00 2.41 6.09 -1.17 -0.87 117.51 127.63 3i7a h ILE 158 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 3i7a h ILE 158 Cb 1.36 0.94 0.00 0.00 0.47 0.00 0.00 36.82 39.60 3i7a h ILE 158 CO 0.21 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 175.90 3i7a n GLY 159 N -1.28 -1.25 0.20 8.18 0.00 -1.26 -2.24 105.19 107.55 3i7a n GLY 159 Ca -0.02 0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.06 3i7a n GLY 159 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i7a h ALA 160 N 2.43 1.35 -0.34 4.61 0.00 -1.40 -3.35 119.26 122.56 3i7a h ALA 160 Ca 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3i7a h ALA 160 Cb 0.38 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3i7a h ALA 160 CO 0.00 0.38 0.13 -0.07 0.00 0.00 0.00 179.25 179.70 3i7a h LEU 161 N 0.00 0.48 -1.61 0.00 3.38 -1.63 -1.41 115.31 114.52 3i7a h LEU 161 Ca -0.00 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 3i7a h LEU 161 Cb 0.59 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 3i7a h LEU 161 CO 0.04 0.52 -0.22 -0.65 0.09 0.00 0.00 178.44 178.23 3i7a h PRO 162 N 0.41 0.00 -0.33 1.13 0.11 -1.76 0.06 132.00 131.61 3i7a h PRO 162 Ca 0.11 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.17 3i7a h PRO 162 Cb 0.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.29 3i7a h PRO 162 CO -0.01 0.22 0.02 0.28 -0.21 0.00 0.00 178.00 178.29 3i7a h VAL 163 N 0.00 1.25 -0.40 3.15 2.07 -1.57 -1.76 116.25 118.99 3i7a h VAL 163 Ca -0.00 -0.92 -0.08 0.00 0.82 0.00 0.00 66.70 66.51 3i7a h VAL 163 Cb 0.43 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3i7a h VAL 163 CO 0.03 0.30 -0.10 -0.07 0.02 0.00 0.00 177.57 177.75 3i7a h LEU 164 N 0.39 0.68 -0.46 2.57 3.38 -0.77 0.25 115.31 121.36 3i7a h LEU 164 Ca 0.10 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.88 3i7a h LEU 164 Cb 0.42 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3i7a h LEU 164 CO 0.01 0.81 0.29 0.74 0.09 0.00 0.00 178.44 180.39 3i7a h THR 165 N 0.64 1.13 -0.74 0.22 2.02 -0.95 -0.27 112.91 114.95 3i7a h THR 165 Ca 0.11 -0.27 -0.05 0.00 0.77 0.00 0.00 66.41 66.98 3i7a h THR 165 Cb 0.54 0.49 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 3i7a h THR 165 CO 0.03 0.13 0.27 -0.33 0.37 0.00 0.00 175.52 176.00 3i7a h GLU 166 N 0.61 1.11 -0.43 6.66 4.39 -0.60 -2.23 114.58 124.09 3i7a h GLU 166 Ca 0.17 -0.21 -0.08 0.00 0.34 0.00 0.00 59.36 59.58 3i7a h GLU 166 Cb -0.04 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.41 3i7a h GLU 166 CO -0.03 0.91 -0.05 0.00 -1.16 0.00 0.00 179.01 178.68 3i7a h ALA 167 N 1.22 1.12 -0.84 3.43 0.00 -0.51 -1.03 119.26 122.65 3i7a h ALA 167 Ca 0.24 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3i7a h ALA 167 Cb 0.23 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3i7a h ALA 167 CO -0.02 0.56 0.46 0.93 0.00 0.00 0.00 179.25 181.18 3i7a h GLU 168 N 0.67 1.16 0.00 0.00 5.08 -0.65 -3.07 114.58 117.76 3i7a h GLU 168 Ca 0.13 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3i7a h GLU 168 Cb 0.48 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3i7a h GLU 168 CO 0.02 0.84 -0.35 0.00 -1.00 0.00 0.00 179.01 178.53 3i7a h ALA 169 N 1.34 0.83 -2.09 3.43 0.00 -0.85 -3.38 119.26 118.53 3i7a h ALA 169 Ca 0.30 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.65 3i7a h ALA 169 Cb 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 17.40 3i7a h ALA 169 CO -0.05 0.00 -0.94 0.72 0.00 0.00 0.00 179.25 178.98 3i7a n HIS 170 N -2.94 1.38 0.28 0.00 8.25 -0.44 -4.94 115.22 116.82 3i7a n HIS 170 Ca 0.03 -3.83 0.14 0.00 -0.26 0.00 0.00 57.72 53.79 3i7a n HIS 170 Cb 0.53 -0.44 0.84 0.00 1.12 0.00 0.00 29.99 32.04 3i7a n HIS 170 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3i7a h PRO 171 N 3.60 0.00 -1.98 -0.41 0.13 -1.75 -3.33 132.00 128.26 3i7a h PRO 171 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3i7a h PRO 171 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3i7a h PRO 171 CO 0.61 0.04 0.00 -0.85 -0.23 0.00 0.00 178.00 177.58 3i7a n GLU 172 N -3.82 0.16 -1.55 0.86 0.00 -1.26 -4.79 120.64 110.24 3i7a n GLU 172 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.13 3i7a n GLU 172 Cb 0.14 -1.42 0.00 0.00 0.00 0.00 0.00 31.44 30.16 3i7a n GLU 172 