#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b5h s ASP 2 N 0.00 5.23 -0.18 0.00 1.01 -1.26 -4.81 116.67 116.66 1b5h s ASP 2 Ca 0.00 -2.51 -0.29 0.00 0.71 0.00 0.00 52.55 50.45 1b5h s ASP 2 Cb 0.00 -1.84 -0.00 0.00 1.01 0.00 0.00 42.92 42.08 1b5h s ASP 2 CO 0.00 -0.44 1.14 -0.69 0.21 0.00 0.00 175.17 175.39 1b5h s VAL 3 N 0.44 4.49 0.50 -1.27 1.01 -1.26 -5.00 120.40 119.31 1b5h s VAL 3 Ca 0.13 1.80 -0.22 0.00 0.00 0.00 0.00 61.98 63.69 1b5h s VAL 3 Cb -0.21 -4.16 -0.07 0.00 0.00 0.00 0.00 36.38 31.93 1b5h s VAL 3 CO -0.04 -0.13 1.15 -2.65 0.00 0.00 0.00 175.10 173.43 1b5h n PRO 4 N 6.26 1.45 -1.64 2.72 -0.02 -1.26 -4.90 135.00 137.60 1b5h n PRO 4 Ca 0.12 0.53 -0.47 0.00 -2.02 0.00 0.00 63.50 61.67 1b5h n PRO 4 Cb 0.46 -2.29 -0.04 0.00 -0.02 0.00 0.00 33.50 31.61 1b5h n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b5h n ALA 5 N -0.92 0.50 -0.25 3.55 0.00 -1.26 -1.63 120.51 120.50 1b5h n ALA 5 Ca 0.10 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1b5h n ALA 5 Cb 0.43 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.67 1b5h n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b5h n GLY 6 N 2.39 1.91 3.76 0.00 0.00 -1.26 -5.02 105.19 106.97 1b5h n GLY 6 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1b5h n GLY 6 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b5h s VAL 7 N -3.04 4.15 -0.20 1.61 -7.23 -0.65 -5.01 120.40 110.04 1b5h s VAL 7 Ca 0.00 1.98 -0.18 0.00 -1.81 0.00 0.00 61.98 61.98 1b5h s VAL 7 Cb 0.00 -4.27 -0.03 0.00 0.56 0.00 0.00 36.38 32.64 1b5h s VAL 7 CO 0.00 0.49 0.50 -1.10 -0.31 0.00 0.00 175.10 174.67 1b5h s GLN 8 N -1.22 4.19 0.30 4.82 -0.21 -1.26 -4.98 119.66 121.30 1b5h s GLN 8 Ca 0.40 0.38 -0.18 0.00 0.02 0.00 0.00 55.36 55.97 1b5h s GLN 8 Cb -0.25 -3.55 -0.09 0.00 1.00 0.00 0.00 33.01 30.12 1b5h s GLN 8 CO 0.30 -0.12 0.78 -0.51 -2.12 0.00 0.00 175.29 173.62 1b5h s LEU 9 N 1.54 4.18 0.62 2.90 1.43 -1.26 -0.97 118.68 127.12 1b5h s LEU 9 Ca 0.23 1.43 -0.17 0.00 -1.03 0.00 0.00 54.13 54.59 1b5h s LEU 9 Cb -0.15 -3.94 -0.02 0.00 0.03 0.00 0.00 46.19 42.11 1b5h s LEU 9 CO 0.09 -0.12 1.17 0.00 0.23 0.00 0.00 176.35 177.73 1b5h s ALA 10 N -1.80 2.48 0.14 4.21 0.00 -0.10 -4.27 121.76 122.42 1b5h s ALA 10 Ca 0.50 0.86 -0.14 0.00 0.00 0.00 0.00 51.96 53.18 1b5h s ALA 10 Cb -0.13 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1b5h s ALA 10 CO 0.19 -1.24 1.63 -0.44 0.00 0.00 0.00 175.76 175.90 1b5h h ASP 11 N 0.56 0.69 -3.60 0.00 3.32 -1.96 -3.40 116.42 112.02 1b5h h ASP 11 Ca -0.49 -0.24 -0.65 0.00 0.02 0.00 0.00 57.03 55.67 1b5h h ASP 11 Cb 1.28 -0.18 -0.15 0.00 0.22 0.00 0.00 39.33 40.50 1b5h h ASP 11 CO 0.54 0.75 -0.03 -0.75 -1.72 0.00 0.00 179.24 178.03 1b5h s LYS 12 N -5.26 3.60 -1.03 3.56 2.20 -1.26 -5.00 119.74 116.54 1b5h s LYS 12 Ca -0.13 -0.17 -0.04 0.00 -0.36 0.00 0.00 55.97 55.27 1b5h s LYS 12 Cb 0.11 -3.82 0.29 0.00 -1.51 0.00 0.00 37.83 32.89 1b5h s LYS 12 CO 0.78 -0.67 1.23 1.04 -0.36 0.00 0.00 175.35 177.38 1b5h n GLN 13 N 5.78 3.83 -4.29 4.03 1.13 -1.26 -4.91 117.38 121.69 1b5h n GLN 13 Ca -0.04 -4.53 -0.21 0.00 -1.94 0.00 0.00 57.00 50.27 1b5h n GLN 13 Cb 0.49 -2.49 -0.11 0.00 0.11 0.00 0.00 30.24 28.23 1b5h n GLN 13 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1b5h s THR 14 N -2.17 1.65 0.01 5.09 -4.23 -1.26 -0.20 115.64 114.52 1b5h s THR 14 Ca 0.31 -1.77 0.01 0.00 -1.18 0.00 0.00 61.69 59.06 1b5h s THR 14 Cb -0.00 -1.68 -0.01 0.00 1.34 0.00 0.00 72.50 72.15 1b5h s THR 14 CO 0.01 -0.29 -0.02 -0.22 -0.54 0.00 0.00 174.62 173.56 1b5h s LEU 15 N -2.43 2.06 -0.13 4.79 2.96 -0.63 -4.95 118.68 120.35 1b5h s LEU 15 Ca 0.12 -0.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.88 1b5h s LEU 15 Cb -0.06 -0.06 0.02 0.00 0.50 0.00 0.00 46.19 46.59 1b5h s LEU 15 CO 0.05 -0.05 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.23 1b5h s VAL 16 N -0.38 1.32 -0.02 1.68 1.01 -1.26 -1.10 120.40 121.65 1b5h s VAL 16 Ca -0.03 -0.48 0.07 0.00 0.00 0.00 0.00 61.98 61.54 1b5h s VAL 16 Cb -0.03 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 1b5h s VAL 16 CO -0.00 0.42 -0.23 -0.13 0.00 0.00 0.00 175.10 175.15 1b5h s ARG 17 N 1.54 2.19 0.32 2.72 0.52 0.37 -1.21 118.95 125.39 1b5h s ARG 17 Ca 0.04 -0.89 -0.19 0.00 -0.52 0.00 0.00 55.73 54.17 1b5h s ARG 17 Cb -0.13 -2.12 -0.09 0.00 0.52 0.00 0.00 34.95 33.13 1b5h s ARG 17 CO -0.09 0.57 0.80 1.21 0.02 0.00 0.00 175.30 177.82 1b5h s ASN 18 N -0.69 6.96 -0.07 0.23 2.47 -0.48 -1.28 114.94 122.08 1b5h s ASN 18 Ca 0.11 1.47 0.10 0.00 0.42 0.00 0.00 52.86 54.96 1b5h s ASN 18 Cb -0.10 -2.45 0.15 0.00 -1.45 0.00 0.00 41.25 37.40 1b5h s ASN 18 CO -0.00 -0.15 1.05 -3.20 -3.72 0.00 0.00 177.10 171.07 1b5h n ASN 19 N -0.00 1.40 0.00 -4.21 5.15 0.15 -3.58 115.26 114.16 1b5h n ASN 19 Ca 0.02 -2.49 0.00 0.00 -0.60 0.00 0.00 54.58 51.51 1b5h n ASN 19 Cb 0.52 -0.29 0.00 0.00 -0.53 0.00 0.00 39.78 39.49 1b5h n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b5h n GLY 20 N -0.79 1.36 3.83 8.20 0.00 -1.25 -4.50 105.19 112.04 1b5h n GLY 20 Ca 0.08 -0.01 -0.06 0.00 0.00 0.00 0.00 46.02 46.03 1b5h n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b5h s SER 21 N 0.00 -0.08 0.22 1.61 1.04 -1.26 -2.91 113.70 112.32 1b5h s SER 21 Ca 0.00 -0.81 -0.30 0.00 0.48 0.00 0.00 55.95 55.31 1b5h s SER 21 Cb 0.00 0.69 -0.09 0.00 0.10 0.00 0.00 66.02 66.72 1b5h s SER 21 CO 0.00 -1.34 1.35 -0.70 0.98 0.00 0.00 173.24 173.53 1b5h s GLU 22 N -2.76 4.35 0.57 4.02 2.56 -1.26 -4.51 118.70 121.67 1b5h s GLU 22 Ca 0.15 2.13 -0.18 0.00 0.00 0.00 0.00 54.97 57.07 1b5h s GLU 22 Cb -0.04 -3.17 -0.05 0.00 2.00 0.00 0.00 34.13 32.88 1b5h s GLU 22 CO 0.08 -0.30 1.12 0.14 -0.56 0.00 0.00 175.26 175.73 1b5h s VAL 23 N 0.07 3.21 0.20 3.70 -7.23 -1.26 -4.55 120.40 114.54 1b5h s VAL 23 Ca 0.57 0.71 -0.11 0.00 -1.81 0.00 0.00 61.98 61.35 1b5h s VAL 23 Cb -0.38 -3.26 0.14 0.00 0.56 0.00 0.00 36.38 33.44 1b5h s VAL 23 CO 0.40 -0.21 1.85 1.56 -0.31 0.00 0.00 175.10 178.39 1b5h h GLN 24 N 0.95 0.96 -1.99 4.82 4.20 -1.93 -3.48 115.11 118.63 1b5h h GLN 24 Ca -0.49 -0.08 0.24 0.00 0.06 0.00 0.00 58.65 58.38 1b5h h GLN 24 Cb 1.26 -0.21 -0.09 0.00 0.30 0.00 0.00 27.48 28.74 1b5h h GLN 24 CO 0.56 0.67 0.62 0.45 -0.67 0.00 0.00 178.83 180.47 1b5h s SER 25 N -5.92 -0.12 0.00 1.46 0.15 -1.26 -5.01 113.70 103.00 1b5h s SER 25 Ca -0.13 -0.31 0.15 0.00 0.70 0.00 0.00 55.95 56.37 1b5h s SER 25 Cb 0.14 0.36 0.24 0.00 -1.71 0.00 0.00 66.02 65.06 1b5h s SER 25 CO 0.78 -0.67 1.14 0.18 1.20 0.00 0.00 173.24 175.87 1b5h n LEU 26 N -0.49 2.70 -4.62 3.45 4.77 -1.26 -4.91 117.00 116.64 1b5h n LEU 26 Ca -0.07 -1.39 -0.42 0.00 -0.03 0.00 0.00 56.01 54.10 1b5h n LEU 26 Cb 0.61 -0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.53 1b5h n LEU 26 CO 0.13 0.58 0.66 -0.62 -1.33 0.00 0.00 177.39 176.81 1b5h s ASP 27 N -1.19 6.74 0.61 -1.43 -1.08 -1.26 -4.93 116.67 114.13 1b5h s ASP 27 Ca 0.24 0.80 0.29 0.00 -0.52 0.00 0.00 52.55 53.36 1b5h s ASP 27 Cb 0.15 -2.43 1.53 0.00 -1.46 0.00 0.00 42.92 40.70 1b5h s ASP 27 CO 0.21 -0.64 1.93 -0.65 0.52 0.00 0.00 175.17 176.53 1b5h h PRO 28 N 8.02 0.00 -0.02 4.34 0.11 -1.92 0.95 132.00 143.49 1b5h h PRO 28 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1b5h h PRO 28 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1b5h h PRO 28 CO 0.91 0.00 -0.07 0.72 -0.21 0.00 0.00 178.00 179.34 1b5h n HIS 29 N -3.55 0.00 -0.47 0.65 8.25 -1.26 -3.97 115.22 114.87 1b5h n HIS 29 Ca 0.05 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.57 1b5h n HIS 29 Cb 0.56 -0.02 0.13 0.00 1.12 0.00 0.00 29.99 31.78 1b5h n HIS 29 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1b5h n LYS 30 N 0.24 2.64 -4.42 -0.41 4.76 0.33 -4.25 118.16 117.05 1b5h n LYS 30 Ca 0.16 -2.16 -0.26 0.00 -2.87 0.00 0.00 58.31 53.18 1b5h n LYS 30 Cb 0.41 -1.36 -0.11 0.00 -1.84 0.00 0.00 35.03 32.12 1b5h n LYS 30 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1b5h s ILE 31 N -1.74 2.48 0.00 -0.18 -4.36 -1.22 -4.68 121.20 111.50 1b5h s ILE 31 Ca 0.22 -2.07 0.00 0.00 -0.26 0.00 0.00 60.65 58.55 1b5h s ILE 31 Cb 0.16 -2.21 0.00 0.00 1.25 0.00 0.00 42.46 41.66 1b5h s ILE 31 CO 0.08 -0.17 0.00 -1.84 0.24 0.00 0.00 174.94 173.24 1b5h n GLU 32 N 0.06 0.00 -4.03 0.37 0.28 -1.26 -4.61 120.64 111.45 1b5h n GLU 32 Ca -0.11 0.00 -0.25 0.00 -0.16 0.00 0.00 57.16 56.64 1b5h n GLU 32 Cb 0.57 -0.38 -0.05 0.00 1.43 0.00 0.00 31.44 33.01 1b5h n GLU 32 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1b5h s GLY 33 N 0.00 2.38 0.12 -1.84 0.00 -1.26 -5.01 107.32 101.72 1b5h s GLY 33 Ca 0.00 -1.66 -0.16 0.00 0.00 0.00 0.00 44.72 42.90 1b5h s GLY 33 CO 0.00 -1.92 1.65 -2.08 0.00 0.00 0.00 173.10 170.75 1b5h h VAL 34 N 1.15 1.21 -0.74 1.40 2.07 -1.98 -0.69 116.25 118.67 1b5h h VAL 34 Ca -0.41 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.43 1b5h h VAL 34 Cb 1.28 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.96 1b5h h VAL 34 CO 0.65 0.24 0.44 -0.65 0.02 0.00 0.00 177.57 178.27 1b5h h PRO 35 N 0.45 1.01 -0.42 1.57 0.11 -1.95 0.16 132.00 132.93 1b5h h PRO 35 Ca 0.12 -0.09 -0.15 0.00 0.11 0.00 0.00 66.00 65.99 1b5h h PRO 35 Cb 0.25 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 1b5h h PRO 35 CO -0.00 0.71 -0.31 0.93 -0.21 0.00 0.00 178.00 179.11 1b5h h GLU 36 N 1.02 0.95 0.00 1.05 3.07 -1.87 -2.93 114.58 115.88 1b5h h GLU 36 Ca 0.27 -0.46 -0.13 0.00 -0.50 0.00 0.00 59.36 58.54 1b5h h GLU 36 Cb -0.04 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.85 1b5h h GLU 36 CO -0.05 1.13 -0.60 0.77 -1.40 0.00 0.00 179.01 178.85 1b5h h SER 37 N 0.78 0.00 -0.20 1.42 0.02 -0.25 -0.32 113.55 115.00 1b5h h SER 37 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1b5h h SER 37 Cb 0.90 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 1b5h h SER 37 CO 0.08 0.60 0.13 0.78 -1.14 0.00 0.00 176.83 177.29 1b5h h ASN 38 N 0.00 0.23 -0.17 3.07 2.35 -0.54 -1.52 115.58 119.01 1b5h h ASN 38 Ca -0.01 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 1b5h h ASN 38 Cb 1.08 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 1b5h h ASN 38 CO 0.08 0.17 -0.25 0.58 -1.65 0.00 0.00 177.43 176.36 1b5h h VAL 39 N 0.27 1.35 -0.91 2.81 2.07 -1.43 -3.31 116.25 117.10 1b5h h VAL 39 Ca 0.07 -1.47 0.13 0.00 0.82 0.00 0.00 66.70 66.26 1b5h h VAL 39 Cb -0.03 1.90 -0.07 0.00 -1.52 0.00 0.00 31.29 31.57 1b5h h VAL 39 CO -0.02 0.44 0.58 -1.28 0.02 0.00 0.00 177.57 177.32 1b5h h SER 40 N 0.10 0.73 0.16 0.57 0.87 -0.80 -1.89 113.55 113.29 1b5h h SER 40 Ca 0.02 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.57 1b5h h SER 40 Cb 0.82 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.67 1b5h h SER 40 CO 0.06 0.39 -0.19 0.03 -0.53 0.00 0.00 176.83 176.59 1b5h h ARG 41 N 0.78 0.07 0.00 2.24 3.08 -1.37 0.54 114.38 119.72 1b5h h ARG 41 Ca 0.45 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.39 1b5h h ARG 41 Cb 0.62 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1b5h h ARG 41 CO -0.21 0.26 -0.47 -0.44 -1.07 0.00 0.00 179.97 178.04 1b5h h ASP 42 N 0.06 0.00 0.02 7.04 3.32 -1.49 -3.40 116.42 121.98 1b5h h ASP 42 Ca 0.01 0.00 -0.39 0.00 0.02 0.00 0.00 57.03 56.67 1b5h h ASP 42 Cb 0.37 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.86 1b5h h ASP 42 CO 0.03 0.47 -2.38 0.18 -1.72 0.00 0.00 179.24 175.82 1b5h n LEU 43 N -3.34 2.74 -4.27 1.55 4.77 -0.61 -1.36 117.00 116.47 1b5h n LEU 43 Ca 0.01 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.67 1b5h n LEU 43 Cb 0.65 -0.93 -0.16 0.00 -2.33 0.00 0.00 43.42 40.65 1b5h n LEU 43 CO 0.39 0.85 -0.52 -0.36 -1.33 0.00 0.00 177.39 176.42 1b5h s PHE 44 N -2.52 2.63 -0.15 -1.77 0.40 0.08 0.40 117.98 117.06 1b5h s PHE 44 Ca -0.33 -0.89 0.02 0.00 -0.60 0.00 0.00 56.93 55.12 1b5h s PHE 44 Cb 0.09 -1.74 0.01 0.00 0.51 0.00 0.00 43.02 41.89 1b5h s PHE 44 CO 0.61 -0.33 -0.19 -2.00 0.70 0.00 0.00 175.22 174.01 1b5h s GLU 45 N 0.29 3.10 0.00 0.44 2.12 -1.26 -4.54 118.70 118.85 1b5h s GLU 45 Ca -0.15 -0.81 0.00 0.00 0.36 0.00 0.00 54.97 54.37 1b5h s GLU 45 Cb -0.17 -2.51 0.00 0.00 0.26 0.00 0.00 34.13 31.71 1b5h s GLU 45 CO 0.08 -0.01 0.00 0.41 -0.54 0.00 0.00 175.26 175.20 1b5h n GLY 46 N 4.07 0.29 0.06 -1.50 0.00 -1.26 -4.37 105.19 102.49 1b5h n GLY 46 Ca -0.20 -1.80 -0.12 0.00 0.00 0.00 0.00 46.02 43.90 1b5h n GLY 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1b5h h LEU 47 N 0.00 0.07 -9.33 0.99 3.38 -1.82 0.10 115.31 108.71 1b5h h LEU 47 Ca 0.00 -0.07 -0.61 0.00 0.09 0.00 0.00 57.88 57.29 1b5h h LEU 47 Cb 0.00 -0.02 -0.14 0.00 0.09 0.00 0.00 40.66 40.59 1b5h h LEU 47 CO 0.00 0.13 -0.71 -0.76 0.09 0.00 0.00 178.44 177.18 1b5h s LEU 48 N -10.04 2.67 0.19 1.67 1.02 -1.26 -0.96 118.68 111.97 1b5h s LEU 48 Ca -0.13 -1.13 0.01 0.00 0.02 0.00 0.00 54.13 52.90 1b5h s LEU 48 Cb 0.06 -1.03 -0.05 0.00 0.02 0.00 0.00 46.19 45.20 1b5h s LEU 48 CO 0.67 -0.11 0.04 0.27 0.02 0.00 0.00 176.35 177.25 1b5h s ILE 49 N -2.58 0.49 0.28 -0.59 -4.36 0.32 -4.11 121.20 110.64 1b5h s ILE 49 Ca 0.31 -1.97 -0.20 0.00 -0.26 0.00 0.00 60.65 58.53 1b5h s ILE 49 Cb -0.01 -2.25 -0.09 0.00 1.25 0.00 0.00 42.46 41.36 1b5h s ILE 49 CO 0.16 -0.33 0.79 -0.44 0.24 0.00 0.00 174.94 175.36 1b5h s SER 50 N -3.18 7.06 1.00 4.36 0.01 -1.26 0.10 113.70 121.79 1b5h s SER 50 Ca 0.28 1.51 -0.00 0.00 1.31 0.00 0.00 55.95 59.05 1b5h s SER 50 Cb 0.07 -2.46 0.00 0.00 0.21 0.00 0.00 66.02 63.84 1b5h s SER 50 CO 0.06 -0.06 0.01 -0.90 0.41 0.00 0.00 173.24 172.76 1b5h n ASP 51 N 0.39 -0.11 0.12 2.44 3.85 -0.04 -4.80 116.55 118.41 1b5h n ASP 51 Ca 0.00 -0.95 0.11 0.00 -0.71 0.00 0.00 54.79 53.25 1b5h n ASP 51 Cb 0.51 -0.01 0.49 0.00 -1.35 0.00 0.00 41.12 40.76 1b5h n ASP 51 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.20 177.52 1b5h n VAL 52 N -2.07 0.90 0.46 2.12 0.24 -1.26 -1.00 118.33 117.71 1b5h n VAL 52 Ca 0.00 0.32 0.08 0.00 -2.04 0.00 0.00 64.34 62.70 1b5h n VAL 52 Cb 0.00 -1.26 0.10 0.00 -1.47 0.00 0.00 33.84 31.22 1b5h n VAL 52 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1b5h n GLU 53 N -2.18 1.54 -0.03 7.34 1.02 -1.26 -4.59 120.64 122.47 1b5h n GLU 53 Ca 0.02 -1.62 0.00 0.00 -0.02 0.00 0.00 57.16 55.53 1b5h n GLU 53 Cb 0.19 -1.32 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 1b5h n GLU 53 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b5h n GLY 54 N 0.90 0.38 3.76 0.62 0.00 -0.17 -3.37 105.19 107.30 1b5h n GLY 54 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1b5h n GLY 54 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1b5h s HIS 55 N -2.09 3.70 0.23 1.61 3.76 -1.26 -4.58 115.29 116.66 1b5h s HIS 55 Ca 0.00 1.77 -0.32 0.00 -0.15 0.00 0.00 55.06 56.36 1b5h s HIS 55 Cb 0.00 -3.18 -0.12 0.00 1.11 0.00 0.00 32.58 30.38 1b5h s HIS 55 CO 0.00 -0.23 1.64 -2.30 -0.85 0.00 0.00 174.74 173.00 1b5h n PRO 56 N 1.25 2.62 -4.07 8.40 -0.02 -1.26 -0.86 135.00 141.06 1b5h n PRO 56 Ca -0.01 0.94 -0.10 0.00 -2.02 0.00 0.00 63.50 62.31 1b5h n PRO 56 Cb 0.46 -2.74 -0.07 0.00 -0.02 0.00 0.00 33.50 31.12 1b5h n PRO 56 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1b5h