#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g5h h ALA 42 N 0.00 1.68 0.09 4.31 0.00 -2.05 -0.99 119.26 122.30 1g5h h ALA 42 Ca 0.00 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1g5h h ALA 42 Cb 0.00 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1g5h h ALA 42 CO 0.00 -0.59 -0.04 1.25 0.00 0.00 0.00 179.25 179.86 1g5h h LEU 43 N 0.21 -0.10 -0.59 0.00 7.12 -2.00 -1.66 115.31 118.28 1g5h h LEU 43 Ca 0.68 -0.36 -0.03 0.00 0.13 0.00 0.00 57.88 58.29 1g5h h LEU 43 Cb 1.53 0.03 -0.03 0.00 -0.53 0.00 0.00 40.66 41.66 1g5h h LEU 43 CO -0.68 0.32 0.23 0.58 -0.13 0.00 0.00 178.44 178.77 1g5h h VAL 44 N -0.54 1.23 -0.85 1.05 2.07 -1.95 -0.06 116.25 117.19 1g5h h VAL 44 Ca -0.01 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 1g5h h VAL 44 Cb 0.45 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 1g5h h VAL 44 CO 0.02 0.28 0.45 0.44 0.02 0.00 0.00 177.57 178.78 1g5h h ASP 45 N 0.82 1.08 -0.41 0.57 3.32 -1.20 0.58 116.42 121.18 1g5h h ASP 45 Ca 0.20 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1g5h h ASP 45 Cb 0.21 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1g5h h ASP 45 CO -0.02 0.88 0.16 0.25 -1.72 0.00 0.00 179.24 178.79 1g5h h LEU 46 N 1.19 0.56 -0.99 1.55 6.46 -0.91 -0.92 115.31 122.26 1g5h h LEU 46 Ca 0.30 -0.17 -0.02 0.00 -0.12 0.00 0.00 57.88 57.86 1g5h h LEU 46 Cb 0.05 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 39.80 1g5h h LEU 46 CO -0.05 0.58 0.40 0.00 -0.62 0.00 0.00 178.44 178.75 1g5h h ARG 48 N 1.11 0.63 -0.72 0.00 9.65 -0.72 0.39 114.38 124.71 1g5h h ARG 48 Ca 0.27 -0.35 -0.03 0.00 -1.10 0.00 0.00 59.98 58.78 1g5h h ARG 48 Cb 0.08 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.65 1g5h h ARG 48 CO -0.04 0.95 0.34 -0.09 2.80 0.00 0.00 179.97 183.94 1g5h h ARG 49 N 0.34 1.03 -0.63 0.20 2.43 -0.77 -2.84 114.38 114.15 1g5h h ARG 49 Ca 0.03 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1g5h h ARG 49 Cb 0.86 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1g5h h ARG 49 CO 0.07 0.80 0.00 0.54 -1.51 0.00 0.00 179.97 179.87 1g5h n ARG 50 N -4.33 2.70 -2.27 0.20 5.12 0.25 -4.95 116.66 113.39 1g5h n ARG 50 Ca 0.07 -2.28 -0.12 0.00 -1.93 0.00 0.00 57.85 53.59 1g5h n ARG 50 Cb 0.14 -1.58 -0.00 0.00 -1.16 0.00 0.00 32.46 29.86 1g5h n ARG 50 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1g5h n HIS 51 N 1.20 -0.61 0.02 -1.55 8.25 -0.79 -4.76 115.22 116.99 1g5h n HIS 51 Ca 0.21 0.03 -0.14 0.00 -0.26 0.00 0.00 57.72 57.56 1g5h n HIS 51 Cb 0.60 -2.69 -0.14 0.00 1.12 0.00 0.00 29.99 28.88 1g5h n HIS 51 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 1g5h h PHE 52 N -0.08 0.27 -2.25 4.41 0.04 -0.51 -1.31 116.94 117.50 1g5h h PHE 52 Ca -0.28 -0.19 -0.56 0.00 2.80 0.00 0.00 57.97 59.74 1g5h h PHE 52 Cb 1.20 -0.01 -0.10 0.00 2.20 0.00 0.00 35.95 39.25 1g5h h PHE 52 CO 0.31 1.29 -0.64 -0.51 -0.60 0.00 0.00 178.31 178.16 1g5h s LEU 53 N -6.67 3.21 0.41 1.54 1.43 -0.75 -1.97 118.68 115.88 1g5h s LEU 53 Ca -0.09 -0.62 0.05 0.00 -1.03 0.00 0.00 54.13 52.44 1g5h s LEU 53 Cb 0.07 -1.74 -0.06 0.00 0.03 0.00 0.00 46.19 44.49 1g5h s LEU 53 CO 0.83 0.01 0.03 -0.55 0.23 0.00 0.00 176.35 176.89 1g5h s SER 54 N -3.63 3.52 0.00 2.29 0.15 0.50 -3.82 113.70 112.71 1g5h s SER 54 Ca 0.31 -1.45 0.00 0.00 0.70 0.00 0.00 55.95 55.52 1g5h s SER 54 Cb -0.07 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.15 1g5h s SER 54 CO 0.20 -0.59 0.00 0.61 1.20 0.00 0.00 173.24 174.66 1g5h n GLY 55 N -0.96 3.14 3.83 9.45 0.00 -1.26 -4.80 105.19 114.59 1g5h n GLY 55 Ca -0.07 -1.96 -0.30 0.00 0.00 0.00 0.00 46.02 43.69 1g5h n GLY 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1g5h s THR 56 N -2.96 2.97 0.42 2.61 -4.23 -1.26 -4.87 115.64 108.32 1g5h s THR 56 Ca 0.00 0.32 0.14 0.00 -1.18 0.00 0.00 61.69 60.97 1g5h s THR 56 Cb 0.00 -3.14 0.34 0.00 1.34 0.00 0.00 72.50 71.04 1g5h s THR 56 CO 0.00 -0.41 1.94 -0.65 -0.54 0.00 0.00 174.62 174.96 1g5h h PRO 57 N -1.03 0.44 0.00 3.99 0.11 -1.98 0.30 132.00 133.83 1g5h h PRO 57 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1g5h h PRO 57 Cb 1.28 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1g5h h PRO 57 CO 0.61 0.29 0.00 1.96 -0.21 0.00 0.00 178.00 180.65 1g5h h GLN 58 N 0.45 0.00 -0.01 1.05 4.20 -2.00 -2.01 115.11 116.79 1g5h h GLN 58 Ca 0.34 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.05 1g5h h GLN 58 Cb 0.71 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.49 1g5h h GLN 58 CO -0.11 0.00 -0.28 1.04 -0.67 0.00 0.00 178.83 178.81 1g5h n GLN 59 N -2.87 0.62 -0.42 1.46 6.02 0.99 -3.94 117.38 119.23 1g5h n GLN 59 Ca 0.02 -0.34 0.10 0.00 -0.01 0.00 0.00 57.00 56.76 1g5h n GLN 59 Cb 0.34 -1.49 0.30 0.00 1.02 0.00 0.00 30.24 30.40 1g5h n GLN 59 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1g5h n LEU 60 N -0.89 4.03 -4.82 1.08 4.77 -0.76 -4.04 117.00 116.37 1g5h n LEU 60 Ca 0.11 -2.19 -0.31 0.00 -0.03 0.00 0.00 56.01 53.59 1g5h n LEU 60 Cb 0.33 -0.47 0.05 0.00 -2.33 0.00 0.00 43.42 41.00 1g5h n LEU 60 CO 0.27 0.87 0.71 -0.94 -1.33 0.00 0.00 177.39 176.98 1g5h s SER 61 N -1.02 5.45 0.21 -1.43 1.04 -1.25 -4.83 113.70 111.88 1g5h s SER 61 Ca 0.45 1.61 -0.10 0.00 0.48 0.00 0.00 55.95 58.38 1g5h s SER 61 Cb 0.26 -2.49 0.16 0.00 0.10 0.00 0.00 66.02 64.04 1g5h s SER 61 CO 0.26 -1.40 1.87 0.74 0.98 0.00 0.00 173.24 175.69 1g5h h THR 62 N -0.66 1.16 -0.32 2.02 2.02 -1.95 -1.02 112.91 114.15 1g5h h THR 62 Ca -0.44 -0.32 0.06 0.00 0.77 0.00 0.00 66.41 66.47 1g5h h THR 62 Cb 1.21 0.13 -0.05 0.00 -1.74 0.00 0.00 68.15 67.70 1g5h h THR 62 CO 0.57 0.17 0.00 0.00 0.37 0.00 0.00 175.52 176.64 1g5h h ALA 63 N 1.28 0.29 -0.19 6.16 0.00 -1.97 -1.07 119.26 123.76 1g5h h ALA 63 Ca 0.27 0.09 -0.12 0.00 0.00 0.00 0.00 54.91 55.16 1g5h h ALA 63 Cb -0.07 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1g5h h ALA 63 CO -0.07 -0.40 -0.38 0.00 0.00 0.00 0.00 179.25 178.39 1g5h h ALA 64 N 1.28 0.99 -0.12 0.00 0.00 -1.73 -1.36 119.26 118.32 1g5h h ALA 64 Ca 0.16 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 1g5h h ALA 64 Cb 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1g5h h ALA 64 CO -0.26 0.61 -0.29 -0.07 0.00 0.00 0.00 179.25 179.24 1g5h h LEU 65 N 0.36 0.22 0.00 0.00 3.38 -0.85 -2.99 115.31 115.43 1g5h h LEU 65 Ca 0.04 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 1g5h h LEU 65 Cb 0.83 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1g5h h LEU 65 CO 0.07 0.51 -0.85 -0.07 0.09 0.00 0.00 178.44 178.19 1g5h h LEU 66 N 0.20 0.00 -0.76 1.67 3.38 -0.92 -3.37 115.31 115.51 1g5h h LEU 66 Ca 0.03 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1g5h h LEU 66 Cb 0.62 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 1g5h h LEU 66 CO 0.04 0.54 -0.12 0.77 0.09 0.00 0.00 178.44 179.77 1g5h h SER 67 N 0.00 0.81 0.00 -0.43 4.64 -1.10 -3.47 113.55 114.01 1g5h h SER 67 Ca -0.06 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1g5h h SER 67 Cb 1.47 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1g5h h SER 67 CO 0.06 0.95 0.00 0.61 -0.87 0.00 0.00 176.83 177.58 1g5h n GLY 68 N -0.39 0.50 0.21 -0.77 0.00 -1.24 -4.43 105.19 99.05 1g5h n GLY 68 Ca 0.01 -0.58 0.14 0.00 0.00 0.00 0.00 46.02 45.59 1g5h n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g5h s HIS 70 N -3.36 1.23 -0.41 0.00 -3.43 -1.26 -4.95 115.29 103.11 1g5h s HIS 70 Ca 0.05 -0.68 -0.28 0.00 -0.80 0.00 0.00 55.06 53.35 1g5h s HIS 70 Cb 0.08 -0.64 -0.01 0.00 -1.43 0.00 0.00 32.58 30.57 1g5h s HIS 70 CO 0.58 0.07 1.76 0.00 -2.00 0.00 0.00 174.74 175.15 1g5h s ALA 71 N -2.81 2.71 0.24 -1.38 0.00 -1.26 -4.87 121.76 114.38 1g5h s ALA 71 Ca 0.12 -0.03 0.24 0.00 0.00 0.00 0.00 51.96 52.28 1g5h s ALA 71 Cb -0.01 -4.08 1.07 0.00 0.00 0.00 0.00 23.12 20.10 1g5h s ALA 71 CO 0.01 -2.92 1.90 0.00 0.00 0.00 0.00 175.76 174.74 1g5h h ARG 72 N 13.10 0.00 -5.86 0.00 3.08 -1.95 -3.43 114.38 119.33 1g5h h ARG 72 Ca -0.31 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.07 1g5h h ARG 72 Cb 1.16 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 31.02 1g5h h ARG 72 CO 1.09 0.21 -0.66 -0.06 -1.07 0.00 0.00 179.97 179.48 1g5h s PHE 73 N -3.84 3.04 0.59 3.04 0.08 -1.26 -0.37 117.98 119.26 1g5h s PHE 73 Ca -0.01 -0.00 -0.04 0.00 0.12 0.00 0.00 56.93 57.00 1g5h s PHE 73 Cb 0.11 -1.80 0.12 0.00 -0.57 0.00 0.00 43.02 40.88 1g5h s PHE 73 CO 0.63 0.28 0.81 0.41 -0.10 0.00 0.00 175.22 177.24 1g5h n GLY 74 N 2.55 0.03 0.37 4.36 0.00 -0.83 -4.50 105.19 107.17 1g5h n GLY 74 Ca -0.18 -1.91 0.05 0.00 0.00 0.00 0.00 46.02 43.98 1g5h n GLY 74 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1g5h h PRO 75 N 0.00 1.03 -0.18 1.61 0.11 -1.83 0.13 132.00 132.86 1g5h h PRO 75 Ca -0.26 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.66 1g5h h PRO 75 Cb 0.89 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.75 1g5h h PRO 75 CO 0.25 0.68 -0.40 -0.07 -0.21 0.00 0.00 178.00 178.25 1g5h h LEU 76 N 1.06 0.44 -0.49 2.35 4.07 -1.54 -2.06 115.31 119.15 1g5h h LEU 76 Ca 0.46 -0.19 -0.14 0.00 0.08 0.00 0.00 57.88 58.09 1g5h h LEU 76 Cb 0.34 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 41.95 1g5h h LEU 76 CO -0.21 0.80 -0.31 1.23 -1.08 0.00 0.00 178.44 178.87 1g5h h GLY 77 N 1.13 0.99 1.08 0.83 0.00 -1.24 -1.26 103.07 104.60 1g5h h GLY 77 Ca 0.03 -0.94 -0.08 0.00 0.00 0.00 0.00 47.33 46.34 1g5h h GLY 77 CO 0.07 0.85 0.11 -2.08 0.00 0.00 0.00 176.54 175.49 1g5h h VAL 78 N 0.76 1.27 -0.42 4.60 2.07 -0.67 -0.56 116.25 123.30 1g5h h VAL 78 Ca 0.08 -1.05 -0.06 0.00 0.82 0.00 0.00 66.70 66.49 1g5h h VAL 78 Cb 0.88 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1g5h h VAL 78 CO 0.08 0.39 0.02 -0.33 0.02 0.00 0.00 177.57 177.75 1g5h h GLU 79 N 1.05 0.73 -0.37 1.57 4.39 -1.32 0.40 114.58 121.03 1g5h h GLU 79 Ca 0.21 -0.22 0.05 0.00 0.34 0.00 0.00 59.36 59.73 1g5h h GLU 79 Cb 0.45 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.98 1g5h h GLU 79 CO 0.01 0.80 0.10 1.25 -1.16 0.00 0.00 179.01 180.01 1g5h h LEU 80 N 0.57 0.07 -0.46 1.33 5.85 -1.01 -0.84 115.31 120.82 1g5h h LEU 80 Ca 0.12 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 1g5h h LEU 80 Cb 0.46 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1g5h h LEU 80 CO 0.02 0.07 0.17 -0.09 -0.34 0.00 0.00 178.44 178.27 1g5h h ARG 81 N 0.24 0.71 -0.80 1.25 2.43 -0.91 -0.26 114.38 117.03 1g5h h ARG 81 Ca 0.17 -0.14 0.08 0.00 -0.81 0.00 0.00 59.98 59.28 1g5h h ARG 81 Cb 0.18 -0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 29.56 1g5h h ARG 81 CO -0.21 0.66 0.47 -0.22 -1.51 0.00 0.00 179.97 179.16 1g5h h LYS 82 N 0.61 0.80 -0.54 0.20 3.64 -0.60 0.18 116.57 120.85 1g5h h LYS 82 Ca 0.15 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1g5h h LYS 82 Cb 0.23 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1g5h h LYS 82 CO -0.01 0.53 0.27 -0.91 -2.27 0.00 0.00 179.45 177.06 1g5h h ASN 83 N 0.82 0.70 -0.44 4.20 2.35 -0.66 0.21 115.58 122.77 1g5h h ASN 83 Ca 0.37 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.99 1g5h h ASN 83 Cb 0.27 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 1g5h h ASN 83 CO -0.21 0.63 0.25 0.25 -1.65 0.00 0.00 177.43 176.69 1g5h h LEU 84 N 0.73 0.54 -0.82 1.61 5.85 -0.68 -1.17 115.31 121.37 1g5h h LEU 84 Ca 0.19 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1g5h h LEU 84 Cb 0.11 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 1g5h h LEU 84 CO -0.02 0.46 0.32 0.00 -0.34 0.00 0.00 178.44 178.85 1g5h h ALA 85 N 1.10 1.05 -0.79 1.25 0.00 -0.75 -0.63 119.26 120.49 1g5h h ALA 85 Ca 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1g5h h ALA 85 Cb 0.03 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 1g5h h ALA 85 CO -0.03 0.67 0.39 0.77 0.00 0.00 0.00 179.25 181.05 1g5h h SER 86 N 1.16 1.03 -0.74 0.00 0.02 -0.40 -0.47 113.55 114.15 1g5h h SER 86 Ca 0.27 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1g5h h SER 86 Cb 0.22 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.46 1g5h h SER 86 CO -0.02 0.87 0.23 1.56 -1.14 0.00 0.00 176.83 178.33 1g5h h GLN 87 N 1.12 1.15 -0.20 3.45 1.08 -0.72 0.62 115.11 121.61 1g5h h GLN 87 Ca 0.27 -0.25 -0.02 0.00 -1.45 0.00 0.00 58.65 57.21 1g5h h GLN 87 Cb 0.10 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 1g5h h GLN 87 CO -0.04 0.98 0.05 2.35 -0.95 0.00 0.00 178.83 181.22 1g5h h TRP 88 N 1.11 0.34 -0.99 2.96 7.01 -0.85 -1.60 115.95 123.93 1g5h h TRP 88 Ca 0.24 -0.04 0.03 0.00 2.11 0.00 0.00 58.89 61.23 1g5h h TRP 88 Cb 0.31 -0.10 -0.06 0.00 -2.10 0.00 0.00 29.16 27.21 1g5h h TRP 88 CO 0.03 0.45 0.65 2.35 -2.79 0.00 0.00 178.44 179.12 1g5h h TRP 89 N 0.14 1.22 -0.12 2.65 2.91 -0.78 -2.48 115.95 119.49 1g5h h TRP 89 Ca 0.06 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.11 1g5h h TRP 89 Cb 0.28 -0.41 -0.01 0.00 -0.51 0.00 0.00 29.16 28.51 1g5h h TRP 89 CO 0.01 0.71 0.05 0.77 -1.03 0.00 0.00 178.44 178.95 1g5h h SER 90 N 1.27 0.16 0.00 2.65 0.02 -0.70 -0.41 113.55 116.55 1g5h h SER 90 Ca 0.39 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1g5h h SER 90 Cb -0.02 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.48 1g5h h SER 90 CO -0.12 0.29 0.00 -1.20 -1.14 0.00 0.00 176.83 174.66 1g5h n SER 91 N -4.90 0.17 0.00 3.07 7.64 -0.62 -1.28 113.62 117.70 1g5h n SER 91 Ca -0.05 -1.05 0.00 0.00 1.01 0.00 0.00 58.87 58.78 1g5h n SER 91 Cb 0.12 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1g5h n SER 91 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1g5h n VAL 93 N -0.27 0.00 -0.12 0.44 0.31 -0.26 -4.53 118.33 113.90 1g5h n VAL 93 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 1g5h n VAL 93 Cb 0.04 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.95 1g5h n VAL 93 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1g5h h VAL 94 N 0.00 1.20 0.00 2.52 2.07 -1.23 -2.70 116.25 118.10 1g5h h VAL 94 Ca 0.00 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1g5h h VAL 94 Cb 0.00 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1g5h h VAL 94 CO 0.00 0.22 0.00 0.49 0.02 0.00 0.00 177.57 178.30 1g5h n PHE 95 N -4.67 0.00 -3.90 1.57 3.72 -0.40 -4.72 117.46 109.06 1g5h n PHE 95 Ca -0.01 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.09 1g5h n PHE 95 Cb 0.15 0.00 -0.16 0.00 -0.94 0.00 0.00 39.48 38.54 1g5h n PHE 95 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1g5h s ARG 96 N -2.00 1.39 0.37 -1.08 0.52 -1.02 -4.99 118.95 112.14 1g5h s ARG 96 Ca 0.39 -1.01 0.27 0.00 -0.52 0.00 0.00 55.73 54.86 1g5h s ARG 96 Cb 0.18 -2.51 1.04 0.00 0.52 0.00 0.00 34.95 34.17 1g5h s ARG 96 CO 0.30 -0.68 1.81 1.05 0.02 0.00 0.00 175.30 177.80 1g5h h GLU 97 N 7.98 0.00 -0.60 3.54 9.09 -1.84 -1.91 114.58 130.83 1g5h h GLU 97 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1g5h h GLU 97 Cb 1.