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 3i7a n PHE 174 N 1.76 -1.07 -0.00 -1.84 -0.00 -1.25 -5.19 117.46 109.87 3i7a n PHE 174 Ca 0.00 0.56 -0.01 0.00 -0.00 0.00 0.00 57.45 58.00 3i7a n PHE 174 Cb 0.08 -1.20 -0.00 0.00 -0.00 0.00 0.00 39.48 38.36 3i7a n PHE 174 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 3i7a n THR 175 N 0.35 0.42 -4.20 -2.13 -2.24 -1.26 -5.11 114.28 100.11 3i7a n THR 175 Ca 0.00 0.22 -0.12 0.00 -2.27 0.00 0.00 64.05 61.88 3i7a n THR 175 Cb 0.00 -1.40 -0.10 0.00 -2.10 0.00 0.00 70.33 66.73 3i7a n THR 175 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3i7a s THR 176 N -1.42 0.65 0.29 4.28 -4.23 -1.26 -5.04 115.64 108.90 3i7a s THR 176 Ca -0.03 -1.96 0.05 0.00 -1.18 0.00 0.00 61.69 58.57 3i7a s THR 176 Cb 0.00 -1.93 0.04 0.00 1.34 0.00 0.00 72.50 71.96 3i7a s THR 176 CO 0.05 -0.65 1.70 -0.29 -0.54 0.00 0.00 174.62 174.89 3i7a h ILE 177 N 2.82 1.29 -0.62 2.99 2.10 -1.99 -1.86 117.51 122.24 3i7a h ILE 177 Ca -0.36 -1.44 -0.06 0.00 1.08 0.00 0.00 64.86 64.08 3i7a h ILE 177 Cb 1.19 1.58 -0.03 0.00 -1.09 0.00 0.00 36.82 38.47 3i7a h ILE 177 CO 0.63 0.44 0.15 -0.08 -1.08 0.00 0.00 178.15 178.21 3i7a h GLU 178 N 0.28 0.98 -0.62 2.19 4.57 -1.99 -0.35 114.58 119.64 3i7a h GLU 178 Ca 0.03 -0.22 -0.07 0.00 -1.18 0.00 0.00 59.36 57.92 3i7a h GLU 178 Cb 0.77 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.20 3i7a h GLU 178 CO 0.06 0.87 0.10 0.45 -1.18 0.00 0.00 179.01 179.31 3i7a h HIS 179 N 0.94 1.07 -0.31 0.92 3.86 -1.84 -1.43 115.15 118.35 3i7a h HIS 179 Ca 0.20 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.26 3i7a h HIS 179 Cb 0.34 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.49 3i7a h HIS 179 CO 0.02 0.91 0.17 1.25 0.86 0.00 0.00 177.93 181.14 3i7a h LEU 180 N 0.96 0.39 -0.72 2.43 5.85 -0.82 -0.66 115.31 122.75 3i7a h LEU 180 Ca 0.19 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.88 3i7a h LEU 180 Cb 0.42 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 3i7a h LEU 180 CO 0.01 0.37 0.43 0.03 -0.34 0.00 0.00 178.44 178.93 3i7a h ARG 181 N 0.39 0.78 -0.48 1.25 3.08 -0.73 0.81 114.38 119.47 3i7a h ARG 181 Ca 0.11 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.06 3i7a h ARG 181 Cb 0.06 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 3i7a h ARG 181 CO -0.02 0.51 0.08 1.03 -1.07 0.00 0.00 179.97 180.50 3i7a h SER 182 N 0.80 0.76 -0.68 7.04 0.87 -0.94 -1.16 113.55 120.25 3i7a h SER 182 Ca 0.31 -0.26 -0.02 0.00 -1.23 0.00 0.00 61.79 60.59 3i7a h SER 182 Cb 0.14 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.86 3i7a h SER 182 CO -0.16 0.83 0.33 -0.07 -0.53 0.00 0.00 176.83 177.24 3i7a h LEU 183 N 0.67 0.89 -0.03 2.23 3.38 -0.61 -1.61 115.31 120.22 3i7a h LEU 183 Ca 0.15 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.01 3i7a h LEU 183 Cb 0.39 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3i7a h LEU 183 CO 0.01 0.77 -0.13 0.58 0.09 0.00 0.00 178.44 179.76 3i7a h VAL 184 N 0.95 0.66 -0.53 1.22 2.07 -0.55 -2.83 116.25 117.25 3i7a h VAL 184 Ca 0.23 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.74 3i7a h VAL 184 Cb 0.11 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 3i7a h VAL 184 CO -0.03 0.00 0.25 0.03 0.02 0.00 0.00 177.57 177.84 3i7a h ARG 185 N -0.20 0.74 -0.34 1.57 3.08 -0.83 -0.43 114.38 117.98 3i7a h ARG 185 Ca 0.06 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3i7a h ARG 185 Cb 0.28 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3i7a h ARG 185 CO -0.15 0.58 0.00 1.63 -1.07 0.00 0.00 179.97 180.96 3i7a n LYS 186 N -4.37 0.69 0.00 0.04 5.02 -0.64 -4.60 118.16 114.31 3i7a n LYS 186 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 3i7a n LYS 186 Cb 0.13 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 3i7a n LYS 186 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3i7a n GLN 188 N -0.18 0.00 0.33 1.97 10.64 -0.17 -4.76 117.38 125.21 3i7a n GLN 188 Ca 0.00 0.00 -0.16 0.00 -1.83 0.00 0.00 57.00 55.01 3i7a n GLN 188 Cb 0.08 -1.55 -0.08 0.00 -0.86 0.00 0.00 30.24 27.84 3i7a n GLN 188 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 3i7a h GLY 189 N 0.00 -0.90 1.56 2.61 0.00 -1.81 0.17 103.07 104.71 3i7a h GLY 189 Ca 0.00 0.33 -0.05 0.00 0.00 0.00 0.00 47.33 47.61 3i7a h GLY 189 CO 0.00 -0.33 0.00 -2.55 0.00 0.00 0.00 176.54 173.67 3i7a h PRO 190 N -1.06 0.55 -0.22 4.80 0.11 -1.89 -0.75 132.00 133.54 3i7a h PRO 190 Ca -0.09 -0.12 -0.17 0.00 0.11 0.00 0.00 66.00 65.73 3i7a h PRO 190 Cb 0.70 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.74 3i7a h PRO 190 CO 0.14 0.57 -0.54 0.82 -0.21 0.00 0.00 178.00 178.78 3i7a h ILE 191 N 0.52 1.30 -0.99 4.15 2.04 -1.87 -2.77 117.51 119.89 3i7a h ILE 191 Ca 0.11 -1.75 0.05 0.00 1.00 0.00 0.00 64.86 64.27 3i7a h ILE 191 Cb 0.33 1.82 -0.06 0.00 -0.74 0.00 0.00 36.82 38.18 3i7a h ILE 191 CO 0.01 0.56 0.65 1.23 0.00 0.00 0.00 178.15 180.59 3i7a h GLY 192 N 0.48 1.48 0.70 5.37 0.00 -0.41 0.12 103.07 110.81 3i7a h GLY 192 Ca -0.01 -0.48 0.06 0.00 0.00 0.00 0.00 47.33 46.90 3i7a h GLY 192 CO 0.12 0.37 0.40 -0.09 0.00 0.00 0.00 176.54 177.34 3i7a h ARG 193 N 1.20 0.71 -0.12 4.80 2.43 -1.08 0.08 114.38 122.41 3i7a h ARG 193 Ca 0.41 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 59.39 3i7a h ARG 193 Cb 0.10 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 3i7a h ARG 193 CO -0.15 0.47 -0.59 0.00 -1.51 0.00 0.00 179.97 178.19 3i7a h ALA 194 N 1.35 0.76 0.14 2.80 0.00 -0.63 -0.78 119.26 122.90 3i7a h ALA 194 Ca 0.31 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 3i7a h ALA 194 Cb 0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3i7a h ALA 194 CO -0.18 0.71 -0.10 0.28 0.00 0.00 0.00 179.25 179.97 3i7a h VAL 195 N 0.30 0.79 -0.03 0.00 2.07 -0.36 -1.97 116.25 117.04 3i7a h VAL 195 Ca -0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 3i7a h VAL 195 Cb 1.11 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 3i7a h VAL 195 CO 0.10 0.00 -0.48 -0.07 0.02 0.00 0.00 177.57 177.14 3i7a h LEU 196 N -0.24 0.08 -0.91 2.57 4.07 -0.79 -1.02 115.31 119.07 3i7a h LEU 196 Ca -0.01 -0.04 -0.07 0.00 0.08 0.00 0.00 57.88 57.85 3i7a h LEU 196 Cb 0.21 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.90 3i7a h LEU 196 CO -0.00 0.55 0.03 0.11 -1.08 0.00 0.00 178.44 178.05 3i7a h LYS 197 N 0.06 0.84 0.00 1.13 6.56 -1.05 -1.27 116.57 122.84 3i7a h LYS 197 Ca 0.00 -0.22 -0.05 0.00 -1.06 0.00 0.00 60.65 59.33 3i7a h LYS 197 Cb 0.87 -0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 32.42 3i7a h LYS 197 CO 0.07 0.82 -0.23 0.66 -2.06 0.00 0.00 179.45 178.70 3i7a h SER 198 N 0.79 0.00 -0.02 0.86 4.64 -0.42 -2.13 113.55 117.27 3i7a h SER 198 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3i7a h SER 198 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3i7a h SER 198 CO 0.02 0.23 0.00 0.79 -0.87 0.00 0.00 176.83 176.99 3i7a n TRP 199 N -4.17 0.01 -3.93 4.77 8.01 -0.80 -4.97 117.44 116.36 3i7a n TRP 199 Ca -0.02 -0.00 -0.28 0.00 -1.31 0.00 0.00 57.50 55.89 3i7a n TRP 199 Cb 0.29 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.60 3i7a n TRP 199 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 3i7a n ASP 200 N 0.45 -2.32 -4.80 -0.99 2.03 -0.56 -4.97 116.55 105.39 3i7a n ASP 200 Ca 0.18 -0.90 -0.30 0.00 0.52 0.00 0.00 54.79 54.29 3i7a n ASP 200 Cb 0.41 -3.49 0.09 0.00 -0.72 0.00 0.00 41.12 37.41 3i7a n ASP 200 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 3i7a s PHE 201 N -3.59 2.82 0.45 -0.67 0.40 -0.70 -5.01 117.98 111.69 3i7a s PHE 201 Ca 0.32 1.20 -0.23 0.00 -0.60 0.00 0.00 56.93 57.62 3i7a s PHE 201 Cb -0.16 -3.09 -0.08 0.00 0.51 0.00 0.00 43.02 40.20 3i7a s PHE 201 CO 0.86 -1.75 1.15 0.00 0.70 0.00 0.00 175.22 176.18 3i7a s ALA 202 N -3.12 2.99 0.45 5.36 0.00 -1.26 -4.93 121.76 121.25 3i7a s ALA 202 Ca 0.61 0.90 0.16 0.00 0.00 0.00 0.00 51.96 53.63 3i7a s ALA 202 Cb -0.15 -3.37 1.10 0.00 0.00 0.00 0.00 23.12 20.71 3i7a s ALA 202 CO 0.55 -0.59 1.96 -1.35 0.00 0.00 0.00 175.76 176.32 3i7a h PRO 203 N 2.11 0.33 -0.15 0.00 0.10 -2.00 -2.36 132.00 130.04 3i7a h PRO 203 Ca -0.49 -0.02 -0.08 0.00 0.10 0.00 0.00 66.00 65.50 3i7a h PRO 203 Cb 1.24 -0.08 -0.01 0.00 0.10 0.00 0.00 31.00 32.25 3i7a h PRO 203 CO 0.60 0.22 -0.28 1.05 0.10 0.00 0.00 178.00 179.70 3i7a h GLU 204 N 0.35 0.27 -1.35 1.05 4.11 -2.05 -0.40 114.58 116.56 3i7a h GLU 204 Ca 0.31 -0.10 0.00 0.00 0.07 0.00 0.00 59.36 59.64 3i7a h GLU 204 Cb 0.75 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.98 3i7a h GLU 204 CO -0.08 0.54 0.00 0.28 0.07 0.00 0.00 179.01 179.82 3i7a n VAL 205 N -4.13 1.08 0.00 -1.06 0.31 -0.89 -3.40 118.33 110.24 3i7a n VAL 205 Ca -0.01 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3i7a n VAL 205 Cb 0.39 -1.