s SER 57 N 0.85 0.02 0.16 2.55 0.01 0.11 -4.84 113.70 112.56 1b5h s SER 57 Ca 0.71 -1.09 -0.34 0.00 1.31 0.00 0.00 55.95 56.54 1b5h s SER 57 Cb -0.53 0.49 -0.14 0.00 0.21 0.00 0.00 66.02 66.05 1b5h s SER 57 CO 0.40 -1.00 1.59 -2.65 0.41 0.00 0.00 173.24 171.98 1b5h n PRO 58 N -0.32 2.16 0.00 12.44 -0.02 -1.26 -0.52 135.00 147.48 1b5h n PRO 58 Ca -0.01 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1b5h n PRO 58 Cb 0.64 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1b5h n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b5h n GLY 59 N 3.44 1.34 0.25 -1.23 0.00 -0.18 -4.33 105.19 104.48 1b5h n GLY 59 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 1b5h n GLY 59 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1b5h h VAL 60 N 0.00 1.25 -3.19 1.61 2.07 -0.31 -3.41 116.25 114.27 1b5h h VAL 60 Ca 0.00 -1.19 -0.56 0.00 0.82 0.00 0.00 66.70 65.77 1b5h h VAL 60 Cb 0.00 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.00 1b5h h VAL 60 CO 0.00 0.38 0.63 0.00 0.02 0.00 0.00 177.57 178.60 1b5h s ALA 61 N -4.59 3.46 -0.17 1.67 0.00 -0.13 -0.94 121.76 121.05 1b5h s ALA 61 Ca -0.07 0.42 0.17 0.00 0.00 0.00 0.00 51.96 52.49 1b5h s ALA 61 Cb 0.14 -3.47 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 1b5h s ALA 61 CO 0.79 -0.70 1.12 1.05 0.00 0.00 0.00 175.76 178.02 1b5h h GLU 62 N 7.25 0.00 -2.94 0.00 4.11 -0.92 -3.41 114.58 118.67 1b5h h GLU 62 Ca -0.31 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.10 1b5h h GLU 62 Cb 1.14 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.27 1b5h h GLU 62 CO 0.87 0.30 0.20 -1.59 0.07 0.00 0.00 179.01 178.87 1b5h s LYS 63 N -3.02 1.26 0.12 1.06 0.00 -1.21 -4.85 119.74 113.11 1b5h s LYS 63 Ca 0.00 -0.43 -0.18 0.00 0.00 0.00 0.00 55.97 55.37 1b5h s LYS 63 Cb 0.08 0.58 0.04 0.00 0.00 0.00 0.00 37.83 38.54 1b5h s LYS 63 CO 0.78 -0.54 0.45 1.67 0.00 0.00 0.00 175.35 177.71 1b5h s TRP 64 N -3.58 -0.29 0.12 1.78 -2.14 -1.26 -0.33 118.94 113.23 1b5h s TRP 64 Ca 0.00 0.04 0.00 0.00 2.66 0.00 0.00 56.10 58.80 1b5h s TRP 64 Cb -0.01 0.33 -0.04 0.00 -3.10 0.00 0.00 33.47 30.64 1b5h s TRP 64 CO -0.11 -0.72 -0.00 -1.21 -2.66 0.00 0.00 176.95 172.24 1b5h s GLU 65 N -3.63 0.89 0.03 3.25 8.01 -0.59 -4.99 118.70 121.68 1b5h s GLU 65 Ca 0.02 -1.40 0.02 0.00 0.01 0.00 0.00 54.97 53.62 1b5h s GLU 65 Cb 0.01 0.01 -0.02 0.00 -4.31 0.00 0.00 34.13 29.82 1b5h s GLU 65 CO -0.11 -0.15 -0.08 0.54 0.01 0.00 0.00 175.26 175.48 1b5h s ASN 66 N -3.05 0.84 -0.29 -0.19 2.20 -1.26 -0.76 114.94 112.43 1b5h s ASN 66 Ca 0.18 -0.43 -0.04 0.00 -0.94 0.00 0.00 52.86 51.63 1b5h s ASN 66 Cb 0.07 0.00 0.03 0.00 -2.00 0.00 0.00 41.25 39.35 1b5h s ASN 66 CO -0.01 -0.12 0.02 -0.75 -2.94 0.00 0.00 177.10 173.30 1b5h s LYS 67 N -1.18 2.80 -1.41 3.55 2.47 0.50 -4.63 119.74 121.85 1b5h s LYS 67 Ca -0.06 -1.03 0.00 0.00 -1.56 0.00 0.00 55.97 53.32 1b5h s LYS 67 Cb -0.08 -3.22 0.00 0.00 -1.46 0.00 0.00 37.83 33.07 1b5h s LYS 67 CO 0.00 -0.50 0.00 -0.25 0.16 0.00 0.00 175.35 174.76 1b5h n ASP 68 N 4.75 -4.36 -1.69 1.43 8.00 -1.26 -0.84 116.55 122.57 1b5h n ASP 68 Ca -0.15 0.21 -0.21 0.00 0.71 0.00 0.00 54.79 55.36 1b5h n ASP 68 Cb 0.46 -3.78 -0.08 0.00 -0.02 0.00 0.00 41.12 37.70 1b5h n ASP 68 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1b5h n PHE 69 N -3.02 -0.10 -0.00 1.24 3.01 -1.26 -4.60 117.46 112.73 1b5h n PHE 69 Ca -0.17 0.00 -0.00 0.00 1.01 0.00 0.00 57.45 58.29 1b5h n PHE 69 Cb 0.59 -3.55 -0.00 0.00 -0.01 0.00 0.00 39.48 36.51 1b5h n PHE 69 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1b5h n LYS 70 N -2.46 2.61 -4.01 -1.08 5.02 -0.02 -1.72 118.16 116.50 1b5h n LYS 70 Ca -0.21 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.74 1b5h n LYS 70 Cb 0.69 -1.00 -0.15 0.00 -0.02 0.00 0.00 35.03 34.55 1b5h n LYS 70 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1b5h s VAL 71 N -2.00 2.56 -0.21 -0.18 1.01 -0.80 -0.21 120.40 120.56 1b5h s VAL 71 Ca -0.00 -1.22 -0.05 0.00 0.00 0.00 0.00 61.98 60.70 1b5h s VAL 71 Cb 0.00 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 1b5h s VAL 71 CO 0.00 0.16 0.01 0.26 0.00 0.00 0.00 175.10 175.53 1b5h s TRP 72 N 1.25 3.04 -0.21 5.22 0.52 0.15 -0.37 118.94 128.55 1b5h s TRP 72 Ca -0.02 -0.48 -0.03 0.00 0.02 0.00 0.00 56.10 55.58 1b5h s TRP 72 Cb -0.17 -2.11 -0.01 0.00 -1.15 0.00 0.00 33.47 30.03 1b5h s TRP 72 CO -0.06 -0.28 -0.07 0.99 0.02 0.00 0.00 176.95 177.56 1b5h s THR 73 N 1.14 3.21 -0.20 2.01 2.01 0.06 0.08 115.64 123.95 1b5h s THR 73 Ca 0.03 -0.55 -0.04 0.00 0.31 0.00 0.00 61.69 61.44 1b5h s THR 73 Cb -0.14 -2.44 -0.01 0.00 0.01 0.00 0.00 72.50 69.91 1b5h s THR 73 CO 0.02 0.44 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.99 1b5h s PHE 74 N 1.36 2.96 -0.52 4.92 0.40 0.29 -1.54 117.98 125.86 1b5h s PHE 74 Ca 0.04 -0.78 -0.20 0.00 -0.60 0.00 0.00 56.93 55.40 1b5h s PHE 74 Cb -0.14 -2.07 0.05 0.00 0.51 0.00 0.00 43.02 41.37 1b5h s PHE 74 CO -0.04 -0.43 0.70 -1.01 0.70 0.00 0.00 175.22 175.14 1b5h s HIS 75 N 1.22 2.99 0.11 0.36 3.76 0.55 -1.36 115.29 122.92 1b5h s HIS 75 Ca 0.03 -0.42 -0.30 0.00 -0.15 0.00 0.00 55.06 54.21 1b5h s HIS 75 Cb -0.14 -3.66 -0.06 0.00 1.11 0.00 0.00 32.58 29.83 1b5h s HIS 75 CO -0.01 -1.10 0.98 -0.51 -0.85 0.00 0.00 174.74 173.25 1b5h s LEU 76 N 2.92 4.48 0.34 0.89 1.43 0.70 -0.34 118.68 129.10 1b5h s LEU 76 Ca 0.18 1.81 -0.29 0.00 -1.03 0.00 0.00 54.13 54.81 1b5h s LEU 76 Cb -0.18 -3.59 -0.11 0.00 0.03 0.00 0.00 46.19 42.35 1b5h s LEU 76 CO 0.13 -0.11 1.49 0.00 0.23 0.00 0.00 176.35 178.10 1b5h s ARG 77 N 0.08 4.16 0.52 1.70 1.70 -0.12 -4.81 118.95 122.17 1b5h s ARG 77 Ca 0.48 2.51 0.26 0.00 -0.47 0.00 0.00 55.73 58.50 1b5h s ARG 77 Cb -0.24 -3.01 1.41 0.00 -0.57 0.00 0.00 34.95 32.55 1b5h s ARG 77 CO 0.30 -0.51 2.07 0.93 -1.08 0.00 0.00 175.30 177.02 1b5h h GLU 78 N 3.71 0.00 -0.64 3.89 5.08 -1.94 -2.96 114.58 121.73 1b5h h GLU 78 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1b5h h GLU 78 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1b5h h GLU 78 CO 0.69 0.12 0.00 0.27 -1.00 0.00 0.00 179.01 179.09 1b5h n ASN 79 N -3.76 4.32 -4.69 1.42 6.94 -1.26 -4.92 115.26 113.30 1b5h n ASN 79 Ca -0.02 -2.49 -0.42 0.00 -0.02 0.00 0.00 54.58 51.63 1b5h n ASN 79 Cb 0.23 -0.56 -0.03 0.00 -2.36 0.00 0.00 39.78 37.05 1b5h n ASN 79 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1b5h s ALA 80 N -1.99 3.55 0.10 -2.53 0.00 -1.12 -4.37 121.76 115.40 1b5h s ALA 80 Ca 0.44 0.88 0.03 0.00 0.00 0.00 0.00 51.96 53.30 1b5h s ALA 80 Cb 0.30 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1b5h s ALA 80 CO 0.19 -0.79 -0.08 0.15 0.00 0.00 0.00 175.76 175.22 1b5h s LYS 81 N 2.03 0.84 0.72 0.00 1.02 -1.26 -0.97 119.74 122.12 1b5h s LYS 81 Ca 0.62 -1.25 -0.09 0.00 0.02 0.00 0.00 55.97 55.27 1b5h s LYS 81 Cb -0.31 -0.36 0.05 0.00 -0.52 0.00 0.00 37.83 36.68 1b5h s LYS 81 CO 0.27 0.03 1.07 -1.58 -0.92 0.00 0.00 175.35 174.21 1b5h s TRP 82 N -3.07 3.08 0.05 3.18 0.52 0.57 -4.58 118.94 118.70 1b5h s TRP 82 Ca 0.09 0.71 0.32 0.00 0.02 0.00 0.00 56.10 57.24 1b5h s TRP 82 Cb 0.01 -3.19 1.52 0.00 -1.15 0.00 0.00 33.47 30.67 1b5h s TRP 82 CO -0.02 -1.38 1.96 0.66 0.02 0.00 0.00 176.95 178.19 1b5h h SER 83 N -0.69 0.00 -0.14 2.95 4.64 0.09 -0.43 113.55 119.98 1b5h h SER 83 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1b5h h SER 83 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1b5h h SER 83 CO 0.63 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.69 1b5h n ASP 84 N -2.72 1.41 0.00 4.97 5.68 -1.26 -4.83 116.55 119.80 1b5h n ASP 84 Ca -0.00 -1.66 0.00 0.00 -0.50 0.00 0.00 54.79 52.63 1b5h n ASP 84 Cb 0.17 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 1b5h n ASP 84 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b5h n GLY 85 N 1.08 2.07 3.79 6.12 0.00 -0.17 -5.05 105.19 113.03 1b5h n GLY 85 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 1b5h n GLY 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b5h s THR 86 N -2.35 3.83 0.44 2.61 -4.23 -1.26 -4.73 115.64 109.96 1b5h s THR 86 Ca 0.00 1.28 -0.25 0.00 -1.18 0.00 0.00 61.69 61.54 1b5h s THR 86 Cb 0.00 -3.60 -0.08 0.00 1.34 0.00 0.00 72.50 70.16 1b5h s THR 86 CO 0.00 -0.11 1.35 -2.84 -0.54 0.00 0.00 174.62 172.48 1b5h s PRO 87 N -2.82 3.75 -0.12 3.99 0.02 -1.26 -0.31 135.00 138.24 1b5h s PRO 87 Ca 0.61 2.25 -0.24 0.00 0.02 0.00 0.00 61.00 63.64 1b5h s PRO 87 Cb -0.18 -2.64 -0.03 0.00 0.02 0.00 0.00 34.50 31.67 1b5h s PRO 87 CO 0.23 -0.70 0.76 0.08 -0.33 0.00 0.00 177.00 177.04 1b5h s VAL 88 N -1.26 4.96 0.43 3.83 1.01 -0.14 -4.70 120.40 124.53 1b5h s VAL 88 Ca 0.60 1.52 0.04 0.00 0.00 0.00 0.00 61.98 64.14 1b5h s VAL 88 Cb -0.40 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 31.85 1b5h s VAL 88 CO 0.51 0.13 0.03 0.42 0.00 0.00 0.00 175.10 176.19 1b5h s THR 89 N 1.54 1.37 0.39 3.92 -4.23 -1.26 -4.78 115.64 112.58 1b5h s THR 89 Ca 0.37 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.12 1b5h s THR 89 Cb -0.17 -2.59 0.25 0.00 1.34 0.00 0.00 72.50 71.33 1b5h s THR 89 CO 0.15 0.00 2.01 0.00 -0.54 0.00 0.00 174.62 176.24 1b5h h ALA 90 N 1.69 1.32 -0.53 3.99 0.00 -1.24 -1.98 119.26 122.50 1b5h h ALA 90 Ca -0.42 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 1b5h h ALA 90 Cb 1.27 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1b5h h ALA 90 CO 0.73 0.21 0.14 0.45 0.00 0.00 0.00 179.25 180.78 1b5h h HIS 91 N 0.00 0.82 -0.67 0.00 3.86 -1.84 -1.15 115.15 116.17 1b5h h HIS 91 Ca -0.00 -0.07 0.03 0.00 -1.16 0.00 0.00 60.37 59.17 1b5h h HIS 91 Cb 0.41 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.59 1b5h h HIS 91 CO 0.00 0.69 0.41 -0.44 0.86 0.00 0.00 177.93 179.45 1b5h h ASP 92 N 0.78 0.67 -0.03 2.45 3.32 -1.74 -1.15 116.42 120.72 1b5h h ASP 92 Ca 0.17 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.11 1b5h h ASP 92 Cb 0.27 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1b5h h ASP 92 CO -0.00 0.46 -0.36 -0.26 -1.72 0.00 0.00 179.24 177.35 1b5h h PHE 93 N 0.80 0.62 0.12 4.55 -1.00 -1.40 -0.54 116.94 120.08 1b5h h PHE 93 Ca 0.27 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 60.88 1b5h h PHE 93 Cb 0.03 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.46 1b5h h PHE 93 CO -0.05 0.82 -0.06 0.28 -1.61 0.00 0.00 178.31 177.69 1b5h h VAL 94 N 0.44 0.93 -0.19 -0.55 2.07 -0.86 0.31 116.25 118.40 1b5h h VAL 94 Ca 0.05 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1b5h h VAL 94 Cb 0.84 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1b5h h VAL 94 CO 0.07 0.04 0.12 0.22 0.02 0.00 0.00 177.57 178.04 1b5h h TYR 95 N -0.24 0.22 -0.14 1.57 3.20 -1.19 -1.95 116.97 118.44 1b5h h TYR 95 Ca -0.02 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1b5h h TYR 95 Cb 0.19 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 1b5h h TYR 95 CO -0.05 0.14 0.09 0.77 -1.64 0.00 0.00 178.16 177.47 1b5h h SER 96 N 0.24 0.17 0.45 -2.11 0.02 -0.83 -0.57 113.55 110.92 1b5h h SER 96 Ca 0.07 -0.05 -0.08 0.00 -0.84 0.00 0.00 61.79 60.89 1b5h h SER 96 Cb -0.02 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1b5h h SER 96 CO -0.02 0.17 -0.39 -0.50 -1.14 0.00 0.00 176.83 174.95 1b5h h TRP 97 N 0.16 0.00 -0.42 3.45 4.06 -0.92 0.06 115.95 122.34 1b5h h TRP 97 Ca 0.05 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.93 1b5h h TRP 97 Cb 0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.18 1b5h h TRP 97 CO -0.05 0.39 -0.01 1.96 -3.56 0.00 0.00 178.44 177.17 1b5h h GLN 98 N 0.00 0.74 -0.71 0.49 4.20 -1.06 -2.15 115.11 116.62 1b5h h GLN 98 Ca -0.00 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.45 1b5h h GLN 98 Cb 0.71 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 1b5h h GLN 98 CO 0.05 0.82 0.39 -0.09 -0.67 0.00 0.00 178.83 179.34 1b5h h ARG 99 N 0.57 0.99 -0.66 1.46 2.43 -0.68 -1.14 114.38 117.36 1b5h h ARG 99 Ca 0.12 -0.11 0.04 0.00 -0.81 0.00 0.00 59.98 59.22 1b5h h ARG 99 Cb 0.50 -0.20 -0.05 0.00 -0.42 0.00 0.00 29.97 29.80 1b5h h ARG 99 CO 0.02 0.74 0.39 1.25 -1.51 0.00 0.00 179.97 180.86 1b5h h LEU 100 N 0.98 0.61 -1.08 3.80 5.85 -0.89 -2.90 115.31 121.68 1b5h h LEU 100 Ca 0.25 0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.89 1b5h h LEU 100 Cb 0.03 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 1b5h h LEU 100 CO -0.04 0.41 -0.43 0.00 -0.34 0.00 0.00 178.44 178.03 1b5h h ALA 101 N 1.32 1.24 -2.33 1.25 0.00 -0.91 -3.40 119.26 116.42 1b5h h ALA 101 Ca 0.28 -0.40 -0.54 0.00 0.00 0.00 0.00 54.91 54.25 1b5h h ALA 101 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1b5h h ALA 101 CO -0.14 0.56 1.07 0.34 0.00 0.00 0.00 179.25 181.07 1b5h s ASP 102 N -6.90 6.63 0.54 0.00 3.68 -0.47 -4.32 116.67 115.82 1b5h s ASP 102 Ca -0.03 2.35 0.22 0.00 2.13 0.00 0.00 52.55 57.23 1b5h s ASP 102 Cb 0.14 -2.54 1.42 0.00 -1.45 0.00 0.00 42.92 40.49 1b5h s ASP 102 CO 0.74 -0.92 2.10 -0.65 0.13 0.00 0.00 175.17 176.57 1b5h h PRO 103 N 9.23 0.00 0.00 4.34 0.10 -1.86 0.56 132.00 144.38 1b5h h PRO 103 Ca -0.41 0.00 -0.03 0.00 0.10 0.00 0.00 66.00 65.66 1b5h h PRO 103 Cb 1.19 0.00 -0.00 0.00 0.10 0.00 0.00 31.00 32.29 1b5h h PRO 103 CO 0.94 0.00 -0.14 -0.91 0.10 0.00 0.00 178.00 177.99 1b5h h ASN 104 N 0.00 0.00 1.24 -2.05 2.35 -1.93 -1.45 115.58 113.73 1b5h h ASN 104 Ca 0.10 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.80 1b5h h ASN 104 Cb 0.42 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1b5h h ASN 104 CO -0.00 0.14 -0.22 0.74 -1.65 0.00 0.00 177.43 176.44 1b5h h THR 105 N 0.00 0.46 -6.40 2.81 2.02 -1.13 -3.47 112.91 107.19 1b5h h THR 105 Ca -0.00 -1.26 -0.48 0.00 0.77 0.00 0.00 66.41 65.44 1b5h h THR 105 Cb 0.30 1.91 -0.04 0.00 -1.74 0.00 0.00 68.15 68.58 1b5h h THR 105 CO 0.02 0.21 -0.85 0.00 0.37 0.00 0.00 175.52 175.27 1b5h n ALA 106 N -2.19 -1.81 -1.91 6.16 0.00 -0.55 -4.89 120.51 115.33 1b5h n ALA 106 Ca 0.01 -0.14 -0.41 0.00 0.00 0.00 0.00 53.44 52.91 1b5h n ALA 106 Cb 0.50 -2.30 -0.04 0.00 0.00 0.00 0.00 19.45 17.60 1b5h n ALA 106 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1b5h s SER 107 N -4.07 7.26 0.63 0.00 0.15 -1.26 -4.89 113.70 111.52 1b5h s SER 107 Ca 0.20 2.18 0.41 0.00 0.70 0.00 0.00 55.95 59.44 1b5h s SER 107 Cb -0.10 -2.61 2.05 0.00 -1.71 0.00 0.00 66.02 63.65 1b5h s SER 107 CO 0.87 -0.19 2.24 1.55 1.20 0.00 0.00 173.24 178.91 1b5h h PRO 108 N 4.50 0.00 -0.40 5.44 0.13 -1.86 -1.97 132.00 137.84 1b5h h PRO 108 Ca -0.45 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 1b5h h PRO 108 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 1b5h h PRO 108 CO 0.70 0.00 0.03 0.66 -0.23 0.00 0.00 178.00 179.16 1b5h n TYR 109 N -3.11 1.41 -0.34 1.56 4.02 -1.26 -3.66 117.16 115.78 1b5h n TYR 109 Ca -0.02 -0.95 0.08 0.00 -0.01 0.00 0.00 57.90 57.01 1b5h n TYR 109 Cb 0.15 -0.42 0.27 0.00 -0.02 0.00 0.00 39.34 39.32 1b5h n TYR 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1b5h h ALA 110 N 2.34 1.59 0.00 -0.72 0.00 -1.57 -0.94 119.26 119.96 1b5h h ALA 110 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1b5h h ALA 110 Cb 1.71 