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.17 1g5h h GLU 97 CO 0.42 0.00 0.00 1.04 0.05 0.00 0.00 179.01 180.52 1g5h n GLN 98 N -2.63 2.75 -4.61 1.06 6.02 -1.26 -4.87 117.38 113.84 1g5h n GLN 98 Ca 0.02 -2.17 -0.33 0.00 -0.01 0.00 0.00 57.00 54.51 1g5h n GLN 98 Cb 0.31 -1.60 -0.16 0.00 1.02 0.00 0.00 30.24 29.81 1g5h n GLN 98 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1g5h s VAL 99 N -1.50 2.53 0.16 5.09 1.01 -0.72 -0.56 120.40 126.41 1g5h s VAL 99 Ca 0.40 -0.82 0.10 0.00 0.00 0.00 0.00 61.98 61.65 1g5h s VAL 99 Cb 0.23 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 1g5h s VAL 99 CO 0.23 0.52 -0.17 -0.36 0.00 0.00 0.00 175.10 175.33 1g5h s PHE 100 N 0.76 2.50 0.24 5.22 0.40 0.21 -4.87 117.98 122.44 1g5h s PHE 100 Ca -0.07 -0.28 -0.30 0.00 -0.60 0.00 0.00 56.93 55.69 1g5h s PHE 100 Cb -0.16 -1.27 -0.09 0.00 0.51 0.00 0.00 43.02 42.01 1g5h s PHE 100 CO 0.00 0.46 1.01 0.00 0.70 0.00 0.00 175.22 177.39 1g5h s ALA 101 N -1.46 3.36 0.10 5.36 0.00 -1.26 -0.30 121.76 127.56 1g5h s ALA 101 Ca 0.21 0.74 0.06 0.00 0.00 0.00 0.00 51.96 52.96 1g5h s ALA 101 Cb -0.09 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 1g5h s ALA 101 CO 0.12 0.02 -0.15 0.54 0.00 0.00 0.00 175.76 176.29 1g5h s VAL 102 N -1.02 1.29 0.01 0.00 0.11 -0.01 -4.79 120.40 115.98 1g5h s VAL 102 Ca 0.43 -1.53 0.03 0.00 -2.93 0.00 0.00 61.98 57.99 1g5h s VAL 102 Cb -0.28 -1.34 -0.01 0.00 -1.53 0.00 0.00 36.38 33.21 1g5h s VAL 102 CO 0.35 -0.29 -0.11 -0.62 -3.33 0.00 0.00 175.10 171.10 1g5h s ASP 103 N -2.09 1.27 0.05 3.54 2.15 -1.26 -4.51 116.67 115.81 1g5h s ASP 103 Ca 0.04 -0.27 -0.04 0.00 0.43 0.00 0.00 52.55 52.71 1g5h s ASP 103 Cb -0.08 -0.11 -0.02 0.00 -0.30 0.00 0.00 42.92 42.41 1g5h s ASP 103 CO 0.03 0.08 0.07 -0.94 -0.17 0.00 0.00 175.17 174.23 1g5h s SER 104 N -0.53 0.28 0.88 -0.34 1.04 -1.26 -5.02 113.70 108.74 1g5h s SER 104 Ca 0.02 -0.71 -0.11 0.00 0.48 0.00 0.00 55.95 55.64 1g5h s SER 104 Cb -0.05 0.23 0.12 0.00 0.10 0.00 0.00 66.02 66.42 1g5h s SER 104 CO 0.00 -0.57 1.11 -0.76 0.98 0.00 0.00 173.24 174.00 1g5h s LEU 105 N -2.50 2.72 0.28 2.42 1.43 -1.26 -4.94 118.68 116.83 1g5h s LEU 105 Ca 0.00 1.94 0.18 0.00 -1.03 0.00 0.00 54.13 55.22 1g5h s LEU 105 Cb 0.03 -4.41 0.10 0.00 0.03 0.00 0.00 46.19 41.94 1g5h s LEU 105 CO -0.08 -2.73 1.34 0.45 0.23 0.00 0.00 176.35 175.57 1g5h h HIS 106 N -1.61 0.00 -2.95 0.29 3.86 -1.95 -3.46 115.15 109.33 1g5h h HIS 106 Ca -0.45 0.00 -0.65 0.00 -1.16 0.00 0.00 60.37 58.11 1g5h h HIS 106 Cb 1.26 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.66 1g5h h HIS 106 CO 0.51 0.31 -0.53 1.14 0.86 0.00 0.00 177.93 180.22 1g5h s GLN 107 N -3.07 3.25 0.22 2.45 -2.07 -1.26 -0.60 119.66 118.58 1g5h s GLN 107 Ca 0.03 -0.40 0.10 0.00 -1.82 0.00 0.00 55.36 53.27 1g5h s GLN 107 Cb 0.07 -2.98 -0.05 0.00 -1.09 0.00 0.00 33.01 28.97 1g5h s GLN 107 CO 0.74 0.66 -0.19 -1.21 -1.32 0.00 0.00 175.29 173.98 1g5h s GLU 108 N -1.83 1.45 0.37 9.60 2.02 0.15 -4.89 118.70 125.57 1g5h s GLU 108 Ca 0.25 -1.58 -0.27 0.00 0.02 0.00 0.00 54.97 53.39 1g5h s GLU 108 Cb -0.12 -1.48 -0.11 0.00 0.10 0.00 0.00 34.13 32.51 1g5h s GLU 108 CO 0.16 0.28 1.19 -2.30 0.02 0.00 0.00 175.26 174.61 1g5h n PRO 109 N -0.17 1.81 -2.50 0.39 -0.02 -1.26 -1.23 135.00 132.02 1g5h n PRO 109 Ca -0.09 0.64 -0.39 0.00 -2.02 0.00 0.00 63.50 61.64 1g5h n PRO 109 Cb 0.59 -2.22 -0.04 0.00 -0.02 0.00 0.00 33.50 31.81 1g5h n PRO 109 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1g5h s GLY 110 N -0.49 2.96 0.02 -1.23 0.00 -1.23 -4.52 107.32 102.82 1g5h s GLY 110 Ca 0.59 0.83 0.00 0.00 0.00 0.00 0.00 44.72 46.14 1g5h s GLY 110 CO 0.60 1.38 0.00 -1.14 0.00 0.00 0.00 173.10 173.93 1g5h n SER 111 N 0.76 0.07 0.00 1.64 3.41 -1.26 -4.79 113.62 113.45 1g5h n SER 111 Ca 0.01 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1g5h n SER 111 Cb 0.46 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1g5h n SER 111 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1g5h n SER 112 N -2.62 0.00 -0.14 4.04 3.41 -1.26 -4.64 113.62 112.41 1g5h n SER 112 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1g5h n SER 112 Cb 0.00 -0.48 0.02 0.00 -0.26 0.00 0.00 64.21 63.50 1g5h n SER 112 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1g5h h GLN 113 N 0.23 0.50 -0.28 4.33 4.20 -1.93 -2.81 115.11 119.35 1g5h h GLN 113 Ca 0.00 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 1g5h h GLN 113 Cb 0.00 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 1g5h h GLN 113 CO 0.00 0.33 -0.08 -1.35 -0.67 0.00 0.00 178.83 177.06 1g5h h PRO 114 N 0.52 0.46 0.00 1.46 0.11 -2.01 -3.47 132.00 129.06 1g5h h PRO 114 Ca 0.18 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1g5h h PRO 114 Cb 0.03 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.08 1g5h h PRO 114 CO -0.09 0.55 0.00 2.89 -0.21 0.00 0.00 178.00 181.14 1g5h n ARG 115 N -4.24 0.00 -0.70 1.05 1.85 -1.06 -5.08 116.66 108.48 1g5h n ARG 115 Ca 0.01 0.00 -0.24 0.00 -1.00 0.00 0.00 57.85 56.62 1g5h n ARG 115 Cb 0.29 0.00 0.02 0.00 -1.05 0.00 0.00 32.46 31.71 1g5h n ARG 115 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1g5h n ASP 116 N 0.00 -3.24 -1.16 2.89 5.75 -1.26 -4.86 116.55 114.67 1g5h n ASP 116 Ca 0.00 0.23 0.12 0.00 -0.01 0.00 0.00 54.79 55.13 1g5h n ASP 116 Cb 0.00 -0.50 0.21 0.00 -1.03 0.00 0.00 41.12 39.80 1g5h n ASP 116 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1g5h n SER 117 N 1.97 3.47 -4.76 -1.12 3.41 -1.26 -4.98 113.62 110.34 1g5h n SER 117 Ca 0.01 -2.00 -0.41 0.00 -0.26 0.00 0.00 58.87 56.22 1g5h n SER 117 Cb 0.33 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 64.02 1g5h n SER 117 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1g5h s ALA 118 N -1.51 3.54 0.34 7.33 0.00 -1.26 -4.72 121.76 125.48 1g5h s ALA 118 Ca 0.38 1.32 -0.29 0.00 0.00 0.00 0.00 51.96 53.38 1g5h s ALA 118 Cb 0.23 -3.52 -0.11 0.00 0.00 0.00 0.00 23.12 19.72 1g5h s ALA 118 CO 0.32 -0.73 1.48 -0.06 0.00 0.00 0.00 175.76 176.76 1g5h s PHE 119 N -0.85 2.73 0.18 0.00 0.40 -1.26 -4.83 117.98 114.35 1g5h s PHE 119 Ca 0.52 1.12 -0.02 0.00 -0.60 0.00 0.00 56.93 57.95 1g5h s PHE 119 Cb -0.41 -3.96 -0.05 0.00 0.51 0.00 0.00 43.02 39.11 1g5h s PHE 119 CO 0.52 -2.91 0.38 1.03 0.70 0.00 0.00 175.22 174.95 1g5h s ARG 120 N -1.58 3.54 -0.27 0.44 3.00 -1.26 -1.66 118.95 121.16 1g5h s ARG 120 Ca 0.55 -0.27 -0.09 0.00 0.00 0.00 0.00 55.73 55.92 1g5h s ARG 120 Cb -0.45 -2.85 -0.03 0.00 0.00 0.00 0.00 34.95 31.62 1g5h s ARG 120 CO 0.57 0.42 0.12 -0.51 0.00 0.00 0.00 175.30 175.90 1g5h s LEU 121 N -3.11 3.75 -0.07 2.53 1.43 -0.16 -4.95 118.68 118.11 1g5h s LEU 121 Ca 0.39 -0.23 0.04 0.00 -1.03 0.00 0.00 54.13 53.30 1g5h s LEU 121 Cb -0.11 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.11 1g5h s LEU 121 CO 0.28 -0.08 -0.19 -0.69 0.23 0.00 0.00 176.35 175.90 1g5h s VAL 122 N 1.65 1.65 -0.15 -1.59 1.01 -1.26 -4.18 120.40 117.54 1g5h s VAL 122 Ca 0.06 -0.81 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 1g5h s VAL 122 Cb -0.16 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 1g5h s VAL 122 CO 0.06 0.47 1.28 -0.55 0.00 0.00 0.00 175.10 176.36 1g5h s SER 123 N 0.25 6.93 0.31 3.32 0.15 -1.26 -4.93 113.70 118.48 1g5h s SER 123 Ca -0.11 1.74 -0.01 0.00 0.70 0.00 0.00 55.95 58.27 1g5h s SER 123 Cb -0.15 -2.54 0.50 0.00 -1.71 0.00 0.00 66.02 62.12 1g5h s SER 123 CO 0.05 -0.76 1.97 1.55 1.20 0.00 0.00 173.24 177.25 1g5h h PRO 124 N 8.22 1.00 0.02 5.44 0.13 -2.00 -2.32 132.00 142.49 1g5h h PRO 124 Ca -0.28 -0.07 0.01 0.00 -0.87 0.00 0.00 66.00 64.79 1g5h h PRO 124 Cb 1.11 -0.22 -0.04 0.00 0.13 0.00 0.00 31.00 31.99 1g5h h PRO 124 CO 0.96 0.67 -0.36 0.93 -0.23 0.00 0.00 178.00 179.97 1g5h h GLU 125 N 1.02 -0.45 -0.96 0.86 5.08 -1.99 0.09 114.58 118.23 1g5h h GLU 125 Ca 0.27 0.03 0.22 0.00 -1.00 0.00 0.00 59.36 58.88 1g5h h GLU 125 Cb -0.09 0.10 -0.18 0.00 0.50 0.00 0.00 28.75 29.08 1g5h h GLU 125 CO -0.06 -0.30 -0.16 -1.13 -1.00 0.00 0.00 179.01 176.37 1g5h n SER 126 N -4.48 -0.27 -0.07 1.42 3.41 -0.90 0.09 113.62 112.81 1g5h n SER 126 Ca -0.05 1.65 -0.11 0.00 -0.26 0.00 0.00 58.87 60.09 1g5h n SER 126 Cb 0.27 -0.53 -0.05 0.00 -0.26 0.00 0.00 64.21 63.64 1g5h n SER 126 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1g5h h ILE 127 N 0.00 1.26 -0.57 -1.33 2.04 -1.09 -2.73 117.51 115.10 1g5h h ILE 127 Ca 0.50 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 65.44 1g5h h ILE 127 Cb 0.87 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 1g5h h ILE 127 CO -0.96 0.29 0.37 0.03 0.00 0.00 0.00 178.15 177.87 1g5h h ARG 128 N 0.16 0.76 -0.83 2.37 3.08 0.16 -1.79 114.38 118.29 1g5h h ARG 128 Ca 0.06 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.13 1g5h h ARG 128 Cb 0.43 -0.17 -0.06 0.00 0.08 0.00 0.00 29.97 30.26 1g5h h ARG 128 CO 0.01 0.52 0.54 1.49 -1.07 0.00 0.00 179.97 181.46 1g5h h GLU 129 N 0.77 0.83 0.00 0.04 4.22 -0.39 0.13 114.58 120.19 1g5h h GLU 129 Ca 0.21 -0.05 -0.04 0.00 0.08 0.00 0.00 59.36 59.56 1g5h h GLU 129 Cb -0.06 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 1g5h h GLU 129 CO -0.04 0.55 -0.39 -0.84 -2.18 0.00 0.00 179.01 176.11 1g5h h ILE 130 N 0.86 0.27 0.00 2.32 3.07 -1.15 -3.36 117.51 119.52 1g5h h ILE 130 Ca 0.37 -1.40 0.00 0.00 1.55 0.00 0.00 64.86 65.38 1g5h h ILE 130 Cb 0.31 2.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.90 1g5h h ILE 130 CO -0.14 0.15 0.00 -0.11 -1.05 0.00 0.00 178.15 177.00 1g5h n LEU 131 N -3.05 1.18 -4.26 0.16 7.94 -0.14 -4.63 117.00 114.20 1g5h n LEU 131 Ca 0.02 0.08 -0.43 0.00 -1.11 0.00 0.00 56.01 54.57 1g5h n LEU 131 Cb 0.61 -0.15 -0.04 0.00 0.53 0.00 0.00 43.42 44.37 1g5h n LEU 131 CO 0.37 -0.15 0.37 -1.58 -1.11 0.00 0.00 177.39 175.29 1g5h s GLN 132 N -0.30 3.40 0.00 1.96 0.74 -0.19 -5.08 119.66 120.19 1g5h s GLN 132 Ca 0.00 -2.64 0.00 0.00 0.05 0.00 0.00 55.36 52.77 1g5h s GLN 132 Cb 0.00 -4.24 0.00 0.00 1.10 0.00 0.00 33.01 29.87 1g5h s GLN 132 CO 0.00 -1.25 0.00 -0.25 -0.55 0.00 0.00 175.29 173.24 1g5h n ASP 133 N 3.56 0.00 0.00 6.67 8.00 -1.26 -4.61 116.55 128.92 1g5h n ASP 133 Ca 0.14 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.64 1g5h n ASP 133 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 1g5h n ASP 133 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1g5h n SER 137 N 0.00 0.99 -0.12 -2.24 2.88 -1.26 -4.95 113.62 108.91 1g5h n SER 137 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 1g5h n SER 137 Cb 0.00 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.48 1g5h n SER 137 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1g5h h LYS 138 N 0.00 0.02 -0.19 -1.46 3.64 -2.05 0.15 116.57 116.67 1g5h h LYS 138 Ca 0.00 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1g5h h LYS 138 Cb 0.00 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.77 1g5h h LYS 138 CO 0.00 0.01 -0.11 0.93 -2.27 0.00 0.00 179.45 178.01 1g5h h GLU 139 N 0.02 -0.09 -0.33 1.90 5.08 -2.05 -2.00 114.58 117.10 1g5h h GLU 139 Ca 0.19 0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.49 1g5h h GLU 139 Cb 0.29 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1g5h h GLU 139 CO -0.40 -0.06 -0.09 1.96 -1.00 0.00 0.00 179.01 179.42 1g5h h GLN 140 N -0.10 0.55 -0.15 2.33 7.50 -1.83 -2.22 115.11 121.19 1g5h h GLN 140 Ca 0.11 -0.15 -0.21 0.00 0.50 0.00 0.00 58.65 58.90 1g5h h GLN 140 Cb 0.25 -0.06 0.01 0.00 0.05 0.00 0.00 27.48 27.73 1g5h h GLN 140 CO -0.25 0.64 -0.74 -0.07 -1.50 0.00 0.00 178.83 176.91 1g5h h LEU 141 N 0.51 0.85 -0.43 1.46 3.38 -0.66 -1.13 115.31 119.29 1g5h h LEU 141 Ca 0.10 -0.54 -0.10 0.00 0.09 0.00 0.00 57.88 57.43 1g5h h LEU 141 Cb 0.47 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1g5h h LEU 141 CO 0.03 1.33 -0.11 0.58 0.09 0.00 0.00 178.44 180.36 1g5h h VAL 142 N 0.50 1.27 -0.39 1.22 2.07 -1.30 -1.32 116.25 118.30 1g5h h VAL 142 Ca -0.04 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.25 1g5h h VAL 142 Cb 1.36 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 32.29 1g5h h VAL 142 CO 0.15 0.41 0.21 0.00 0.02 0.00 0.00 177.57 178.36 1g5h h ALA 143 N 0.85 0.50 -0.12 1.67 0.00 -1.32 -0.22 119.26 120.62 1g5h h ALA 143 Ca 0.11 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.98 1g5h h ALA 143 Cb 0.65 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1g5h h ALA 143 CO 0.04 0.03 -0.27 0.35 0.00 0.00 0.00 179.25 179.41 1g5h h PHE 144 N 0.50 -0.73 -0.57 0.00 3.57 -0.90 0.43 116.94 119.24 1g5h h PHE 144 Ca 0.14 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.73 1g5h h PHE 144 Cb 0.06 0.34 -0.05 0.00 2.79 0.00 0.00 35.95 39.09 1g5h h PHE 144 CO -0.02 -0.35 0.29 -0.07 -2.23 0.00 0.00 178.31 175.92 1g5h h LEU 145 N -0.34 0.40 -0.65 0.59 3.38 -0.99 -1.80 115.31 115.89 1g5h h LEU 145 Ca 0.10 