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.26 3i7a n VAL 205 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 3i7a n GLU 207 N 0.82 0.00 -0.02 5.55 2.13 -0.16 -1.77 120.64 127.18 3i7a n GLU 207 Ca 0.00 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.71 3i7a n GLU 207 Cb 0.43 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.10 3i7a n GLU 207 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3i7a h VAL 208 N 0.00 1.02 -1.00 6.31 2.07 -1.83 -0.12 116.25 122.70 3i7a h VAL 208 Ca 0.00 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.48 3i7a h VAL 208 Cb 0.00 0.83 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 3i7a h VAL 208 CO 0.00 0.03 0.66 0.58 0.02 0.00 0.00 177.57 178.86 3i7a h VAL 209 N 0.18 1.22 0.03 2.57 2.07 -1.67 -0.59 116.25 120.05 3i7a h VAL 209 Ca 0.05 -0.45 -0.25 0.00 0.82 0.00 0.00 66.70 66.87 3i7a h VAL 209 Cb -0.01 -0.21 0.01 0.00 -1.52 0.00 0.00 31.29 29.56 3i7a h VAL 209 CO -0.02 0.24 -1.04 -0.08 0.02 0.00 0.00 177.57 176.69 3i7a h GLU 210 N 1.32 0.53 -0.02 1.57 4.81 -1.77 -3.40 114.58 117.61 3i7a h GLU 210 Ca 0.38 -0.60 0.00 0.00 -0.13 0.00 0.00 59.36 59.01 3i7a h GLU 210 Cb -0.09 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.47 3i7a h GLU 210 CO -0.10 1.23 0.00 0.54 -0.73 0.00 0.00 179.01 179.95 3i7a n ARG 211 N -3.77 0.40 -0.16 1.92 5.12 -0.07 -4.74 116.66 115.36 3i7a n ARG 211 Ca -0.09 -0.92 0.01 0.00 -1.93 0.00 0.00 57.85 54.92 3i7a n ARG 211 Cb 0.88 -1.04 0.28 0.00 -1.16 0.00 0.00 32.46 31.42 3i7a n ARG 211 CO 0.00 0.00 0.00 0.11 -1.93 0.00 0.00 177.63 175.81 3i7a h TRP 212 N 0.40 0.84 -0.38 -1.55 5.08 -1.29 -1.51 115.95 117.54 3i7a h TRP 212 Ca 0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 3i7a h TRP 212 Cb 0.22 -0.28 0.00 0.00 -3.00 0.00 0.00 29.16 26.11 3i7a h TRP 212 CO 0.01 0.55 0.00 0.00 -1.28 0.00 0.00 178.44 177.72 3i7a n ALA 213 N -2.44 2.44 -2.85 0.11 0.00 -1.26 -4.67 120.51 111.84 3i7a n ALA 213 Ca 0.07 -0.89 -0.43 0.00 0.00 0.00 0.00 53.44 52.18 3i7a n ALA 213 Cb 0.06 -0.94 -0.02 0.00 0.00 0.00 0.00 19.45 18.55 3i7a n ALA 213 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3i7a s ASP 214 N -1.40 6.78 0.15 0.00 -1.08 -0.57 -4.91 116.67 115.64 3i7a s ASP 214 Ca 0.37 -2.31 -0.16 0.00 -0.52 0.00 0.00 52.55 49.93 3i7a s ASP 214 Cb 0.21 -2.44 0.03 0.00 -1.46 0.00 0.00 42.92 39.26 3i7a s ASP 214 CO 0.29 -1.03 1.78 -0.07 0.52 0.00 0.00 175.17 176.67 3i7a h LEU 215 N 10.70 0.31 0.00 -1.34 3.38 -1.85 -0.11 115.31 126.40 3i7a h LEU 215 Ca 0.24 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.22 3i7a h LEU 215 Cb 0.96 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3i7a h LEU 215 CO 1.23 0.22 0.00 -2.65 0.09 0.00 0.00 178.44 177.33 3i7a n PRO 216 N -4.91 0.06 -3.19 1.13 -0.02 -1.26 -4.54 135.00 122.27 3i7a n PRO 216 Ca 0.01 0.25 -0.40 0.00 -2.02 0.00 0.00 63.50 61.34 3i7a n PRO 216 Cb 0.07 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 31.99 3i7a n PRO 216 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3i7a s TYR 217 N -2.86 3.32 -0.29 6.00 6.14 -0.06 -5.02 117.35 124.58 3i7a s TYR 217 Ca 0.08 0.76 -0.14 0.00 0.64 0.00 0.00 57.07 58.41 3i7a s TYR 217 Cb 0.08 -2.75 0.13 0.00 0.42 0.00 0.00 41.96 39.85 3i7a s TYR 217 CO 0.21 -0.22 0.82 -1.17 0.64 0.00 0.00 175.55 175.83 3i7a s LEU 218 N 2.10 -0.80 0.88 6.97 2.96 -1.26 -4.87 118.68 124.65 3i7a s LEU 218 Ca 0.24 1.18 -0.14 0.00 -0.22 0.00 0.00 54.13 55.20 3i7a s LEU 218 Cb -0.16 2.03 0.13 0.00 0.50 0.00 0.00 46.19 48.69 3i7a s LEU 218 CO 0.09 -0.17 1.22 -0.83 -1.32 0.00 0.00 176.35 175.34 3i7a s GLY 219 N 2.09 1.65 0.20 7.98 0.00 -1.26 -4.98 107.32 113.00 3i7a s GLY 219 Ca -0.07 -0.83 0.09 0.00 0.00 0.00 0.00 44.72 43.91 3i7a s GLY 219 CO -0.18 -0.24 1.44 -0.55 0.00 0.00 0.00 173.10 173.58 3i7a h ASP 220 N -1.32 0.00 -3.48 1.64 3.32 -2.05 -3.44 116.42 111.09 3i7a h ASP 220 Ca -0.46 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 