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1b5h h ALA 110 CO 0.37 0.16 0.00 0.43 0.00 0.00 0.00 179.25 180.21 1b5h n SER 111 N -4.61 0.00 0.05 0.00 7.64 -1.26 -2.62 113.62 112.82 1b5h n SER 111 Ca 0.19 0.40 0.10 0.00 1.01 0.00 0.00 58.87 60.58 1b5h n SER 111 Cb 0.39 -0.45 0.56 0.00 -1.01 0.00 0.00 64.21 63.70 1b5h n SER 111 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1b5h h TYR 112 N 0.00 0.24 0.00 1.43 3.20 -1.52 0.18 116.97 120.50 1b5h h TYR 112 Ca 0.00 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1b5h h TYR 112 Cb 0.18 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.37 1b5h h TYR 112 CO 0.00 0.13 -0.15 -0.07 -1.64 0.00 0.00 178.16 176.43 1b5h h LEU 113 N 0.24 0.00 -0.16 2.82 3.38 -1.69 -2.06 115.31 117.84 1b5h h LEU 113 Ca 0.16 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.90 1b5h h LEU 113 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1b5h h LEU 113 CO -0.03 0.15 -0.94 1.56 0.09 0.00 0.00 178.44 179.27 1b5h h GLN 114 N 0.00 0.46 -0.50 1.13 4.20 -1.00 -1.86 115.11 117.54 1b5h h GLN 114 Ca -0.00 -0.48 -0.04 0.00 0.06 0.00 0.00 58.65 58.19 1b5h h GLN 114 Cb 0.92 0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 1b5h h GLN 114 CO 0.02 1.13 0.15 1.88 -0.67 0.00 0.00 178.83 181.34 1b5h h TYR 115 N 0.27 0.75 -0.00 2.96 0.05 -0.26 -1.39 116.97 119.34 1b5h h TYR 115 Ca -0.08 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.65 1b5h h TYR 115 Cb 1.57 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 39.09 1b5h h TYR 115 CO 0.07 0.62 -0.16 0.41 -1.05 0.00 0.00 178.16 178.04 1b5h n GLY 116 N -0.99 -1.21 3.44 3.88 0.00 -0.82 -4.98 105.19 104.52 1b5h n GLY 116 Ca 0.04 -0.23 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 1b5h n GLY 116 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1b5h n HIS 117 N -1.27 -2.62 -2.02 1.61 8.25 -0.53 -4.86 115.22 113.78 1b5h n HIS 117 Ca 0.10 0.95 -0.41 0.00 -0.26 0.00 0.00 57.72 58.09 1b5h n HIS 117 Cb 0.31 -4.82 -0.02 0.00 1.12 0.00 0.00 29.99 26.58 1b5h n HIS 117 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1b5h s ILE 118 N -3.31 2.64 0.29 1.59 1.09 -0.80 -0.48 121.20 122.23 1b5h s ILE 118 Ca 0.47 0.56 -0.29 0.00 -1.10 0.00 0.00 60.65 60.29 1b5h s ILE 118 Cb -0.21 -3.36 -0.13 0.00 -1.06 0.00 0.00 42.46 37.70 1b5h s ILE 118 CO 0.69 0.10 1.27 0.00 -0.10 0.00 0.00 174.94 176.90 1b5h n ALA 119 N 1.97 0.90 -0.98 9.38 0.00 -0.10 -2.51 120.51 129.18 1b5h n ALA 119 Ca 0.05 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1b5h n ALA 119 Cb 0.40 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.64 1b5h n ALA 119 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1b5h n ASN 120 N 1.32 -4.29 -0.24 0.00 3.02 -1.26 -1.45 115.26 112.36 1b5h n ASN 120 Ca 0.08 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.55 1b5h n ASN 120 Cb 0.33 -2.08 0.04 0.00 -0.61 0.00 0.00 39.78 37.46 1b5h n ASN 120 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1b5h h ILE 121 N 0.00 1.26 -0.26 2.41 6.09 -1.85 -2.35 117.51 122.81 1b5h h ILE 121 Ca 0.00 -0.97 0.04 0.00 -1.37 0.00 0.00 64.86 62.56 1b5h h ILE 121 Cb 0.51 0.61 -0.03 0.00 0.47 0.00 0.00 36.82 38.37 1b5h h ILE 121 CO 0.00 0.37 0.05 0.44 -3.07 0.00 0.00 178.15 175.94 1b5h h ASP 122 N 1.00 0.01 -0.75 2.19 3.45 -1.91 0.24 116.42 120.64 1b5h h ASP 122 Ca 0.21 0.04 0.02 0.00 0.43 0.00 0.00 57.03 57.73 1b5h h ASP 122 Cb 0.38 0.05 -0.04 0.00 -0.56 0.00 0.00 39.33 39.17 1b5h h ASP 122 CO 0.00 0.04 0.50 0.44 -1.57 0.00 0.00 179.24 178.65 1b5h h ASP 123 N 0.15 0.82 -0.04 6.45 5.19 -1.93 -1.31 116.42 125.75 1b5h h ASP 123 Ca 0.12 -0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.49 1b5h h ASP 123 Cb 0.12 -0.20 -0.00 0.00 0.18 0.00 0.00 39.33 39.43 1b5h h ASP 123 CO -0.16 0.58 -0.06 0.40 -3.12 0.00 0.00 179.24 176.89 1b5h h ILE 124 N 0.96 1.40 -0.87 0.35 2.04 -0.85 0.17 117.51 120.71 1b5h h ILE 124 Ca 0.29 -1.27 0.07 0.00 1.00 0.00 0.00 64.86 64.94 1b5h h ILE 124 Cb -0.02 2.15 -0.06 0.00 -0.74 0.00 0.00 36.82 38.16 1b5h h ILE 124 CO -0.08 0.35 0.57 0.40 0.00 0.00 0.00 178.15 179.38 1b5h h ILE 125 N -0.37 1.05 0.00 -0.67 2.04 -0.69 -1.34 117.51 117.53 1b5h h ILE 125 Ca 0.01 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.54 1b5h h ILE 125 Cb 0.59 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 1b5h h ILE 125 CO 0.01 0.17 0.00 0.00 0.00 0.00 0.00 178.15 178.34 1b5h n ALA 126 N -2.41 2.41 -0.97 1.87 0.00 -0.52 -4.77 120.51 116.13 1b5h n ALA 126 Ca 0.13 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1b5h n ALA 126 Cb 0.22 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1b5h n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b5h n GLY 127 N 0.79 0.57 0.07 0.00 0.00 -0.51 -4.92 105.19 101.20 1b5h n GLY 127 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1b5h n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b5h h LYS 128 N 1.34 0.06 -5.17 1.61 1.57 -0.90 -3.46 116.57 111.63 1b5h h LYS 128 Ca 0.00 -0.11 -0.38 0.00 -1.87 0.00 0.00 60.65 58.29 1b5h h LYS 128 Cb 0.00 0.04 -0.21 0.00 0.08 0.00 0.00 32.23 32.14 1b5h h LYS 128 CO 0.00 1.03 -0.77 0.15 -0.57 0.00 0.00 179.45 179.30 1b5h s LYS 129 N -2.69 0.77 0.72 3.15 1.02 -0.89 -4.97 119.74 116.84 1b5h s LYS 129 Ca -0.00 -0.94 -0.12 0.00 0.02 0.00 0.00 55.97 54.92 1b5h s LYS 129 Cb 0.09 -0.70 0.03 0.00 -0.52 0.00 0.00 37.83 36.73 1b5h s LYS 129 CO 0.83 0.15 1.09 -1.25 -0.92 0.00 0.00 175.35 175.26 1b5h s PRO 130 N -1.81 2.53 0.49 -1.68 0.04 -1.26 -4.21 135.00 129.11 1b5h s PRO 130 Ca -0.03 1.23 0.15 0.00 0.04 0.00 0.00 61.00 62.40 1b5h s PRO 130 Cb -0.09 -1.93 1.18 0.00 0.04 0.00 0.00 34.50 33.70 1b5h s PRO 130 CO 0.02 -1.44 2.11 0.00 0.04 0.00 0.00 177.00 177.73 1b5h h ALA 131 N -0.63 1.99 0.00 8.56 0.00 -1.91 -0.49 119.26 126.78 1b5h h ALA 131 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1b5h h ALA 131 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1b5h h ALA 131 CO 0.53 -0.02 0.00 0.25 0.00 0.00 0.00 179.25 180.01 1b5h n THR 132 N -4.51 1.52 1.39 0.00 -2.24 -1.26 -1.33 114.28 107.86 1b5h n THR 132 Ca 0.00 0.38 0.12 0.00 -2.27 0.00 0.00 64.05 62.28 1b5h n THR 132 Cb 0.15 -1.31 0.46 0.00 -2.10 0.00 0.00 70.33 67.54 1b5h n THR 132 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1b5h n ASP 133 N -1.44 1.48 -4.71 3.42 9.92 -0.19 -4.94 116.55 120.09 1b5h n ASP 133 Ca 0.01 -1.59 -0.40 0.00 -0.53 0.00 0.00 54.79 52.29 1b5h n ASP 133 Cb 0.05 -0.06 0.03 0.00 -0.64 0.00 0.00 41.12 40.50 1b5h n ASP 133 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1b5h n LEU 134 N 0.18 4.50 -3.31 0.64 7.94 -0.44 -4.74 117.00 121.77 1b5h n LEU 134 Ca 0.17 1.03 -0.37 0.00 -1.11 0.00 0.00 56.01 55.74 1b5h n LEU 134 Cb 0.32 -1.51 -0.03 0.00 0.53 0.00 0.00 43.42 42.73 1b5h n LEU 134 CO 0.14 -0.76 3.23 0.61 -1.11 0.00 0.00 177.39 179.51 1b5h n GLY 135 N 0.84 4.09 3.12 -3.96 0.00 -0.53 -4.79 105.19 103.96 1b5h n GLY 135 Ca 0.09 -1.41 -0.18 0.00 0.00 0.00 0.00 46.02 44.51 1b5h n GLY 135 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b5h s VAL 136 N 2.40 0.95 -0.05 1.61 -7.23 -1.26 -0.53 120.40 116.30 1b5h s VAL 136 Ca 0.65 -1.01 -0.21 0.00 -1.81 0.00 0.00 61.98 59.60 1b5h s VAL 136 Cb 0.17 -0.90 0.04 0.00 0.56 0.00 0.00 36.38 36.25 1b5h s VAL 136 CO -0.06 -0.10 0.47 -1.59 -0.31 0.00 0.00 175.10 173.52 1b5h s LYS 137 N -1.25 0.80 -0.30 4.82 -2.85 -0.61 -5.01 119.74 115.35 1b5h s LYS 137 Ca -0.01 0.08 -0.18 0.00 -1.00 0.00 0.00 55.97 54.87 1b5h s LYS 137 Cb -0.08 0.37 -0.02 0.00 -2.06 0.00 0.00 37.83 36.04 1b5h s LYS 137 CO 0.01 -0.22 0.51 0.00 0.10 0.00 0.00 175.35 175.74 1b5h s ALA 138 N -1.08 3.54 -0.21 0.59 0.00 -1.26 -0.66 121.76 122.68 1b5h s ALA 138 Ca -0.11 -0.78 0.17 0.00 0.00 0.00 0.00 51.96 51.24 1b5h s ALA 138 Cb -0.03 -2.93 0.15 0.00 0.00 0.00 0.00 23.12 20.31 1b5h s ALA 138 CO 0.06 -0.92 1.49 -0.07 0.00 0.00 0.00 175.76 176.32 1b5h h LEU 139 N 8.90 0.00 0.00 0.00 3.38 -1.28 -3.48 115.31 122.83 1b5h h LEU 139 Ca -0.29 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.77 1b5h h LEU 139 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1b5h h LEU 139 CO 0.73 0.39 0.43 -0.90 0.09 0.00 0.00 178.44 179.18 1b5h n ASP 140 N -3.20 -1.63 0.29 -0.43 3.85 -1.24 -4.98 116.55 109.22 1b5h n ASP 140 Ca 0.02 -1.94 0.14 0.00 -0.71 0.00 0.00 54.79 52.30 1b5h n ASP 140 Cb 0.68 2.67 0.89 0.00 -1.35 0.00 0.00 41.12 44.00 1b5h n ASP 140 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 1b5h h ASP 141 N 1.69 0.00 -0.10 -1.12 3.45 -1.99 -2.76 116.42 115.59 1b5h h ASP 141 Ca -0.25 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.19 1b5h h ASP 141 Cb 1.04 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.79 1b5h h ASP 141 CO 0.33 0.01 -0.10 1.41 -1.57 0.00 0.00 179.24 179.32 1b5h n HIS 142 N -3.88 0.34 -3.66 4.55 8.25 -1.26 -0.92 115.22 118.64 1b5h n HIS 142 Ca -0.03 -1.13 -0.23 0.00 -0.26 0.00 0.00 57.72 56.07 1b5h n HIS 142 Cb 0.09 -0.24 -0.17 0.00 1.12 0.00 0.00 29.99 30.79 1b5h n HIS 142 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1b5h s THR 143 N -2.98 0.01 -0.18 1.59 2.01 -1.04 -0.22 115.64 114.83 1b5h s THR 143 Ca 0.37 0.08 -0.03 0.00 0.31 0.00 0.00 61.69 62.41 1b5h s THR 143 Cb 0.32 -0.43 -0.02 0.00 0.01 0.00 0.00 72.50 72.38 1b5h s THR 143 CO 0.02 -0.02 -0.05 0.12 -0.69 0.00 0.00 174.62 174.00 1b5h s PHE 144 N 2.11 2.97 -0.13 4.92 2.19 -0.47 -0.68 117.98 128.89 1b5h s PHE 144 Ca 0.03 -0.58 0.02 0.00 0.33 0.00 0.00 56.93 56.74 1b5h s PHE 144 Cb -0.14 -2.01 0.00 0.00 -1.31 0.00 0.00 43.02 39.56 1b5h s PHE 144 CO -0.06 -0.26 -0.21 -2.00 1.83 0.00 0.00 175.22 174.52 1b5h s GLU 145 N 0.84 3.10 -0.12 10.12 2.12 0.16 -0.55 118.70 134.38 1b5h s GLU 145 Ca -0.01 -0.83 0.01 0.00 0.36 0.00 0.00 54.97 54.50 1b5h s GLU 145 Cb -0.15 -2.44 -0.01 0.00 0.26 0.00 0.00 34.13 31.79 1b5h s GLU 145 CO 0.01 0.09 -0.15 0.08 -0.54 0.00 0.00 175.26 174.76 1b5h s VAL 146 N 0.59 2.93 -0.21 3.70 1.01 0.11 -1.57 120.40 126.95 1b5h s VAL 146 Ca -0.12 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 1b5h s VAL 146 Cb -0.16 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 1b5h s VAL 146 CO 0.03 0.53 -0.04 -0.89 0.00 0.00 0.00 175.10 174.74 1b5h s THR 147 N 0.25 3.43 0.22 3.92 2.01 0.32 -0.67 115.64 125.12 1b5h s THR 147 Ca -0.10 -0.48 0.02 0.00 0.31 0.00 0.00 61.69 61.44 1b5h s THR 147 Cb -0.16 -2.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 1b5h s THR 147 CO 0.06 0.43 0.39 -0.76 -0.69 0.00 0.00 174.62 174.04 1b5h s LEU 148 N 1.38 4.24 0.00 4.42 1.43 0.70 -0.92 118.68 129.93 1b5h s LEU 148 Ca 0.05 0.28 0.29 0.00 -1.03 0.00 0.00 54.13 53.72 1b5h s LEU 148 Cb -0.14 -3.06 1.26 0.00 0.03 0.00 0.00 46.19 44.28 1b5h s LEU 148 CO -0.02 -0.07 1.89 -1.54 0.23 0.00 0.00 176.35 176.84 1b5h n SER 149 N -1.00 0.27 -3.50 2.29 3.41 0.37 -4.75 113.62 110.71 1b5h n SER 149 Ca -0.06 -0.29 -0.10 0.00 -0.26 0.00 0.00 58.87 58.17 1b5h n SER 149 Cb 0.55 -0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 1b5h n SER 149 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1b5h s GLU 150 N -2.61 1.11 0.17 4.33 -1.05 -1.26 -5.09 118.70 114.30 1b5h s GLU 150 Ca 0.26 -0.44 -0.31 0.00 -0.15 0.00 0.00 54.97 54.32 1b5h s GLU 150 Cb 0.20 0.49 -0.10 0.00 -0.44 0.00 0.00 34.13 34.28 1b5h s GLU 150 CO 0.49 -0.49 1.55 -2.14 0.95 0.00 0.00 175.26 175.62 1b5h s PRO 151 N -3.47 4.22 -0.36 -4.83 0.02 -1.26 -4.68 135.00 124.65 1b5h s PRO 151 Ca 0.04 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.41 1b5h s PRO 151 Cb -0.01 -3.15 0.12 0.00 0.02 0.00 0.00 34.50 31.47 1b5h s PRO 151 CO -0.09 -0.58 0.16 0.08 -0.33 0.00 0.00 177.00 176.23 1b5h s VAL 152 N 1.02 0.98 0.41 3.83 1.01 -0.70 -4.90 120.40 122.04 1b5h s VAL 152 Ca 0.69 -1.83 0.13 0.00 0.00 0.00 0.00 61.98 60.97 1b5h s VAL 152 Cb -0.43 -1.72 0.13 0.00 0.00 0.00 0.00 36.38 34.36 1b5h s VAL 152 CO 0.32 -0.79 1.90 -0.65 0.00 0.00 0.00 175.10 175.89 1b5h h PRO 153 N 7.50 0.00 -0.37 2.72 0.11 -1.94 -1.90 132.00 138.11 1b5h h PRO 153 Ca -0.07 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1b5h h PRO 153 Cb 0.98 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1b5h h PRO 153 CO 0.45 0.28 0.00 2.48 -0.21 0.00 0.00 178.00 181.01 1b5h n TYR 154 N -4.21 0.50 -0.22 0.65 4.11 -1.26 -4.60 117.16 112.14 1b5h n TYR 154 Ca -0.02 -0.25 0.02 0.00 -0.00 0.00 0.00 57.90 57.66 1b5h n TYR 154 Cb 0.33 -0.00 0.13 0.00 -0.00 0.00 0.00 39.34 39.80 1b5h n TYR 154 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.86 177.21 1b5h h PHE 155 N 2.14 0.21 -0.27 -3.48 3.57 -1.72 -1.35 116.94 116.03 1b5h h PHE 155 Ca 0.00 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.61 1b5h h PHE 155 Cb 0.50 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1b5h h PHE 155 CO 0.25 -0.06 0.19 0.10 -2.23 0.00 0.00 178.31 176.56 1b5h h TYR 156 N 0.25 0.03 -0.07 0.41 -0.00 -1.84 -1.49 116.97 114.25 1b5h h TYR 156 Ca 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 59.07 1b5h h TYR 156 Cb 0.55 -0.01 -0.00 0.00 0.00 0.00 0.00 36.73 37.27 1b5h h TYR 156 CO -0.26 0.02 -0.01 0.87 -0.00 0.00 0.00 178.16 178.77 1b5h h LYS 157 N 0.03 0.10 0.00 0.10 1.57 -1.60 -1.71 116.57 115.06 1b5h h LYS 157 Ca 0.13 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1b5h h LYS 157 Cb 0.48 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 1b5h h LYS 157 CO -0.01 0.12 -0.14 -0.07 -0.57 0.00 0.00 179.45 178.79 1b5h h LEU 158 N 0.10 0.00 0.00 2.94 4.07 -1.37 -3.33 115.31 117.72 1b5h h LEU 158 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 1b5h h LEU 158 Cb 0.