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.18 1g5h h LEU 145 Cb 0.49 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 1g5h h LEU 145 CO -0.32 0.26 0.32 -0.33 0.09 0.00 0.00 178.44 178.47 1g5h h GLU 146 N 0.54 0.56 -0.48 1.13 5.08 -0.41 -1.89 114.58 119.10 1g5h h GLU 146 Ca 0.26 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.61 1g5h h GLU 146 Cb 0.19 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1g5h h GLU 146 CO -0.19 0.37 0.27 -0.91 -1.00 0.00 0.00 179.01 177.56 1g5h h ASN 147 N 0.58 0.43 -0.01 1.42 2.35 -0.45 -1.03 115.58 118.88 1g5h h ASN 147 Ca 0.31 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 56.09 1g5h h ASN 147 Cb 0.29 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 1g5h h ASN 147 CO -0.24 0.31 -0.15 -0.07 -1.65 0.00 0.00 177.43 175.63 1g5h h LEU 148 N 0.55 -0.44 -0.73 1.61 3.38 -0.58 0.35 115.31 119.43 1g5h h LEU 148 Ca 0.19 0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.27 1g5h h LEU 148 Cb 0.04 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1g5h h LEU 148 CO -0.10 -0.21 0.45 0.25 0.09 0.00 0.00 178.44 178.92 1g5h h LEU 149 N -0.25 0.73 0.16 1.67 5.85 -1.20 -1.88 115.31 120.40 1g5h h LEU 149 Ca 0.05 0.01 -0.30 0.00 0.84 0.00 0.00 57.88 58.48 1g5h h LEU 149 Cb 0.32 -0.15 0.02 0.00 0.37 0.00 0.00 40.66 41.22 1g5h h LEU 149 CO -0.15 0.49 -1.32 0.11 -0.34 0.00 0.00 178.44 177.23 1g5h h LYS 150 N 0.87 0.39 0.00 1.25 1.57 -0.41 -3.35 116.57 116.89 1g5h h LYS 150 Ca 0.30 -0.65 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 1g5h h LYS 150 Cb 0.07 0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1g5h h LYS 150 CO -0.13 1.30 -1.25 0.25 -0.57 0.00 0.00 179.45 179.06 1g5h n THR 151 N -3.62 0.00 -2.02 -0.16 -2.24 0.12 -4.09 114.28 102.27 1g5h n THR 151 Ca -0.12 -0.22 -0.39 0.00 -2.27 0.00 0.00 64.05 61.05 1g5h n THR 151 Cb 1.05 0.41 -0.00 0.00 -2.10 0.00 0.00 70.33 69.69 1g5h n THR 151 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1g5h s SER 152 N -2.84 6.22 1.01 3.42 0.01 -0.71 -4.44 113.70 116.37 1g5h s SER 152 Ca -0.02 2.68 -0.12 0.00 1.31 0.00 0.00 55.95 59.80 1g5h s SER 152 Cb 0.06 -2.64 0.20 0.00 0.21 0.00 0.00 66.02 63.85 1g5h s SER 152 CO 0.38 -0.91 1.08 -0.83 0.41 0.00 0.00 173.24 173.36 1g5h s GLY 153 N -0.73 1.60 0.11 3.44 0.00 -1.26 -3.58 107.32 106.89 1g5h s GLY 153 Ca 0.58 -0.02 0.04 0.00 0.00 0.00 0.00 44.72 45.32 1g5h s GLY 153 CO 0.49 0.56 -0.11 -1.59 0.00 0.00 0.00 173.10 172.45 1g5h s LYS 154 N -4.72 0.90 0.15 2.90 -2.85 -0.36 -0.99 119.74 114.77 1g5h s LYS 154 Ca 0.66 -1.21 -0.24 0.00 -1.00 0.00 0.00 55.97 54.19 1g5h s LYS 154 Cb -0.21 -0.60 -0.08 0.00 -2.06 0.00 0.00 37.83 34.87 1g5h s LYS 154 CO 0.60 0.10 0.73 -0.51 0.10 0.00 0.00 175.35 176.37 1g5h s LEU 155 N -2.53 4.57 0.48 2.77 1.43 -0.66 0.31 118.68 125.04 1g5h s LEU 155 Ca 0.07 1.56 -0.23 0.00 -1.03 0.00 0.00 54.13 54.50 1g5h s LEU 155 Cb -0.03 -3.24 -0.07 0.00 0.03 0.00 0.00 46.19 42.89 1g5h s LEU 155 CO 0.01 0.21 1.26 0.00 0.23 0.00 0.00 176.35 178.06 1g5h s ARG 156 N -1.20 3.55 -0.04 1.70 1.70 0.23 -4.59 118.95 120.30 1g5h s ARG 156 Ca 0.35 2.02 0.19 0.00 -0.47 0.00 0.00 55.73 57.81 1g5h s ARG 156 Cb -0.22 -2.40 -0.29 0.00 -0.57 0.00 0.00 34.95 31.47 1g5h s ARG 156 CO 0.25 -0.79 0.38 0.00 -1.08 0.00 0.00 175.30 174.06 1g5h n ALA 157 N -0.60 2.60 -2.80 7.88 0.00 -1.26 -1.08 120.51 125.25 1g5h n ALA 157 Ca 0.08 -0.51 -0.10 0.00 0.00 0.00 0.00 53.44 52.91 1g5h n ALA 157 Cb 0.46 -0.60 -0.07 0.00 0.00 0.00 0.00 19.45 19.24 1g5h n ALA 157 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1g5h s THR 158 N -3.23 0.01 -1.92 0.00 -4.23 -1.26 -4.58 115.64 100.43 1g5h s THR 158 Ca -0.07 -1.58 0.24 0.00 -1.18 0.00 0.00 61.69 59.10 1g5h s THR 158 Cb 0.11 -2.22 0.12 0.00 1.34 0.00 0.00 72.50 71.85 1g5h s THR 158 CO 0.78 -0.06 1.30 0.18 -0.54 0.00 0.00 174.62 176.28 1g5h n LEU 159 N -0.32 1.60 -0.03 4.79 4.77 -1.26 -4.54 117.00 122.01 1g5h n LEU 159 Ca -0.02 -0.54 -0.09 0.00 -0.03 0.00 0.00 56.01 55.33 1g5h n LEU 159 Cb 0.63 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 1g5h n LEU 159 CO 0.26 0.30 0.67 0.25 -1.33 0.00 0.00 177.39 177.53 1g5h h LEU 160 N 1.91 -0.92 -2.06 2.23 5.85 -2.00 -2.08 115.31 118.24 1g5h h LEU 160 Ca 0.00 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.87 1g5h h LEU 160 Cb 0.65 0.41 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1g5h h LEU 160 CO 0.00 -0.32 -0.02 0.45 -0.34 0.00 0.00 178.44 178.21 1g5h h HIS 161 N -0.32 0.00 -0.17 1.25 3.86 -2.00 -1.19 115.15 116.58 1g5h h HIS 161 Ca 0.12 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1g5h h HIS 161 Cb 0.51 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 1g5h h HIS 161 CO -0.42 0.02 0.11 0.78 0.86 0.00 0.00 177.93 179.28 1g5h h GLY 162 N 0.07 0.24 0.86 2.45 0.00 -1.68 -0.91 103.07 104.10 1g5h h GLY 162 Ca -0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 1g5h h GLY 162 CO 0.00 0.09 0.06 0.00 0.00 0.00 0.00 176.54 176.69 1g5h h ALA 163 N 1.06 0.22 -0.90 3.60 0.00 -1.03 -3.02 119.26 119.20 1g5h h ALA 163 Ca 0.06 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.94 1g5h h ALA 163 Cb -0.02 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.63 1g5h h ALA 163 CO -0.01 -0.16 0.54 -0.07 0.00 0.00 0.00 179.25 179.54 1g5h h LEU 164 N 0.10 0.80 -1.66 0.00 3.38 -1.08 -1.26 115.31 115.59 1g5h h LEU 164 Ca 0.06 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1g5h h LEU 164 Cb 0.21 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1g5h h LEU 164 CO -0.00 0.46 0.00 -0.33 0.09 0.00 0.00 178.44 178.66 1g5h h GLU 165 N 0.91 0.00 -0.27 1.13 5.08 -1.06 -2.53 114.58 117.83 1g5h h GLU 165 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1g5h h GLU 165 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1g5h h GLU 165 CO -0.24 0.00 0.00 0.72 -1.00 0.00 0.00 179.01 178.49 1g5h n HIS 166 N -3.03 0.34 -0.11 4.33 8.25 -0.56 -4.62 115.22 119.82 1g5h n HIS 166 Ca 0.00 -0.24 -0.07 0.00 -0.26 0.00 0.00 57.72 57.15 1g5h n HIS 166 Cb 0.26 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.37 1g5h n HIS 166 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1g5h h TYR 167 N 3.21 0.31 -0.17 4.41 3.20 -0.86 -2.37 116.97 124.70 1g5h h TYR 167 Ca 0.00 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 1g5h h TYR 167 Cb 0.78 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 1g5h h TYR 167 CO 0.17 0.16 -0.20 0.28 -1.64 0.00 0.00 178.16 176.94 1g5h h VAL 168 N 0.35 1.22 -0.41 1.81 2.07 -1.82 0.45 116.25 119.92 1g5h h VAL 168 Ca 0.16 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.63 1g5h h VAL 168 Cb 0.08 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1g5h h VAL 168 CO -0.12 0.31 0.12 0.78 0.02 0.00 0.00 177.57 178.68 1g5h h ASN 169 N 0.27 0.60 0.28 0.57 2.35 -1.84 -2.53 115.58 115.29 1g5h h ASN 169 Ca 0.05 -0.21 -0.12 0.00 -0.55 0.00 0.00 56.30 55.47 1g5h h ASN 169 Cb 0.50 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1g5h h ASN 169 CO 0.03 0.66 -0.47 0.00 -1.65 0.00 0.00 177.43 176.00 1g5h h LEU 171 N 0.18 0.23 -0.63 0.00 5.85 -0.82 -0.65 115.31 119.48 1g5h h LEU 171 Ca 0.01 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 1g5h h LEU 171 Cb 0.90 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.97 1g5h h LEU 171 CO 0.07 0.13 0.17 -0.78 -0.34 0.00 0.00 178.44 177.69 1g5h h ASP 172 N 0.42 0.94 -0.74 1.25 3.58 -0.83 0.66 116.42 121.69 1g5h h ASP 172 Ca 0.33 -0.22 0.02 0.00 0.42 0.00 0.00 57.03 57.58 1g5h h ASP 172 Cb 0.44 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 41.20 1g5h h ASP 172 CO -0.33 0.92 0.49 0.25 -2.88 0.00 0.00 179.24 177.68 1g5h h LEU 173 N 0.91 0.80 -3.03 2.28 5.85 -0.36 -1.38 115.31 120.38 1g5h h LEU 173 Ca 0.20 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1g5h h LEU 173 Cb 0.34 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1g5h h LEU 173 CO -0.00 0.56 0.00 1.33 -0.34 0.00 0.00 178.44 179.99 1g5h n VAL 174 N -4.44 1.60 -4.11 1.05 0.24 -0.35 -4.93 118.33 107.38 1g5h n VAL 174 Ca 0.09 -1.15 -0.33 0.00 -2.04 0.00 0.00 64.34 60.91 1g5h n VAL 174 Cb 0.09 0.23 -0.01 0.00 -1.47 0.00 0.00 33.84 32.68 1g5h n VAL 174 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1g5h n ASN 175 N 1.25 -3.15 0.00 -1.34 5.15 -0.52 -1.84 115.26 114.81 1g5h n ASN 175 Ca 0.25 -0.96 0.00 0.00 -0.60 0.00 0.00 54.58 53.27 1g5h n ASN 175 Cb 0.81 -3.07 0.00 0.00 -0.53 0.00 0.00 39.78 36.99 1g5h n ASN 175 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1g5h n ARG 176 N -4.45 -0.26 -2.38 1.20 1.74 0.22 -4.90 116.66 107.82 1g5h n ARG 176 Ca 0.00 0.07 -0.43 0.00 -0.77 0.00 0.00 57.85 56.72 1g5h n ARG 176 Cb 0.53 -3.37 -0.02 0.00 -1.02 0.00 0.00 32.46 28.58 1g5h n ARG 176 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1g5h s LYS 177 N -0.47 4.29 0.22 5.56 1.02 -0.77 0.18 119.74 129.77 1g5h s LYS 177 Ca 0.00 1.74 -0.03 0.00 0.02 0.00 0.00 55.97 57.70 1g5h s LYS 177 Cb 0.00 -3.66 -0.05 0.00 -0.52 0.00 0.00 37.83 33.60 1g5h s LYS 177 CO 0.00 -0.59 0.45 -0.51 -0.92 0.00 0.00 175.35 173.78 1g5h s LEU 178 N 2.84 4.18 0.48 3.17 1.43 -1.00 -4.45 118.68 125.33 1g5h s LEU 178 Ca 0.58 0.56 -0.02 0.00 -1.03 0.00 0.00 54.13 54.21 1g5h s LEU 178 Cb -0.25 -3.33 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 1g5h s LEU 178 CO 0.20 -0.08 0.74 -2.16 0.23 0.00 0.00 176.35 175.28 1g5h s PRO 179 N -3.26 3.19 0.21 1.29 0.04 -1.26 -4.87 135.00 130.34 1g5h s PRO 179 Ca 0.41 -0.19 -0.18 0.00 0.04 0.00 0.00 61.00 61.08 1g5h s PRO 179 Cb -0.11 -2.46 0.03 0.00 0.04 0.00 0.00 34.50 32.00 1g5h s PRO 179 CO 0.28 -0.31 0.56 -0.59 0.04 0.00 0.00 177.00 176.98 1g5h s PHE 180 N -2.68 -0.14 0.07 0.56 -0.71 -0.93 -4.93 117.98 109.23 1g5h s PHE 180 Ca 0.48 -0.21 0.03 0.00 -1.04 0.00 0.00 56.93 56.19 1g5h s PHE 180 Cb -0.10 0.44 -0.03 0.00 -1.21 0.00 0.00 43.02 42.12 1g5h s PHE 180 CO 0.41 -0.96 -0.09 0.20 -1.34 0.00 0.00 175.22 173.44 1g5h s GLY 181 N -2.88 0.69 -0.14 1.99 0.00 0.28 -0.72 107.32 106.55 1g5h s GLY 181 Ca 0.10 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.79 1g5h s GLY 181 CO -0.02 -1.11 -0.20 1.08 0.00 0.00 0.00 173.10 172.86 1g5h s LEU 182 N -2.18 2.00 0.07 0.66 1.43 -0.04 -0.62 118.68 120.00 1g5h s LEU 182 Ca 0.00 -0.56 0.07 0.00 -1.03 0.00 0.00 54.13 52.61 1g5h s LEU 182 Cb -0.04 -1.35 -0.04 0.00 0.03 0.00 0.00 46.19 44.79 1g5h s LEU 182 CO -0.01 0.05 -0.16 0.00 0.23 0.00 0.00 176.35 176.46 1g5h s ALA 183 N 0.95 2.71 -0.23 4.21 0.00 0.58 -0.99 121.76 128.99 1g5h s ALA 183 Ca -0.05 -1.23 -0.23 0.00 0.00 0.00 0.00 51.96 50.45 1g5h s ALA 183 Cb -0.15 -0.77 0.06 0.00 0.00 0.00 0.00 23.12 22.27 1g5h s ALA 183 CO -0.04 0.59 0.66 -1.14 0.00 0.00 0.00 175.76 175.83 1g5h s GLN 184 N -1.73 0.79 -0.17 0.00 0.74 -0.46 -0.83 119.66 117.99 1g5h s GLN 184 Ca 0.17 0.86 -0.01 0.00 0.05 0.00 0.00 55.36 56.42 1g5h s GLN 184 Cb -0.11 0.38 -0.00 0.00 1.10 0.00 0.00 33.01 34.38 1g5h s GLN 184 CO 0.08 -0.11 -0.13 0.42 -0.55 0.00 0.00 175.29 175.00 1g5h s ILE 185 N 0.22 2.85 0.05 -2.34 1.01 -1.26 -0.07 121.20 121.65 1g5h s ILE 185 Ca -0.01 -0.70 -0.28 0.00 0.00 0.00 0.00 60.65 59.66 1g5h s ILE 185 Cb -0.04 -2.23 0.09 0.00 0.01 0.00 0.00 42.46 40.29 1g5h s ILE 185 CO 0.02 0.50 1.00 -0.83 0.00 0.00 0.00 174.94 175.62 1g5h s GLY 186 N 0.96 -0.34 0.19 6.18 0.00 -0.04 -4.97 107.32 109.30 1g5h s GLY 186 Ca -0.02 0.64 -0.28 0.00 0.00 0.00 0.00 44.72 45.06 1g5h s GLY 186 CO -0.02 0.18 0.87 0.14 0.00 0.00 0.00 173.10 174.28 1g5h s VAL 187 N -3.05 4.25 0.18 1.40 1.01 -1.26 -0.58 120.40 122.36 1g5h s VAL 187 Ca 0.10 1.93 0.10 0.00 0.00 0.00 0.00 61.98 64.10 1g5h s VAL 187 Cb -0.00 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 1g5h s VAL 187 CO -0.03 0.48 -0.21 0.00 0.00 0.00 0.00 175.10 175.35 1g5h s PHE 189 N -1.95 2.63 -0.10 0.00 0.40 -0.24 -1.07 117.98 117.64 1g5h s PHE 189 Ca 0.19 -0.21 -0.12 0.00 -0.60 0.00 0.00 56.93 56.19 1g5h s PHE 189 Cb -0.06 -1.48 0.03 0.00 0.51 0.00 0.00 43.02 42.02 1g5h s PHE 189 CO 0.08 0.30 0.32 -3.38 0.70 0.00 0.00 175.22 173.24 1g5h s HIS 190 N -0.98 -0.33 0.14 0.36 -3.43 0.08 -4.21 115.29 106.92 1g5h s HIS 190 Ca 0.16 0.77 -0.35 0.00 -0.80 0.00 0.00 55.06 54.84 1g5h s HIS 190 Cb -0.11 0.12 -0.15 0.00 -1.43 0.00 0.00 32.58 31.01 1g5h s HIS 190 CO 0.07 -0.21 1.40 -2.30 -2.00 0.00 0.00 174.74 171.70 1g5h n PRO 191 N 2.65 1.58 -4.06 -0.38 -0.02 -1.26 -0.16 135.00 133.34 1g5h n PRO 191 Ca -0.14 0.57 -0.32 0.00 -2.02 0.00 0.00 63.50 61.59 1g5h n PRO 191 Cb 0.57 -2.24 -0.16 0.00 -0.02 0.00 0.00 33.50 31.66 1g5h n PRO 191 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1g5h s VAL 192 N 0.46 1.89 0.00 -1.45 1.01 0.16 -4.80 120.40 117.68 1g5h s VAL 192 Ca 0.79 -1.03 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1g5h s VAL 192 Cb -0.81 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 33.73 1g5h s VAL 192 CO 0.45 0.33 0.00 -1.20 0.00 0.00 0.00 175.10 174.68 1g5h n SER 193 N 4.63 0.00 -3.76 3.32 7.64 -1.26 -2.10 113.62 122.09 1g5h n SER 193 Ca -0.18 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.40 1g5h n SER 193 Cb 0.48 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.59 1g5h n SER 193 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1g5h n THR 203 N 0.00 2.46 -4.35 0.44 -1.04 -1.26 -5.17 114.28 105.36 1g5h n THR 203 Ca 0.00 -5.14 -0.23 0.00 -2.04 0.00 0.00 64.05 56.64 1g5h n THR 203 Cb 0.00 -2.18 -0.08 0.00 -1.82 0.00 0.00 70.33 66.25 1g5h n THR 203 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1g5h s ARG 204 N -1.96 2.10 -0.28 -2.82 0.52 -0.89 -5.10 118.95 110.51 1g5h s ARG 204 Ca 0.32 -1.52 -0.10 0.00 -0.52 0.00 0.00 55.73 53.91 1g5h s ARG 204 Cb 0.04 -2.04 -0.03 0.00 0.52 0.00 0.00 34.95 33.43 1g5h s ARG 204 CO -0.08 0.36 0.15 0.54 0.02 0.00 0.00 175.30 176.28 1g5h s VAL 205 N -2.36 