55.93 3i7a h ASP 220 Cb 1.30 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.70 3i7a h ASP 220 CO 0.56 0.81 -0.69 -1.00 -1.72 0.00 0.00 179.24 177.20 3i7a s HIS 221 N -3.14 2.92 0.18 4.55 3.76 -1.26 -5.07 115.29 117.23 3i7a s HIS 221 Ca -0.00 -0.04 -0.31 0.00 -0.15 0.00 0.00 55.06 54.56 3i7a s HIS 221 Cb 0.11 -1.56 -0.09 0.00 1.11 0.00 0.00 32.58 32.15 3i7a s HIS 221 CO 0.79 0.43 1.47 0.08 -0.85 0.00 0.00 174.74 176.66 3i7a s VAL 222 N -1.15 2.85 0.00 -0.90 1.01 -1.26 -4.99 120.40 115.96 3i7a s VAL 222 Ca 0.21 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.83 3i7a s VAL 222 Cb -0.11 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.85 3i7a s VAL 222 CO 0.13 0.07 0.00 -0.24 0.00 0.00 0.00 175.10 175.05 3i7a n SER 223 N 3.44 0.00 -0.34 3.32 2.88 -1.26 -5.03 113.62 116.63 3i7a n SER 223 Ca 0.11 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.71 3i7a n SER 223 Cb 0.40 0.00 0.22 0.00 -0.75 0.00 0.00 64.21 64.08 3i7a n SER 223 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 3i7a h TYR 224 N 0.00 1.06 -0.59 0.66 0.05 -1.94 -2.20 116.97 114.02 3i7a h TYR 224 Ca 0.00 0.03 0.10 0.00 0.05 0.00 0.00 58.73 58.91 3i7a h TYR 224 Cb 0.00 -0.33 -0.07 0.00 1.01 0.00 0.00 36.73 37.33 3i7a h TYR 224 CO 0.00 0.42 0.19 1.25 -1.05 0.00 0.00 178.16 178.98 3i7a h LEU 225 N 0.94 0.15 -1.04 3.88 6.46 -1.96 -1.05 115.31 122.70 3i7a h LEU 225 Ca 0.47 0.09 0.12 0.00 -0.12 0.00 0.00 57.88 58.43 3i7a h LEU 225 Cb 0.45 0.08 -0.08 0.00 -0.73 0.00 0.00 40.66 40.38 3i7a h LEU 225 CO -0.26 0.10 0.63 0.44 -0.62 0.00 0.00 178.44 178.72 3i7a h ASP 226 N 0.36 0.91 -0.14 1.25 5.19 -1.78 -0.50 116.42 121.71 3i7a h ASP 226 Ca 0.30 0.05 -0.17 0.00 -0.62 0.00 0.00 57.03 56.59 3i7a h ASP 226 Cb 0.39 -0.14 0.01 0.00 0.18 0.00 0.00 39.33 39.77 3i7a h ASP 226 CO -0.33 0.49 -0.57 -0.26 -3.12 0.00 0.00 179.24 175.44 3i7a h PHE 227 N 0.98 0.85 -0.30 4.55 -1.00 -1.25 -1.65 116.94 119.11 3i7a h PHE 227 Ca 0.49 -0.36 -0.04 0.00 2.81 0.00 0.00 57.97 60.87 3i7a h PHE 227 Cb 0.49 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 3i7a h PHE 227 CO -0.00 1.16 0.05 0.82 -1.61 0.00 0.00 178.31 178.72 3i7a h ILE 228 N 0.30 1.24 -0.07 -0.55 1.08 -1.01 -1.70 117.51 116.80 3i7a h ILE 228 Ca -0.03 -0.82 -0.01 0.00 -0.39 0.00 0.00 64.86 63.61 3i7a h ILE 228 Cb 1.21 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 36.14 3i7a h ILE 228 CO 0.12 0.27 0.01 -0.09 -0.69 0.00 0.00 178.15 177.77 3i7a h ARG 229 N 0.33 0.11 -0.70 2.37 2.43 -1.10 0.66 114.38 118.48 3i7a h ARG 229 Ca 0.09 -0.03 0.11 0.00 -0.81 0.00 0.00 59.98 59.35 3i7a h ARG 229 Cb 0.35 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.81 3i7a h ARG 229 CO 0.01 0.35 0.30 0.00 -1.51 0.00 0.00 179.97 179.11 3i7a h ALA 230 N 0.76 0.96 -0.60 2.80 0.00 -1.33 -0.27 119.26 121.59 3i7a h ALA 230 Ca 0.02 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3i7a h ALA 230 Cb 0.29 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3i7a h ALA 230 CO 0.00 -0.16 0.07 0.00 0.00 0.00 0.00 179.25 179.16 3i7a h ALA 231 N 1.48 0.80 -0.89 0.00 0.00 -1.06 0.44 119.26 120.02 3i7a h ALA 231 Ca 0.37 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3i7a h ALA 231 Cb 0.49 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 3i7a h ALA 231 CO -0.34 0.58 0.58 0.00 0.00 0.00 0.00 179.25 180.07 3i7a h ALA 232 N 1.00 1.18 -0.11 0.00 0.00 -0.24 0.20 119.26 121.30 3i7a h ALA 232 Ca 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3i7a h ALA 232 Cb 0.47 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3i7a h ALA 232 CO 0.02 0.43 0.02 0.74 0.00 0.00 0.00 179.25 180.46 3i7a h PHE 233 N 1.12 0.19 -0.73 0.00 0.04 -0.50 0.53 116.94 117.60 3i7a h PHE 233 Ca 0.36 -0.03 0.03 0.00 2.80 0.00 0.00 57.97 61.13 3i7a h PHE 233 Cb 0.00 -0.05 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 3i7a h PHE 233 CO -0.02 0.38 0.45 -0.92 -0.60 0.00 0.00 178.31 177.60 3i7a h TYR 234 N -0.06 0.85 -0.00 -0.55 3.20 -0.45 -2.10 116.97 117.86 3i7a h TYR 234 Ca 0.03 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.93 3i7a h TYR 234 Cb 0.29 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.29 3i7a h TYR 234 CO 0.02 0.48 -0.13 0.25 -1.64 0.00 0.00 178.16 177.13 3i7a n