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.82 1b5h h LEU 158 CO 0.00 0.14 0.00 0.18 -1.08 0.00 0.00 178.44 177.68 1b5h n LEU 159 N -4.35 0.00 -0.05 1.67 4.77 -0.64 -2.84 117.00 115.55 1b5h n LEU 159 Ca -0.03 0.07 0.14 0.00 -0.03 0.00 0.00 56.01 56.16 1b5h n LEU 159 Cb 0.21 -0.07 0.62 0.00 -2.33 0.00 0.00 43.42 41.85 1b5h n LEU 159 CO 0.36 -0.03 0.89 1.33 -1.33 0.00 0.00 177.39 178.60 1b5h n VAL 160 N -1.07 0.00 -2.67 4.08 0.24 -1.25 -4.14 118.33 113.53 1b5h n VAL 160 Ca 0.12 -0.03 -0.37 0.00 -2.04 0.00 0.00 64.34 62.02 1b5h n VAL 160 Cb 0.08 -0.24 -0.05 0.00 -1.47 0.00 0.00 33.84 32.16 1b5h n VAL 160 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1b5h s HIS 161 N -2.63 3.53 0.46 6.34 5.04 -1.13 -4.90 115.29 121.99 1b5h s HIS 161 Ca 0.25 1.73 0.14 0.00 -1.54 0.00 0.00 55.06 55.63 1b5h s HIS 161 Cb 0.20 -3.03 1.10 0.00 0.04 0.00 0.00 32.58 30.89 1b5h s HIS 161 CO 0.50 -0.16 2.05 -1.35 -2.34 0.00 0.00 174.74 173.44 1b5h h PRO 162 N 2.99 0.28 0.00 2.88 0.11 -1.91 -2.42 132.00 133.92 1b5h h PRO 162 Ca -0.47 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1b5h h PRO 162 Cb 1.20 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1b5h h PRO 162 CO 0.64 0.18 -0.03 0.66 -0.21 0.00 0.00 178.00 179.25 1b5h h SER 163 N 0.28 0.00 -0.49 -2.05 4.64 -1.93 -1.31 113.55 112.70 1b5h h SER 163 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1b5h h SER 163 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1b5h h SER 163 CO -0.03 0.03 0.00 1.33 -0.87 0.00 0.00 176.83 177.28 1b5h n VAL 164 N -3.49 2.24 -2.40 0.95 0.24 -0.91 -4.81 118.33 110.14 1b5h n VAL 164 Ca -0.03 -1.45 -0.32 0.00 -2.04 0.00 0.00 64.34 60.50 1b5h n VAL 164 Cb 0.13 -0.10 -0.03 0.00 -1.47 0.00 0.00 33.84 32.36 1b5h n VAL 164 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1b5h s SER 165 N -1.16 6.62 0.51 -1.34 0.01 -0.49 -4.61 113.70 113.23 1b5h s SER 165 Ca 0.48 1.56 -0.19 0.00 1.31 0.00 0.00 55.95 59.11 1b5h s SER 165 Cb 0.35 -2.51 -0.08 0.00 0.21 0.00 0.00 66.02 64.00 1b5h s SER 165 CO 0.16 -0.59 1.02 -2.16 0.41 0.00 0.00 173.24 172.09 1b5h s PRO 166 N -4.07 3.77 0.10 12.44 0.04 -1.26 -4.88 135.00 141.13 1b5h s PRO 166 Ca 0.59 1.22 0.09 0.00 0.04 0.00 0.00 61.00 62.94 1b5h s PRO 166 Cb -0.10 -2.10 -0.03 0.00 0.04 0.00 0.00 34.50 32.31 1b5h s PRO 166 CO 0.31 -0.44 -0.23 0.14 0.04 0.00 0.00 177.00 176.83 1b5h s VAL 167 N -2.23 1.87 -0.53 -0.36 -7.23 -1.26 -4.83 120.40 105.83 1b5h s VAL 167 Ca 0.64 -1.54 -0.25 0.00 -1.81 0.00 0.00 61.98 59.02 1b5h s VAL 167 Cb -0.14 -1.67 0.04 0.00 0.56 0.00 0.00 36.38 35.16 1b5h s VAL 167 CO 0.25 0.04 0.98 -2.16 -0.31 0.00 0.00 175.10 173.89 1b5h s PRO 168 N -1.81 3.42 0.23 4.82 0.04 -1.26 -4.77 135.00 135.67 1b5h s PRO 168 Ca 0.09 -0.05 -0.08 0.00 0.04 0.00 0.00 61.00 61.00 1b5h s PRO 168 Cb -0.10 -4.01 0.37 0.00 0.04 0.00 0.00 34.50 30.80 1b5h s PRO 168 CO 0.04 -1.44 1.69 -0.22 0.04 0.00 0.00 177.00 177.12 1b5h h LYS 169 N 9.28 0.24 -0.96 4.56 3.64 -1.99 -2.05 116.57 129.30 1b5h h LYS 169 Ca -0.25 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1b5h h LYS 169 Cb 1.07 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.79 1b5h h LYS 169 CO 1.09 0.16 0.60 0.66 -2.27 0.00 0.00 179.45 179.69 1b5h h SER 170 N 0.25 1.14 -0.25 4.20 4.64 -1.99 0.11 113.55 121.65 1b5h h SER 170 Ca 0.36 -0.06 -0.13 0.00 -0.47 0.00 0.00 61.79 61.49 1b5h h SER 170 Cb 0.58 -0.29 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1b5h h SER 170 CO -0.46 0.86 -0.35 0.00 -0.87 0.00 0.00 176.83 176.00 1b5h h ALA 171 N 1.33 0.37 0.11 5.18 0.00 -1.81 -0.99 119.26 123.45 1b5h h ALA 171 Ca 0.35 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1b5h h ALA 171 Cb -0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1b5h h ALA 171 CO -0.07 0.44 -0.15 0.28 0.00 0.00 0.00 179.25 179.76 1b5h h VAL 172 N 0.39 0.67 -0.71 0.00 2.07 -0.90 -0.02 116.25 117.74 1b5h h VAL 172 Ca 0.03 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.48 1b5h h VAL 172 Cb 0.94 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1b5h h VAL 172 CO 0.08 0.00 0.19 -0.33 0.02 0.00 0.00 177.57 177.53 1b5h h GLU 173 N -0.30 1.11 -0.07 1.57 5.08 -0.77 0.26 114.58 121.46 1b5h h GLU 173 Ca 0.01 -0.25 -0.22 0.00 -1.00 0.00 0.00 59.36 57.91 1b5h h GLU 173 Cb 0.30 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.41 1b5h h GLU 173 CO -0.06 0.97 -0.79 -0.22 -1.00 0.00 0.00 179.01 177.90 1b5h h LYS 174 N 1.06 0.67 -0.03 2.33 3.64 -1.09 -3.37 116.57 119.77 1b5h h LYS 174 Ca 0.23 -0.62 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1b5h h LYS 174 Cb 0.34 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1b5h h LYS 174 CO -0.00 1.23 0.00 1.19 -2.27 0.00 0.00 179.45 179.59 1b5h n PHE 175 N -4.00 0.03 -0.40 1.91 3.01 -0.03 -5.07 117.46 112.90 1b5h n PHE 175 Ca -0.09 -0.03 0.00 0.00 1.01 0.00 0.00 57.45 58.34 1b5h n PHE 175 Cb 0.76 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.23 1b5h n PHE 175 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1b5h n GLY 176 N 0.68 3.38 0.00 1.37 0.00 0.91 -1.65 105.19 109.87 1b5h n GLY 176 Ca 0.07 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1b5h n GLY 176 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1b5h n ASP 177 N 3.97 0.00 -1.37 1.61 5.68 -1.26 -1.84 116.55 123.35 1b5h n ASP 177 Ca 0.00 0.02 0.11 0.00 -0.50 0.00 0.00 54.79 54.42 1b5h n ASP 177 Cb 0.00 -0.28 0.32 0.00 -1.14 0.00 0.00 41.12 40.02 1b5h n ASP 177 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1b5h n LYS 178 N -1.28 3.06 0.27 0.11 5.02 -0.66 -4.49 118.16 120.20 1b5h n LYS 178 Ca 0.08 -2.69 0.11 0.00 -2.02 0.00 0.00 58.31 53.79 1b5h n LYS 178 Cb 0.14 -1.65 0.74 0.00 -0.02 0.00 0.00 35.03 34.23 1b5h n LYS 178 CO 0.00 0.00 0.00 0.11 -0.52 0.00 0.00 177.40 176.99 1b5h h TRP 179 N 4.02 0.00 -0.08 2.13 5.08 -1.45 -2.22 115.95 123.43 1b5h h TRP 179 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1b5h h TRP 179 Cb 1.12 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.28 1b5h h TRP 179 CO 0.56 0.03 0.00 0.25 -1.28 0.00 0.00 178.44 178.00 1b5h n THR 180 N -4.17 0.10 -1.91 0.12 -2.24 -1.26 -1.82 114.28 103.10 1b5h n THR 180 Ca -0.03 -0.24 -0.34 0.00 -2.27 0.00 0.00 64.05 61.17 1b5h n THR 180 Cb 0.12 0.23 0.04 0.00 -2.10 0.00 0.00 70.33 68.62 1b5h n THR 180 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1b5h s GLN 181 N -1.90 2.91 0.46 -0.78 -1.52 -0.84 -4.65 119.66 113.35 1b5h s GLN 181 Ca 0.35 1.57 0.13 0.00 -1.95 0.00 0.00 55.36 55.46 1b5h s GLN 181 Cb 0.18 -1.95 1.08 0.00 -0.22 0.00 0.00 33.01 32.10 1b5h s GLN 181 CO 0.28 -1.19 2.05 -1.35 -0.25 0.00 0.00 175.29 174.84 1b5h h PRO 182 N 0.48 0.30 0.00 2.91 0.11 -1.90 0.70 132.00 134.60 1b5h h PRO 182 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1b5h h PRO 182 Cb 1.26 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1b5h h PRO 182 CO 0.55 0.20 0.00 0.00 -0.21 0.00 0.00 178.00 178.53 1b5h h ALA 183 N 1.80 1.00 0.00 -0.75 0.00 -1.92 -3.33 119.26 116.06 1b5h h ALA 183 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1b5h h ALA 183 Cb 0.24 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1b5h h ALA 183 CO -0.03 0.00 -1.34 0.09 0.00 0.00 0.00 179.25 177.97 1b5h n ASN 184 N -2.54 3.71 -4.75 0.00 3.02 -0.18 -5.05 115.26 109.47 1b5h n ASN 184 Ca 0.03 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.22 1b5h n ASN 184 Cb 0.35 0.73 0.03 0.00 -0.61 0.00 0.00 39.78 40.29 1b5h n ASN 184 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1b5h s ILE 185 N -2.17 2.60 -0.06 2.41 2.07 0.06 -4.89 121.20 121.22 1b5h s ILE 185 Ca -0.02 0.37 0.02 0.00 -1.41 0.00 0.00 60.65 59.61 1b5h s ILE 185 Cb 0.02 -3.15 0.02 0.00 0.13 0.00 0.00 42.46 39.47 1b5h s ILE 185 CO 0.22 -0.08 -0.09 -0.69 -1.91 0.00 0.00 174.94 172.39 1b5h s VAL 186 N -1.58 0.87 0.15 4.00 1.01 -1.26 -4.98 120.40 118.62 1b5h s VAL 186 Ca 0.77 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 62.50 1b5h s VAL 186 Cb -0.31 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1b5h s VAL 186 CO 0.33 0.30 -0.14 0.42 0.00 0.00 0.00 175.10 176.02 1b5h s THR 187 N 0.80 1.43 0.00 3.92 -4.23 -1.26 -4.69 115.64 111.62 1b5h s THR 187 Ca -0.13 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.44 1b5h s THR 187 Cb -0.15 -1.76 0.00 0.00 1.34 0.00 0.00 72.50 71.93 1b5h s THR 187 CO 0.02 -0.53 0.81 -0.46 -0.54 0.00 0.00 174.62 173.91 1b5h n ASN 188 N 0.10 1.55 -1.98 3.99 6.94 -0.82 0.82 115.26 125.87 1b5h n ASN 188 Ca -0.12 -1.65 0.00 0.00 -0.02 0.00 0.00 54.58 52.79 1b5h n ASN 188 Cb 0.59 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.01 1b5h n ASN 188 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1b5h n GLY 189 N -0.32 0.04 0.19 4.83 0.00 0.16 -4.44 105.19 105.66 1b5h n GLY 189 Ca 0.00 -1.82 0.14 0.00 0.00 0.00 0.00 46.02 44.34 1b5h n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5h h ALA 190 N -1.22 1.00 -1.98 4.61 0.00 -1.79 -3.42 119.26 116.46 1b5h h ALA 190 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1b5h h ALA 190 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.65 1b5h h ALA 190 CO 0.00 0.00 -0.66 0.71 0.00 0.00 0.00 179.25 179.30 1b5h s TYR 191 N -3.49 2.16 0.19 0.00 1.51 -0.46 -0.66 117.35 116.60 1b5h s TYR 191 Ca 0.02 -0.66 0.08 0.00 -1.01 0.00 0.00 57.07 55.50 1b5h s TYR 191 Cb 0.09 -1.30 -0.05 0.00 -0.11 0.00 0.00 41.96 40.60 1b5h s TYR 191 CO 0.44 0.37 -0.15 0.15 -1.11 0.00 0.00 175.55 175.24 1b5h s LYS 192 N -3.70 1.31 -0.16 -0.62 1.02 0.13 -4.52 119.74 113.21 1b5h s LYS 192 Ca 0.32 -1.53 -0.23 0.00 0.02 0.00 0.00 55.97 54.54 1b5h s LYS 192 Cb 0.05 -1.18 -0.02 0.00 -0.52 0.00 0.00 37.83 36.15 1b5h s LYS 192 CO 0.14 0.21 0.73 -1.17 -0.92 0.00 0.00 175.35 174.35 1b5h s LEU 193 N -3.12 4.19 -0.20 3.17 2.96 -1.26 -0.72 118.68 123.71 1b5h s LEU 193 Ca 0.20 1.05 -0.15 0.00 -0.22 0.00 0.00 54.13 55.01 1b5h s LEU 193 Cb -0.02 -3.08 -0.08 0.00 0.50 0.00 0.00 46.19 43.50 1b5h s LEU 193 CO 0.07 -0.29 -0.22 1.17 -1.32 0.00 0.00 176.35 175.75 1b5h n LYS 194 N 4.85 0.53 -4.15 1.98 4.81 0.34 -4.81 118.16 121.71 1b5h n LYS 194 Ca 0.01 0.36 -0.16 0.00 -0.87 0.00 0.00 58.31 57.65 1b5h n LYS 194 Cb 0.50 -1.56 -0.12 0.00 0.02 0.00 0.00 35.03 33.86 1b5h n LYS 194 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1b5h s ASN 195 N -6.35 1.17 -0.32 3.14 0.01 -0.70 -4.89 114.94 107.01 1b5h s ASN 195 Ca -0.27 -0.51 0.00 0.00 -0.71 0.00 0.00 52.86 51.37 1b5h s ASN 195 Cb 0.06 -0.02 0.14 0.00 0.41 0.00 0.00 41.25 41.84 1b5h s ASN 195 CO 0.41 -0.11 0.29 0.86 -1.51 0.00 0.00 177.10 177.05 1b5h s TRP 196 N -1.14 -0.25 -0.35 2.20 -0.00 -1.26 -0.60 118.94 117.54 1b5h s TRP 196 Ca -0.05 -0.53 -0.07 0.00 -0.00 0.00 0.00 56.10 55.46 1b5h s TRP 196 Cb -0.09 -0.53 0.05 0.00 -0.00 0.00 0.00 33.47 32.90 1b5h s TRP 196 CO 0.01 -0.92 0.13 0.08 -0.00 0.00 0.00 176.95 176.25 1b5h s VAL 197 N 1.99 3.81 0.17 5.86 1.01 -0.31 -5.01 120.40 127.92 1b5h s VAL 197 Ca 0.12 -1.23 -0.34 0.00 0.00 0.00 0.00 61.98 60.53 1b5h s VAL 197 Cb -0.15 -3.21 -0.14 0.00 0.00 0.00 0.00 36.38 32.87 1b5h s VAL 197 CO -0.23 -0.26 1.47 0.52 0.00 0.00 0.00 175.10 176.60 1b5h n VAL 198 N 4.81 0.28 -1.30 2.92 0.31 -1.26 -0.70 118.33 123.39 1b5h n VAL 198 Ca -0.11 -0.07 -0.10 0.00 -0.01 0.00 0.00 64.34 64.04 1b5h n VAL 198 Cb 0.44 -1.36 -0.04 0.00 -0.91 0.00 0.00 33.84 31.97 1b5h n VAL 198 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1b5h n ASN 199 N 2.88 -4.74 0.03 4.52 5.03 -1.26 -4.78 115.26 116.95 1b5h n ASN 199 Ca 0.16 0.25 0.00 0.00 0.87 0.00 0.00 54.58 55.86 1b5h n ASN 199 Cb 0.28 -3.14 0.00 0.00 -1.02 0.00 0.00 39.78 35.90 1b5h n ASN 199 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 1b5h n GLU 200 N -2.02 0.00 -3.48 3.52 2.13 0.12 -4.91 120.64 116.00 1b5h n GLU 200 Ca -0.10 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.62 1b5h n GLU 200 Cb 0.42 -0.12 -0.02 0.00 0.27 0.00 0.00 31.44 31.99 1b5h n GLU 200 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1b5h s ARG 201 N -1.39 1.09 -0.15 5.31 1.70 -0.55 -4.36 118.95 120.61 1b5h s ARG 201 Ca 0.00 -0.42 0.02 0.00 -0.47 0.00 0.00 55.73 54.86 1b5h s ARG 201 Cb 0.00 0.49 0.02 0.00 -0.57 0.00 0.00 34.95 34.89 1b5h s ARG 201 CO 0.00 -0.48 -0.19 0.42 -1.08 0.00 0.00 175.30 173.97 1b5h s ILE 202 N -3.47 1.92 -0.15 4.99 1.01 0.28 -1.16 121.20 124.62 1b5h s ILE 202 Ca 0.03 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.81 1b5h s ILE 202 Cb -0.01 -1.73 -0.00 0.00 0.01 0.00 0.00 42.46 40.73 1b5h s ILE 202 CO -0.10 0.52 -0.15 -0.69 0.00 0.00 0.00 174.94 174.52 1b5h s VAL 203 N 1.10 2.73 -0.01 2.92 1.01 0.23 0.35 120.40 128.74 1b5h s VAL 203 Ca -0.01 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1b5h s VAL 203 Cb -0.14 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1b5h s VAL 203 CO -0.07 0.51 -0.09 -0.76 0.00 0.00 0.00 175.10 174.69 1b5h s LEU 204 N 0.79 3.07 0.08 3.92 1.43 0.00 -0.50 118.68 127.47 1b5h s LEU 204 Ca -0.05 -0.16 0.08 0.00 -1.03 0.00 0.00 54.13 52.97 1b5h s LEU 204 Cb -0.15 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 1b5h s LEU 204 CO 0.00 0.30 -0.20 -1.83 0.23 0.00 0.00 176.35 174.85 1b5h s GLU 205 N -1.24 1.16 0.20 1.70 -1.05 0.10 -1.94 118.70 117.63 1b5h s GLU 205 Ca 0.15 -1.08 -0.30 0.00 -0.15 0.00 0.00 54.97 53.59 1b5h s GLU 205 Cb -0.11 -1.36 -0.16 0.00 -0.44 0.00 0.00 34.13 32.05 1b5h s GLU 205 CO 0.05 0.32 0.81 -2.13 0.95 0.00 0.00 175.26 175.26 1b5h n ARG 206 N 1.30 0.53 -3.39 -4.83 0.63 -0.15 0.22 116.66 110.98 1b5h n ARG 206 Ca -0.19 0.19 -0.44 0.00 -0.92 0.00 0.00 57.85 56.48 1b5h n ARG 206 Cb 0.54 -1.41 -0.08 0.00 0.45 0.00 0.00 32.46 31.95 1b5h n ARG 206 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1b5h s ASN 207 N -0.62 6.15 0.06 6.15 2.47 0.16 -4.54 114.94 124.77 1b5h s ASN 207 Ca 0.67 -1.30 0.16 0.00 0.42 0.00 0.00 52.86 52.81 1b5h s ASN 207 Cb -0.89 -2.18 0.69 0.00 -1.45 0.00 0.00 41.25 37.41 1b5h s ASN 207 CO 0.57 -0.64 1.51 -0.81 -3.72 0.00 0.00 177.10 174.01 1b5h n PRO 208 N 5.21 0.05 0.05 0.43 -0.04 -1.26 -1.91 135.00 137.52 1b5h n PRO 208 Ca -0.12 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 63.77 1b5h n PRO 208 Cb 0.44 -1.59 0.30 0.00 -0.04 0.00 0.00 33.50 32.61 1b5h n PRO 208 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1b5h n GLN 209 N -1.68 0.18 -1.66 0.54 1.13 -1.26 -4.87 117.38 109.75 1b5h n GLN 209 Ca 0.03 0.08 -0.46 0.00 -1.94 0.00 0.00 57.00 54.71 1b5h n GLN 209 Cb 0.18 -1.64 -0.04 0.00 0.11 0.00 0.00 30.24 28.85 1b5h n GLN 209 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 1b5h n TYR 210 N -1.91 2.17 -0.22 1.08 9.36 -0.80 -4.22 117.16 122.61 1b5h n TYR 210 Ca 0.05 0.34 0.13 0.00 3.32 0.00 0.00 57.90 61.74 1b5h n TYR 210 Cb 0.40 -2.50 0.42 0.00 -0.63 0.00 0.00 39.34 37.03 1b5h n TYR 210 CO 0.00 0.00 0.00 0.11 0.22 0.00 0.00 176.86 177.19 1b5h h TRP 211 N 5.41 0.69 -0.72 2.98 5.08 -1.85 -0.43 115.95 127.11 1b5h h TRP 211 Ca -0.45 0.02 -0.21 0.00 1.08 0.00 0.00 58.89 59.33 1b5h h TRP 211 Cb 1.27 -0.22 -0.13 0.00 -3.00 0.00 0.00 29.16 27.08 1b5h h TRP 211 CO 0.61 0.27 0.27 -3.47 -1.28 0.00 0.00 178.44 174.83 1b5h n ASP 212 N -4.52 4.72 -0.19 0.11 2.03 -1.26 -4.72 116.55 112.71 1b5h n ASP 212 Ca 0.16 -3.16 0.12 0.00 0.52 0.00 0.00 54.79 52.44 1b5h n ASP 212 Cb 0.47 -0.74 0.44 0.00 -0.72 0.00 0.00 41.12 40.57 1b5h n ASP 212 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 1b5h h ASN 213 N 2.55 0.51 -0.00 1.67 -1.24 -1.39 -2.24 115.58 115.44 1b5h h ASN 213 Ca 0.26 0.02 0.00 0.00 0.71 0.00 0.00 56.30 57.29 1b5h h ASN 213 Cb 2.28 -0.08 -0.00 0.00 0.73 0.00 0.00 38.32 41.25 1b5h h ASN 213 CO 0.72 0.28 0.00 0.00 -1.29 0.00 0.00 177.43 177.14 1b5h h ALA 214 N 1.63 1.71 -0.00 1.57 0.00 -1.84 -1.27 119.26 121.05 1b5h h ALA 214 Ca 0.37 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1b5h h ALA 214 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1b5h h ALA 214 CO -0.14 -0.00 -0.40 1.63 0.00 0.00 0.00 179.25 180.34 1b5h n LYS 215 N -4.11 0.48 -2.37 0.00 5.02 -0.85 -4.89 118.16 111.45 1b5h n LYS 215 Ca -0.03 -0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 55.55 1b5h n LYS 215 Cb 0.09 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.57 1b5h n LYS 215 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1b5h s THR 216 N -2.72 3.43 -0.10 -0.18 2.01 -0.48 0.81 115.64 118.41 1b5h s THR 216 Ca 0.18 1.29 -0.02 0.00 0.31 0.00 0.00 61.69 63.45 1b5h s THR 216 Cb 0.18 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 1b5h s THR 216 CO 0.61 0.25 -0.10 0.52 -0.69 0.00 0.00 174.62 175.20 1b5h n VAL 217 N 1.93 0.53 -2.23 3.82 0.31 -1.26 -4.91 118.33 116.52 1b5h n VAL 217 Ca 0.02 -0.17 -0.42 0.00 -0.01 0.00 0.00 64.34 63.76 1b5h n VAL 217 Cb 0.44 -1.23 -0.03 0.00 -0.91 0.00 0.00 33.84 32.12 1b5h n VAL 217 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1b5h s ILE 218 N -2.18 3.66 -0.19 2.52 -1.09 -1.26 -4.83 121.20 117.84 1b5h s ILE 218 Ca -0.13 1.10 0.19 0.00 -2.23 0.00 0.00 60.65 59.58 1b5h s ILE 218 Cb 0.04 -3.71 -0.03 0.00 -1.58 0.00 0.00 42.46 37.19 1b5h s ILE 218 CO 0.19 0.02 1.03 0.78 -1.23 0.00 0.00 174.94 175.74 1b5h h ASN 219 N 7.54 0.00 -3.36 3.58 2.35 -0.96 -3.43 115.58 121.30 1b5h h ASN 219 Ca -0.39 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.25 1b5h h ASN 219 Cb 1.19 0.00 -0.26 0.00 0.05 0.00 0.00 38.32 39.30 1b5h h ASN 219 CO 0.89 0.33 -0.27 -1.58 -1.65 0.00 0.00 177.43 175.15 1b5h s GLN 220 N -3.10 0.42 -0.01 0.81 0.74 -1.23 -0.97 119.66 116.32 1b5h s GLN 220 Ca -0.01 0.76 0.05 0.00 0.05 0.00 0.00 55.36 56.22 1b5h s GLN 220 Cb 0.09 0.04 -0.01 0.00 1.10 0.00 0.00 33.01 34.22 1b5h s GLN 220 CO 0.79 -0.14 -0.17 0.54 -0.55 0.00 0.00 175.29 175.76 1b5h s VAL 221 N 1.15 1.33 -0.11 1.34 0.11 -0.82 -1.60 120.40 121.81 1b5h s VAL 221 Ca -0.08 -0.72 0.01 0.00 -2.93 0.00 0.00 61.98 58.27 1b5h s VAL 221 Cb -0.07 -1.11 -0.02 0.00 -1.53 0.00 0.00 36.38 33.65 1b5h s VAL 221 CO -0.10 0.38 -0.14 -0.89 -3.33 0.00 0.00 175.10 171.02 1b5h s THR 222 N -0.36 3.03 -0.18 5.04 2.01 -0.26 -0.82 115.64 124.10 1b5h s THR 222 Ca 0.06 -0.68 -0.05 0.00 0.31 0.00 0.00 61.69 61.32 1b5h s THR 222 Cb -0.07 -2.25 -0.03 0.00 0.01 0.00 0.00 72.50 70.16 1b5h s THR 222 CO -0.00 0.54 -0.01 -0.31 -0.69 0.00 0.00 174.62 174.15 1b5h s TYR 223 N 0.11 3.07 0.21 4.92 1.51 0.16 -0.48 117.35 126.85 1b5h s TYR 223 Ca -0.06 -0.29 0.06 0.00 -1.01 0.00 0.00 57.07 55.76 1b5h s TYR 223 Cb -0.15 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.64 1b5h s TYR 223 CO 0.05 -0.08 0.21 -0.51 -1.11 0.00 0.00 175.55 174.11 1b5h s LEU 224 N 0.59 3.95 -0.47 -1.29 1.43 -0.40 -0.55 118.68 121.93 1b5h s LEU 224 Ca -0.01 -0.12 0.03 0.00 -1.03 0.00 0.00 54.13 53.00 1b5h s LEU 224 Cb -0.14 -2.51 0.46 0.00 0.03 0.00 0.00 46.19 44.03 1b5h s LEU 224 CO 0.02 0.00 1.62 -0.81 0.23 0.00 0.00 176.35 177.41 1b5h n PRO 225 N -0.88 3.10 -2.78 1.29 -0.04 -1.26 0.30 135.00 134.73 1b5h n PRO 225 Ca -0.08 -3.70 -0.42 0.00 -0.04 0.00 0.00 63.50 59.25 1b5h n PRO 225 Cb 0.56 -2.27 -0.03 0.00 -0.04 0.00 0.00 33.50 31.72 1b5h n PRO 225 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1b5h s ILE 226 N -4.65 4.65 -0.56 0.52 1.01 -1.26 -4.03 121.20 116.88 1b5h s ILE 226 Ca 0.58 1.50 0.23 0.00 0.00 0.00 0.00 60.65 62.96 1b5h s ILE 226 Cb 0.46 -4.29 -0.08 0.00 0.01 0.00 0.00 42.46 38.56 1b5h s ILE 226 CO 0.02 -0.36 1.07 -1.54 0.00 0.00 0.00 174.94 174.12 1b5h n SER 227 N 6.54 0.63 -4.62 3.58 3.41 -1.15 -3.91 113.62 118.11 1b5h n SER 227 Ca 0.08 -0.09 -0.43 0.00 -0.26 0.00 0.00 58.87 58.17 1b5h n SER 227 Cb 0.47 0.68 -0.02 0.00 -0.26 0.00 0.00 64.21 65.09 1b5h n SER 227 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1b5h s SER 228 N -4.13 6.77 0.41 4.04 0.15 -1.26 -4.04 113.70 115.63 1b5h s SER 228 Ca 0.03 0.72 0.11 0.00 0.70 0.00 0.00 55.95 57.51 1b5h s SER 228 Cb 0.14 -2.54 0.87 0.00 -1.71 0.00 0.00 66.02 62.78 1b5h s SER 228 CO 0.79 -1.07 1.96 -0.33 1.20 0.00 0.00 173.24 175.79 1b5h h GLU 229 N 8.70 0.20 -0.09 5.44 3.07 -1.87 -0.17 114.58 129.86 1b5h h GLU 229 Ca -0.22 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.60 1b5h h GLU 229 Cb 1.06 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.93 1b5h h GLU 229 CO 1.08 0.31 0.03 0.28 -1.40 0.00 0.00 179.01 179.30 1b5h h VAL 230 N 0.20 1.17 -0.83 3.13 2.07 -1.94 -1.23 116.25 118.83 1b5h h VAL 230 Ca 0.04 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.04 1b5h h VAL 230 Cb 0.29 1.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1b5h h VAL 230 CO 0.01 0.15 0.52 0.74 0.02 0.00 0.00 177.57 179.01 1b5h h THR 231 N -0.05 1.22 0.03 2.57 2.02 -1.84 0.12 112.91 116.98 1b5h h THR 231 Ca 0.03 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 66.75 1b5h h THR 231 Cb 0.21 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 1b5h h THR 231 CO -0.00 0.23 -0.05 -0.78 0.37 0.00 0.00 175.52 175.29 1b5h h ASP 232 N 1.13 -0.13 -0.69 4.18 -0.00 -0.86 -0.01 116.42 120.04 1b5h h ASP 232 Ca 0.30 0.02 0.02 0.00 -0.00 0.00 0.00 57.03 57.37 1b5h h ASP 232 Cb -0.08 0.05 -0.04 0.00 -0.00 0.00 0.00 39.33 39.27 1b5h h ASP 232 CO -0.06 -0.08 0.44 0.58 -0.00 0.00 0.00 179.24 180.12 1b5h h VAL 233 N -0.10 1.11 -0.10 2.25 2.07 -0.91 0.45 116.25 121.01 1b5h h VAL 233 Ca 0.01 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.25 1b5h h VAL 233 Cb 0.11 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1b5h h VAL 233 CO -0.03 0.16 0.01 0.78 0.02 0.00 0.00 177.57 178.51 1b5h h ASN 234 N 0.87 -0.02 1.24 0.57 2.35 -0.23 0.85 115.58 121.21 1b5h h ASN 234 Ca 0.27 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 1b5h h ASN 234 Cb -0.01 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1b5h h ASN 234 CO -0.09 0.01 0.00 0.03 -1.65 0.00 0.00 177.43 175.72 1b5h h ARG 235 N 0.05 0.00 0.13 0.81 3.08 -0.58 -0.41 114.38 117.46 1b5h h ARG 235 Ca 0.05 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1b5h h ARG 235 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1b5h h ARG 235 CO -0.07 0.00 -0.06 -0.92 -1.07 0.00 0.00 179.97 177.85 1b5h h TYR 236 N 0.00 -0.16 0.00 3.04 3.20 -0.48 -0.01 116.97 122.56 1b5h h TYR 236 Ca 0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1b5h h TYR 236 Cb 0.62 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.94 1b5h h TYR 236 CO 0.00 0.30 -0.03 0.00 -1.64 0.00 0.00 178.16 176.78 1b5h h ARG 237 N -0.73 0.00 0.00 1.82 3.08 -0.37 -0.96 114.38 117.22 1b5h h ARG 237 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1b5h h ARG 237 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1b5h h ARG 237 CO 0.03 0.03 0.00 0.66 -1.07 0.00 0.00 179.97 179.62 1b5h h SER 238 N 0.00 0.00 0.00 7.04 4.64 -1.16 -3.47 113.55 120.60 1b5h h SER 238 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1b5h h SER 238 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1b5h h SER 238 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1b5h n GLY 239 N 0.70 1.06 0.21 -0.77 0.00 -0.36 -5.00 105.19 101.04 1b5h n GLY 239 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 1b5h n GLY 239 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1b5h h GLU 240 N 1.95 0.71 -5.33 1.61 4.81 -1.33 -3.44 114.58 113.55 1b5h h GLU 240 Ca 0.00 -0.42 -0.62 0.00 -0.13 0.00 0.00 59.36 58.20 1b5h h GLU 240 Cb 0.00 0.03 -0.13 0.00 0.63 0.00 0.00 28.75 29.28 1b5h h GLU 240 CO 0.00 1.04 -0.52 0.42 -0.73 0.00 0.00 179.01 179.21 1b5h s ILE 241 N -4.22 5.11 -0.04 2.32 1.01 -0.16 -4.74 121.20 120.48 1b5h s ILE 241 Ca -0.12 0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.69 1b5h s ILE 241 Cb 0.09 -3.31 -0.24 0.00 0.01 0.00 0.00 42.46 39.01 1b5h s ILE 241 CO 0.84 0.47 0.67 0.44 0.00 0.00 0.00 174.94 177.37 1b5h h ASP 242 N 6.47 0.09 -3.25 3.58 3.32 -1.46 -3.39 116.42 121.77 1b5h h ASP 242 Ca -0.41 -0.18 -0.44 0.00 0.02 0.00 0.00 57.03 56.03 1b5h h ASP 242 Cb 1.17 -0.03 -0.39 0.00 0.22 0.00 0.00 39.33 40.30 1b5h h ASP 242 CO 0.71 1.16 -0.76 -0.04 -1.72 0.00 0.00 179.24 178.59 1b5h s MET 243 N -2.60 0.49 1.11 3.56 -1.94 -1.00 -1.72 119.30 117.19 1b5h s MET 243 Ca -0.07 0.08 -0.16 0.00 -1.71 0.00 0.00 55.69 53.83 1b5h s MET 243 Cb 0.08 -1.07 0.24 0.00 2.01 0.00 0.00 34.83 36.09 1b5h s MET 243 CO 0.82 -0.36 1.11 0.95 -0.01 0.00 0.00 175.02 177.52 1b5h s THR 244 N 2.00 1.79 0.73 2.05 -4.23 -0.54 -1.39 115.64 116.05 1b5h s THR 244 Ca 0.04 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.44 1b5h s THR 244 Cb -0.13 -2.50 0.03 0.00 1.34 0.00 0.00 72.50 71.24 1b5h s THR 244 CO -0.05 0.00 1.10 -0.47 -0.54 0.00 0.00 174.62 174.65 1b5h s TYR 245 N -3.00 3.22 -1.07 3.99 5.04 -1.24 -4.54 117.35 119.75 1b5h s TYR 245 Ca 0.68 1.07 -0.02 0.00 -2.44 0.00 0.00 57.07 56.36 1b5h s TYR 245 Cb -0.14 -3.08 0.30 0.00 0.35 0.00 0.00 41.96 39.39 1b5h s TYR 245 CO 0.57 -1.31 1.81 0.27 -1.34 0.00 0.00 175.55 175.55 1b5h n ASN 246 N -3.10 7.19 -3.75 4.32 6.94 -1.26 -4.65 115.26 120.95 1b5h n ASN 246 Ca 0.07 -3.57 -0.23 0.00 -0.02 0.00 0.00 54.58 50.83 1b5h n ASN 246 Cb 0.57 -1.21 -0.18 0.00 -2.36 0.00 0.00 39.78 36.60 1b5h n ASN 246 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1b5h s ASN 247 N -1.23 1.64 0.00 0.53 0.01 -1.25 -4.68 114.94 109.95 1b5h s ASN 247 Ca 0.39 -0.13 0.03 0.00 -0.71 0.00 0.00 52.86 52.43 1b5h s ASN 247 Cb 0.16 -0.40 -0.03 0.00 0.41 0.00 0.00 41.25 41.39 1b5h s ASN 247 CO -0.07 -0.22 -0.05 -0.04 -1.51 0.00 0.00 177.10 175.21 1b5h s MET 248 N 2.00 2.61 0.15 -0.60 -1.94 -1.26 -4.82 119.30 115.45 1b5h s MET 248 Ca 0.04 -0.70 -0.30 0.00 -1.71 0.00 0.00 55.69 53.03 1b5h s MET 248 Cb -0.13 -2.55 -0.07 0.00 2.01 0.00 0.00 34.83 34.09 1b5h s MET 248 CO -0.05 0.61 1.09 -1.25 -0.01 0.00 0.00 175.02 175.41 1b5h s PRO 249 N -1.48 4.59 0.29 2.03 0.04 -1.26 -4.78 135.00 134.42 1b5h s PRO 249 Ca 0.18 1.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.90 1b5h s PRO 249 Cb -0.11 -3.30 0.44 0.00 0.04 0.00 0.00 34.50 31.57 1b5h s PRO 249 CO 0.09 0.05 1.87 0.82 0.04 0.00 0.00 177.00 179.86 1b5h h ILE 250 N 3.87 1.21 -0.97 0.56 2.04 -1.92 -2.24 117.51 120.06 1b5h h ILE 250 Ca -0.44 -0.69 0.11 0.00 1.00 0.00 0.00 64.86 64.84 1b5h h ILE 250 Cb 1.21 0.53 -0.08 0.00 -0.74 0.00 0.00 36.82 37.74 1b5h h ILE 250 CO 0.73 0.27 0.60 -0.33 0.00 0.00 0.00 178.15 179.43 1b5h h GLU 251 N 0.85 0.95 0.00 2.37 3.07 -1.96 -3.36 114.58 116.50 1b5h h GLU 251 Ca 0.20 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 1b5h h GLU 251 Cb 0.19 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 1b5h h GLU 251 CO -0.02 0.63 -1.36 1.28 -1.40 0.00 0.00 179.01 178.14 1b5h n LEU 252 N -4.63 0.02 -0.09 1.33 4.77 -1.09 -4.86 117.00 112.45 1b5h n LEU 252 Ca 0.17 -0.02 -0.06 0.00 -0.03 0.00 0.00 56.01 56.07 1b5h n LEU 252 Cb 0.31 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1b5h n LEU 252 CO 0.28 0.00 0.79 0.15 -1.33 0.00 0.00 177.39 177.29 1b5h h PHE 253 N 0.00 -0.21 -0.59 -1.77 3.57 -1.55 -0.70 116.94 115.70 1b5h h PHE 253 Ca 0.00 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.58 1b5h h PHE 253 Cb 0.39 0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.23 1b5h h PHE 253 CO 0.00 -0.16 0.33 1.96 -2.23 0.00 0.00 178.31 178.21 1b5h h GLN 254 N -0.02 0.61 -0.39 1.11 1.08 -1.87 -1.27 115.11 114.36 1b5h h GLN 254 Ca 0.16 -0.04 0.03 0.00 -1.45 0.00 0.00 58.65 57.35 1b5h h GLN 254 Cb 0.26 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.52 1b5h h GLN 254 CO -0.35 0.40 0.20 0.87 -0.95 0.00 0.00 178.83 179.00 1b5h h LYS 255 N 0.62 0.39 -0.94 1.46 1.57 -1.76 -2.84 116.57 115.07 1b5h h LYS 255 Ca 0.25 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 59.04 1b5h h LYS 255 Cb 0.12 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.29 1b5h h LYS 255 CO -0.15 0.26 0.61 -0.07 -0.57 0.00 0.00 179.45 179.53 1b5h h LEU 256 N 0.40 1.03 -1.42 2.94 3.38 -0.24 0.32 115.31 121.72 1b5h h LEU 256 Ca 0.17 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1b5h h LEU 256 Cb 0.07 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 1b5h h LEU 256 CO -0.11 0.71 0.05 0.50 0.09 0.00 0.00 178.44 179.68 1b5h h LYS 257 N 1.20 0.44 0.00 1.13 1.63 -1.03 0.27 116.57 120.20 1b5h h LYS 257 Ca 0.37 -0.07 -0.18 0.00 -0.85 0.00 0.00 60.65 59.92 1b5h h LYS 257 Cb -0.02 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.51 1b5h h LYS 257 CO -0.12 0.43 -1.18 0.87 -3.45 0.00 0.00 179.45 176.01 1b5h h LYS 258 N 0.43 0.00 0.17 1.90 1.79 -1.20 -3.19 116.57 116.46 1b5h h LYS 258 Ca 0.10 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.26 1b5h h LYS 258 Cb 0.20 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.86 1b5h h LYS 258 CO -0.00 0.48 -1.54 0.93 -1.08 0.00 0.00 179.45 178.23 1b5h h GLU 259 N 0.00 0.35 -2.02 3.15 5.08 0.24 -3.41 114.58 117.96 1b5h h GLU 259 Ca -0.12 -0.60 -0.49 0.00 -1.00 0.00 0.00 59.36 57.15 1b5h h GLU 259 Cb 1.63 0.22 -0.40 0.00 0.50 0.00 0.00 28.75 30.71 1b5h h GLU 259 CO 0.07 1.29 -1.15 0.44 -1.00 0.00 0.00 179.01 178.66 1b5h n ILE 260 N -3.76 0.07 -0.32 3.13 -5.35 0.89 -4.99 119.36 109.02 1b5h n ILE 260 Ca -0.23 -4.64 0.16 0.00 -0.27 0.00 0.00 62.75 57.77 1b5h n ILE 260 Cb 1.00 -0.43 0.36 0.00 -1.74 0.00 0.00 39.64 38.82 1b5h n ILE 260 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1b5h h PRO 261 N 3.05 0.38 0.00 6.28 0.13 -1.62 0.28 132.00 140.49 1b5h h PRO 261 Ca 0.10 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1b5h h PRO 261 Cb 0.93 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1b5h h PRO 261 CO 0.52 0.25 0.00 -0.91 -0.23 0.00 0.00 178.00 177.63 1b5h h ASN 262 N 0.39 0.00 0.52 1.44 2.35 -1.92 -2.94 115.58 115.42 1b5h h ASN 262 Ca 0.61 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.36 1b5h h ASN 262 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 1b5h h ASN 262 CO -0.56 0.00 -1.46 -0.62 -1.65 0.00 0.00 177.43 173.14 1b5h n GLU 263 N -2.74 0.62 -2.60 0.81 1.02 0.07 -4.84 120.64 112.97 1b5h n GLU 263 Ca 0.01 -0.03 -0.42 0.00 -0.02 0.00 0.00 57.16 56.71 1b5h n GLU 263 Cb 0.26 -1.68 -0.03 0.00 -0.02 0.00 0.00 31.44 29.97 1b5h n GLU 263 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1b5h s VAL 264 N -3.43 3.88 -0.12 2.62 1.01 -1.11 -1.46 120.40 121.79 1b5h s VAL 264 Ca -0.04 0.45 -0.16 0.00 0.00 0.00 0.00 61.98 62.23 1b5h s VAL 264 Cb 0.12 -4.84 -0.05 0.00 0.00 0.00 0.00 36.38 31.62 1b5h s VAL 264 CO 0.85 -1.67 0.40 -0.13 0.00 0.00 0.00 175.10 174.55 1b5h s ARG 265 N 5.32 4.25 -0.17 2.72 1.81 0.06 -4.97 118.95 127.97 1b5h s ARG 265 Ca 0.35 0.32 -0.03 0.00 -1.72 0.00 0.00 55.73 54.65 1b5h s ARG 265 Cb -0.09 -3.40 0.06 0.00 -0.45 0.00 0.00 34.95 31.06 1b5h s ARG 265 CO 0.17 0.26 0.04 0.08 -0.68 0.00 0.00 175.30 175.17 1b5h s VAL 266 N 0.34 0.36 0.17 3.52 1.01 -1.26 -1.97 120.40 122.58 1b5h s VAL 266 Ca 0.22 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1b5h s VAL 266 Cb -0.15 -0.86 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 1b5h s VAL 266 CO 0.08 -0.16 0.02 -1.81 0.00 0.00 0.00 175.10 173.23 1b5h s ASP 267 N 1.94 1.02 0.73 3.32 1.11 -0.91 -4.94 116.67 118.94 1b5h s ASP 267 Ca 0.01 -1.19 -0.16 0.00 0.18 0.00 0.00 52.55 51.39 1b5h s ASP 267 Cb -0.16 0.16 0.04 0.00 1.07 0.00 0.00 42.92 44.03 1b5h s ASP 267 CO -0.08 -0.61 1.25 -2.84 1.18 0.00 0.00 175.17 174.07 1b5h s PRO 268 N -3.95 2.06 -0.20 8.23 0.02 -1.26 0.15 135.00 140.05 1b5h s PRO 268 Ca 0.25 1.91 -0.10 0.00 0.02 0.00 0.00 61.00 63.08 1b5h s PRO 268 Cb 0.06 -1.81 0.07 0.00 0.02 0.00 0.00 34.50 32.85 1b5h s PRO 268 CO 0.04 -1.94 0.47 -0.47 -0.33 0.00 0.00 177.00 174.78 1b5h s TYR 269 N -1.78 -0.76 -1.28 6.54 5.04 -1.25 -4.48 117.35 119.37 1b5h s TYR 269 Ca 0.78 1.53 -0.10 0.00 -2.44 0.00 0.00 57.07 56.84 1b5h s TYR 269 Cb -0.33 0.37 0.16 0.00 0.35 