4.85 0.03 3.52 0.11 -1.26 0.38 120.40 125.68 1g5h s VAL 205 Ca 0.31 -0.07 -0.08 0.00 -2.93 0.00 0.00 61.98 59.21 1g5h s VAL 205 Cb -0.06 -3.34 -0.05 0.00 -1.53 0.00 0.00 36.38 31.40 1g5h s VAL 205 CO 0.18 0.23 0.31 -0.83 -3.33 0.00 0.00 175.10 171.67 1g5h s GLY 206 N 1.68 2.28 -0.07 6.54 0.00 0.77 -4.44 107.32 114.08 1g5h s GLY 206 Ca 0.06 -0.51 0.05 0.00 0.00 0.00 0.00 44.72 44.32 1g5h s GLY 206 CO 0.08 -0.32 -0.24 -0.54 0.00 0.00 0.00 173.10 172.08 1g5h s GLU 207 N -1.82 2.70 -0.03 2.90 2.02 -0.18 -0.75 118.70 123.54 1g5h s GLU 207 Ca 0.29 -0.88 0.01 0.00 0.02 0.00 0.00 54.97 54.42 1g5h s GLU 207 Cb -0.13 -2.18 0.01 0.00 0.10 0.00 0.00 34.13 31.93 1g5h s GLU 207 CO 0.17 0.29 -0.04 -1.59 0.02 0.00 0.00 175.26 174.11 1g5h s LYS 208 N 0.06 0.63 -0.26 1.61 -2.85 -0.24 -4.61 119.74 114.08 1g5h s LYS 208 Ca -0.10 -0.11 -0.27 0.00 -1.00 0.00 0.00 55.97 54.49 1g5h s LYS 208 Cb -0.15 -0.65 0.01 0.00 -2.06 0.00 0.00 37.83 34.97 1g5h s LYS 208 CO 0.06 -0.02 0.96 0.99 0.10 0.00 0.00 175.35 177.44 1g5h s THR 209 N 0.57 4.70 -0.10 3.79 2.01 -1.26 -0.49 115.64 124.86 1g5h s THR 209 Ca -0.07 1.75 -0.02 0.00 0.31 0.00 0.00 61.69 63.66 1g5h s THR 209 Cb -0.10 -4.26 -0.03 0.00 0.01 0.00 0.00 72.50 68.11 1g5h s THR 209 CO -0.00 -0.22 -0.00 -0.70 -0.69 0.00 0.00 174.62 173.01 1g5h s GLU 210 N 3.17 3.09 -0.31 4.92 2.12 0.25 -1.20 118.70 130.74 1g5h s GLU 210 Ca 0.40 -0.42 -0.05 0.00 0.36 0.00 0.00 54.97 55.27 1g5h s GLU 210 Cb -0.14 -2.82 0.03 0.00 0.26 0.00 0.00 34.13 31.46 1g5h s GLU 210 CO 0.09 0.63 0.05 0.00 -0.54 0.00 0.00 175.26 175.49 1g5h s ALA 211 N -0.69 2.94 -0.05 6.30 0.00 -0.20 -0.87 121.76 129.20 1g5h s ALA 211 Ca 0.11 -1.66 0.06 0.00 0.00 0.00 0.00 51.96 50.48 1g5h s ALA 211 Cb -0.12 -2.08 -0.01 0.00 0.00 0.00 0.00 23.12 20.91 1g5h s ALA 211 CO 0.02 -1.17 -0.25 0.45 0.00 0.00 0.00 175.76 174.81 1g5h s SER 212 N 1.37 3.03 -0.12 0.00 0.15 0.90 -0.75 113.70 118.29 1g5h s SER 212 Ca -0.02 -0.50 0.03 0.00 0.70 0.00 0.00 55.95 56.16 1g5h s SER 212 Cb -0.19 -0.80 0.01 0.00 -1.71 0.00 0.00 66.02 63.33 1g5h s SER 212 CO 0.01 0.25 -0.22 -0.22 1.20 0.00 0.00 173.24 174.26 1g5h s LEU 213 N -0.19 2.04 -0.19 3.45 2.96 0.19 -1.35 118.68 125.59 1g5h s LEU 213 Ca -0.03 -0.55 -0.01 0.00 -0.22 0.00 0.00 54.13 53.33 1g5h s LEU 213 Cb -0.13 -1.36 0.01 0.00 0.50 0.00 0.00 46.19 45.20 1g5h s LEU 213 CO 0.03 0.10 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.33 1g5h s VAL 214 N 0.63 2.53 -0.16 1.68 1.01 -0.16 -0.27 120.40 125.65 1g5h s VAL 214 Ca -0.12 -0.78 -0.00 0.00 0.00 0.00 0.00 61.98 61.07 1g5h s VAL 214 Cb -0.17 -2.10 -0.00 0.00 0.00 0.00 0.00 36.38 34.12 1g5h s VAL 214 CO 0.03 0.50 -0.14 0.86 0.00 0.00 0.00 175.10 176.35 1g5h s TRP 215 N 1.29 2.80 -0.30 5.22 -0.11 0.60 -0.86 118.94 127.59 1g5h s TRP 215 Ca 0.04 -1.08 -0.10 0.00 1.22 0.00 0.00 56.10 56.19 1g5h s TRP 215 Cb -0.14 -1.91 -0.02 0.00 -1.50 0.00 0.00 33.47 29.90 1g5h s TRP 215 CO -0.08 -0.51 0.15 -0.06 -4.62 0.00 0.00 176.95 171.83 1g5h s PHE 216 N 0.92 3.17 0.04 5.86 0.08 0.10 -0.11 117.98 128.05 1g5h s PHE 216 Ca -0.03 -0.43 -0.01 0.00 0.12 0.00 0.00 56.93 56.58 1g5h s PHE 216 Cb -0.15 -2.35 -0.03 0.00 -0.57 0.00 0.00 43.02 39.92 1g5h s PHE 216 CO -0.02 -0.39 -0.03 -0.08 -0.10 0.00 0.00 175.22 174.60 1g5h s THR 217 N 1.64 0.21 0.58 0.64 -1.32 -0.66 -2.20 115.64 114.54 1g5h s THR 217 Ca 0.05 -1.56 -0.20 0.00 -1.21 0.00 0.00 61.69 58.77 1g5h s THR 217 Cb -0.17 -1.17 -0.04 0.00 -1.51 0.00 0.00 72.50 69.62 1g5h s THR 217 CO 0.07 -0.85 1.30 -2.16 -2.21 0.00 0.00 174.62 170.77 1g5h s PRO 218 N -3.21 2.97 0.39 7.08 0.04 -1.26 0.41 135.00 141.42 1g5h s PRO 218 Ca 0.01 2.08 0.11 0.00 0.04 0.00 0.00 61.00 63.23 1g5h s PRO 218 Cb 0.03 -2.08 0.89 0.00 0.04 0.00 0.00 34.50 33.38 1g5h s PRO 218 CO -0.07 -1.28 1.93 1.15 0.04 0.00 0.00 177.00 178.77 1g5h h THR 219 N 1.10 0.89 0.00 1.26 2.02 -1.91 -1.74 112.91 114.53 1g5h h THR 219 Ca -0.51 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.47 1g5h h THR 219 Cb 1.31 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 1g5h h THR 219 CO 0.56 0.11 0.00 -2.11 0.37 0.00 0.00 175.52 174.45 1g5h n ARG 220 N -4.50 0.14 -0.00 6.66 1.85 -1.26 -2.17 116.66 117.37 1g5h n ARG 220 Ca 0.13 0.40 0.01 0.00 -1.00 0.00 0.00 57.85 57.39 1g5h n ARG 220 Cb 0.40 -1.78 0.01 0.00 -1.05 0.00 0.00 32.46 30.03 1g5h n ARG 220 CO 0.00 0.00 0.00 -2.37 -0.01 0.00 0.00 177.63 175.25 1g5h n THR 221 N -2.04 0.25 -0.29 8.89 5.66 -0.68 -4.73 114.28 121.33 1g5h n THR 221 Ca 0.02 -0.63 -0.05 0.00 -3.05 0.00 0.00 64.05 60.35 1g5h n THR 221 Cb 0.19 0.89 0.07 0.00 -1.55 0.00 0.00 70.33 69.93 1g5h n THR 221 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 1g5h h SER 222 N 0.21 0.97 -0.44 1.09 4.64 -1.09 -1.34 113.55 117.59 1g5h h SER 222 Ca 0.00 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 1g5h h SER 222 Cb 0.16 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 1g5h h SER 222 CO 0.00 0.76 0.24 0.28 -0.87 0.00 0.00 176.83 177.24 1g5h h SER 223 N 1.09 0.55 -0.82 4.97 0.02 -1.85 -0.83 113.55 116.67 1g5h h SER 223 Ca 0.28 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.13 1g5h h SER 223 Cb -0.02 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.34 1g5h h SER 223 CO -0.05 0.47 0.43 1.56 -1.14 0.00 0.00 176.83 178.10 1g5h h GLN 224 N 0.58 1.17 -0.39 3.45 4.20 -1.83 -2.35 115.11 119.93 1g5h h GLN 224 Ca 0.16 -0.15 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 1g5h h GLN 224 Cb 0.04 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 1g5h h GLN 224 CO -0.03 0.88 -0.16 -1.49 -0.67 0.00 0.00 178.83 177.37 1g5h h TRP 225 N 1.16 0.80 -0.31 2.96 4.06 -0.98 -0.36 115.95 123.27 1g5h h TRP 225 Ca 0.29 -0.16 0.03 0.00 2.06 0.00 0.00 58.89 61.11 1g5h h TRP 225 Cb 0.07 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 28.00 1g5h h TRP 225 CO 0.01 0.83 0.12 1.25 -3.56 0.00 0.00 178.44 177.09 1g5h h LEU 226 N 0.65 0.13 -0.77 -4.49 5.85 -0.93 -0.39 115.31 115.36 1g5h h LEU 226 Ca 0.10 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.75 1g5h h LEU 226 Cb 0.63 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1g5h h LEU 226 CO 0.04 0.11 -0.19 0.44 -0.34 0.00 0.00 178.44 178.50 1g5h h ASP 227 N 0.26 0.73 -0.15 1.25 3.32 -1.25 -1.38 116.42 119.19 1g5h h ASP 227 Ca 0.14 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 1g5h h ASP 227 Cb 0.10 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1g5h h ASP 227 CO -0.14 0.92 0.09 0.15 -1.72 0.00 0.00 179.24 178.54 1g5h h PHE 228 N 0.64 0.21 -0.13 4.55 3.04 -0.69 -2.69 116.94 121.88 1g5h h PHE 228 Ca 0.10 -0.00 -0.15 0.00 3.98 0.00 0.00 57.97 61.89 1g5h h PHE 228 Cb 0.68 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.11 1g5h h PHE 228 CO 0.03 0.20 -0.57 -1.49 -2.02 0.00 0.00 178.31 174.46 1g5h h TRP 229 N 0.16 0.52 0.08 0.41 4.06 -0.94 -1.24 115.95 118.99 1g5h h TRP 229 Ca 0.05 -0.19 0.01 0.00 2.06 0.00 0.00 58.89 60.82 1g5h h TRP 229 Cb 0.06 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 1g5h h TRP 229 CO -0.04 0.88 -0.11 1.25 -3.56 0.00 0.00 178.44 176.86 1g5h h LEU 230 N 0.31 -0.29 -0.66 -4.49 5.85 -1.23 0.20 115.31 115.00 1g5h h LEU 230 Ca 0.00 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1g5h h LEU 230 Cb 1.09 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 1g5h h LEU 230 CO 0.10 -0.16 0.26 -0.09 -0.34 0.00 0.00 178.44 178.21 1g5h h ARG 231 N -0.23 0.98 0.10 1.25 9.65 -1.37 -0.84 114.38 123.93 1g5h h ARG 231 Ca 0.01 -0.18 -0.00 0.00 -1.10 0.00 0.00 59.98 58.71 1g5h h ARG 231 Cb 0.23 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.65 1g5h h ARG 231 CO -0.05 0.82 -0.05 1.25 2.80 0.00 0.00 179.97 184.74 1g5h h HIS 232 N 0.93 -0.12 -0.55 2.20 2.76 -0.89 -1.70 115.15 117.78 1g5h h HIS 232 Ca 0.22 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.31 1g5h h HIS 232 Cb 0.21 0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.19 1g5h h HIS 232 CO 0.01 -0.08 0.06 0.00 -1.30 0.00 0.00 177.93 176.63 1g5h h ARG 233 N -0.13 0.93 -0.65 5.26 2.47 -0.47 -1.85 114.38 119.94 1g5h h ARG 233 Ca -0.01 -0.26 -0.00 0.00 -1.26 0.00 0.00 59.98 58.44 1g5h h ARG 233 Cb 0.10 -0.10 -0.03 0.00 -1.65 0.00 0.00 29.97 28.29 1g5h h ARG 233 CO 0.02 0.91 0.40 1.25 0.56 0.00 0.00 179.97 183.11 1g5h h LEU 234 N 0.82 0.77 -1.35 3.04 5.85 -1.03 -1.78 115.31 121.63 1g5h h LEU 234 Ca 0.16 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 1g5h h LEU 234 Cb 0.45 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1g5h h LEU 234 CO 0.02 0.60 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.38 1g5h h LEU 235 N 0.88 0.09 -0.15 2.25 3.38 -1.19 -2.04 115.31 118.53 1g5h h LEU 235 Ca 0.23 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 1g5h h LEU 235 Cb -0.03 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1g5h h LEU 235 CO -0.04 0.36 0.03 -0.25 0.09 0.00 0.00 178.44 178.62 1g5h h TRP 236 N 0.08 0.26 -0.72 1.13 7.01 -0.70 -1.41 115.95 121.59 1g5h h TRP 236 Ca 0.01 -0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.95 1g5h h TRP 236 Cb 0.52 -0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.48 1g5h h TRP 236 CO 0.00 0.41 0.34 -1.49 -2.79 0.00 0.00 178.44 174.91 1g5h h TRP 237 N 0.03 1.06 0.00 2.65 4.06 -1.12 -3.16 115.95 119.47 1g5h h TRP 237 Ca 0.05 -0.06 -0.08 0.00 2.06 0.00 0.00 58.89 60.86 1g5h h TRP 237 Cb 0.29 -0.33 -0.01 0.00 -1.00 0.00 0.00 29.16 28.11 1g5h h TRP 237 CO 0.01 0.79 -0.37 0.00 -3.56 0.00 0.00 178.44 175.32 1g5h h ARG 238 N 1.02 0.00 0.00 0.49 3.08 -1.25 -3.18 114.38 114.54 1g5h h ARG 238 Ca 0.25 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.28 1g5h h ARG 238 Cb 0.14 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1g5h h ARG 238 CO -0.03 0.37 -0.06 1.57 -1.07 0.00 0.00 179.97 180.75 1g5h h LYS 239 N 0.00 0.00 -0.02 0.04 2.10 -1.22 -1.66 116.57 115.82 1g5h h LYS 239 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1g5h h LYS 239 Cb 0.74 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.07 1g5h h LYS 239 CO 0.05 0.06 -0.23 1.19 -2.00 0.00 0.00 179.45 178.52 1g5h n PHE 240 N -3.26 0.00 -0.94 0.07 3.72 -1.20 -4.90 117.46 110.96 1g5h n PHE 240 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1g5h n PHE 240 Cb 0.26 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 1g5h n PHE 240 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1g5h n ALA 241 N 0.35 0.00 -0.72 4.37 0.00 -0.62 -4.37 120.51 119.52 1g5h n ALA 241 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1g5h n ALA 241 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1g5h n ALA 241 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1g5h n SER 243 N 0.00 -1.43 0.26 0.00 7.64 -1.26 -5.04 113.62 113.78 1g5h n SER 243 Ca 0.00 -1.01 0.18 0.00 1.01 0.00 0.00 58.87 59.05 1g5h n SER 243 Cb 0.00 -0.43 0.91 0.00 -1.01 0.00 0.00 64.21 63.68 1g5h n SER 243 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1g5h h PRO 244 N 6.45 0.00 0.00 1.43 0.13 -1.94 -0.85 132.00 137.21 1g5h h PRO 244 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1g5h h PRO 244 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1g5h h PRO 244 CO 0.72 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.36 1g5h n SER 245 N -3.59 0.25 -0.02 1.44 3.41 -1.26 -1.62 113.62 112.22 1g5h n SER 245 Ca -0.00 0.55 0.15 0.00 -0.26 0.00 0.00 58.87 59.31 1g5h n SER 245 Cb 0.25 -0.61 0.71 0.00 -0.26 0.00 0.00 64.21 64.30 1g5h n SER 245 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1g5h n ASN 246 N -1.76 0.10 -4.51 4.04 3.02 -0.33 -4.46 115.26 111.36 1g5h n ASN 246 Ca 0.04 -0.19 -0.36 0.00 -0.03 0.00 0.00 54.58 54.03 1g5h n ASN 246 Cb 0.22 -0.24 -0.12 0.00 -0.61 0.00 0.00 39.78 39.03 1g5h n ASN 246 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1g5h s PHE 247 N -2.58 3.14 0.23 3.10 0.08 -0.64 -1.33 117.98 119.97 1g5h s PHE 247 Ca 0.27 -0.22 0.00 0.00 0.12 0.00 0.00 56.93 57.11 1g5h s PHE 247 Cb 0.20 -2.23 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 1g5h s PHE 247 CO 0.47 -0.22 0.15 -1.54 -0.10 0.00 0.00 175.22 173.98 1g5h s SER 248 N 1.40 0.49 0.25 1.36 1.04 -0.76 -4.98 113.70 112.49 1g5h s SER 248 Ca 0.06 -1.45 0.06 0.00 0.48 0.00 0.00 55.95 55.10 1g5h s SER 248 Cb -0.15 0.39 -0.05 0.00 0.10 0.00 0.00 66.02 66.31 1g5h s SER 248 CO 0.05 -0.86 -0.08 -0.94 0.98 0.00 0.00 173.24 172.39 1g5h s SER 249 N -3.21 2.52 -0.07 7.02 1.04 -1.26 -0.06 113.70 119.69 1g5h s SER 249 Ca 0.39 -1.14 -0.05 0.00 0.48 0.00 0.00 55.95 55.63 1g5h s SER 249 Cb 0.06 -0.12 0.02 0.00 0.10 0.00 0.00 66.02 66.08 1g5h s SER 249 CO 0.14 -0.32 0.17 0.00 0.98 0.00 0.00 173.24 174.21 1g5h s ALA 250 N -3.08 -0.40 0.42 5.32 0.00 -0.33 -4.98 121.76 118.71 1g5h s ALA 250 Ca 0.27 0.52 -0.14 0.00 0.00 0.00 0.00 51.96 52.61 1g5h s ALA 250 Cb 0.03 -0.31 -0.08 0.00 0.00 0.00 0.00 23.12 22.76 1g5h s ALA 250 CO 0.09 -0.09 0.84 -0.51 0.00 0.00 0.00 175.76 176.09 1g5h s ASP 251 N 0.27 6.65 0.31 0.00 1.01 -1.26 -0.88 116.67 122.77 1g5h s ASP 251 Ca -0.02 1.34 -0.11 0.00 0.71 0.00 0.00 52.55 54.47 1g5h s ASP 251 Cb -0.03 -2.41 0.02 0.00 1.01 0.00 0.00 42.92 41.51 1g5h s ASP 251 CO -0.01 -0.41 0.58 0.00 0.21 0.00 0.00 175.17 175.55 1g5h s GLN 253 N -3.29 0.67 0.56 0.00 -2.07 -1.26 -1.20 119.66 113.07 1g5h s GLN 253 Ca 0.22 -0.49 0.09 0.00 -1.82 0.00 0.00 55.36 53.36 1g5h s GLN 253 Cb -0.02 0.29 0.07 0.00 -1.09 0.00 0.00 33.01 32.26 1g5h s GLN 253 CO 0.13 -0.19 0.72 0.16 -1.32 0.00 0.00 175.29 174.78 1g5h s ASP 254 N -1.83 5.08 0.34 12.60 -4.77 -0.56 -4.94 116.67 122.58 1g5h s ASP 254 Ca -0.08 -0.87 0.12 0.00 -3.30 0.00 0.00 52.55 48.41 1g5h s ASP 254 Cb -0.03 0.24 1.05 0.00 -1.09 0.00 0.00 42.92 43.08 1g5h s ASP 254 CO -0.01 -1.26 1.60 -0.33 0.70 0.00 0.00 175.17 175.86 1g5h h GLU 255 N 0.30 0.08 -0.53 2.11 5.08 -2.03 