THR 235 N -4.66 0.00 -0.54 1.81 -2.24 0.67 -4.91 114.28 104.41 3i7a n THR 235 Ca 0.08 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 3i7a n THR 235 Cb 0.10 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 3i7a n THR 235 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i7a n GLY 236 N 1.30 0.80 0.30 3.38 0.00 -0.79 -4.94 105.19 105.24 3i7a n GLY 236 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.09 3i7a n GLY 236 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3i7a h GLU 237 N 3.86 1.01 -5.42 1.61 4.81 -1.21 -3.35 114.58 115.90 3i7a h GLU 237 Ca 0.00 -0.15 -0.60 0.00 -0.13 0.00 0.00 59.36 58.47 3i7a h GLU 237 Cb 0.00 -0.18 -0.12 0.00 0.63 0.00 0.00 28.75 29.08 3i7a h GLU 237 CO 0.00 0.80 -0.15 -0.51 -0.73 0.00 0.00 179.01 178.43 3i7a s LEU 238 N -9.84 4.13 -0.14 1.64 1.43 -0.46 -5.00 118.68 110.45 3i7a s LEU 238 Ca -0.13 0.53 -0.24 0.00 -1.03 0.00 0.00 54.13 53.27 3i7a s LEU 238 Cb 0.14 -2.57 -0.03 0.00 0.03 0.00 0.00 46.19 43.77 3i7a s LEU 238 CO 0.80 -0.13 0.74 -0.13 0.23 0.00 0.00 176.35 177.86 3i7a s ARG 239 N 1.56 4.33 0.00 1.70 3.00 -1.26 -4.44 118.95 123.84 3i7a s ARG 239 Ca 0.20 0.88 0.00 0.00 0.00 0.00 0.00 55.73 56.81 3i7a s ARG 239 Cb -0.15 -3.53 0.00 0.00 0.00 0.00 0.00 34.95 31.27 3i7a s ARG 239 CO 0.09 -0.16 0.09 0.00 0.00 0.00 0.00 175.30 175.31 3i7a n ALA 240 N 4.66 1.63 -0.49 2.13 0.00 -1.26 -5.10 120.51 122.08 3i7a n ALA 240 Ca 0.01 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3i7a n ALA 240 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 3i7a n ALA 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3i7a n GLY 241 N 0.59 3.14 0.27 0.00 0.00 -1.26 -0.94 105.19 107.00 3i7a n GLY 241 Ca 0.00 0.08 0.16 0.00 0.00 0.00 0.00 46.02 46.26 3i7a n GLY 241 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3i7a h ASN 242 N 0.00 0.00 -0.43 1.61 4.21 -2.06 -2.99 115.58 115.93 3i7a h ASN 242 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 3i7a h ASN 242 Cb 0.00 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.20 3i7a h ASN 242 CO 0.00 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.52 3i7a n GLU 243 N -2.70 2.20 0.15 0.81 -0.58 -0.11 -4.65 120.64 115.76 3i7a n GLU 243 Ca -0.02 -1.85 -0.15 0.00 -0.42 0.00 0.00 57.16 54.72 3i7a n GLU 243 Cb 0.15 -1.44 -0.09 0.00 -0.57 0.00 0.00 31.44 29.49 3i7a n GLU 243 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 3i7a h LEU 244 N 3.27 -1.31 -1.13 -4.62 5.85 -1.64 0.12 115.31 115.84 3i7a h LEU 244 Ca 0.00 0.13 0.19 0.00 0.84 0.00 0.00 57.88 59.04 3i7a h LEU 244 Cb 0.74 0.47 -0.10 0.00 0.37 0.00 0.00 40.66 42.14 3i7a h LEU 244 CO 0.00 -0.52 0.61 -0.33 -0.34 0.00 0.00 178.44 177.87 3i7a h GLU 245 N -0.73 0.67 -0.26 1.25 5.08 -1.89 0.04 114.58 118.75 3i7a h GLU 245 Ca -0.02 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3i7a h GLU 245 Cb 0.69 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 3i7a h GLU 245 CO -0.18 0.45 0.08 0.37 -1.00 0.00 0.00 179.01 178.72 3i7a h GLN 246 N 0.69 0.41 -0.61 2.33 4.15 -1.42 -0.32 115.11 120.34 3i7a h GLN 246 Ca 0.55 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.87 3i7a h GLN 246 Cb 0.95 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.55 3i7a h GLN 246 CO -0.32 0.49 0.35 0.00 -1.93 0.00 0.00 178.83 177.41 3i7a h ARG 247 N 0.26 0.84 0.00 1.69 2.47 0.99 -2.33 114.38 118.31 3i7a h ARG 247 Ca 0.08 -0.09 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 3i7a h ARG 247 Cb 0.25 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.39 3i7a h ARG 247 CO -0.00 0.63 -0.31 -0.07 0.56 0.00 0.00 179.97 180.77 3i7a h LEU 248 N 0.83 0.00 -1.25 3.04 3.38 -1.08 -3.01 115.31 117.22 3i7a h LEU 248 Ca 0.22 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.11 3i7a h LEU 248 Cb 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3i7a h LEU 248 CO -0.04 0.31 -0.37 -0.78 0.09 0.00 0.00 178.44 177.65 3i7a h ASP 249 N 0.00 0.00 -0.86 -0.43 3.58 -0.47 0.58 116.42 118.82 3i7a h ASP 249 Ca -0.00 0.00 0.14 0.00 0.42 0.00 0.00 57.03 57.58 3i7a h ASP 249 Cb 0.88 0.00 -0.09 0.00 1.72 0.00 0.00 39.33 41.84 3i7a h ASP 249 CO 0.04 0.37 0.46 0.58 -2.88 0.00 0.00 179.24 177.82 3i7a h VAL 250 N 0.00 0.78 0.10 2.25 2.07 -1.50 0.26 116.25 