0.00 0.00 41.96 42.51 1b5h s TYR 269 CO 0.45 -0.42 1.86 1.28 -1.34 0.00 0.00 175.55 177.38 1b5h n LEU 270 N 4.52 6.54 -4.03 6.97 4.77 0.24 -4.50 117.00 131.50 1b5h n LEU 270 Ca -0.20 -4.61 -0.12 0.00 -0.03 0.00 0.00 56.01 51.06 1b5h n LEU 270 Cb 0.55 -1.50 -0.11 0.00 -2.33 0.00 0.00 43.42 40.03 1b5h n LEU 270 CO 0.04 1.31 -0.39 0.00 -1.33 0.00 0.00 177.39 177.02 1b5h s THR 272 N -1.40 1.46 -0.16 0.00 2.01 0.07 -1.40 115.64 116.20 1b5h s THR 272 Ca -0.12 -0.71 -0.12 0.00 0.31 0.00 0.00 61.69 61.06 1b5h s THR 272 Cb -0.10 -1.27 -0.05 0.00 0.01 0.00 0.00 72.50 71.09 1b5h s THR 272 CO -0.00 0.42 0.22 -0.47 -0.69 0.00 0.00 174.62 174.10 1b5h s TYR 273 N 0.24 3.47 0.23 4.92 5.04 0.45 -1.81 117.35 129.89 1b5h s TYR 273 Ca -0.09 0.50 -0.13 0.00 -2.44 0.00 0.00 57.07 54.91 1b5h s TYR 273 Cb -0.14 -2.22 -0.00 0.00 0.35 0.00 0.00 41.96 39.95 1b5h s TYR 273 CO 0.04 0.33 0.47 1.52 -1.34 0.00 0.00 175.55 176.57 1b5h s TYR 274 N 0.19 0.30 -0.31 4.97 -0.85 -0.23 -0.41 117.35 121.01 1b5h s TYR 274 Ca 0.13 -0.66 -0.11 0.00 -0.52 0.00 0.00 57.07 55.91 1b5h s TYR 274 Cb -0.12 0.21 -0.02 0.00 0.38 0.00 0.00 41.96 42.40 1b5h s TYR 274 CO 0.02 -0.97 0.19 0.71 -1.52 0.00 0.00 175.55 173.98 1b5h s TYR 275 N -3.99 3.20 -0.21 -3.49 1.51 0.11 -0.60 117.35 113.88 1b5h s TYR 275 Ca 0.20 -0.27 -0.29 0.00 -1.01 0.00 0.00 57.07 55.71 1b5h s TYR 275 Cb -0.01 -2.40 0.00 0.00 -0.11 0.00 0.00 41.96 39.45 1b5h s TYR 275 CO 0.07 -0.35 1.01 -2.00 -1.11 0.00 0.00 175.55 173.17 1b5h s GLU 276 N 1.69 4.28 -0.04 -0.62 2.12 0.19 -1.11 118.70 125.21 1b5h s GLU 276 Ca 0.06 1.32 -0.15 0.00 0.36 0.00 0.00 54.97 56.56 1b5h s GLU 276 Cb -0.17 -3.62 -0.05 0.00 0.26 0.00 0.00 34.13 30.55 1b5h s GLU 276 CO 0.09 -0.56 0.39 0.42 -0.54 0.00 0.00 175.26 175.06 1b5h s ILE 277 N 2.95 5.10 -0.78 -3.70 1.01 -1.25 -0.72 121.20 123.82 1b5h s ILE 277 Ca 0.44 0.80 -0.26 0.00 0.00 0.00 0.00 60.65 61.62 1b5h s ILE 277 Cb -0.16 -3.71 0.03 0.00 0.01 0.00 0.00 42.46 38.64 1b5h s ILE 277 CO 0.08 0.52 1.33 0.21 0.00 0.00 0.00 174.94 177.08 1b5h s ASN 278 N -0.65 6.17 0.20 3.58 3.84 -0.01 -4.65 114.94 123.43 1b5h s ASN 278 Ca 0.23 -0.57 0.20 0.00 0.21 0.00 0.00 52.86 52.93 1b5h s ASN 278 Cb -0.16 -2.56 0.89 0.00 -0.55 0.00 0.00 41.25 38.87 1b5h s ASN 278 CO 0.11 -1.82 1.62 0.59 -2.79 0.00 0.00 177.10 174.82 1b5h n ASN 279 N 9.44 0.49 -0.57 -4.21 4.13 -0.14 -2.85 115.26 121.54 1b5h n ASN 279 Ca 0.08 0.64 0.12 0.00 1.68 0.00 0.00 54.58 57.10 1b5h n ASN 279 Cb 0.49 -0.74 0.19 0.00 -1.54 0.00 0.00 39.78 38.19 1b5h n ASN 279 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1b5h n GLN 280 N -2.06 1.52 -4.18 3.52 6.02 -1.26 -3.87 117.38 117.07 1b5h n GLN 280 Ca 0.02 -1.15 -0.34 0.00 -0.01 0.00 0.00 57.00 55.51 1b5h n GLN 280 Cb 0.18 -1.48 -0.14 0.00 1.02 0.00 0.00 30.24 29.82 1b5h n GLN 280 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1b5h s LYS 281 N -2.27 3.46 0.41 -1.09 2.20 -1.13 -4.87 119.74 116.46 1b5h s LYS 281 Ca 0.25 -0.60 -0.26 0.00 -0.36 0.00 0.00 55.97 55.00 1b5h s LYS 281 Cb 0.19 -2.93 -0.09 0.00 -1.51 0.00 0.00 37.83 33.49 1b5h s LYS 281 CO 0.45 -0.01 1.36 0.00 -0.36 0.00 0.00 175.35 176.78 1b5h s ALA 282 N 1.01 3.29 -1.25 3.13 0.00 -1.26 0.15 121.76 126.83 1b5h s ALA 282 Ca 0.00 1.34 0.09 0.00 0.00 0.00 0.00 51.96 53.40 1b5h s ALA 282 Cb -0.15 -3.53 0.38 0.00 0.00 0.00 0.00 23.12 19.82 1b5h s ALA 282 CO 0.00 -0.96 1.20 -0.35 0.00 0.00 0.00 175.76 175.65 1b5h n PRO 283 N 0.08 2.47 0.00 0.00 -0.04 -1.26 -4.89 135.00 131.36 1b5h n PRO 283 Ca 0.04 -1.48 0.14 0.00 -0.04 0.00 0.00 63.50 62.15 1b5h n PRO 283 Cb 0.42 -1.62 0.78 0.00 -0.04 0.00 0.00 33.50 33.05 1b5h n PRO 283 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1b5h n PHE 284 N 0.44 0.00 1.68 0.54 3.01 0.39 -2.37 117.46 121.15 1b5h n PHE 284 Ca 0.13 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.74 1b5h n PHE 284 Cb 0.54 -0.08 0.75 0.00 -0.01 0.00 0.00 39.48 40.68 1b5h n PHE 284 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1b5h n ASN 285 N -1.08 0.46 -4.61 4.37 6.94 -1.15 -4.64 115.26 115.55 1b5h n ASN 285 Ca 0.19 -0.93 -0.40 0.00 -0.02 0.00 0.00 54.58 53.42 1b5h n ASN 285 Cb 0.13 -0.04 -0.08 0.00 -2.36 0.00 0.00 39.78 37.42 1b5h n ASN 285 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1b5h s ASP 286 N -2.17 6.37 0.54 0.53 3.68 -1.00 -4.96 116.67 119.65 1b5h s ASP 286 Ca 0.39 0.39 0.20 0.00 2.13 0.00 0.00 52.55 55.66 1b5h s ASP 286 Cb 0.21 -2.26 1.42 0.00 -1.45 0.00 0.00 42.92 40.84 1b5h s ASP 286 CO 0.40 -0.28 2.17 1.62 0.13 0.00 0.00 175.17 179.21 1b5h h VAL 287 N 5.42 0.86 -0.76 1.11 3.04 -1.89 -2.12 116.25 121.91 1b5h h VAL 287 Ca -0.30 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.36 1b5h h VAL 287 Cb 1.15 0.98 -0.03 0.00 -2.01 0.00 0.00 31.29 31.37 1b5h h VAL 287 CO 0.70 0.00 0.34 0.03 -1.01 0.00 0.00 177.57 177.63 1b5h h ARG 288 N 0.00 1.12 -0.05 4.17 3.08 -1.93 0.18 114.38 120.95 1b5h h ARG 288 Ca 0.01 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 1b5h h ARG 288 Cb 0.06 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 1b5h h ARG 288 CO -0.00 0.89 0.00 0.28 -1.07 0.00 0.00 179.97 180.07 1b5h h VAL 289 N 1.09 1.23 -0.51 2.04 2.07 -1.68 -1.21 116.25 119.28 1b5h h VAL 289 Ca 0.26 -0.70 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 1b5h h VAL 289 Cb 0.16 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1b5h h VAL 289 CO -0.03 0.19 0.27 0.03 0.02 0.00 0.00 177.57 178.06 1b5h h ARG 290 N -0.18 0.71 -0.72 1.57 3.08 -1.23 -1.76 114.38 115.85 1b5h h ARG 290 Ca 0.02 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1b5h h ARG 290 Cb 0.30 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 1b5h h ARG 290 CO 0.00 0.56 0.40 1.15 -1.07 0.00 0.00 179.97 181.01 1b5h h THR 291 N 0.67 1.21 -0.30 2.04 2.02 -0.63 -1.23 112.91 116.69 1b5h h THR 291 Ca 0.18 -0.53 -0.01 0.00 0.77 0.00 0.00 66.41 66.83 1b5h h THR 291 Cb 0.06 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 1b5h h THR 291 CO -0.03 0.24 0.16 0.00 0.37 0.00 0.00 175.52 176.26 1b5h h ALA 292 N 1.44 0.38 -0.72 6.16 0.00 -0.73 -0.27 119.26 125.52 1b5h h ALA 292 Ca 0.26 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1b5h h ALA 292 Cb 0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1b5h h ALA 292 CO -0.04 -0.08 0.37 -0.07 0.00 0.00 0.00 179.25 179.42 1b5h h LEU 293 N 0.36 0.93 -0.12 0.00 3.38 -0.98 -0.39 115.31 118.50 1b5h h LEU 293 Ca 0.11 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1b5h h LEU 293 Cb 0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1b5h h LEU 293 CO -0.02 0.78 0.06 0.50 0.09 0.00 0.00 178.44 179.86 1b5h h LYS 294 N 1.00 0.16 -0.15 1.13 3.64 -0.84 -2.93 116.57 118.58 1b5h h LYS 294 Ca 0.25 -0.02 -0.17 0.00 -1.27 0.00 0.00 60.65 59.44 1b5h h LYS 294 Cb 0.09 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1b5h h LYS 294 CO -0.04 0.20 -0.61 -0.07 -2.27 0.00 0.00 179.45 176.66 1b5h h LEU 295 N 0.08 0.59 -0.83 5.20 3.38 -0.97 -3.28 115.31 119.49 1b5h h LEU 295 Ca 0.04 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 1b5h h LEU 295 Cb 0.08 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1b5h h LEU 295 CO -0.01 1.06 -0.10 0.00 0.09 0.00 0.00 178.44 179.49 1b5h h ALA 296 N 0.94 0.98 -2.67 1.53 0.00 -1.07 -3.41 119.26 115.56 1b5h h ALA 296 Ca -0.01 -0.09 -0.53 0.00 0.00 0.00 0.00 54.91 54.29 1b5h h ALA 296 Cb 1.16 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.98 1b5h h ALA 296 CO 0.11 0.12 0.77 -1.17 0.00 0.00 0.00 179.25 179.08 1b5h s LEU 297 N -6.36 4.38 -0.66 0.00 0.20 -1.11 -4.76 118.68 110.38 1b5h s LEU 297 Ca 0.03 2.56 -0.15 0.00 0.69 0.00 0.00 54.13 57.26 1b5h s LEU 297 Cb 0.08 -3.61 0.17 0.00 -0.43 0.00 0.00 46.19 42.40 1b5h s LEU 297 CO 0.62 -0.70 0.61 -0.62 -0.29 0.00 0.00 176.35 175.96 1b5h s ASP 298 N 0.69 6.42 0.40 3.68 -1.08 -1.26 -4.94 116.67 120.56 1b5h s ASP 298 Ca 0.63 -2.16 0.06 0.00 -0.52 0.00 0.00 52.55 50.55 1b5h s ASP 298 Cb -0.41 -2.21 0.81 0.00 -1.46 0.00 0.00 42.92 39.65 1b5h s ASP 298 CO 0.37 -0.74 2.04 0.03 0.52 0.00 0.00 175.17 177.40 1b5h h ARG 299 N 8.43 0.61 -0.73 4.34 3.08 -1.92 -2.31 114.38 125.88 1b5h h ARG 299 Ca -0.13 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.88 1b5h h ARG 299 Cb 1.07 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 30.95 1b5h h ARG 299 CO 0.92 0.41 0.46 0.22 -1.07 0.00 0.00 179.97 180.91 1b5h h ASP 300 N 0.63 0.86 -0.03 7.04 3.58 -1.95 0.51 116.42 127.05 1b5h h ASP 300 Ca 0.18 -0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.58 1b5h h ASP 300 Cb -0.04 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 40.79 1b5h h ASP 300 CO -0.04 0.64 0.01 0.40 -2.88 0.00 0.00 179.24 177.37 1b5h h ILE 301 N 0.99 1.20 0.48 2.25 2.04 -1.83 -0.71 117.51 121.93 1b5h h ILE 301 Ca 0.26 -0.61 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1b5h h ILE 301 Cb -0.08 1.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1b5h h ILE 301 CO -0.05 0.16 -0.23 0.40 0.00 0.00 0.00 178.15 178.43 1b5h h ILE 302 N -0.19 0.53 0.15 -0.67 2.04 -1.32 0.58 117.51 118.63 1b5h h ILE 302 Ca 0.01 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1b5h h ILE 302 Cb 0.26 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1b5h h ILE 302 CO 0.00 0.00 -0.07 0.58 0.00 0.00 0.00 178.15 178.66 1b5h h VAL 303 N -0.65 0.99 0.00 1.67 2.07 -0.04 -0.40 116.25 119.89 1b5h h VAL 303 Ca -0.07 -0.79 -0.29 0.00 0.82 0.00 0.00 66.70 66.38 1b5h h VAL 303 Cb 0.50 1.46 -0.05 0.00 -1.52 0.00 0.00 31.29 31.68 1b5h h VAL 303 CO 0.11 0.18 -1.86 0.59 0.02 0.00 0.00 177.57 176.60 1b5h n ASN 304 N -5.01 0.61 -0.08 0.57 5.03 -0.28 -0.76 115.26 115.34 1b5h n ASN 304 Ca -0.09 0.29 -0.10 0.00 0.87 0.00 0.00 54.58 55.55 1b5h n ASN 304 Cb 0.24 0.31 -0.04 0.00 -1.02 0.00 0.00 39.78 39.26 1b5h n ASN 304 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1b5h n LYS 305 N -2.92 0.49 0.12 3.52 5.02 0.13 -4.09 118.16 120.43 1b5h n LYS 305 Ca -0.20 0.49 -0.24 0.00 -2.02 0.00 0.00 58.31 56.34 1b5h n LYS 305 Cb 1.04 -1.66 -0.15 0.00 -0.02 0.00 0.00 35.03 34.24 1b5h n LYS 305 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1b5h h VAL 306 N -1.00 1.30 0.00 -0.18 -1.51 0.10 -3.40 116.25 111.56 1b5h h VAL 306 Ca -0.11 -2.60 -0.19 0.00 -1.23 0.00 0.00 66.70 62.58 1b5h h VAL 306 Cb 0.79 2.93 -0.03 0.00 -2.13 0.00 0.00 31.29 32.84 1b5h h VAL 306 CO -0.06 0.78 -1.27 1.17 -1.23 0.00 0.00 177.57 176.96 1b5h n LYS 307 N -3.78 0.54 -4.05 5.19 4.81 -0.17 -4.97 118.16 115.73 1b5h n LYS 307 Ca -0.16 0.47 -0.43 0.00 -0.87 0.00 0.00 58.31 57.32 1b5h n LYS 307 Cb 1.04 -1.66 0.02 0.00 0.02 0.00 0.00 35.03 34.46 1b5h n LYS 307 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1b5h n ASN 308 N -4.45 -3.96 -0.00 3.14 2.85 0.06 -4.89 115.26 108.01 1b5h n ASN 308 Ca -0.28 -1.22 0.00 0.00 -0.11 0.00 0.00 54.58 52.97 1b5h n ASN 308 Cb 0.59 -1.50 0.00 0.00 1.24 0.00 0.00 39.78 40.11 1b5h n ASN 308 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1b5h n GLN 309 N -4.66 2.95 0.00 1.20 6.02 -1.26 -4.94 117.38 116.69 1b5h n GLN 309 Ca -0.13 -1.52 0.00 0.00 -0.01 0.00 0.00 57.00 55.34 1b5h n GLN 309 Cb 0.55 -1.01 0.00 0.00 1.02 0.00 0.00 30.24 30.80 1b5h n GLN 309 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b5h n GLY 310 N -0.52 0.72 3.76 1.08 0.00 -1.26 -4.95 105.19 104.02 1b5h n GLY 310 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1b5h n GLY 310 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1b5h s ASP 311 N -2.46 4.29 -0.10 1.61 1.01 -1.26 -4.74 116.67 115.01 1b5h s ASP 311 Ca 0.00 1.81 0.02 0.00 0.71 0.00 0.00 52.55 55.09 1b5h s ASP 311 Cb 0.00 -2.49 -0.02 0.00 1.01 0.00 0.00 42.92 41.42 1b5h s ASP 311 CO 0.00 -2.17 -0.15 -0.76 0.21 0.00 0.00 175.17 172.30 1b5h s LEU 312 N -6.00 2.62 0.19 1.23 1.02 -0.91 -4.92 118.68 111.91 1b5h s LEU 312 Ca 0.62 -0.33 -0.32 0.00 0.02 0.00 0.00 54.13 54.11 1b5h s LEU 312 Cb -0.18 -1.56 -0.15 0.00 0.02 0.00 0.00 46.19 44.32 1b5h s LEU 312 CO 0.56 0.21 1.26 -2.65 0.02 0.00 0.00 176.35 175.75 1b5h n PRO 313 N 3.19 1.46 -4.33 1.29 -0.02 -1.26 0.15 135.00 135.48 1b5h n PRO 313 Ca -0.18 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.49 1b5h n PRO 313 Cb 0.53 -2.08 -0.09 0.00 -0.02 0.00 0.00 33.50 31.83 1b5h n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b5h s ALA 314 N -0.09 3.24 0.00 3.55 0.00 -0.61 -4.71 121.76 123.15 1b5h s ALA 314 Ca 0.72 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.75 1b5h s ALA 314 Cb -0.79 -1.34 0.00 0.00 0.00 0.00 0.00 23.12 21.00 1b5h s ALA 314 CO 0.51 0.63 0.50 2.48 0.00 0.00 0.00 175.76 179.88 1b5h n TYR 315 N 1.55 0.00 -4.20 0.00 0.18 -1.26 -4.46 117.16 108.97 1b5h n TYR 315 Ca -0.15 -0.12 -0.17 0.00 1.88 0.00 0.00 57.90 59.33 1b5h n TYR 315 Cb 0.53 -0.01 -0.07 0.00 -0.38 0.00 0.00 39.34 39.41 1b5h n TYR 315 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1b5h s SER 316 N -0.25 1.25 -0.14 9.48 1.04 -1.26 -4.86 113.70 118.96 1b5h s SER 316 Ca 0.00 -1.62 -0.09 0.00 0.48 0.00 0.00 55.95 54.72 1b5h s SER 316 Cb 0.00 0.58 -0.03 0.00 0.10 0.00 0.00 66.02 66.67 1b5h s SER 316 CO 0.00 -1.13 -0.17 0.22 0.98 0.00 0.00 173.24 173.14 1b5h h TYR 317 N 2.17 0.00 -2.71 5.02 3.20 -1.98 -3.45 116.97 119.22 1b5h h TYR 317 Ca -0.27 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.07 1b5h h TYR 317 Cb 1.24 0.00 0.04 0.00 1.54 0.00 0.00 36.73 39.55 1b5h h TYR 317 CO 1.50 0.00 0.97 0.99 -1.64 0.00 0.00 178.16 179.98 1b5h s THR 318 N -2.18 2.54 0.33 1.81 2.01 -1.26 -4.71 115.64 114.17 1b5h s THR 318 Ca -0.14 0.28 -0.29 0.00 0.31 0.00 0.00 61.69 61.85 1b5h s THR 318 Cb 0.02 -3.18 -0.11 0.00 0.01 0.00 0.00 72.50 69.24 1b5h s THR 318 CO 0.21 0.01 1.41 -2.84 -0.69 0.00 0.00 174.62 172.72 1b5h s PRO 319 N 1.71 4.24 0.45 4.92 0.02 -1.26 -4.87 135.00 140.21 1b5h s PRO 319 Ca 0.74 2.37 0.31 0.00 0.02 0.00 0.00 61.00 64.44 1b5h s PRO 319 Cb -0.45 -3.04 1.52 0.00 0.02 0.00 0.00 34.50 32.55 1b5h s PRO 319 CO 0.32 -0.37 1.93 -1.00 -0.33 0.00 0.00 177.00 177.55 1b5h h PRO 320 N 3.69 0.00 -0.71 5.54 0.13 -1.94 -1.34 132.00 137.38 1b5h h PRO 320 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1b5h h PRO 320 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1b5h h PRO 320 CO 0.68 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.93 1b5h n TYR 321 N -2.64 0.96 -2.03 1.56 0.18 -1.26 -4.64 117.16 109.30 1b5h n TYR 321 Ca -0.01 -0.48 -0.39 0.00 1.88 0.00 0.00 57.90 58.91 1b5h n TYR 321 Cb 0.14 -0.01 0.00 0.00 -0.38 0.00 0.00 39.34 39.09 1b5h n TYR 321 CO 0.00 0.00 0.00 0.99 -2.08 0.00 0.00 176.86 175.77 1b5h s THR 322 N -1.08 2.57 -0.14 -3.48 2.01 -0.51 -4.88 115.64 110.12 1b5h s THR 322 Ca 0.47 0.49 -0.30 0.00 0.31 0.00 0.00 61.69 62.66 1b5h s THR 322 Cb 0.25 -3.28 -0.08 0.00 0.01 0.00 0.00 72.50 69.40 1b5h s THR 322 CO 0.32 0.06 2.10 -0.67 -0.69 0.00 0.00 174.62 175.73 1b5h n ASP 323 N -0.06 3.43 0.00 3.53 -0.08 -1.26 -1.53 116.55 120.58 1b5h n ASP 323 Ca 0.05 0.55 0.00 0.00 -1.51 0.00 0.00 54.79 53.87 1b5h n ASP 323 Cb 0.44 -1.49 0.00 0.00 2.34 0.00 0.00 41.12 42.41 1b5h n