0.38 114.58 119.97 1g5h h GLU 255 Ca -0.32 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 1g5h h GLU 255 Cb 1.29 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1g5h h GLU 255 CO 0.44 0.05 0.00 1.28 -1.00 0.00 0.00 179.01 179.78 1g5h n LEU 256 N -5.29 2.83 0.00 1.33 4.77 -1.26 -4.90 117.00 114.47 1g5h n LEU 256 Ca 0.30 -1.42 0.00 0.00 -0.03 0.00 0.00 56.01 54.87 1g5h n LEU 256 Cb 1.00 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1g5h n LEU 256 CO 0.01 0.61 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1g5h n GLY 257 N 1.09 0.64 3.74 -0.72 0.00 0.12 -5.03 105.19 105.04 1g5h n GLY 257 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1g5h n GLY 257 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g5h s ARG 258 N -0.09 4.65 0.40 1.61 0.52 -1.26 -4.78 118.95 119.99 1g5h s ARG 258 Ca 0.00 1.70 -0.16 0.00 -0.52 0.00 0.00 55.73 56.74 1g5h s ARG 258 Cb 0.00 -3.26 -0.09 0.00 0.52 0.00 0.00 34.95 32.12 1g5h s ARG 258 CO 0.00 0.18 0.85 0.15 0.02 0.00 0.00 175.30 176.49 1g5h s LYS 259 N -0.74 4.03 0.29 3.54 -0.14 -1.26 -1.50 119.74 123.96 1g5h s LYS 259 Ca 0.47 0.82 -0.19 0.00 -1.36 0.00 0.00 55.97 55.71 1g5h s LYS 259 Cb -0.29 -2.30 0.02 0.00 -1.68 0.00 0.00 37.83 33.58 1g5h s LYS 259 CO 0.36 -0.00 0.70 0.20 -0.76 0.00 0.00 175.35 175.84 1g5h s GLY 260 N -2.52 0.09 0.06 -3.33 0.00 -0.34 -1.21 107.32 100.08 1g5h s GLY 260 Ca 0.57 -0.47 0.02 0.00 0.00 0.00 0.00 44.72 44.83 1g5h s GLY 260 CO 0.21 -0.21 -0.07 -0.56 0.00 0.00 0.00 173.10 172.47 1g5h s SER 261 N -2.96 0.91 0.03 1.64 0.01 0.46 -0.18 113.70 113.60 1g5h s SER 261 Ca 0.13 -0.72 0.06 0.00 1.31 0.00 0.00 55.95 56.74 1g5h s SER 261 Cb -0.05 0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.22 1g5h s SER 261 CO 0.08 -0.31 -0.19 -0.54 0.41 0.00 0.00 173.24 172.69 1g5h s LYS 262 N -2.42 1.32 -0.05 12.44 1.02 -0.06 -0.26 119.74 131.73 1g5h s LYS 262 Ca -0.02 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.14 1g5h s LYS 262 Cb -0.04 -1.37 -0.03 0.00 -0.52 0.00 0.00 37.83 35.86 1g5h s LYS 262 CO -0.02 0.35 -0.03 -0.51 -0.92 0.00 0.00 175.35 174.23 1g5h s LEU 263 N -0.98 3.39 0.08 3.17 1.43 0.51 -1.18 118.68 125.10 1g5h s LEU 263 Ca 0.06 0.03 0.07 0.00 -1.03 0.00 0.00 54.13 53.26 1g5h s LEU 263 Cb -0.08 -1.81 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 1g5h s LEU 263 CO 0.01 0.34 -0.18 -0.31 0.23 0.00 0.00 176.35 176.45 1g5h s TYR 264 N -0.91 1.52 -0.10 0.29 2.02 0.92 -0.00 117.35 121.09 1g5h s TYR 264 Ca 0.15 -0.43 0.02 0.00 -0.37 0.00 0.00 57.07 56.43 1g5h s TYR 264 Cb -0.11 -0.85 -0.02 0.00 -0.40 0.00 0.00 41.96 40.59 1g5h s TYR 264 CO 0.04 0.13 -0.15 -0.47 -1.57 0.00 0.00 175.55 173.53 1g5h s TYR 265 N -1.19 2.73 -1.11 2.71 5.04 -0.49 -1.84 117.35 123.20 1g5h s TYR 265 Ca 0.03 -0.55 -0.18 0.00 -2.44 0.00 0.00 57.07 53.92 1g5h s TYR 265 Cb -0.10 -1.75 0.11 0.00 0.35 0.00 0.00 41.96 40.57 1g5h s TYR 265 CO 0.03 -0.12 1.43 -1.12 -1.34 0.00 0.00 175.55 174.43 1g5h s SER 266 N 0.01 6.76 0.94 4.32 0.01 -0.44 -1.16 113.70 124.14 1g5h s SER 266 Ca -0.05 -2.24 -0.12 0.00 1.31 0.00 0.00 55.95 54.85 1g5h s SER 266 Cb -0.14 -2.48 0.16 0.00 0.21 0.00 0.00 66.02 63.76 1g5h s SER 266 CO 0.04 -1.11 1.10 -0.36 0.41 0.00 0.00 173.24 173.31 1g5h s PHE 267 N 3.32 2.25 0.60 2.43 0.08 -0.79 -4.90 117.98 120.96 1g5h s PHE 267 Ca 0.44 1.10 0.31 0.00 0.12 0.00 0.00 56.93 58.89 1g5h s PHE 267 Cb -0.01 -3.22 1.78 0.00 -0.57 0.00 0.00 43.02 41.00 1g5h s PHE 267 CO -0.03 -2.61 2.17 -1.35 -0.10 0.00 0.00 175.22 173.30 1g5h h PRO 268 N -1.69 0.00 -0.53 0.24 0.11 -2.00 -1.85 132.00 126.28 1g5h h PRO 268 Ca -0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1g5h h PRO 268 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1g5h h PRO 268 CO 0.57 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.69 1g5h n TRP 269 N -3.71 0.70 0.00 0.65 2.14 -1.26 -5.05 117.44 110.91 1g5h n TRP 269 Ca -0.01 -0.35 0.00 0.00 2.07 0.00 0.00 57.50 59.21 1g5h n TRP 269 Cb 0.22 -0.00 0.00 0.00 -0.81 0.00 0.00 31.31 30.72 1g5h n TRP 269 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1g5h n GLY 270 N 1.57 2.03 3.73 -1.67 0.00 -0.70 -5.06 105.19 105.09 1g5h n GLY 270 Ca 0.22 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 43.80 1g5h n GLY 270 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g5h s LYS 271 N -1.55 4.41 -0.02 1.61 1.02 -1.26 -1.89 119.74 122.07 1g5h s LYS 271 Ca 0.00 1.98 0.06 0.00 0.02 0.00 0.00 55.97 58.03 1g5h s LYS 271 Cb 0.00 -3.23 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 1g5h s LYS 271 CO 0.00 -0.24 -0.21 -1.21 -0.92 0.00 0.00 175.35 172.77 1g5h s GLU 272 N 0.16 1.74 -0.05 1.68 0.41 -0.31 -4.94 118.70 117.40 1g5h s GLU 272 Ca 0.57 -0.75 -0.30 0.00 -0.41 0.00 0.00 54.97 54.08 1g5h s GLU 272 Cb -0.35 -1.67 -0.04 0.00 -1.78 0.00 0.00 34.13 30.30 1g5h s GLU 272 CO 0.36 0.44 1.28 -1.25 -0.49 0.00 0.00 175.26 175.60 1g5h s PRO 273 N -0.45 4.32 0.00 0.39 0.04 -1.26 -1.40 135.00 136.64 1g5h s PRO 273 Ca 0.07 1.78 0.16 0.00 0.04 0.00 0.00 61.00 63.05 1g5h s PRO 273 Cb -0.09 -3.59 -0.11 0.00 0.04 0.00 0.00 34.50 30.75 1g5h s PRO 273 CO -0.00 -0.52 0.73 0.44 0.04 0.00 0.00 177.00 177.69 1g5h n ILE 274 N 4.71 0.00 -3.56 0.56 -5.35 1.00 -4.93 119.36 111.80 1g5h n ILE 274 Ca 0.12 -0.20 -0.16 0.00 -0.27 0.00 0.00 62.75 62.24 1g5h n ILE 274 Cb 0.45 1.07 -0.06 0.00 -1.74 0.00 0.00 39.64 39.35 1g5h n ILE 274 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1g5h s GLU 275 N -2.29 0.97 -0.02 6.28 2.12 -1.13 -0.64 118.70 123.99 1g5h s GLU 275 Ca 0.08 0.48 0.03 0.00 0.36 0.00 0.00 54.97 55.92 1g5h s GLU 275 Cb 0.12 0.46 -0.00 0.00 0.26 0.00 0.00 34.13 34.97 1g5h s GLU 275 CO 0.56 -0.25 -0.09 0.95 -0.54 0.00 0.00 175.26 175.90 1g5h s THR 276 N -0.70 0.72 -0.09 -1.70 -4.23 -0.30 -0.37 115.64 108.97 1g5h s THR 276 Ca -0.07 -0.35 0.03 0.00 -1.18 0.00 0.00 61.69 60.11 1g5h s THR 276 Cb -0.02 -0.63 0.01 0.00 1.34 0.00 0.00 72.50 73.21 1g5h s THR 276 CO 0.07 0.22 -0.17 -0.76 -0.54 0.00 0.00 174.62 173.43 1g5h s LEU 277 N 0.02 1.83 -0.04 4.79 1.02 0.64 -0.86 118.68 126.08 1g5h s LEU 277 Ca -0.00 -0.43 0.02 0.00 0.02 0.00 0.00 54.13 53.75 1g5h s LEU 277 Cb -0.06 -1.11 0.01 0.00 0.02 0.00 0.00 46.19 45.05 1g5h s LEU 277 CO 0.00 0.08 -0.11 0.26 0.02 0.00 0.00 176.35 176.60 1g5h s TRP 278 N 0.62 1.19 -0.71 0.29 0.52 -0.36 -0.41 118.94 120.08 1g5h s TRP 278 Ca -0.14 -0.36 -0.21 0.00 0.02 0.00 0.00 56.10 55.40 1g5h s TRP 278 Cb -0.16 -0.86 0.09 0.00 -1.15 0.00 0.00 33.47 31.38 1g5h s TRP 278 CO 0.04 -0.18 0.97 1.21 0.02 0.00 0.00 176.95 179.02 1g5h s ASN 279 N 0.41 6.27 0.35 2.95 3.84 -0.35 -1.08 114.94 127.34 1g5h s ASN 279 Ca -0.08 -1.27 0.25 0.00 0.21 0.00 0.00 52.86 51.96 1g5h s ASN 279 Cb -0.12 -2.40 0.56 0.00 -0.55 0.00 0.00 41.25 38.74 1g5h s ASN 279 CO 0.02 -1.32 1.69 -0.07 -2.79 0.00 0.00 177.10 174.62 1g5h h LEU 280 N 10.99 0.00 0.00 3.21 3.38 -1.18 -3.39 115.31 128.33 1g5h h LEU 280 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1g5h h LEU 280 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1g5h h LEU 280 CO 1.16 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.30 1g5h n GLY 281 N 1.13 0.04 0.21 0.83 0.00 -1.22 -4.42 105.19 101.74 1g5h n GLY 281 Ca 0.04 -0.95 0.03 0.00 0.00 0.00 0.00 46.02 45.14 1g5h n GLY 281 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1g5h n ASP 282 N -0.40 1.24 -0.08 1.61 5.68 -1.26 -0.83 116.55 122.51 1g5h n ASP 282 Ca 0.00 -1.12 -0.07 0.00 -0.50 0.00 0.00 54.79 53.10 1g5h n ASP 282 Cb 0.00 0.26 -0.00 0.00 -1.14 0.00 0.00 41.12 40.24 1g5h n ASP 282 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1g5h h GLN 283 N 1.01 -0.06 -0.49 0.11 4.20 -1.94 0.23 115.11 118.16 1g5h h GLN 283 Ca 0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.64 1g5h h GLN 283 Cb 0.25 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1g5h h GLN 283 CO 0.00 -0.04 -0.01 0.93 -0.67 0.00 0.00 178.83 179.04 1g5h h GLU 284 N -0.07 0.82 -0.37 1.46 3.07 -1.86 -0.76 114.58 116.87 1g5h h GLU 284 Ca 0.15 -0.23 -0.09 0.00 -0.50 0.00 0.00 59.36 58.69 1g5h h GLU 284 Cb 0.30 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 1g5h h GLU 284 CO -0.35 0.83 -0.14 1.25 -1.40 0.00 0.00 179.01 179.21 1g5h h LEU 285 N 0.76 0.77 -1.19 1.33 5.85 -1.68 -2.45 115.31 118.71 1g5h h LEU 285 Ca 0.15 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.45 1g5h h LEU 285 Cb 0.48 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 1g5h h LEU 285 CO 0.02 0.98 0.18 -0.07 -0.34 0.00 0.00 178.44 179.21 1g5h h LEU 286 N 0.55 0.68 -1.08 2.25 3.38 -0.30 -2.01 115.31 118.79 1g5h h LEU 286 Ca 0.09 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1g5h h LEU 286 Cb 0.67 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1g5h h LEU 286 CO 0.05 0.64 0.00 -0.74 0.09 0.00 0.00 178.44 178.47 1g5h h HIS 287 N 0.73 0.00 0.00 1.13 2.76 -0.86 -2.81 115.15 116.11 1g5h h HIS 287 Ca 0.17 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.33 1g5h h HIS 287 Cb 0.19 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.14 1g5h h HIS 287 CO 0.01 0.00 -0.07 1.15 -1.30 0.00 0.00 177.93 177.72 1g5h h THR 288 N 0.00 0.14 -2.57 6.26 2.02 -0.89 -3.36 112.91 114.50 1g5h h THR 288 Ca 0.00 -1.07 -0.60 0.00 0.77 0.00 0.00 66.41 65.52 1g5h h THR 288 Cb 0.61 1.95 -0.40 0.00 -1.74 0.00 0.00 68.15 68.58 1g5h h THR 288 CO 0.00 0.07 -0.83 -1.22 0.37 0.00 0.00 175.52 173.91 1g5h n TYR 289 N -3.13 0.75 -2.78 3.16 4.01 -1.06 -5.03 117.16 113.08 1g5h n TYR 289 Ca 0.03 -3.71 -0.41 0.00 -0.16 0.00 0.00 57.90 53.65 1g5h n TYR 289 Cb 0.51 -0.12 -0.04 0.00 -0.31 0.00 0.00 39.34 39.38 1g5h n TYR 289 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1g5h s PRO 290 N -0.67 4.55 0.00 -0.72 0.04 -1.24 -3.36 135.00 133.59 1g5h s PRO 290 Ca 0.31 1.31 0.00 0.00 0.04 0.00 0.00 61.00 62.66 1g5h s PRO 290 Cb 0.03 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 31.12 1g5h s PRO 290 CO -0.17 0.01 0.00 0.41 0.04 0.00 0.00 177.00 177.29 1g5h n GLY 291 N 2.85 0.68 0.35 0.56 0.00 -1.26 -4.87 105.19 103.50 1g5h n GLY 291 Ca 0.04 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.09 1g5h n GLY 291 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1g5h n ASN 292 N 0.00 0.77 0.20 1.61 5.03 -1.21 -4.85 115.26 116.81 1g5h n ASN 292 Ca 0.00 -2.35 0.06 0.00 0.87 0.00 0.00 54.58 53.17 1g5h n ASN 292 Cb 0.00 -0.27 0.56 0.00 -1.02 0.00 0.00 39.78 39.05 1g5h n ASN 292 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 1g5h h VAL 293 N 4.66 1.06 0.00 2.41 2.07 -1.90 -1.76 116.25 122.80 1g5h h VAL 293 Ca 0.00 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 1g5h h VAL 293 Cb 1.26 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1g5h h VAL 293 CO 0.00 0.07 -0.14 0.28 0.02 0.00 0.00 177.57 177.80 1g5h h SER 294 N 0.10 0.00 -0.24 0.57 0.02 -1.95 -3.10 113.55 108.95 1g5h h SER 294 Ca 0.03 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 1g5h h SER 294 Cb 0.08 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1g5h h SER 294 CO 0.00 0.14 -0.01 0.35 -1.14 0.00 0.00 176.83 176.18 1g5h n THR 295 N -3.66 2.28 -0.54 -2.27 -2.24 -0.67 -4.42 114.28 102.76 1g5h n THR 295 Ca -0.02 -2.03 0.06 0.00 -2.27 0.00 0.00 64.05 59.80 1g5h n THR 295 Cb 0.26 -0.26 0.15 0.00 -2.10 0.00 0.00 70.33 68.38 1g5h n THR 295 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1g5h n ILE 296 N -0.69 1.54 -2.65 2.28 -5.35 -1.17 -5.02 119.36 108.29 1g5h n ILE 296 Ca 0.22 -1.49 -0.41 0.00 -0.27 0.00 0.00 62.75 60.81 1g5h n ILE 296 Cb 0.89 0.14 -0.05 0.00 -1.74 0.00 0.00 39.64 38.88 1g5h n ILE 296 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1g5h s GLN 297 N -1.88 4.73 0.53 6.28 -0.21 -1.26 -4.70 119.66 123.15 1g5h s GLN 297 Ca 0.25 1.58 0.09 0.00 0.02 0.00 0.00 55.36 57.30 1g5h s GLN 297 Cb 0.19 -3.29 0.06 0.00 1.00 0.00 0.00 33.01 30.97 1g5h s GLN 297 CO 0.08 0.30 0.72 0.20 -2.12 0.00 0.00 175.29 174.47 1g5h s GLY 298 N -0.61 1.80 -0.20 3.09 0.00 -0.06 -4.84 107.32 106.50 1g5h s GLY 298 Ca 0.45 -2.00 -0.07 0.00 0.00 0.00 0.00 44.72 43.10 1g5h s GLY 298 CO 0.33 -1.62 0.05 0.50 0.00 0.00 0.00 173.10 172.36 1g5h s ARG 299 N -4.57 3.84 -0.70 2.90 0.52 0.13 -1.36 118.95 119.71 1g5h s ARG 299 Ca 0.60 -0.41 -0.02 0.00 -0.52 0.00 0.00 55.73 55.38 1g5h s ARG 299 Cb -0.07 -3.20 0.18 0.00 0.52 0.00 0.00 34.95 32.38 1g5h s ARG 299 CO 0.37 0.14 0.53 0.34 0.02 0.00 0.00 175.30 176.70 1g5h s ASP 300 N 0.72 5.38 1.29 0.23 2.15 0.44 -2.36 116.67 124.51 1g5h s ASP 300 Ca 0.03 -3.17 0.00 0.00 0.43 0.00 0.00 52.55 49.84 1g5h s ASP 300 Cb -0.13 -1.85 0.00 0.00 -0.30 0.00 0.00 42.92 40.64 1g5h s ASP 300 CO 0.02 -0.29 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 1g5h n GLY 301 N 3.05 1.50 0.00 2.66 0.00 -1.26 -2.14 105.19 109.00 1g5h n GLY 301 Ca 0.12 0.03 0.08 0.00 0.00 0.00 0.00 46.02 46.25 1g5h n GLY 301 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1g5h n ARG 302 N 0.00 1.48 -3.40 1.61 1.85 -1.26 -4.97 116.66 111.97 1g5h n ARG 302 Ca 0.00 -0.01 -0.35 0.00 -1.00 0.00 0.00 57.85 56.49 1g5h n ARG 302 Cb 0.00 -1.29 -0.06 0.00 -1.05 0.00 0.00 32.46 30.07 1g5h n ARG 302 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1g5h s LYS 303 N -2.60 3.92 -0.23 2.89 1.02 -0.91 -5.08 119.74 118.74 1g5h s LYS 303 Ca 0.05 0.41 -0.09 0.00 0.02 0.00 0.00 55.97 56.36 1g5h s LYS 303 Cb 0.12 -2.90 -0.04 0.00 -0.52 0.00 0.00 37.83 34.49 1g5h s LYS 303 CO 0.68 0.47 0.13 -0.80 -0.92 0.00 0.00 175.35 174.90 1g5h s ASN 304 N -1.82 5.84 0.07 2.83 0.01 -1.26 -0.42 114.94 120.19 1g5h s ASN 304 Ca 0.38 0.04 0.01 0.00 -0.71 0.00 0.00 52.86 52.58 1g5h s ASN 304 Cb -0.14 -2.05 -0.04 0.00 0.41 0.00 0.00 41.25 39.43 1g5h s ASN 304 CO 0.19 0.06 -0.05 0.68 -1.51 0.00 0.00 177.10 176.47 1g5h s VAL 305 N 1.07 0.49 -0.15 1.60 -7.23 -0.46 -4.94 120.40 110.78 1g5h s VAL 305 Ca 0.06 -1.75 -0.25 0.00 -1.81 0.00 0.00 61.98 58.23 1g5h s VAL 305 Cb -0.14 -1.44 -0.02 0.00 0.56 0.00 0.00 36.38 35.34 1g5h s VAL 305 CO 0.04 -0.84 0.81 -0.69 -0.31 0.00 0.00 175.10 174.11 1g5h s VAL 306 N -3.37 4.91 0.68 1.32 1.01 -1.26 -0.88 120.40 122.81 1g5h s VAL 306 Ca 0.06 1.60 -0.12 0.00 0.00 0.00 0.00 61.98 63.53 1g5h s VAL 306 Cb 0.04 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.30 1g5h s VAL 306 CO -0.06 0.07 1.07 -2.16 0.00 0.00 0.00 175.10 174.02 1g5h s PRO 307 N 1.90 2.91 0.39 2.72 0.04 -1.26 -4.74 135.00 136.95 1g5h s PRO 307 Ca 0.38 1.08 -0.21 0.00 0.04 0.00 0.00 61.00 62.30 1g5h s PRO 307 Cb -0.17 -1.98 -0.10 0.00 0.04 0.00 0.00 34.50 32.29 1g5h s PRO 307 CO 0.14 -1.13 0.91 0.00 0.04 0.00 0.00 177.00 176.96 1g5h s VAL 309 N -2.01 3.54 -0.19 0.00 1.01 -0.01 -1.65 120.40 121.09 1g5h s VAL 309 Ca 0.58 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 1g5h s VAL 309 Cb -0.11 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 1g5h s VAL 309 CO 0.16 0.42 0.09 -0.76 0.00 0.00 0.00 175.10 175.01 1g5h s LEU 310 N 1.37 3.98 -0.22 3.92 1.43 0.85 -0.64 118.68 129.37 1g5h s LEU 310 Ca 0.04 0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1g5h s LEU 310 Cb -0.14 -2.01 0.02 0.00 0.03 0.00 0.00 46.19 44.08 1g5h s LEU 310 CO -0.01 0.19 -0.11 -0.55 0.23 0.00 0.00 176.35 176.09 1g5h s SER 311 N 0.31 3.88 -0.17 2.29 0.15 -0.24 -0.29 113.70 119.63 1g5h s SER 311 Ca 0.05 -0.76 -0.01 0.00 0.70 0.00 0.00 55.95 55.93 1g5h s SER 311 Cb -0.12 -1.60 -0.00 0.00 -1.71 0.00 0.00 66.02 62.59 1g5h s SER 311 CO -0.01 -0.07 -0.12 -0.69 1.20 0.00 0.00 173.24 173.56 1g5h s VAL 312 N 1.32 2.91 -0.11 4.45 1.01 0.62 -1.22 120.40 129.39 1g5h s VAL 312 Ca 0.02 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1g5h s VAL 312 Cb -0.15 -2.26 0.05 0.00 0.00 0.00 0.00 36.38 34.01 1g5h s VAL 312 CO -0.08 0.49 0.08 -0.55 0.00 0.00 0.00 175.10 175.05 1g5h s SER 313 N 0.99 1.68 -0.08 3.32 0.15 -0.04 -0.63 113.70 119.09 1g5h s SER 313 Ca -0.01 -0.23 -0.00 0.00 0.70 0.00 0.00 55.95 56.40 1g5h s SER 313 Cb -0.15 -0.15 -0.03 0.00 -1.71 0.00 0.00 66.02 63.98 1g5h s SER 313 CO -0.02 -0.30 -0.04 -0.83 1.20 0.00 0.00 173.24 173.26 1g5h s GLY 314 N 2.17 1.76 -0.52 9.45 0.00 0.07 -1.15 107.32 119.10 1g5h s GLY 314 Ca 0.04 -0.85 -0.18 0.00 0.00 0.00 0.00 44.72 43.72 1g5h s GLY 314 CO -0.06 -0.60 0.57 -0.35 0.00 0.00 0.00 173.10 172.66 1g5h s ASP 315 N -0.79 6.19 0.26 1.64 -1.08 0.19 -1.03 116.67 122.06 1g5h s ASP 315 Ca 0.12 -1.17 0.03 0.00 -0.52 0.00 0.00 52.55 51.01 1g5h s ASP 315 Cb -0.11 -2.26 0.35 0.00 -1.46 0.00 0.00 42.92 39.44 1g5h s ASP 315 CO 0.02 -0.87 1.66 0.58 0.52 0.00 0.00 175.17 177.08 1g5h h VAL 316 N 5.85 1.31 -0.05 1.11 2.07 -1.48 -0.16 116.25 124.90 1g5h h VAL 316 Ca -0.28 -1.54 -0.05 0.00 0.82 0.00 0.00 66.70 65.65 1g5h h VAL 316 Cb 1.10 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 1g5h h VAL 316 CO 0.97 0.47 -0.16 0.44 0.02 0.00 0.00 177.57 179.31 1g5h h ASP 317 N 0.32 0.22 -0.15 0.57 3.32 -1.92 -0.81 116.42 117.96 1g5h h ASP 317 Ca 0.03 -0.63 -0.06 0.00 0.02 0.00 0.00 57.03 56.39 1g5h h ASP 317 Cb 0.85 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 1g5h h ASP 317 CO 0.07 0.81 -0.08 0.25 -1.72 0.00 0.00 179.24 178.57 1g5h h LEU 318 N -0.35 0.45 -0.93 1.55 5.85 -1.89 -1.97 115.31 118.01 1g5h h LEU 318 Ca -0.01 -0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.53 1g5h h LEU 318 Cb 0.79 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 1g5h h LEU 318 CO 0.03 0.58 -0.13 1.23 -0.34 0.00 0.00 178.44 179.82 1g5h h GLY 319 N 0.87 0.69 0.84 3.75 0.00 -0.88 0.96 103.07 109.30 1g5h h GLY 319 Ca 0.09 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1g5h h GLY 319 CO 0.02 0.47 0.02 -0.84 0.00 0.00 0.00 176.54 176.21 1g5h h THR 320 N 0.58 1.14 -0.97 4.70 2.02 -0.62 -1.76 112.91 118.01 1g5h h THR 320 Ca 0.10 -0.43 0.05 0.00 0.77 0.00 0.00 66.41 66.91 1g5h h THR 320 Cb 0.56 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 68.25 1g5h h THR 320 CO 0.04 0.12 0.62 -0.07 0.37 0.00 0.00 175.52 176.60 1g5h h LEU 321 N -0.09 1.01 -0.28 2.58 3.38 -0.97 -1.68 115.31 119.26 1g5h h LEU 321 Ca 0.02 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1g5h h LEU 321 Cb 0.17 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1g5h h LEU 321 CO -0.00 0.66 -0.05 0.00 0.09 0.00 0.00 178.44 179.15 1g5h h ALA 322 N 1.42 0.21 -0.29 1.53 0.00 -0.50 -0.78 119.26 120.85 1g5h h ALA 322 Ca 0.41 0.10 -0.08 0.00 0.00 0.00 0.00 54.91 55.33 1g5h h ALA 322 Cb 0.11 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1g5h h ALA 322 CO -0.15 -0.45 -0.17 1.88 0.00 0.00 0.00 179.25 180.36 1g5h h TYR 323 N 0.03 0.57 0.23 0.00 0.05 -0.86 0.80 116.97 117.78 1g5h h TYR 323 Ca 0.13 -0.10 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 1g5h h TYR 323 Cb 0.20 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 37.79 1g5h h TYR 323 CO -0.25 0.66 -0.11 -0.07 -1.05 0.00 0.00 178.16 177.34 1g5h h LEU 324 N 0.47 -0.26 -1.08 3.88 3.38 -0.67 -1.20 115.31 119.85 1g5h h LEU 324 Ca 0.08 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.09 1g5h h LEU 324 Cb 0.56 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.32 1g5h h LEU 324 CO 0.04 -0.16 0.62 1.88 0.09 0.00 0.00 178.44 180.90 1g5h h TYR 325 N -0.33 1.15 0.00 1.13 0.05 -0.86 -2.89 116.97 115.22 1g5h h TYR 325 Ca -0.03 0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.71 1g5h h TYR 325 Cb 0.25 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 37.60 1g5h h TYR 325 CO -0.06 0.64 -0.34 0.22 -1.05 0.00 0.00 178.16 177.57 1g5h h ASP 326 N 1.16 0.00 0.97 3.88 3.58 -0.62 -2.94 116.42 122.46 1g5h h ASP 326 Ca 0.39 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.84 1g5h h ASP 326 Cb 0.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.13 1g5h h ASP 326 CO -0.13 0.34 -0.23 -1.54 -2.88 0.00 0.00 179.24 174.80 1g5h n SER 327 N -3.89 0.43 -4.67 2.28 3.41 -0.47 -4.62 113.62 106.09 1g5h n SER 327 Ca -0.01 0.28 -0.43 0.00 -0.26 0.00 0.00 58.87 58.44 1g5h n SER 327 Cb 0.41 -0.28 -0.02 0.00 -0.26 0.00 0.00 64.21 64.06 1g5h n SER 327 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1g5h s PHE 328 N -3.05 3.29 0.05 7.33 5.36 -1.11 -0.52 117.98 129.33 1g5h s PHE 328 Ca 0.11 1.41 0.03 0.00 -0.96 0.00 0.00 56.93 57.52 1g5h s PHE 328 Cb 0.16 -3.30 -0.03 0.00 -0.34 0.00 0.00 43.02 39.51 1g5h s PHE 328 CO 0.62 -0.67 -0.10 -0.65 -1.46 0.00 0.00 175.22 172.96 1g5h s GLN 329 N 2.95 0.64 0.06 10.12 -0.21 0.03 -4.98 119.66 128.26 1g5h s GLN 329 Ca 0.47 -0.84 0.02 0.00 0.02 0.00 0.00 55.36 55.03 1g5h s GLN 329 Cb -0.17 -0.48 -0.04 0.00 1.00 0.00 0.00 33.01 33.32 1g5h s GLN 329 CO 0.11 0.10 0.10 -0.51 -2.12 0.00 0.00 175.29 172.96 1g5h s LEU 330 N -1.67 3.92 0.00 2.90 1.43 -1.26 -1.01 118.68 122.99 1g5h s LEU 330 Ca -0.07 0.07 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 1g5h s LEU 330 Cb -0.10 -2.52 0.00 0.00 0.03 0.00 0.00 46.19 43.60 1g5h s LEU 330 CO 0.01 0.19 0.00 -2.11 0.23 0.00 0.00 176.35 174.67 1g5h n ARG 343 N 0.58 0.00 -3.72 1.70 1.85 -1.26 -4.67 116.66 111.14 1g5h n ARG 343 Ca -0.09 0.00 -0.35 0.00 -1.00 0.00 0.00 57.85 56.41 1g5h n ARG 343 Cb 0.52 -0.14 -0.08 0.00 -1.05 0.00 0.00 32.46 31.71 1g5h n ARG 343 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1g5h s LYS 344 N -1.17 4.18 0.01 2.89 1.02 -1.26 -5.08 119.74 120.33 1g5h s LYS 344 Ca 0.00 -0.22 0.01 0.00 0.02 0.00 0.00 55.97 55.78 1g5h s LYS 344 Cb 0.00 -3.43 -0.01 0.00 -0.52 0.00 0.00 37.83 33.87 1g5h s LYS 344 CO 0.00 0.28 -0.04 0.54 -0.92 0.00 0.00 175.35 175.21 1g5h s VAL 345 N 0.43 0.30 -0.36 3.17 0.11 -0.18 -4.13 120.40 119.73 1g5h s VAL 345 Ca 0.08 -0.35 -0.14 0.00 -2.93 0.00 0.00 61.98 58.64 1g5h s VAL 345 Cb -0.11 -0.29 -0.00 0.00 -1.53 0.00 0.00 36.38 34.44 1g5h s VAL 345 CO -0.01 -0.04 0.28 -0.76 -3.33 0.00 0.00 175.10 171.24 1g5h s LEU 346 N -0.43 4.69 -1.13 2.54 1.43 -0.82 -0.79 118.68 124.16 1g5h s LEU 346 Ca -0.02 -0.54 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 1g5h s LEU 346 Cb -0.03 -2.19 0.26 0.00 0.03 0.00 0.00 46.19 44.26 1g5h s LEU 346 CO -0.00 -0.33 1.74 0.29 0.23 0.00 0.00 176.35 178.28 1g5h n LYS 347 N 5.19 4.56 -2.26 1.70 5.02 0.32 -4.18 118.16 128.51 1g5h n LYS 347 Ca -0.11 -4.27 -0.37 0.00 -2.02 0.00 0.00 58.31 51.54 1g5h n LYS 347 Cb 0.49 -2.59 -0.01 0.00 -0.02 0.00 0.00 35.03 32.89 1g5h n LYS 347 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1g5h s LEU 348 N -2.58 4.05 0.31 -0.35 1.43 -1.26 -4.72 118.68 115.56 1g5h s LEU 348 Ca 0.37 2.31 -0.28 0.00 -1.03 0.00 0.00 54.13 55.50 1g5h s LEU 348 Cb 0.11 -4.20 -0.13 0.00 0.03 0.00 0.00 46.19 41.99 1g5h s LEU 348 CO 0.01 -0.87 1.20 1.57 0.23 0.00 0.00 176.35 178.49 1g5h n HIS 349 N -0.38 1.90 -0.34 0.29 -0.00 -1.26 -4.59 115.22 110.84 1g5h n HIS 349 Ca 0.07 0.60 0.28 0.00 -0.00 0.00 0.00 57.72 58.66 1g5h n HIS 349 Cb 0.48 -2.36 0.59 0.00 -0.00 0.00 0.00 29.99 28.70 1g5h n HIS 349 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1g5h h PRO 350 N 2.54 0.24 0.00 1.57 0.11 -1.95 0.40 132.00 134.91 1g5h h PRO 350 Ca -0.44 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.64 1g5h h PRO 350 Cb 1.30 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1g5h h PRO 350 CO 0.63 0.16 -0.08 0.00 -0.21 0.00 0.00 178.00 178.50 1g5h n LEU 352 N -3.16 0.26 -4.64 0.00 4.77 0.11 -4.86 117.00 109.49 1g5h n LEU 352 Ca 0.02 -0.01 -0.50 0.00 -0.03 0.00 0.00 56.01 55.49 1g5h n LEU 352 Cb 0.43 0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 41.81 1g5h n LEU 352 CO 0.32 0.50 1.11 0.00 -1.33 0.00 0.00 177.39 177.98 1g5h n ALA 353 N -2.73 0.13 -0.01 -1.18 0.00 0.27 -4.51 120.51 112.48 1g5h n ALA 353 Ca -0.31 0.46 -0.07 0.00 0.00 0.00 0.00 53.44 53.51 1g5h n ALA 353 Cb 1.09 -2.23 0.11 0.00 0.00 0.00 0.00 19.45 18.41 1g5h n ALA 353 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1g5h h PRO 354 N 5.78 0.58 -5.01 0.00 0.13 -1.88 -3.41 132.00 128.19 1g5h h PRO 354 Ca -0.47 -0.29 -0.66 0.00 -0.87 0.00 0.00 66.00 63.72 1g5h h PRO 354 Cb 1.30 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.14 1g5h h PRO 354 CO 0.85 0.87 -0.75 0.42 -0.23 0.00 0.00 178.00 179.17 1g5h s ILE 355 N -4.29 3.15 0.01 -3.56 1.01 -1.26 -4.79 121.20 111.46 1g5h s ILE 355 Ca -0.08 -0.57 -0.10 0.00 0.00 0.00 0.00 60.65 59.90 1g5h s ILE 355 Cb 0.12 -2.42 -0.32 0.00 0.01 0.00 0.00 42.46 39.86 1g5h s ILE 355 CO 0.82 0.44 0.89 0.11 0.00 0.00 0.00 174.94 177.21 1g5h h LYS 356 N 8.06 0.40 -3.31 2.79 1.79 -1.71 -3.14 116.57 121.44 1g5h h LYS 356 Ca -0.42 -0.68 -0.16 0.00 -2.18 0.00 0.00 60.65 57.21 1g5h h LYS 356 Cb 1.16 0.25 -0.23 0.00 -1.58 0.00 0.00 32.23 31.83 1g5h h LYS 356 CO 0.61 1.31 -0.46 0.54 -1.08 0.00 0.00 179.45 180.37 1g5h s VAL 357 N -2.61 0.04 -0.05 0.50 0.11 -1.08 -2.15 120.40 115.16 1g5h s VAL 357 Ca -0.10 -0.33 0.03 0.00 -2.93 0.00 0.00 61.98 58.65 1g5h s VAL 357 Cb 0.05 -0.39 -0.03 0.00 -1.53 0.00 0.00 36.38 34.49 1g5h s VAL 357 CO 0.89 -0.18 -0.13 0.00 -3.33 0.00 0.00 175.10 172.35 1g5h s ALA 358 N -0.65 2.72 -0.12 1.54 0.00 -0.56 0.65 121.76 125.34 1g5h s ALA 358 Ca -0.07 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1g5h s ALA 358 Cb -0.04 -1.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.05 1g5h s ALA 358 CO 0.01 0.56 -0.17 -0.51 0.00 0.00 0.00 175.76 175.66 1g5h s LEU 359 N -0.76 2.50 0.19 0.00 1.43 -0.62 -0.34 118.68 121.08 1g5h s LEU 359 Ca 0.12 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 1g5h s LEU 359 Cb -0.11 -1.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.52 1g5h s LEU 359 CO 0.01 0.15 0.03 -1.81 0.23 0.00 0.00 176.35 174.96 1g5h s ASP 360 N 0.41 1.07 0.11 2.29 1.01 0.56 -1.63 116.67 120.49 1g5h s ASP 360 Ca -0.13 -1.22 0.10 0.00 0.71 0.00 0.00 52.55 52.01 1g5h s ASP 360 Cb -0.16 0.15 -0.04 0.00 1.01 0.00 0.00 42.92 43.88 1g5h s ASP 360 CO 0.06 -0.63 -0.22 0.68 0.21 0.00 0.00 175.17 175.27 1g5h s VAL 361 N -3.74 2.55 0.00 -1.27 -7.23 -1.26 -0.33 120.40 109.12 1g5h s VAL 361 Ca 0.27 -1.56 0.00 0.00 -1.81 0.00 0.00 61.98 58.88 1g5h s VAL 361 Cb 0.07 -2.13 0.00 0.00 0.56 0.00 0.00 36.38 34.87 1g5h s VAL 361 CO 0.06 0.15 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 1g5h n GLY 362 N 1.01 3.47 3.72 2.32 0.00 0.02 -4.85 105.19 110.88 1g5h n GLY 362 Ca -0.17 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 1g5h n GLY 362 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g5h s LYS 363 N 4.94 4.15 0.00 1.61 -0.14 -1.26 -4.89 119.74 124.14 1g5h s LYS 363 Ca 0.00 2.54 0.00 0.00 -1.36 0.00 0.00 55.97 57.15 1g5h s LYS 363 Cb 0.00 -3.13 0.00 0.00 -1.68 0.00 0.00 37.83 33.02 1g5h s LYS 363 CO 0.00 -0.72 0.00 0.41 -0.76 0.00 0.00 175.35 174.28 1g5h n GLY 364 N 3.94 0.68 3.53 -3.33 0.00 -1.26 -1.63 105.19 107.11 1g5h n GLY 364 Ca 0.15 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 1g5h n GLY 364 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1g5h n PRO 365 N -1.63 1.09 -0.18 1.61 -0.04 -1.26 -4.87 135.00 129.71 1g5h n PRO 365 Ca 0.00 0.17 -0.11 0.00 -0.04 0.00 0.00 63.50 63.52 1g5h n PRO 365 Cb 0.00 -2.91 -0.08 0.00 -0.04 0.00 0.00 33.50 30.46 1g5h n PRO 365 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1g5h h THR 366 N 7.50 0.00 0.00 0.52 2.02 -1.97 -1.80 112.91 119.17 1g5h h THR 366 Ca -0.26 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1g5h h THR 366 Cb 1.28 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1g5h h THR 366 CO 1.12 0.00 0.00 0.52 0.37 0.00 0.00 175.52 177.53 1g5h n VAL 367 N -4.87 0.00 -0.04 3.16 0.31 -1.26 -1.90 118.33 113.72 1g5h n VAL 367 Ca -0.02 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.26 1g5h n VAL 367 Cb 0.26 -0.69 -0.04 0.00 -0.91 0.00 0.00 33.84 32.46 1g5h n VAL 367 