120.21 3i7a h VAL 250 Ca -0.00 -0.24 -0.26 0.00 0.82 0.00 0.00 66.70 67.02 3i7a h VAL 250 Cb 0.67 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3i7a h VAL 250 CO 0.05 0.13 -1.18 -0.26 0.02 0.00 0.00 177.57 176.32 3i7a h PHE 251 N 0.69 0.52 -0.33 1.57 0.04 -1.17 -2.92 116.94 115.34 3i7a h PHE 251 Ca 0.46 -0.36 0.06 0.00 2.80 0.00 0.00 57.97 60.93 3i7a h PHE 251 Cb 0.59 -0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.65 3i7a h PHE 251 CO -0.08 1.25 -0.05 0.28 -0.60 0.00 0.00 178.31 179.12 3i7a h VAL 252 N 0.10 0.71 0.00 -0.55 2.07 -0.26 -1.24 116.25 117.08 3i7a h VAL 252 Ca -0.12 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3i7a h VAL 252 Cb 1.89 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 3i7a h VAL 252 CO 0.20 0.01 0.00 0.29 0.02 0.00 0.00 177.57 178.08 3i7a n LYS 253 N -5.23 0.18 -0.04 1.57 5.02 0.01 -0.86 118.16 118.80 3i7a n LYS 253 Ca 0.01 0.51 0.12 0.00 -2.02 0.00 0.00 58.31 56.93 3i7a n LYS 253 Cb 0.18 -1.91 0.28 0.00 -0.02 0.00 0.00 35.03 33.56 3i7a n LYS 253 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3i7a n ARG 254 N -2.26 2.09 0.00 1.97 1.74 -0.67 -4.96 116.66 114.58 3i7a n ARG 254 Ca 0.01 -1.60 0.00 0.00 -0.77 0.00 0.00 57.85 55.49 3i7a n ARG 254 Cb 0.16 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 3i7a n ARG 254 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i7a n GLY 255 N 1.30 0.49 3.75 -0.13 0.00 -0.04 -4.92 105.19 105.64 3i7a n GLY 255 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3i7a n GLY 255 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3i7a s LEU 256 N 0.00 4.55 -1.29 0.99 1.02 -0.56 -4.94 118.68 118.45 3i7a s LEU 256 Ca 0.00 2.13 -0.13 0.00 0.02 0.00 0.00 54.13 56.15 3i7a s LEU 256 Cb 0.00 -3.61 -0.05 0.00 0.02 0.00 0.00 46.19 42.54 3i7a s LEU 256 CO 0.00 -0.11 2.38 -0.81 0.02 0.00 0.00 176.35 177.84 3i7a n PRO 257 N 1.71 2.74 -0.69 1.29 -0.04 -1.26 -4.02 135.00 134.72 3i7a n PRO 257 Ca 0.00 -2.13 0.05 0.00 -0.04 0.00 0.00 63.50 61.39 3i7a n PRO 257 Cb 0.46 -2.91 0.19 0.00 -0.04 0.00 0.00 33.50 31.19 3i7a n PRO 257 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3i7a n VAL 258 N 4.62 2.03 -1.24 0.52 0.24 -1.26 -4.55 118.33 118.69 3i7a n VAL 258 Ca 0.59 -3.07 -0.31 0.00 -2.04 0.00 0.00 64.34 59.50 3i7a n VAL 258 Cb 0.29 -0.15 0.10 0.00 -1.47 0.00 0.00 33.84 32.62 3i7a n VAL 258 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3i7a s SER 259 N -3.14 4.22 0.35 -1.34 1.04 -1.26 -4.83 113.70 108.74 3i7a s SER 259 Ca 0.38 1.74 0.07 0.00 0.48 0.00 0.00 55.95 58.62 3i7a s SER 259 Cb 0.37 -2.43 0.77 0.00 0.10 0.00 0.00 66.02 64.83 3i7a s SER 259 CO -0.08 -2.20 1.90 -0.65 0.98 0.00 0.00 173.24 173.19 3i7a h PRO 260 N -1.25 0.72 -0.49 4.02 0.11 -1.98 -1.38 132.00 131.75 3i7a h PRO 260 Ca -0.45 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 3i7a h PRO 260 Cb 1.24 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 3i7a h PRO 260 CO 0.52 0.48 0.14 0.93 -0.21 0.00 0.00 178.00 179.85 3i7a h GLU 261 N 0.74 0.78 -0.79 1.05 3.07 -1.98 -2.27 114.58 115.19 3i7a h GLU 261 Ca 0.41 -0.18 -0.01 0.00 -0.50 0.00 0.00 59.36 59.08 3i7a h GLU 261 Cb 0.55 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.31 3i7a h GLU 261 CO -0.17 0.74 0.46 -0.44 -1.40 0.00 0.00 179.01 178.20 3i7a h ASP 262 N 0.67 0.96 1.12 1.42 3.32 -1.57 -2.41 116.42 119.93 3i7a h ASP 262 Ca 0.16 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3i7a h ASP 262 Cb 0.30 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3i7a h ASP 262 CO -0.00 0.76 0.00 0.18 -1.72 0.00 0.00 179.24 178.46 3i7a n LEU 263 N -4.46 0.48 -0.64 1.55 4.77 -0.82 -1.74 117.00 116.14 3i7a n LEU 263 Ca 0.08 0.56 0.13 0.00 -0.03 0.00 0.00 56.01 56.74 3i7a n LEU 263 Cb 0.07 -0.43 0.25 0.00 -2.33 0.00 0.00 43.42 40.97 3i7a n LEU 263 CO 0.38 -0.21 0.65 0.61 -1.33 0.00 0.00 177.39 177.49 3i7a n GLY 264 N 1.00 0.32 3.83 -0.72 0.00 -0.87 -4.73 105.19 104.01 3i7a n GLY 264 Ca 0.05 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.18 3i7a n GLY 264 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3i7a s SER 265 N -2.15 6.56 0.24 1.61 1.04 -0.71 -4.93 113.70 115.36 3i7a s SER 265 Ca 0.29 1.62 -0.07 0.00 0.48 0.00 0.00 55.95 58.28 3i7a