ASP 323 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1b5h n GLY 324 N 5.30 0.55 3.69 0.27 0.00 -1.26 -3.99 105.19 109.74 1b5h n GLY 324 Ca 0.27 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 1b5h n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5h s ALA 325 N -2.00 3.48 -0.44 4.61 0.00 -0.58 -4.65 121.76 122.17 1b5h s ALA 325 Ca 0.00 -0.17 0.08 0.00 0.00 0.00 0.00 51.96 51.86 1b5h s ALA 325 Cb 0.00 -2.85 0.26 0.00 0.00 0.00 0.00 23.12 20.53 1b5h s ALA 325 CO 0.00 -0.28 0.59 1.63 0.00 0.00 0.00 175.76 177.70 1b5h n LYS 326 N 4.33 1.14 -3.00 0.00 5.02 -1.26 -4.81 118.16 119.58 1b5h n LYS 326 Ca -0.03 -3.56 -0.32 0.00 -2.02 0.00 0.00 58.31 52.38 1b5h n LYS 326 Cb 0.51 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 33.99 1b5h n LYS 326 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1b5h s LEU 327 N -1.56 3.96 -0.30 -0.35 1.43 -1.26 -4.68 118.68 115.93 1b5h s LEU 327 Ca 0.37 1.27 -0.14 0.00 -1.03 0.00 0.00 54.13 54.59 1b5h s LEU 327 Cb 0.18 -4.10 -0.03 0.00 0.03 0.00 0.00 46.19 42.26 1b5h s LEU 327 CO -0.09 -0.29 0.35 -0.69 0.23 0.00 0.00 176.35 175.86 1b5h s VAL 328 N -2.14 5.19 -0.13 -1.59 1.01 -1.26 -5.04 120.40 116.43 1b5h s VAL 328 Ca 0.54 0.34 -0.29 0.00 0.00 0.00 0.00 61.98 62.57 1b5h s VAL 328 Cb -0.10 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1b5h s VAL 328 CO 0.22 0.08 1.50 -0.70 0.00 0.00 0.00 175.10 176.20 1b5h s GLU 329 N 2.02 4.13 0.72 2.72 2.12 -1.26 -4.97 118.70 124.18 1b5h s GLU 329 Ca 0.13 1.89 -0.14 0.00 0.36 0.00 0.00 54.97 57.21 1b5h s GLU 329 Cb -0.16 -3.91 0.03 0.00 0.26 0.00 0.00 34.13 30.35 1b5h s GLU 329 CO 0.11 -0.88 1.13 -1.25 -0.54 0.00 0.00 175.26 173.83 1b5h s PRO 330 N 3.96 2.36 0.33 4.30 0.04 -1.26 -4.95 135.00 139.78 1b5h s PRO 330 Ca 0.66 1.44 0.03 0.00 0.04 0.00 0.00 61.00 63.17 1b5h s PRO 330 Cb -0.27 -1.89 0.58 0.00 0.04 0.00 0.00 34.50 32.96 1b5h s PRO 330 CO 0.24 -1.60 1.91 0.93 0.04 0.00 0.00 177.00 178.52 1b5h h GLU 331 N -0.47 0.66 -0.46 4.56 4.39 -2.01 -2.64 114.58 118.60 1b5h h GLU 331 Ca -0.46 -0.11 0.10 0.00 0.34 0.00 0.00 59.36 59.24 1b5h h GLU 331 Cb 1.26 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.77 1b5h h GLU 331 CO 0.51 0.58 0.32 0.11 -1.16 0.00 0.00 179.01 179.38 1b5h h TRP 332 N 0.65 0.17 0.00 4.33 5.08 -1.98 -0.74 115.95 123.46 1b5h h TRP 332 Ca 0.15 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.07 1b5h h TRP 332 Cb 0.20 -0.06 -0.01 0.00 -3.00 0.00 0.00 29.16 26.30 1b5h h TRP 332 CO 0.01 0.08 -0.28 0.35 -1.28 0.00 0.00 178.44 177.33 1b5h h PHE 333 N 0.16 0.00 0.00 0.12 3.57 -1.85 -2.73 116.94 116.21 1b5h h PHE 333 Ca 0.22 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1b5h h PHE 333 Cb 0.65 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.39 1b5h h PHE 333 CO -0.00 0.28 -0.67 0.87 -2.23 0.00 0.00 178.31 176.55 1b5h h LYS 334 N 0.00 0.00 -7.19 1.11 1.57 -1.26 -3.47 116.57 107.32 1b5h h LYS 334 Ca -0.00 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 58.37 1b5h h LYS 334 Cb 0.67 0.00 0.20 0.00 0.08 0.00 0.00 32.23 33.18 1b5h h LYS 334 CO 0.04 0.00 0.01 -1.58 -0.57 0.00 0.00 179.45 177.35 1b5h s TRP 335 N -3.21 0.39 0.55 -1.35 0.51 -1.03 -5.02 118.94 109.77 1b5h s TRP 335 Ca 0.05 0.72 -0.08 0.00 -2.12 0.00 0.00 56.10 54.66 1b5h s TRP 335 Cb 0.12 -3.13 -0.04 0.00 -0.81 0.00 0.00 33.47 29.61 1b5h s TRP 335 CO 0.73 -4.24 0.91 -1.54 -0.51 0.00 0.00 176.95 172.30 1b5h s SER 336 N -3.26 6.26 0.34 2.95 1.04 -1.26 -4.94 113.70 114.83 1b5h s SER 336 Ca 0.69 1.18 0.06 0.00 0.48 0.00 0.00 55.95 58.37 1b5h s SER 336 Cb -0.15 -2.36 0.63 0.00 0.10 0.00 0.00 66.02 64.24 1b5h s SER 336 CO 0.59 -0.72 1.85 -0.61 0.98 0.00 0.00 173.24 175.34 1b5h h GLN 337 N -0.01 0.38 -0.33 4.02 5.75 -1.95 -2.05 115.11 120.92 1b5h h GLN 337 Ca -0.45 -0.10 0.05 0.00 -0.15 0.00 0.00 58.65 57.99 1b5h h GLN 337 Cb 1.20 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 29.66 1b5h h GLN 337 CO 0.62 0.51 0.07 0.37 -2.65 0.00 0.00 178.83 177.74 1b5h h GLN 338 N 0.36 0.18 -0.65 1.69 4.15 -1.98 0.51 115.11 119.36 1b5h h GLN 338 Ca 0.07 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.42 1b5h h GLN 338 Cb 0.44 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.06 1b5h h GLN 338 CO 0.03 0.12 0.19 -0.22 -1.93 0.00 0.00 178.83 177.01 1b5h h LYS 339 N 0.18 1.01 -0.60 1.69 3.64 -1.86 -0.68 116.57 119.96 1b5h h LYS 339 Ca 0.16 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1b5h h LYS 339 Cb 0.17 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 1b5h h LYS 339 CO -0.20 0.89 0.35 0.00 -2.27 0.00 0.00 179.45 178.22 1b5h h ARG 340 N 0.94 0.82 -0.30 1.90 3.08 -0.81 -2.52 114.38 117.48 1b5h h ARG 340 Ca 0.21 -0.08 0.02 0.00 0.07 0.00 0.00 59.98 60.20 1b5h h ARG 340 Cb 0.31 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 1b5h h ARG 340 CO -0.00 0.60 0.15 -0.91 -1.07 0.00 0.00 179.97 178.73 1b5h h ASN 341 N 0.81 0.21 -0.14 7.04 2.35 0.46 -1.37 115.58 124.94 1b5h h ASN 341 Ca 0.21 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1b5h h ASN 341 Cb -0.00 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1b5h h ASN 341 CO -0.04 0.16 0.09 -0.33 -1.65 0.00 0.00 177.43 175.66 1b5h h GLU 342 N 0.31 0.19 -0.78 0.81 4.39 -1.03 -0.70 114.58 117.76 1b5h h GLU 342 Ca 0.13 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.88 1b5h h GLU 342 Cb 0.05 -0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 28.60 1b5h h GLU 342 CO -0.09 0.16 0.45 1.49 -1.16 0.00 0.00 179.01 179.86 1b5h h GLU 343 N 0.16 0.78 0.40 2.33 4.57 -1.34 0.18 114.58 121.67 1b5h h GLU 343 Ca 0.05 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 1b5h h GLU 343 Cb 0.02 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.44 1b5h h GLU 343 CO -0.01 0.52 -0.19 0.00 -1.18 0.00 0.00 179.01 178.15 1b5h h ALA 344 N 1.40 -0.53 -0.64 2.92 0.00 -0.89 0.03 119.26 121.55 1b5h h ALA 344 Ca 0.36 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 55.22 1b5h h ALA 344 Cb 0.25 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1b5h h ALA 344 CO -0.20 -0.79 0.33 0.87 0.00 0.00 0.00 179.25 179.45 1b5h h LYS 345 N -0.54 0.57 -0.49 0.00 1.57 -0.81 -1.20 116.57 115.67 1b5h h LYS 345 Ca -0.05 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1b5h h LYS 345 Cb 0.41 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.54 1b5h h LYS 345 CO 0.09 0.38 0.18 -0.22 -0.57 0.00 0.00 179.45 179.31 1b5h h LYS 346 N 0.59 0.35 -0.62 3.15 3.64 -0.30 -0.05 116.57 123.33 1b5h h LYS 346 Ca 0.30 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.58 1b5h h LYS 346 Cb 0.25 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1b5h h LYS 346 CO -0.22 0.23 0.07 -0.07 -2.27 0.00 0.00 179.45 177.20 1b5h h LEU 347 N 0.36 0.99 -0.40 5.20 3.38 0.13 0.48 115.31 125.45 1b5h h LEU 347 Ca 0.23 -0.24 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 1b5h h LEU 347 Cb 0.23 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1b5h h LEU 347 CO -0.23 1.00 -0.53 -0.07 0.09 0.00 0.00 178.44 178.70 1b5h h LEU 348 N 0.96 0.84 -0.51 1.67 3.38 -1.06 0.21 115.31 120.80 1b5h h LEU 348 Ca 0.19 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1b5h h LEU 348 Cb 0.46 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1b5h h LEU 348 CO 0.02 1.20 0.26 0.00 0.09 0.00 0.00 178.44 180.01 1b5h h ALA 349 N 0.82 0.66 -0.95 1.53 0.00 -0.82 -1.05 119.26 119.45 1b5h h ALA 349 Ca 0.02 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1b5h h ALA 349 Cb 1.11 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 1b5h h ALA 349 CO 0.11 0.21 0.62 0.93 0.00 0.00 0.00 179.25 181.12 1b5h h GLU 350 N 0.68 1.15 0.00 0.00 5.08 -0.69 -2.13 114.58 118.68 1b5h h GLU 350 Ca 0.18 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1b5h h GLU 350 Cb 0.10 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1b5h h GLU 350 CO -0.02 0.76 0.00 0.00 -1.00 0.00 0.00 179.01 178.75 1b5h n ALA 351 N -2.39 2.31 0.00 3.43 0.00 0.72 -4.86 120.51 119.72 1b5h n ALA 351 Ca 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1b5h n ALA 351 Cb 0.10 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1b5h n ALA 351 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b5h n GLY 352 N 0.43 0.95 3.84 0.00 0.00 -0.80 -5.05 105.19 104.57 1b5h n GLY 352 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1b5h n GLY 352 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1b5h s PHE 353 N -2.00 3.67 0.25 1.61 0.40 -0.63 -4.98 117.98 116.30 1b5h s PHE 353 Ca 0.00 0.97 0.01 0.00 -0.60 0.00 0.00 56.93 57.31 1b5h s PHE 353 Cb 0.00 -2.28 -0.05 0.00 0.51 0.00 0.00 43.02 41.20 1b5h s PHE 353 CO 0.00 0.56 0.12 0.95 0.70 0.00 0.00 175.22 177.55 1b5h s THR 354 N -1.25 0.37 0.27 0.64 -4.23 -0.85 -4.33 115.64 106.26 1b5h s THR 354 Ca 0.30 -2.00 -0.02 0.00 -1.18 0.00 0.00 61.69 58.79 1b5h s THR 354 Cb -0.16 -2.58 0.27 0.00 1.34 0.00 0.00 72.50 71.37 1b5h s THR 354 CO 0.16 0.00 1.86 0.00 -0.54 0.00 0.00 174.62 176.11 1b5h h ALA 355 N 2.41 1.41 0.00 3.99 0.00 -1.98 -1.31 119.26 123.78 1b5h h ALA 355 Ca -0.37 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.37 1b5h h ALA 355 Cb 1.25 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1b5h h ALA 355 CO 0.57 0.36 -0.80 0.22 0.00 0.00 0.00 179.25 179.60 1b5h h ASP 356 N 1.10 0.01 -2.25 0.00 3.58 -2.01 -3.36 116.42 113.50 1b5h h ASP 356 Ca 0.45 -0.01 -0.59 0.00 0.42 0.00 0.00 57.03 57.30 1b5h h ASP 356 Cb 0.27 -0.00 -0.40 0.00 1.72 0.00 0.00 39.33 40.91 1b5h h ASP 356 CO -0.20 0.81 -0.82 0.29 -2.88 0.00 0.00 179.24 176.44 1b5h n LYS 357 N -3.59 1.55 -1.59 0.28 5.02 -0.72 -5.11 118.16 114.00 1b5h n LYS 357 Ca -0.01 -3.97 -0.29 0.00 -2.02 0.00 0.00 58.31 52.01 1b5h n LYS 357 Cb 0.77 -1.82 0.18 0.00 -0.02 0.00 0.00 35.03 34.13 1b5h n LYS 357 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1b5h s PRO 358 N -1.63 0.41 -0.28 1.97 0.04 -0.57 -2.01 135.00 132.92 1b5h s PRO 358 Ca 0.36 -0.06 -0.21 0.00 0.04 0.00 0.00 61.00 61.13 1b5h s PRO 358 Cb 0.12 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.86 1b5h s PRO 358 CO -0.09 -2.62 0.65 -1.17 0.04 0.00 0.00 177.00 173.81 1b5h s LEU 359 N -6.18 4.10 -0.07 -3.56 2.96 -1.26 -4.88 118.68 109.78 1b5h s LEU 359 Ca 0.69 0.58 0.01 0.00 -0.22 0.00 0.00 54.13 55.19 1b5h s LEU 359 Cb -0.09 -2.87 0.02 0.00 0.50 0.00 0.00 46.19 43.74 1b5h s LEU 359 CO 0.54 -0.45 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.13 1b5h s THR 360 N 2.62 0.97 0.30 3.68 2.01 -1.26 -1.23 115.64 122.73 1b5h s THR 360 Ca 0.27 -0.36 -0.14 0.00 0.31 0.00 0.00 61.69 61.78 1b5h s THR 360 Cb -0.15 -0.93 0.01 0.00 0.01 0.00 0.00 72.50 71.45 1b5h s THR 360 CO 0.10 0.33 0.60 0.72 -0.69 0.00 0.00 174.62 175.68 1b5h s PHE 361 N 0.94 0.30 0.26 4.92 -0.12 -0.76 -5.02 117.98 118.51 1b5h s PHE 361 Ca -0.10 -0.73 -0.03 0.00 -0.05 0.00 0.00 56.93 56.03 1b5h s PHE 361 Cb -0.15 0.40 -0.05 0.00 -0.63 0.00 0.00 43.02 42.59 1b5h s PHE 361 CO 0.01 -1.19 0.49 -0.51 -0.05 0.00 0.00 175.22 173.96 1b5h s ASP 362 N -3.04 6.41 -0.27 1.98 -0.00 -1.26 -0.90 116.67 119.59 1b5h s ASP 362 Ca 0.20 0.57 0.00 0.00 -0.00 0.00 0.00 52.55 53.32 1b5h s ASP 362 Cb -0.03 -2.08 0.08 0.00 -0.00 0.00 0.00 42.92 40.89 1b5h s ASP 362 CO 0.11 -0.14 0.02 -0.22 -0.00 0.00 0.00 175.17 174.93 1b5h s LEU 363 N -3.52 2.61 -0.04 1.23 2.96 0.54 -2.76 118.68 119.69 1b5h s LEU 363 Ca 0.41 -1.41 -0.16 0.00 -0.22 0.00 0.00 54.13 52.75 1b5h s LEU 363 Cb -0.11 -1.07 -0.05 0.00 0.50 0.00 0.00 46.19 45.46 1b5h s LEU 363 CO 0.30 -0.32 0.44 -0.22 -1.32 0.00 0.00 176.35 175.23 1b5h s LEU 364 N 1.45 4.40 0.05 -0.68 2.96 -0.12 -0.71 118.68 126.04 1b5h s LEU 364 Ca 0.02 0.92 -0.07 0.00 -0.22 0.00 0.00 54.13 54.78 1b5h s LEU 364 Cb -0.18 -2.64 -0.01 0.00 0.50 0.00 0.00 46.19 43.86 1b5h s LEU 364 CO -0.12 0.20 0.13 -0.72 -1.32 0.00 0.00 176.35 174.51 1b5h s TYR 365 N -0.42 0.19 0.08 5.38 -0.85 0.29 -0.81 117.35 121.20 1b5h s TYR 365 Ca 0.25 -0.52 -0.27 0.00 -0.52 0.00 0.00 57.07 56.01 1b5h s TYR 365 Cb -0.16 -0.12 -0.06 0.00 0.38 0.00 0.00 41.96 42.00 1b5h s TYR 365 CO 0.12 -0.42 0.83 0.54 -1.52 0.00 0.00 175.55 175.10 1b5h s ASN 366 N -2.36 7.32 -0.30 -0.18 4.22 -1.26 -0.99 114.94 121.39 1b5h s ASN 366 Ca -0.02 1.58 -0.38 0.00 -2.14 0.00 0.00 52.86 51.90 1b5h s ASN 366 Cb 0.01 -2.51 -0.17 0.00 1.28 0.00 0.00 41.25 39.86 1b5h s ASN 366 CO -0.06 0.00 1.23 0.41 -2.04 0.00 0.00 177.10 176.64 1b5h n THR 367 N 2.71 0.00 -3.65 0.54 -1.04 -0.44 -4.80 114.28 107.59 1b5h n THR 367 Ca -0.01 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.97 1b5h n THR 367 Cb 0.50 -0.30 -0.06 0.00 -1.82 0.00 0.00 70.33 68.65 1b5h n THR 367 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1b5h s SER 368 N 1.81 -0.04 0.08 8.00 0.15 -1.26 -4.79 113.70 117.65 1b5h s SER 368 Ca 0.86 0.07 -0.15 0.00 0.70 0.00 0.00 55.95 57.43 1b5h s SER 368 Cb -1.22 0.07 -0.12 0.00 -1.71 0.00 0.00 66.02 63.04 1b5h s SER 368 CO 0.64 -0.02 1.35 0.44 1.20 0.00 0.00 173.24 176.85 1b5h h ASP 369 N 2.76 0.74 -0.21 5.45 5.19 -1.92 -2.29 116.42 126.14 1b5h h ASP 369 Ca -0.21 -0.54 -0.00 0.00 -0.62 0.00 0.00 57.03 55.67 1b5h h ASP 369 Cb 1.19 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.48 1b5h h ASP 369 CO 0.20 1.13 0.13 0.25 -3.12 0.00 0.00 179.24 177.83 1b5h h LEU 370 N 0.37 0.25 -0.65 1.55 5.85 -1.90 -1.61 115.31 119.17 1b5h h LEU 370 Ca 0.01 -0.05 -0.15 0.00 0.84 0.00 0.00 57.88 58.54 1b5h h LEU 370 Cb 1.00 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 1b5h h LEU 370 CO 0.09 0.23 -0.59 0.45 -0.34 0.00 0.00 178.44 178.28 1b5h h HIS 371 N 0.26 0.34 -0.04 1.25 3.86 -1.87 -1.28 115.15 117.68 1b5h h HIS 371 Ca 0.08 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.15 1b5h h HIS 371 Cb 0.02 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 1b5h h HIS 371 CO -0.05 0.79 -0.00 -0.22 0.86 0.00 0.00 177.93 179.31 1b5h h LYS 372 N 0.20 0.07 -0.60 2.45 3.64 -1.30 0.90 116.57 121.92 1b5h h LYS 372 Ca -0.00 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.41 1b5h h LYS 372 Cb 1.09 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.86 1b5h h LYS 372 CO 0.09 0.38 0.31 0.87 -2.27 0.00 0.00 179.45 178.84 1b5h h LYS 373 N -0.25 0.57 -0.67 1.90 1.57 -1.06 -0.12 116.57 118.51 1b5h h LYS 373 Ca 0.01 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1b5h h LYS 373 Cb 0.35 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1b5h h LYS 373 CO 0.00 0.38 0.18 -0.07 -0.57 0.00 0.00 179.45 179.37 1b5h h LEU 374 N 0.59 1.01 -0.65 2.94 3.38 -1.19 -2.28 115.31 119.11 1b5h h LEU 374 Ca 0.27 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1b5h h LEU 374 Cb 0.19 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1b5h h LEU 374 CO -0.19 0.97 0.07 0.00 0.09 0.00 0.00 178.44 179.38 1b5h h ALA 375 N 1.07 0.86 -0.46 1.53 0.00 -0.27 0.59 119.26 122.59 1b5h h ALA 375 Ca 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1b5h h ALA 375 Cb 0.35 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1b5h h ALA 375 CO -0.00 0.66 0.24 0.82 0.00 0.00 0.00 179.25 180.97 1b5h h ILE 376 N 1.01 1.17 -0.63 