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1g5h n GLU 368 N -0.96 0.42 -0.28 5.55 1.02 -0.94 -4.15 120.64 121.29 1g5h n GLU 368 Ca 0.12 0.04 -0.05 0.00 -0.02 0.00 0.00 57.16 57.26 1g5h n GLU 368 Cb 0.06 -1.16 0.09 0.00 -0.02 0.00 0.00 31.44 30.41 1g5h n GLU 368 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1g5h h LEU 369 N 0.00 1.07 -1.15 -4.62 3.38 -1.20 -1.87 115.31 110.92 1g5h h LEU 369 Ca -0.18 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 1g5h h LEU 369 Cb 1.29 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1g5h h LEU 369 CO -0.03 0.92 0.14 0.03 0.09 0.00 0.00 178.44 179.59 1g5h h ARG 370 N 1.15 0.73 -0.18 1.13 3.08 -1.61 -0.11 114.38 118.57 1g5h h ARG 370 Ca 0.27 -0.13 -0.14 0.00 0.07 0.00 0.00 59.98 60.05 1g5h h ARG 370 Cb 0.16 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1g5h h ARG 370 CO -0.03 0.65 -0.49 1.96 -1.07 0.00 0.00 179.97 180.99 1g5h h GLN 371 N 0.71 0.47 -0.04 0.04 4.20 -1.57 0.02 115.11 118.94 1g5h h GLN 371 Ca 0.16 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 1g5h h GLN 371 Cb 0.24 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 1g5h h GLN 371 CO -0.01 0.86 0.02 0.28 -0.67 0.00 0.00 178.83 179.31 1g5h h VAL 372 N 0.38 1.13 -0.61 -0.54 2.07 -0.51 -1.45 116.25 116.71 1g5h h VAL 372 Ca 0.02 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.21 1g5h h VAL 372 Cb 1.00 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 32.03 1g5h h VAL 372 CO 0.09 0.10 0.34 0.00 0.02 0.00 0.00 177.57 178.12 1g5h h GLN 374 N 0.65 1.04 -0.23 0.00 1.08 -0.88 0.52 115.11 117.29 1g5h h GLN 374 Ca 0.27 -0.22 0.02 0.00 -1.45 0.00 0.00 58.65 57.26 1g5h h GLN 374 Cb 0.13 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 1g5h h GLN 374 CO -0.16 0.90 0.10 0.78 -0.95 0.00 0.00 178.83 179.51 1g5h h GLY 375 N 0.98 0.30 0.73 3.46 0.00 -0.88 0.76 103.07 108.42 1g5h h GLY 375 Ca 0.22 -0.07 0.03 0.00 0.00 0.00 0.00 47.33 47.51 1g5h h GLY 375 CO -0.01 0.05 0.10 -2.00 0.00 0.00 0.00 176.54 174.68 1g5h h LEU 376 N 0.22 0.10 0.25 3.11 5.85 -0.31 -1.59 115.31 122.94 1g5h h LEU 376 Ca 0.10 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1g5h h LEU 376 Cb 0.04 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 1g5h h LEU 376 CO -0.08 0.09 -0.51 0.25 -0.34 0.00 0.00 178.44 177.85 1g5h h LEU 377 N 0.22 -1.48 -0.80 2.25 5.85 0.40 -1.41 115.31 120.34 1g5h h LEU 377 Ca 0.13 0.15 0.18 0.00 0.84 0.00 0.00 57.88 59.18 1g5h h LEU 377 Cb 0.11 0.53 -0.11 0.00 0.37 0.00 0.00 40.66 41.56 1g5h h LEU 377 CO -0.14 -0.59 0.26 0.78 -0.34 0.00 0.00 178.44 178.41 1g5h h ASN 378 N -0.83 0.15 -0.63 1.25 2.35 -0.70 0.34 115.58 117.50 1g5h h ASN 378 Ca -0.02 0.15 -0.06 0.00 -0.55 0.00 0.00 56.30 55.81 1g5h h ASN 378 Cb 0.79 0.17 -0.03 0.00 0.05 0.00 0.00 38.32 39.30 1g5h h ASN 378 CO -0.21 -0.01 0.17 -0.08 -1.65 0.00 0.00 177.43 175.65 1g5h h GLU 379 N 0.34 1.03 0.04 0.81 4.81 -0.92 -2.07 114.58 118.61 1g5h h GLU 379 Ca 0.47 -0.23 -0.23 0.00 -0.13 0.00 0.00 59.36 59.24 1g5h h GLU 379 Cb 0.82 -0.15 0.02 0.00 0.63 0.00 0.00 28.75 30.07 1g5h h GLU 379 CO -0.51 0.90 -0.93 -0.07 -0.73 0.00 0.00 179.01 177.68 1g5h h LEU 380 N 0.98 0.75 -0.30 1.64 3.38 0.12 -2.92 115.31 118.97 1g5h h LEU 380 Ca 0.21 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.40 1g5h h LEU 380 Cb 0.33 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1g5h h LEU 380 CO -0.00 1.44 0.19 -0.07 0.09 0.00 0.00 178.44 180.09 1g5h h LEU 381 N 0.15 0.35 -2.02 1.67 3.38 -1.16 0.93 115.31 118.61 1g5h h LEU 381 Ca -0.13 -0.02 0.15 0.00 0.09 0.00 0.00 57.88 57.97 1g5h h LEU 381 Cb 1.62 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 42.26 1g5h h LEU 381 CO 0.18 0.26 0.40 -0.33 0.09 0.00 0.00 178.44 179.04 1g5h h GLU 382 N 0.40 0.00 -0.63 1.13 5.08 -1.43 1.55 114.58 120.68 1g5h h GLU 382 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1g5h h GLU 382 Cb -0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1g5h h GLU 382 CO -0.02 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.08 1g5h n ASN 383 N -4.21 4.02 -1.35 1.42 5.03 -0.08 -4.94 115.26 115.16 1g5h n ASN 383 Ca 0.09 -2.40 -0.18 0.00 0.87 0.00 0.00 54.58 52.97 1g5h n ASN 383 Cb 0.61 -0.53 -0.08 0.00 -1.02 0.00 0.00 39.78 38.77 1g5h n ASN 383 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1g5h n GLY 384 N 0.93 1.73 3.67 7.41 0.00 0.53 -4.98 105.19 114.48 1g5h n GLY 384 Ca 0.21 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1g5h n GLY 384 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g5h s ILE 385 N -2.64 5.06 0.17 -0.61 1.01 0.12 -4.96 121.20 119.36 1g5h s ILE 385 Ca 0.00 1.11 -0.30 0.00 0.00 0.00 0.00 60.65 61.46 1g5h s ILE 385 Cb 0.00 -3.91 -0.08 0.00 0.01 0.00 0.00 42.46 38.48 1g5h s ILE 385 CO 0.00 0.16 1.20 -0.94 0.00 0.00 0.00 174.94 175.36 1g5h s SER 386 N 1.11 7.08 -0.01 3.58 1.04 -1.26 -3.71 113.70 121.52 1g5h s SER 386 Ca 0.28 2.22 0.01 0.00 0.48 0.00 0.00 55.95 58.94 1g5h s SER 386 Cb -0.16 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.36 1g5h s SER 386 CO 0.11 -0.38 -0.05 -0.69 0.98 0.00 0.00 173.24 173.20 1g5h s VAL 387 N 0.05 0.43 -0.30 5.02 1.01 -1.26 -2.38 120.40 122.98 1g5h s VAL 387 Ca 0.53 -0.18 -0.14 0.00 0.00 0.00 0.00 61.98 62.19 1g5h s VAL 387 Cb -0.32 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 1g5h s VAL 387 CO 0.36 0.15 0.30 0.86 0.00 0.00 0.00 175.10 176.76 1g5h s TRP 388 N 0.18 3.23 -1.32 5.22 -0.11 0.21 -4.98 118.94 121.36 1g5h s TRP 388 Ca -0.02 0.17 -0.12 0.00 1.22 0.00 0.00 56.10 57.35 1g5h s TRP 388 Cb -0.06 -2.52 0.12 0.00 -1.50 0.00 0.00 33.47 29.51 1g5h s TRP 388 CO -0.00 -0.26 1.90 -0.35 -4.62 0.00 0.00 176.95 173.62 1g5h n PRO 389 N 5.24 3.34 0.27 5.86 -0.04 -1.26 -1.59 135.00 146.82 1g5h n PRO 389 Ca -0.11 -3.30 0.13 0.00 -0.04 0.00 0.00 63.50 60.19 1g5h n PRO 389 Cb 0.51 -3.09 0.78 0.00 -0.04 0.00 0.00 33.50 31.66 1g5h n PRO 389 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1g5h h GLY 390 N 9.09 0.00 2.00 0.55 0.00 -1.69 -2.52 103.07 110.49 1g5h h GLY 390 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 1g5h h GLY 390 CO 1.63 0.00 0.00 0.10 0.00 0.00 0.00 176.54 178.27 1g5h h TYR 391 N 0.00 0.00 0.00 5.60 -0.00 -1.65 -0.66 116.97 120.26 1g5h h TYR 391 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1g5h h TYR 391 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.98 1g5h h TYR 391 CO 0.00 0.00 -0.28 0.43 -0.00 0.00 0.00 178.16 178.31 1g5h n SER 392 N -2.71 0.40 -2.72 0.10 7.64 -0.95 -4.86 113.62 110.52 1g5h n SER 392 Ca -0.01 0.19 -0.06 0.00 1.01 0.00 0.00 58.87 60.00 1g5h n SER 392 Cb 0.16 -0.17 0.05 0.00 -1.01 0.00 0.00 64.21 63.24 1g5h n SER 392 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1g5h n GLU 393 N -1.70 -1.46 0.05 1.43 2.13 -0.26 -4.96 120.64 115.87 1g5h n GLU 393 Ca 0.06 -0.34 -0.15 0.00 0.66 0.00 0.00 57.16 57.39 1g5h n GLU 393 Cb 0.37 -0.32 -0.14 0.00 0.27 0.00 0.00 31.44 31.62 1g5h n GLU 393 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1g5h h THR 394 N -1.76 1.10 0.00 6.31 1.03 -1.89 -3.49 112.91 114.22 1g5h h THR 394 Ca -0.08 -2.78 0.00 0.00 -0.01 0.00 0.00 66.41 63.54 1g5h h THR 394 Cb 0.24 2.70 0.00 0.00 -1.07 0.00 0.00 68.15 70.02 1g5h h THR 394 CO 0.05 0.79 0.00 1.33 -0.01 0.00 0.00 175.52 177.68 1g5h n VAL 395 N -3.39 0.00 0.06 0.00 0.24 -1.26 -4.96 118.33 109.01 1g5h n VAL 395 Ca -0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 1g5h n VAL 395 Cb 1.04 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.41 1g5h n VAL 395 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1g5h n HIS 396 N -2.09 0.00 -4.54 6.34 8.25 -1.26 -4.68 115.22 117.25 1g5h n HIS 396 Ca 0.00 -0.15 -0.30 0.00 -0.26 0.00 0.00 57.72 57.01 1g5h n HIS 396 Cb 0.00 -0.21 -0.13 0.00 1.12 0.00 0.00 29.99 30.77 1g5h n HIS 396 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1g5h s SER 397 N 1.49 3.68 0.80 0.41 1.04 -1.26 -5.13 113.70 114.72 1g5h s SER 397 Ca 0.00 -0.54 -0.11 0.00 0.48 0.00 0.00 55.95 55.78 1g5h s SER 397 Cb 0.00 -0.49 0.07 0.00 0.10 0.00 0.00 66.02 65.70 1g5h s SER 397 CO 0.00 0.22 1.09 -0.55 0.98 0.00 0.00 173.24 174.98 1g5h s SER 398 N -1.74 4.40 0.14 7.02 0.15 -1.26 -4.85 113.70 117.56 1g5h s SER 398 Ca 0.15 1.50 -0.15 0.00 0.70 0.00 0.00 55.95 58.14 1g5h s SER 398 Cb -0.10 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 1g5h s SER 398 CO 0.07 -2.05 1.69 0.25 1.20 0.00 0.00 173.24 174.39 1g5h h LEU 399 N -1.14 0.58 -1.27 3.45 5.85 -1.99 -0.50 115.31 120.28 1g5h h LEU 399 Ca -0.46 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.08 1g5h h LEU 399 Cb 1.26 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1g5h h LEU 399 CO 0.56 0.58 0.32 -0.33 -0.34 0.00 0.00 178.44 179.24 1g5h h GLU 400 N 0.54 0.83 -0.25 1.25 3.07 -1.99 -0.32 114.58 117.70 1g5h h GLU 400 Ca 0.14 -0.09 -0.13 0.00 -0.50 0.00 0.00 59.36 58.78 1g5h h GLU 400 Cb 0.18 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1g5h h GLU 400 CO -0.01 0.61 -0.35 1.96 -1.40 0.00 0.00 179.01 179.82 1g5h h GLN 401 N 0.83 0.69 -0.52 2.33 4.20 -1.83 0.04 115.11 120.84 1g5h h GLN 401 Ca 0.21 -0.40 0.03 0.00 0.06 0.00 0.00 58.65 58.55 1g5h h GLN 401 Cb 0.03 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 1g5h h GLN 401 CO -0.03 1.02 0.30 1.25 -0.67 0.00 0.00 178.83 180.69 1g5h h LEU 402 N 0.41 0.48 -0.34 1.46 5.85 -0.53 -0.46 115.31 122.17 1g5h h LEU 402 Ca 0.03 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.63 1g5h h LEU 402 Cb 0.94 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.87 1g5h h LEU 402 CO 0.08 0.34 -0.27 0.45 -0.34 0.00 0.00 178.44 178.70 1g5h h HIS 403 N 0.60 0.93 -0.95 1.25 3.86 -0.97 -1.75 115.15 118.12 1g5h h HIS 403 Ca 0.21 -0.26 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1g5h h HIS 403 Cb 0.04 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 28.26 1g5h h HIS 403 CO -0.07 1.03 0.60 0.66 0.86 0.00 0.00 177.93 181.01 1g5h h SER 404 N 0.56 1.11 -0.28 2.45 4.64 -0.72 -1.14 113.55 120.18 1g5h h SER 404 Ca 0.06 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 1g5h h SER 404 Cb 0.84 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1g5h h SER 404 CO 0.07 0.82 0.13 0.50 -0.87 0.00 0.00 176.83 177.48 1g5h h LYS 405 N 1.30 0.40 -0.55 4.77 3.64 -0.86 -2.53 116.57 122.74 1g5h h LYS 405 Ca 0.34 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.63 1g5h h LYS 405 Cb -0.11 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.61 1g5h h LYS 405 CO -0.07 0.40 0.19 1.88 -2.27 0.00 0.00 179.45 179.58 1g5h h TYR 406 N 0.31 0.82 -0.65 1.91 0.05 -1.00 -2.22 116.97 116.18 1g5h h TYR 406 Ca 0.09 -0.05 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 1g5h h TYR 406 Cb 0.13 -0.25 -0.03 0.00 1.01 0.00 0.00 36.73 37.60 1g5h h TYR 406 CO -0.02 0.65 0.23 -0.44 -1.05 0.00 0.00 178.16 177.54 1g5h h ASP 407 N 0.79 0.90 0.00 3.88 3.32 -1.07 -0.94 116.42 123.31 1g5h h ASP 407 Ca 0.19 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1g5h h ASP 407 Cb 0.20 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1g5h h ASP 407 CO -0.01 0.83 0.00 -0.62 -1.72 0.00 0.00 179.24 177.72 1g5h n GLU 408 N -4.29 0.67 -0.46 3.56 1.02 -0.84 -1.95 120.64 118.35 1g5h n GLU 408 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1g5h n GLU 408 Cb 0.20 -1.17 0.00 0.00 -0.02 0.00 0.00 31.44 30.45 1g5h n GLU 408 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1g5h n SER 410 N 1.33 0.00 -4.70 1.62 2.88 -0.60 -4.58 113.62 109.56 1g5h n SER 410 Ca 0.00 -1.12 -0.44 0.00 -1.33 0.00 0.00 58.87 55.98 1g5h n SER 410 Cb 0.33 -0.02 -0.03 0.00 -0.75 0.00 0.00 64.21 63.73 1g5h n SER 410 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1g5h n VAL 411 N 0.00 0.02 0.00 2.46 0.31 -0.46 -4.80 118.33 115.87 1g5h n VAL 411 Ca 0.00 -0.00 -0.17 0.00 -0.01 0.00 0.00 64.34 64.15 1g5h n VAL 411 Cb 0.52 -1.82 -0.07 0.00 -0.91 0.00 0.00 33.84 31.56 1g5h n VAL 411 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1g5h h LEU 412 N 6.54 0.89 -7.70 7.52 3.38 -1.41 -3.40 115.31 121.13 1g5h h LEU 412 Ca -0.44 -0.62 -0.21 0.00 0.09 0.00 0.00 57.88 56.70 1g5h h LEU 412 Cb 1.22 -0.26 -0.27 0.00 0.09 0.00 0.00 40.66 41.44 1g5h h LEU 412 CO 0.93 1.41 -0.66 -0.36 0.09 0.00 0.00 178.44 179.86 1g5h s PHE 413 N -3.61 -0.04 0.04 1.13 0.08 -0.92 -1.40 117.98 113.27 1g5h s PHE 413 Ca -0.10 0.09 0.08 0.00 0.12 0.00 0.00 56.93 57.13 1g5h s PHE 413 Cb 0.08 0.01 -0.03 0.00 -0.57 0.00 0.00 43.02 42.51 1g5h s PHE 413 CO 0.90 -0.04 -0.22 -1.54 -0.10 0.00 0.00 175.22 174.22 1g5h s SER 414 N -0.08 3.51 -0.04 1.36 1.04 0.09 -1.50 113.70 118.08 1g5h s SER 414 Ca -0.01 -0.51 0.07 0.00 0.48 0.00 0.00 55.95 55.98 1g5h s SER 414 Cb -0.01 -0.46 -0.01 0.00 0.10 0.00 0.00 66.02 65.64 1g5h s SER 414 CO 0.00 0.26 -0.25 -0.69 0.98 0.00 0.00 173.24 173.54 1g5h s VAL 415 N -0.88 2.01 -0.12 5.02 1.01 0.54 -0.91 120.40 127.07 1g5h s VAL 415 Ca 0.13 -1.06 0.02 0.00 0.00 0.00 0.00 61.98 61.08 1g5h s VAL 415 Cb -0.10 -1.69 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 1g5h s VAL 415 CO 0.04 0.56 -0.20 -0.22 0.00 0.00 0.00 175.10 175.28 1g5h s LEU 416 N -0.31 2.29 -0.15 3.92 2.96 -0.31 -0.33 118.68 126.75 1g5h s LEU 416 Ca 0.01 -0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 53.41 1g5h s LEU 416 Cb -0.12 -1.48 -0.02 0.00 0.50 0.00 0.00 46.19 45.07 1g5h s LEU 416 CO 0.02 0.14 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.40 1g5h s VAL 417 N 0.44 3.22 0.29 1.68 1.01 0.55 -2.64 120.40 124.96 1g5h s VAL 417 Ca -0.14 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.29 1g5h s VAL 417 Cb -0.17 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 1g5h s VAL 417 CO 0.06 0.50 0.22 0.42 0.00 0.00 0.00 175.10 176.30 1g5h s THR 418 N 0.53 0.06 0.31 3.92 -4.23 -1.26 -0.80 115.64 114.17 1g5h