s SER 265 Cb 0.20 -2.52 0.24 0.00 0.10 0.00 0.00 66.02 64.04 3i7a s SER 265 CO 0.39 -0.63 1.91 0.44 0.98 0.00 0.00 173.24 176.33 3i7a h ASP 266 N 1.01 1.13 -0.53 7.02 3.32 -1.93 -1.47 116.42 124.97 3i7a h ASP 266 Ca -0.47 -0.04 0.08 0.00 0.02 0.00 0.00 57.03 56.62 3i7a h ASP 266 Cb 1.19 -0.28 -0.07 0.00 0.22 0.00 0.00 39.33 40.39 3i7a h ASP 266 CO 0.61 0.83 0.16 0.00 -1.72 0.00 0.00 179.24 179.12 3i7a h ALA 267 N 1.35 0.64 0.19 3.45 0.00 -1.93 -0.46 119.26 122.49 3i7a h ALA 267 Ca 0.35 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.34 3i7a h ALA 267 Cb -0.13 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3i7a h ALA 267 CO -0.07 -0.25 -0.09 0.35 0.00 0.00 0.00 179.25 179.19 3i7a h PHE 268 N 0.32 -0.24 -0.57 0.00 3.57 -1.74 -3.27 116.94 115.01 3i7a h PHE 268 Ca 0.26 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.68 3i7a h PHE 268 Cb 0.32 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.12 3i7a h PHE 268 CO -0.19 0.15 0.06 -0.07 -2.23 0.00 0.00 178.31 176.03 3i7a h LEU 269 N -0.71 0.93 -0.35 0.59 3.38 -1.05 0.02 115.31 118.12 3i7a h LEU 269 Ca -0.03 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 3i7a h LEU 269 Cb 0.49 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 3i7a h LEU 269 CO 0.04 0.97 0.11 0.44 0.09 0.00 0.00 178.44 180.10 3i7a h ASP 270 N 0.85 0.50 -0.28 -0.43 3.32 -1.24 0.95 116.42 120.10 3i7a h ASP 270 Ca 0.17 -0.20 -0.08 0.00 0.02 0.00 0.00 57.03 56.94 3i7a h ASP 270 Cb 0.46 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3i7a h ASP 270 CO 0.02 0.57 -0.13 -1.28 -1.72 0.00 0.00 179.24 176.69 3i7a h SER 271 N 0.41 0.59 -0.36 6.45 0.87 -1.57 -1.76 113.55 118.19 3i7a h SER 271 Ca 0.11 -0.41 0.08 0.00 -1.23 0.00 0.00 61.79 60.34 3i7a h SER 271 Cb 0.24 -0.16 -0.08 0.00 -0.44 0.00 0.00 62.40 61.96 3i7a h SER 271 CO -0.00 0.87 -0.18 0.22 -0.53 0.00 0.00 176.83 177.21 3i7a h TYR 272 N 0.32 -0.44 -0.53 2.24 3.20 -0.68 -0.45 116.97 120.62 3i7a h TYR 272 Ca 0.06 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.87 3i7a h TYR 272 Cb 0.65 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.15 3i7a h TYR 272 CO 0.06 -0.26 -0.05 0.45 -1.64 0.00 0.00 178.16 176.73 3i7a h HIS 273 N -0.12 1.07 -0.55 -3.82 3.86 -0.75 -1.10 115.15 113.75 3i7a h HIS 273 Ca 0.18 -0.20 -0.06 0.00 -1.16 0.00 0.00 60.37 59.13 3i7a h HIS 273 Cb 0.39 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.57 3i7a h HIS 273 CO -0.40 0.99 0.12 1.03 0.86 0.00 0.00 177.93 180.53 3i7a h SER 274 N 0.85 0.84 -0.19 2.45 0.87 -1.00 -0.28 113.55 117.09 3i7a h SER 274 Ca 0.15 -0.24 -0.06 0.00 -1.23 0.00 0.00 61.79 60.40 3i7a h SER 274 Cb 0.59 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.33 3i7a h SER 274 CO 0.04 0.87 -0.12 0.40 -0.53 0.00 0.00 176.83 177.49 3i7a h ILE 275 N 0.78 1.32 -0.17 2.23 2.04 -1.00 -1.69 117.51 121.02 3i7a h ILE 275 Ca 0.17 -1.21 0.04 0.00 1.00 0.00 0.00 64.86 64.86 3i7a h ILE 275 Cb 0.37 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.12 3i7a h ILE 275 CO 0.00 0.36 -0.10 0.50 0.00 0.00 0.00 178.15 178.92 3i7a h LYS 276 N 0.08 -0.09 -0.23 2.37 3.64 -1.15 -1.84 116.57 119.37 3i7a h LYS 276 Ca 0.04 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3i7a h LYS 276 Cb 0.62 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 3i7a h LYS 276 CO 0.03 -0.06 0.15 0.00 -2.27 0.00 0.00 179.45 177.31 3i7a h ALA 277 N 1.05 1.95 0.00 5.00 0.00 -0.99 -2.51 119.26 123.76 3i7a h ALA 277 Ca 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3i7a h ALA 277 Cb 0.24 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3i7a h ALA 277 CO -0.23 0.02 -0.09 0.66 0.00 0.00 0.00 179.25 179.62 3i7a h SER 278 N 0.21 0.00 0.03 0.00 4.64 -0.42 -2.40 113.55 115.61 3i7a h SER 278 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3i7a h SER 278 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3i7a h SER 278 CO -0.02 0.09 -0.63 -1.22 -0.87 0.00 0.00 176.83 174.18 3i7a n TYR 279 N -3.49 0.00 1.22 4.77 4.01 -0.96 -4.51 117.16 118.20 3i7a n TYR 279 Ca -0.02 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.85 3i7a n TYR 279 Cb 0.22 -0.02 0.29 0.00 -0.31 0.00 0.00 39.34 39.52 3i7a n TYR 279 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79