s THR 418 Ca -0.07 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.48 1g5h s THR 418 Cb -0.15 -2.50 0.38 0.00 1.34 0.00 0.00 72.50 71.57 1g5h s THR 418 CO 0.04 0.00 1.59 -0.33 -0.54 0.00 0.00 174.62 175.38 1g5h h GLU 419 N 2.27 0.05 -0.86 3.99 5.08 -1.65 0.84 114.58 124.30 1g5h h GLU 419 Ca -0.29 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.14 1g5h h GLU 419 Cb 1.24 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.41 1g5h h GLU 419 CO 0.44 0.03 0.51 1.15 -1.00 0.00 0.00 179.01 180.14 1g5h h THR 420 N 0.05 0.97 -0.74 1.13 2.02 -1.92 0.15 112.91 114.57 1g5h h THR 420 Ca 0.62 -0.31 0.05 0.00 0.77 0.00 0.00 66.41 67.54 1g5h h THR 420 Cb 1.33 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 1g5h h THR 420 CO -0.84 0.16 0.49 0.74 0.37 0.00 0.00 175.52 176.45 1g5h h THR 421 N 0.89 1.08 0.00 3.16 2.02 0.59 0.36 112.91 121.02 1g5h h THR 421 Ca 0.40 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 67.24 1g5h h THR 421 Cb 0.29 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1g5h h THR 421 CO -0.21 0.16 -0.20 -0.07 0.37 0.00 0.00 175.52 175.56 1g5h h LEU 422 N 0.86 0.00 0.18 2.58 3.38 -0.49 0.48 115.31 122.29 1g5h h LEU 422 Ca 0.31 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.94 1g5h h LEU 422 Cb 0.13 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.89 1g5h h LEU 422 CO -0.09 0.20 -1.69 -0.33 0.09 0.00 0.00 178.44 176.62 1g5h h GLU 423 N 0.00 0.37 0.00 1.13 5.08 0.12 -3.42 114.58 117.87 1g5h h GLU 423 Ca -0.00 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 1g5h h GLU 423 Cb 0.41 0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1g5h h GLU 423 CO 0.03 1.28 0.00 0.27 -1.00 0.00 0.00 179.01 179.59 1g5h n ASN 424 N -3.57 0.48 -0.04 1.42 0.23 0.27 -5.01 115.26 109.04 1g5h n ASN 424 Ca -0.22 -1.21 -0.01 0.00 -0.53 0.00 0.00 54.58 52.62 1g5h n ASN 424 Cb 1.07 0.00 -0.00 0.00 -2.08 0.00 0.00 39.78 38.77 1g5h n ASN 424 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1g5h n GLY 425 N -0.10 0.24 3.77 4.83 0.00 0.17 -4.96 105.19 109.14 1g5h n GLY 425 Ca 0.00 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1g5h n GLY 425 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g5h s LEU 426 N -0.13 4.37 0.20 0.99 1.43 -1.26 -0.02 118.68 124.27 1g5h s LEU 426 Ca 0.00 0.93 0.11 0.00 -1.03 0.00 0.00 54.13 54.14 1g5h s LEU 426 Cb 0.00 -2.69 -0.04 0.00 0.03 0.00 0.00 46.19 43.48 1g5h s LEU 426 CO 0.00 0.14 -0.23 0.27 0.23 0.00 0.00 176.35 176.75 1g5h s ILE 427 N -0.13 2.35 -0.21 -0.59 -4.36 -1.26 -3.89 121.20 113.10 1g5h s ILE 427 Ca 0.26 -2.07 -0.14 0.00 -0.26 0.00 0.00 60.65 58.43 1g5h s ILE 427 Cb -0.16 -2.14 -0.04 0.00 1.25 0.00 0.00 42.46 41.37 1g5h s ILE 427 CO 0.12 -0.16 0.32 -1.58 0.24 0.00 0.00 174.94 173.89 1g5h s GLN 428 N -2.77 4.15 -0.16 0.37 0.74 -1.08 -4.74 119.66 116.17 1g5h s GLN 428 Ca 0.22 0.06 -0.03 0.00 0.05 0.00 0.00 55.36 55.66 1g5h s GLN 428 Cb -0.07 -3.53 -0.02 0.00 1.10 0.00 0.00 33.01 30.49 1g5h s GLN 428 CO 0.10 0.02 -0.07 -1.17 -0.55 0.00 0.00 175.29 173.62 1g5h s LEU 429 N 1.15 3.02 -0.12 3.68 2.96 0.17 -1.17 118.68 128.39 1g5h s LEU 429 Ca 0.15 -0.23 0.03 0.00 -0.22 0.00 0.00 54.13 53.86 1g5h s LEU 429 Cb -0.14 -1.72 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 1g5h s LEU 429 CO 0.06 0.14 -0.21 -0.60 -1.32 0.00 0.00 176.35 174.43 1g5h s ARG 430 N 0.51 3.13 -0.05 1.98 3.52 -0.09 -0.45 118.95 127.50 1g5h s ARG 430 Ca -0.05 -0.82 -0.22 0.00 -0.13 0.00 0.00 55.73 54.51 1g5h s ARG 430 Cb -0.15 -2.42 -0.04 0.00 -1.56 0.00 0.00 34.95 30.78 1g5h s ARG 430 CO 0.03 0.14 0.64 0.45 -0.81 0.00 0.00 175.30 175.76 1g5h s SER 431 N 0.46 6.95 0.18 -2.12 0.15 -1.26 -0.73 113.70 117.33 1g5h s SER 431 Ca -0.14 1.14 -0.12 0.00 0.70 0.00 0.00 55.95 57.53 1g5h s SER 431 Cb -0.17 -2.38 0.09 0.00 -1.71 0.00 0.00 66.02 61.85 1g5h s SER 431 CO 0.06 -0.03 1.75 -0.09 1.20 0.00 0.00 173.24 176.13 1g5h h ARG 432 N 6.40 0.91 -0.58 5.44 2.43 -1.45 0.04 114.38 127.57 1g5h h ARG 432 Ca -0.42 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 58.62 1g5h h ARG 432 Cb 1.20 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.55 1g5h h ARG 432 CO 0.74 0.75 0.37 -0.44 -1.51 0.00 0.00 179.97 179.87 1g5h h ASP 433 N 0.86 0.62 0.00 -3.80 3.32 -1.91 -3.32 116.42 112.19 1g5h h ASP 433 Ca 0.21 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1g5h h ASP 433 Cb 0.15 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1g5h h ASP 433 CO -0.02 0.44 -1.45 0.35 -1.72 0.00 0.00 179.24 176.84 1g5h n THR 434 N -4.72 0.00 -1.84 0.35 -2.24 -1.23 -5.18 114.28 99.41 1g5h n THR 434 Ca 0.04 -0.24 -0.01 0.00 -2.27 0.00 0.00 64.05 61.57 1g5h n THR 434 Cb 0.05 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1g5h n THR 434 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1g5h n THR 435 N -1.85 -4.63 -4.04 4.28 -2.24 -0.00 -5.04 114.28 100.75 1g5h n THR 435 Ca -0.02 0.40 -0.13 0.00 -2.27 0.00 0.00 64.05 62.04 1g5h n THR 435 Cb 0.27 -4.84 -0.04 0.00 -2.10 0.00 0.00 70.33 63.62 1g5h n THR 435 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1g5h s LYS 437 N -0.84 1.81 0.00 -0.78 1.02 -1.26 -4.76 119.74 114.93 1g5h s LYS 437 Ca 0.03 -1.59 0.00 0.00 0.02 0.00 0.00 55.97 54.43 1g5h s LYS 437 Cb -0.01 0.46 0.00 0.00 -0.52 0.00 0.00 37.83 37.76 1g5h s LYS 437 CO 0.21 -0.76 0.00 -1.91 -0.92 0.00 0.00 175.35 171.97 1g5h n GLU 438 N -0.50 0.00 -2.80 1.68 4.07 0.40 -4.94 120.64 118.56 1g5h n GLU 438 Ca -0.01 0.00 -0.41 0.00 -0.06 0.00 0.00 57.16 56.68 1g5h n GLU 438 Cb 0.62 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.96 1g5h n GLU 438 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 1g5h s HIS 441 N -0.16 3.64 0.40 4.31 2.46 -1.26 0.44 115.29 125.12 1g5h s HIS 441 Ca 0.00 1.58 0.27 0.00 0.47 0.00 0.00 55.06 57.38 1g5h s HIS 441 Cb 0.00 -3.04 1.46 0.00 -0.13 0.00 0.00 32.58 30.87 1g5h s HIS 441 CO 0.00 0.01 1.80 0.97 -2.47 0.00 0.00 174.74 175.05 1g5h h ILE 442 N 4.79 0.00 0.00 0.89 2.10 -0.79 0.25 117.51 124.76 1g5h h ILE 442 Ca -0.41 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.53 1g5h h ILE 442 Cb 1.21 0.60 0.00 0.00 -1.09 0.00 0.00 36.82 37.54 1g5h h ILE 442 CO 0.75 0.00 -0.27 -1.54 -1.08 0.00 0.00 178.15 176.01 1g5h n SER 443 N -2.63 0.71 -0.44 2.19 3.41 -1.26 -3.81 113.62 111.79 1g5h n SER 443 Ca -0.02 0.36 0.11 0.00 -0.26 0.00 0.00 58.87 59.06 1g5h n SER 443 Cb 0.28 -0.36 0.02 0.00 -0.26 0.00 0.00 64.21 63.89 1g5h n SER 443 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1g5h n LYS 444 N -2.13 1.08 -0.03 4.33 5.02 0.87 -4.59 118.16 122.70 1g5h n LYS 444 Ca 0.05 -0.88 -0.13 0.00 -2.02 0.00 0.00 58.31 55.33 1g5h n LYS 444 Cb 0.43 -1.48 -0.08 0.00 -0.02 0.00 0.00 35.03 33.87 1g5h n LYS 444 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1g5h h LEU 445 N 2.15 0.14 -0.46 -0.35 5.85 -1.66 -1.25 115.31 119.74 1g5h h LEU 445 Ca 0.00 -0.42 0.07 0.00 0.84 0.00 0.00 57.88 58.37 1g5h h LEU 445 Cb 0.72 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 1g5h h LEU 445 CO 0.00 0.53 0.10 -0.09 -0.34 0.00 0.00 178.44 178.64 1g5h h ARG 446 N -0.25 0.23 -0.65 1.25 2.43 -1.82 0.74 114.38 116.32 1g5h h ARG 446 Ca 0.01 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1g5h h ARG 446 Cb 0.48 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 1g5h h ARG 446 CO 0.01 0.15 0.17 -0.44 -1.51 0.00 0.00 179.97 178.36 1g5h h ASP 447 N 0.24 0.97 -0.23 -3.80 3.32 -1.83 -1.14 116.42 113.95 1g5h h ASP 447 Ca 0.23 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1g5h h ASP 447 Cb 0.29 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1g5h h ASP 447 CO -0.29 0.94 0.14 0.15 -1.72 0.00 0.00 179.24 178.46 1g5h h PHE 448 N 0.95 0.30 -0.26 4.55 3.57 -0.75 -2.26 116.94 123.03 1g5h h PHE 448 Ca 0.20 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.66 1g5h h PHE 448 Cb 0.34 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1g5h h PHE 448 CO 0.03 0.21 -0.01 -0.07 -2.23 0.00 0.00 178.31 176.24 1g5h h LEU 449 N 0.29 0.47 -0.85 0.59 3.38 -0.51 -0.79 115.31 117.88 1g5h h LEU 449 Ca 0.08 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.76 1g5h h LEU 449 Cb 0.00 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 1g5h h LEU 449 CO -0.02 0.67 0.55 0.58 0.09 0.00 0.00 178.44 180.31 1g5h h VAL 450 N 0.25 1.15 -0.22 1.22 2.07 -1.24 -0.94 116.25 118.55 1g5h h VAL 450 Ca 0.07 -0.37 -0.18 0.00 0.82 0.00 0.00 66.70 67.05 1g5h h VAL 450 Cb 0.44 -0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1g5h h VAL 450 CO 0.02 0.20 -0.58 0.11 0.02 0.00 0.00 177.57 177.34 1g5h h LYS 451 N 1.08 0.69 -0.18 1.57 1.57 -1.24 -0.32 116.57 119.74 1g5h h LYS 451 Ca 0.34 -0.45 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1g5h h LYS 451 Cb -0.01 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1g5h h LYS 451 CO -0.11 1.07 0.06 -0.92 -0.57 0.00 0.00 179.45 178.99 1g5h h TYR 452 N 0.52 0.28 -0.48 -1.35 5.03 -0.89 0.44 116.97 120.52 1g5h h TYR 452 Ca 0.00 -0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.23 1g5h h TYR 452 Cb 1.15 -0.08 -0.02 0.00 1.55 0.00 0.00 36.73 39.33 1g5h h TYR 452 CO 0.06 0.36 0.08 -0.07 -1.32 0.00 0.00 178.16 177.26 1g5h h LEU 453 N 0.12 0.77 -0.92 2.82 3.38 -1.15 -1.88 115.31 118.45 1g5h h LEU 453 Ca 0.06 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.69 1g5h h LEU 453 Cb 0.20 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1g5h h LEU 453 CO -0.00 0.83 -0.06 0.00 0.09 0.00 0.00 178.44 179.31 1g5h h ALA 454 N 0.96 1.10 -0.18 1.53 0.00 -0.88 -2.12 119.26 119.66 1g5h h ALA 454 Ca 0.15 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1g5h h ALA 454 Cb 0.39 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1g5h h ALA 454 CO 0.01 0.56 0.04 1.03 0.00 0.00 0.00 179.25 180.90 1g5h h SER 455 N 0.67 0.28 -0.67 0.00 0.87 -0.79 0.14 113.55 114.05 1g5h h SER 455 Ca 0.13 -0.23 0.06 0.00 -1.23 0.00 0.00 61.79 60.51 1g5h h SER 455 Cb 0.50 -0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.33 1g5h h SER 455 CO 0.03 0.44 0.38 0.00 -0.53 0.00 0.00 176.83 177.14 1g5h h ALA 456 N 0.85 0.90 0.00 6.23 0.00 -1.13 -0.64 119.26 125.47 1g5h h ALA 456 Ca 0.06 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1g5h h ALA 456 Cb 0.27 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1g5h h ALA 456 CO 0.00 0.06 -0.42 0.66 0.00 0.00 0.00 179.25 179.56 1g5h h SER 457 N 0.70 0.00 -0.01 0.00 4.64 -1.13 -1.35 113.55 116.40 1g5h h SER 457 Ca 0.30 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.43 1g5h h SER 457 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 1g5h h SER 457 CO -0.18 0.42 -0.66 0.78 -0.87 0.00 0.00 176.83 176.32 1g5h h ASN 458 N 0.00 0.74 -0.43 4.97 2.35 -0.00 0.70 115.58 123.92 1g5h h ASN 458 Ca -0.00 -0.44 -0.07 0.00 -0.55 0.00 0.00 56.30 55.24 1g5h h ASN 458 Cb 1.00 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 39.14 1g5h h ASN 458 CO 0.05 1.20 0.01 0.58 -1.65 0.00 0.00 177.43 177.63 1g5h h VAL 459 N 0.46 1.26 -0.58 2.81 2.07 -0.95 -2.43 116.25 118.88 1g5h h VAL 459 Ca -0.02 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.46 1g5h h VAL 459 Cb 1.25 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 1g5h h VAL 459 CO 0.13 0.34 0.23 0.00 0.02 0.00 0.00 177.57 178.29 1g5h h ALA 460 N 0.90 0.75 0.00 1.67 0.00 -1.06 -2.24 119.26 119.29 1g5h h ALA 460 Ca 0.12 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1g5h h ALA 460 Cb 0.47 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1g5h h ALA 460 CO 0.02 0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.64 1g5h n ALA 461 N -2.37 2.25 -0.21 0.00 0.00 0.22 -4.30 120.51 116.12 1g5h n ALA 461 Ca 0.03 -0.08 0.01 0.00 0.00 0.00 0.00 53.44 53.40 1g5h n ALA 461 Cb 0.17 -1.20 0.09 0.00 0.00 0.00 0.00 19.45 18.51 1g5h n ALA 461 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1g5h h ALA 462 N 2.93 0.56 -0.55 0.00 0.00 -0.93 -2.05 119.26 119.23 1g5h h ALA 462 Ca 0.00 0.21 -0.23 0.00 0.00 0.00 0.00 54.91 54.89 1g5h h ALA 462 Cb 0.00 0.37 -0.14 0.00 0.00 0.00 0.00 17.79 18.02 1g5h h ALA 462 CO 0.00 -0.41 0.16 1.28 0.00 0.00 0.00 179.25 180.28 1g5h n LEU 463 N -5.32 5.02 0.24 0.00 4.77 -1.26 -4.57 117.00 115.87 1g5h n LEU 463 Ca 0.09 -3.51 0.11 0.00 -0.03 0.00 0.00 56.01 52.66 1g5h n LEU 463 Cb 0.35 -0.68 0.60 0.00 -2.33 0.00 0.00 43.42 41.35 1g5h n LEU 463 CO 0.09 1.03 0.89 -0.78 -1.33 0.00 0.00 177.39 177.29 1g5h h ASP 464 N 1.45 0.00 -0.29 -1.43 1.82 -1.65 -2.76 116.42 113.56 1g5h h ASP 464 Ca 0.28 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.92 1g5h h ASP 464 Cb 2.01 0.00 0.00 0.00 0.68 0.00 0.00 39.33 42.02 1g5h h ASP 464 CO 0.58 0.19 0.00 1.41 -1.61 0.00 0.00 179.24 179.81 1g5h n HIS 465 N -3.61 0.64 -1.84 0.28 8.25 -1.26 -5.01 115.22 112.67 1g5h n HIS 465 Ca -0.01 -0.68 -0.42 0.00 -0.26 0.00 0.00 57.72 56.35 1g5h n HIS 465 Cb 0.32 -0.16 -0.03 0.00 1.12 0.00 0.00 29.99 31.24 1g5h n HIS 465 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1g5h s HIS 466 N -1.85 2.99 -0.95 4.41 5.04 -1.04 -4.92 115.29 118.98 1g5h s HIS 466 Ca 0.31 0.51 -0.21 0.00 -1.54 0.00 0.00 55.06 54.13 1g5h s HIS 466 Cb 0.22 -4.02 0.10 0.00 0.04 0.00 0.00 32.58 28.91 1g5h s HIS 466 CO 0.12 -3.80 1.24 -1.58 -2.34 0.00 0.00 174.74 168.37 1g5h s HIS 467 N 1.12 2.88 -0.02 3.88 2.46 -1.26 -4.99 115.29 119.35 1g5h s HIS 467 Ca 0.72 -1.13 -0.30 0.00 0.47 0.00 0.00 55.06 54.82 1g5h s HIS 467 Cb -0.46 -4.44 -0.07 0.00 -0.13 0.00 0.00 32.58 27.48 1g5h s HIS 467 CO 0.32 -1.67 1.76 -1.01 -2.47 0.00 0.00 174.74 171.68 1g5h s HIS 468 N 3.61 1.73 0.00 3.88 3.76 -1.26 -5.19 115.29 121.82 1g5h s HIS 468 Ca 0.37 -0.04 0.00 0.00 -0.15 0.00 0.00 55.06 55.24 1g5h s HIS 468 Cb -0.04 -4.03 0.00 0.00 1.11 0.00 0.00 32.58 29.62 1g5h s HIS 468 CO -0.08 -4.45 0.00 0.72 -0.85 0.00 0.00 174.74 170.07