0.00 2.04 -0.96 0.15 117.51 120.30 1b5h h ILE 376 Ca 0.19 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 1b5h h ILE 376 Cb 0.49 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1b5h h ILE 376 CO 0.02 0.19 0.32 0.00 0.00 0.00 0.00 178.15 178.67 1b5h h ALA 377 N 1.08 0.81 -0.51 1.87 0.00 -1.09 -1.48 119.26 119.94 1b5h h ALA 377 Ca 0.16 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1b5h h ALA 377 Cb 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1b5h h ALA 377 CO -0.02 0.35 -0.12 0.28 0.00 0.00 0.00 179.25 179.74 1b5h h VAL 378 N 0.86 1.27 -0.51 0.00 2.07 -0.77 -0.66 116.25 118.50 1b5h h VAL 378 Ca 0.22 -1.26 -0.01 0.00 0.82 0.00 0.00 66.70 66.47 1b5h h VAL 378 Cb 0.09 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1b5h h VAL 378 CO -0.03 0.44 0.28 0.00 0.02 0.00 0.00 177.57 178.29 1b5h h ALA 379 N 0.99 0.66 -0.39 1.67 0.00 -0.42 -0.71 119.26 121.07 1b5h h ALA 379 Ca 0.13 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1b5h h ALA 379 Cb 0.67 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1b5h h ALA 379 CO 0.05 0.18 -0.24 1.03 0.00 0.00 0.00 179.25 180.27 1b5h h SER 380 N 0.69 0.79 -0.24 0.00 0.87 -1.09 -0.40 113.55 114.17 1b5h h SER 380 Ca 0.18 -0.29 -0.03 0.00 -1.23 0.00 0.00 61.79 60.42 1b5h h SER 380 Cb 0.04 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 1b5h h SER 380 CO -0.03 1.00 0.02 0.40 -0.53 0.00 0.00 176.83 177.70 1b5h h ILE 381 N 0.68 1.24 -0.28 2.23 2.04 -0.94 0.66 117.51 123.14 1b5h h ILE 381 Ca 0.09 -0.82 -0.08 0.00 1.00 0.00 0.00 64.86 65.05 1b5h h ILE 381 Cb 0.76 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 1b5h h ILE 381 CO 0.06 0.26 -0.18 -0.50 0.00 0.00 0.00 178.15 177.79 1b5h h TRP 382 N 0.21 0.55 0.38 1.37 6.55 -1.06 0.46 115.95 124.41 1b5h h TRP 382 Ca 0.07 -0.10 -0.02 0.00 0.95 0.00 0.00 58.89 59.80 1b5h h TRP 382 Cb 0.36 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 28.52 1b5h h TRP 382 CO 0.03 0.65 -0.18 -0.22 -1.05 0.00 0.00 178.44 177.67 1b5h h LYS 383 N 0.45 -0.49 -0.73 0.49 1.63 -0.82 -0.53 116.57 116.57 1b5h h LYS 383 Ca 0.08 0.03 -0.06 0.00 -0.85 0.00 0.00 60.65 59.85 1b5h h LYS 383 Cb 0.58 0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 32.29 1b5h h LYS 383 CO 0.04 -0.19 0.20 -0.22 -3.45 0.00 0.00 179.45 175.83 1b5h h LYS 384 N -0.78 1.15 0.00 1.90 3.64 -0.68 -0.30 116.57 121.50 1b5h h LYS 384 Ca -0.05 -0.26 -0.28 0.00 -1.27 0.00 0.00 60.65 58.79 1b5h h LYS 384 Cb 0.52 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 1b5h h LYS 384 CO 0.09 0.99 -1.67 0.09 -2.27 0.00 0.00 179.45 176.68 1b5h n ASN 385 N -4.24 0.88 0.00 4.20 4.13 0.16 -4.62 115.26 115.77 1b5h n ASN 385 Ca 0.06 0.41 0.00 0.00 1.68 0.00 0.00 54.58 56.73 1b5h n ASN 385 Cb 0.25 -0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.44 1b5h n ASN 385 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1b5h n LEU 386 N -3.03 0.48 -1.48 3.41 7.94 -0.25 -4.80 117.00 119.28 1b5h n LEU 386 Ca -0.16 -0.53 -0.14 0.00 -1.11 0.00 0.00 56.01 54.07 1b5h n LEU 386 Cb 1.02 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.95 1b5h n LEU 386 CO 0.45 0.12 -0.17 0.61 -1.11 0.00 0.00 177.39 177.29 1b5h n GLY 387 N 0.10 0.26 3.86 -3.96 0.00 -0.12 -4.93 105.19 100.40 1b5h n GLY 387 Ca 0.00 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 1b5h n GLY 387 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b5h s VAL 388 N -2.66 5.18 -0.12 1.61 -7.23 -1.10 -4.48 120.40 111.60 1b5h s VAL 388 Ca 0.00 -0.29 -0.03 0.00 -1.81 0.00 0.00 61.98 59.86 1b5h s VAL 388 Cb 0.00 -3.42 -0.03 0.00 0.56 0.00 0.00 36.38 33.49 1b5h s VAL 388 CO 0.00 0.30 -0.02 0.20 -0.31 0.00 0.00 175.10 175.27 1b5h s ASN 389 N -1.96 4.99 0.01 4.85 0.01 -0.37 -3.38 114.94 119.08 1b5h s ASN 389 Ca 0.27 0.00 0.05 0.00 -0.71 0.00 0.00 52.86 52.47 1b5h s ASN 389 Cb -0.12 -1.58 -0.02 0.00 0.41 0.00 0.00 41.25 39.94 1b5h s ASN 389 CO 0.18 0.28 -0.16 -0.69 -1.51 0.00 0.00 177.10 175.20 1b5h s VAL 390 N -0.27 1.30 -0.28 1.60 1.01 -1.26 -1.82 120.40 120.68 1b5h s VAL 390 Ca 0.05 -0.82 -0.07 0.00 0.00 0.00 0.00 61.98 61.14 1b5h s VAL 390 Cb -0.12 -1.11 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 1b5h s VAL 390 CO 0.02 0.27 0.07 0.20 0.00 0.00 0.00 175.10 175.66 1b5h s ASN 391 N -0.64 5.07 0.26 3.32 0.02 -0.08 -4.94 114.94 117.95 1b5h s ASN 391 Ca 0.06 -0.54 -0.29 0.00 -1.02 0.00 0.00 52.86 51.06 1b5h s ASN 391 Cb -0.07 -1.88 -0.09 0.00 0.02 0.00 0.00 41.25 39.23 1b5h s ASN 391 CO 0.00 -0.14 1.00 -0.76 0.02 0.00 0.00 177.10 177.22 1b5h s LEU 392 N 1.53 4.58 -0.07 0.60 1.02 -1.26 -0.34 118.68 124.75 1b5h s LEU 392 Ca 0.04 2.05 -0.03 0.00 0.02 0.00 0.00 54.13 56.22 1b5h s LEU 392 Cb -0.16 -3.66 0.04 0.00 0.02 0.00 0.00 46.19 42.43 1b5h s LEU 392 CO 0.02 0.03 0.14 -1.61 0.02 0.00 0.00 176.35 174.95 1b5h s GLU 393 N -1.36 0.07 0.14 1.70 2.02 0.11 -4.88 118.70 116.50 1b5h s GLU 393 Ca 0.43 0.39 0.04 0.00 0.02 0.00 0.00 54.97 55.85 1b5h s GLU 393 Cb -0.27 -0.21 -0.04 0.00 0.10 0.00 0.00 34.13 33.71 1b5h s GLU 393 CO 0.34 -0.19 0.17 0.54 0.02 0.00 0.00 175.26 176.14 1b5h s ASN 394 N 1.38 5.78 -0.01 -0.19 4.22 -1.26 -0.55 114.94 124.31 1b5h s ASN 394 Ca -0.07 -0.01 -0.08 0.00 -2.14 0.00 0.00 52.86 50.56 1b5h s ASN 394 Cb -0.12 -1.60 0.01 0.00 1.28 0.00 0.00 41.25 40.82 1b5h s ASN 394 CO -0.06 0.09 0.17 -1.10 -2.04 0.00 0.00 177.10 174.16 1b5h s GLN 395 N -2.98 0.47 0.74 3.55 -0.21 -0.16 -4.86 119.66 116.20 1b5h s GLN 395 Ca 0.32 -0.28 -0.14 0.00 0.02 0.00 0.00 55.36 55.28 1b5h s GLN 395 Cb -0.11 0.20 0.04 0.00 1.00 0.00 0.00 33.01 34.14 1b5h s GLN 395 CO 0.25 -0.11 1.16 -1.21 -2.12 0.00 0.00 175.29 173.26 1b5h s GLU 396 N -1.17 2.21 0.16 2.91 0.41 -1.26 -1.33 118.70 120.62 1b5h s GLU 396 Ca -0.13 1.57 -0.30 0.00 -0.41 0.00 0.00 54.97 55.71 1b5h s GLU 396 Cb -0.06 -1.86 -0.04 0.00 -1.78 0.00 0.00 34.13 30.39 1b5h s GLU 396 CO 0.02 -1.74 1.55 2.35 -0.49 0.00 0.00 175.26 176.94 1b5h h TRP 397 N -0.47 -1.68 -0.57 1.61 -0.00 -1.91 -0.72 115.95 112.22 1b5h h TRP 397 Ca -0.46 0.11 0.04 0.00 -0.00 0.00 0.00 58.89 58.57 1b5h h TRP 397 Cb 1.27 0.84 -0.04 0.00 -0.00 0.00 0.00 29.16 31.22 1b5h h TRP 397 CO 0.51 -0.42 0.32 -0.22 -0.00 0.00 0.00 178.44 178.63 1b5h h LYS 398 N -0.15 0.60 -0.47 2.65 3.64 -1.92 -1.92 116.57 119.00 1b5h h LYS 398 Ca 0.15 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.45 1b5h h LYS 398 Cb 0.50 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1b5h h LYS 398 CO -0.81 0.40 0.10 1.15 -2.27 0.00 0.00 179.45 178.02 1b5h h THR 399 N 0.62 1.24 -0.57 1.00 2.02 -1.76 -2.57 112.91 112.89 1b5h h THR 399 Ca 0.24 -0.85 0.10 0.00 0.77 0.00 0.00 66.41 66.67 1b5h h THR 399 Cb 0.09 0.89 -0.08 0.00 -1.74 0.00 0.00 68.15 67.31 1b5h h THR 399 CO -0.14 0.30 0.13 0.15 0.37 0.00 0.00 175.52 176.34 1b5h h PHE 400 N 0.64 0.20 -0.53 3.16 3.57 -0.96 0.44 116.94 123.47 1b5h h PHE 400 Ca 0.15 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.58 1b5h h PHE 400 Cb 0.34 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 1b5h h PHE 400 CO 0.02 -0.01 -0.08 -0.07 -2.23 0.00 0.00 178.31 175.94 1b5h h LEU 401 N 0.26 0.96 -0.64 0.59 3.38 -1.25 -2.53 115.31 116.09 1b5h h LEU 401 Ca 0.29 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1b5h h LEU 401 Cb 0.42 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1b5h h LEU 401 CO -0.37 1.06 0.14 -0.78 0.09 0.00 0.00 178.44 178.57 1b5h h ASP 402 N 0.87 0.98 -0.44 -0.43 3.58 -1.00 -1.73 116.42 118.26 1b5h h ASP 402 Ca 0.14 -0.24 0.06 0.00 0.42 0.00 0.00 57.03 57.41 1b5h h ASP 402 Cb 0.62 -0.26 -0.05 0.00 1.72 0.00 0.00 39.33 41.36 1b5h h ASP 402 CO 0.04 0.98 0.14 0.74 -2.88 0.00 0.00 179.24 178.26 1b5h h THR 403 N 0.95 0.84 -0.46 2.25 2.02 -0.76 0.24 112.91 117.99 1b5h h THR 403 Ca 0.20 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 1b5h h THR 403 Cb 0.39 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1b5h h THR 403 CO 0.01 0.05 0.26 0.03 0.37 0.00 0.00 175.52 176.24 1b5h h ARG 404 N 0.30 0.64 -0.67 6.66 3.08 -1.21 -0.44 114.38 122.74 1b5h h ARG 404 Ca 0.21 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1b5h h ARG 404 Cb 0.21 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 1b5h h ARG 404 CO -0.22 0.49 0.33 0.45 -1.07 0.00 0.00 179.97 179.95 1b5h h HIS 405 N 0.61 0.93 0.00 3.04 3.86 -0.94 -2.31 115.15 120.34 1b5h h HIS 405 Ca 0.16 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.29 1b5h h HIS 405 Cb 0.03 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.20 1b5h h HIS 405 CO -0.02 0.68 -0.28 1.96 0.86 0.00 0.00 177.93 181.12 1b5h h GLN 406 N 0.95 0.00 -0.17 2.45 4.20 -0.33 -3.47 115.11 118.74 1b5h h GLN 406 Ca 0.23 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.92 1b5h h GLN 406 Cb 0.08 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 1b5h h GLN 406 CO -0.03 0.28 -0.03 0.41 -0.67 0.00 0.00 178.83 178.79 1b5h n GLY 407 N -0.39 0.35 2.70 3.46 0.00 -0.23 -4.94 105.19 106.14 1b5h n GLY 407 Ca -0.01 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 1b5h n GLY 407 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b5h n THR 408 N -3.75 5.12 -3.93 2.61 -2.24 -0.90 -4.89 114.28 106.31 1b5h n THR 408 Ca -0.02 -5.14 -0.09 0.00 -2.27 0.00 0.00 64.05 56.54 1b5h n THR 408 Cb 0.40 -1.52 -0.03 0.00 -2.10 0.00 0.00 70.33 67.09 1b5h n THR 408 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1b5h s PHE 409 N -3.77 0.18 0.00 4.78 -0.12 -1.26 -4.95 117.98 112.83 1b5h s PHE 409 Ca 0.46 -0.61 0.00 0.00 -0.05 0.00 0.00 56.93 56.72 1b5h s PHE 409 Cb 0.28 0.46 0.00 0.00 -0.63 0.00 0.00 43.02 43.12 1b5h s PHE 409 CO -0.22 -1.19 0.00 -0.25 -0.05 0.00 0.00 175.22 173.52 1b5h n ASP 410 N -0.66 0.00 -4.11 1.98 10.43 -1.26 -4.69 116.55 118.25 1b5h n ASP 410 Ca -0.03 0.00 -0.23 0.00 2.57 0.00 0.00 54.79 57.10 1b5h n ASP 410 Cb 0.60 -0.23 -0.15 0.00 1.84 0.00 0.00 41.12 43.19 1b5h n ASP 410 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1b5h s VAL 411 N -0.75 1.14 0.02 2.53 1.01 -1.11 -0.83 120.40 122.41 1b5h s VAL 411 Ca 0.00 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.41 1b5h s VAL 411 Cb 0.00 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 1b5h s VAL 411 CO 0.00 0.32 -0.10 0.00 0.00 0.00 0.00 175.10 175.33 1b5h s ALA 412 N -0.26 0.80 0.52 5.51 0.00 0.11 -0.94 121.76 127.49 1b5h s ALA 412 Ca 0.04 -0.60 -0.22 0.00 0.00 0.00 0.00 51.96 51.18 1b5h s ALA 412 Cb -0.06 -0.12 -0.06 0.00 0.00 0.00 0.00 23.12 22.88 1b5h s ALA 412 CO -0.00 0.14 1.31 0.50 0.00 0.00 0.00 175.76 177.70 1b5h s ARG 413 N -0.83 3.33 0.15 0.00 3.00 0.01 0.56 118.95 125.16 1b5h s ARG 413 Ca -0.01 2.12 -0.23 0.00 -1.00 0.00 0.00 55.73 56.61 1b5h s ARG 413 Cb -0.06 -2.32 0.07 0.00 0.00 0.00 0.00 34.95 32.64 1b5h s ARG 413 CO 0.00 -1.00 0.60 0.00 0.00 0.00 0.00 175.30 174.91 1b5h s ALA 414 N -1.36 -1.61 -0.12 6.12 0.00 0.23 -4.71 121.76 120.31 1b5h s ALA 414 Ca 0.69 0.54 -0.11 0.00 0.00 0.00 0.00 51.96 53.08 1b5h s ALA 414 Cb -0.37 0.83 0.03 0.00 0.00 0.00 0.00 23.12 23.61 1b5h s ALA 414 CO 0.45 -0.74 0.33 0.20 0.00 0.00 0.00 175.76 175.99 1b5h s GLY 415 N -2.65 -0.24 -0.07 0.00 0.00 -1.26 -1.06 107.32 102.04 1b5h s GLY 415 Ca 0.00 0.93 0.03 0.00 0.00 0.00 0.00 44.72 45.67 1b5h s GLY 415 CO -0.11 0.81 -0.14 0.86 0.00 0.00 0.00 173.10 174.51 1b5h s TRP 416 N 0.19 1.58 -0.02 1.90 -0.11 -0.75 -4.96 118.94 116.78 1b5h s TRP 416 Ca -0.00 -0.58 0.05 0.00 1.22 0.00 0.00 56.10 56.79 1b5h s TRP 416 Cb -0.02 -1.14 -0.03 0.00 -1.50 0.00 0.00 33.47 30.78 1b5h s TRP 416 CO 0.00 -0.28 -0.18 0.00 -4.62 0.00 0.00 176.95 171.87 1b5h n ALA 418 N 2.11 1.08 -0.04 0.00 0.00 -0.26 -4.92 120.51 118.49 1b5h n ALA 418 Ca -0.17 0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.41 1b5h n ALA 418 Cb 0.52 -2.27 -0.16 0.00 0.00 0.00 0.00 19.45 17.54 1b5h n ALA 418 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1b5h n ASP 419 N -0.90 0.15 -3.78 0.00 8.00 -1.26 -4.92 116.55 113.83 1b5h n ASP 419 Ca 0.12 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.49 1b5h n ASP 419 Cb 0.45 1.64 -0.09 0.00 -0.02 0.00 0.00 41.12 43.09 1b5h n ASP 419 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1b5h s TYR 420 N -3.14 -0.17 -1.20 1.24 -0.85 -1.26 -4.72 117.35 107.25 1b5h s TYR 420 Ca -0.08 0.31 -0.17 0.00 -0.52 0.00 0.00 57.07 56.60 1b5h s TYR 420 Cb 0.11 0.07 0.10 0.00 0.38 0.00 0.00 41.96 42.63 1b5h s TYR 420 CO 0.86 -0.32 1.55 1.21 -1.52 0.00 0.00 175.55 177.33 1b5h s ASN 421 N -1.01 6.84 -0.22 -0.18 3.84 -1.26 -4.63 114.94 118.32 1b5h s ASN 421 Ca -0.11 -2.44 -0.27 0.00 0.21 0.00 0.00 52.86 50.26 1b5h s ASN 421 Cb -0.05 -2.51 0.09 0.00 -0.55 0.00 0.00 41.25 38.24 1b5h s ASN 421 CO 0.03 -1.08 0.85 -0.70 -2.79 0.00 0.00 177.10 173.41 1b5h s GLU 422 N 3.38 0.73 0.51 0.43 -6.30 -1.26 -4.30 118.70 111.90 1b5h s GLU 422 Ca 0.48 0.63 0.27 0.00 -2.50 0.00 0.00 54.97 53.85 1b5h s GLU 422 Cb 0.01 0.35 1.37 0.00 0.00 0.00 0.00 34.13 35.86 1b5h s GLU 422 CO 0.01 -0.14 1.90 -1.35 0.02 0.00 0.00 175.26 175.71 1b5h h PRO 423 N 4.09 0.10 0.00 4.30 0.11 -1.89 -1.76 132.00 136.95 1b5h h PRO 423 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1b5h h PRO 423 Cb 1.16 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1b5h h PRO 423 CO 0.16 0.06 0.00 1.79 -0.21 0.00 0.00 178.00 179.80 1b5h h THR 424 N 0.10 0.00 0.00 -1.15 1.35 -1.95 -0.67 112.91 110.59 1b5h h THR 424 Ca 0.41 -0.40 -0.01 0.00 -0.55 0.00 0.00 66.41 65.85 1b5h h THR 424 Cb 1.46 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 69.24 1b5h h THR 424 CO -0.05 0.00 -0.05 -1.28 -0.25 0.00 0.00 175.52 173.90 1b5h h SER 425 N 0.00 0.00 0.00 5.36 0.87 -1.58 -0.71 113.55 117.50 1b5h h SER 425 Ca 0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.41 1b5h h SER 425 Cb 0.42 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.36 1b5h h SER 425 CO 0.00 0.05 -1.04 0.49 -0.53 0.00 0.00 176.83 175.79 1b5h n PHE 426 N -4.34 0.89 -0.05 2.24 3.01 -0.39 -4.63 117.46 114.20 1b5h n PHE 426 Ca -0.03 0.39 0.08 0.00 1.01 0.00 0.00 57.45 58.90 1b5h n PHE 426 Cb 0.13 -0.95 0.46 0.00 -0.01 0.00 0.00 39.48 39.11 1b5h n PHE 426 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1b5h h LEU 427 N -1.00 0.42 -2.05 4.37 3.38 -1.08 -2.08 115.31 117.28 1b5h h LEU 427 Ca -0.22 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1b5h h LEU 427 Cb 1.01 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1b5h h LEU 427 CO -0.14 0.28 -0.09 0.78 0.09 0.00 0.00 178.44 179.36 1b5h h ASN 428 N 0.49 0.00 0.92 -0.43 2.35 -1.39 -1.30 115.58 116.21 1b5h h ASN 428 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1b5h h ASN 428 Cb 0.26 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1b5h h ASN 428 CO -0.06 0.09 0.00 0.35 -1.65 0.00 0.00 177.43 176.16 1b5h n THR 429 N -3.65 0.63 0.15 2.81 -2.24 -0.78 -2.52 114.28 108.67 1b5h n THR 429 Ca -0.02 0.06 0.12 0.00 -2.27 0.00 0.00 64.05 61.93 1b5h n THR 429 Cb 0.20 -0.83 0.24 0.00 -2.10 0.00 0.00 70.33 67.84 1b5h n THR 429 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1b5h n MET 430 N -1.90 2.56 -2.01 -0.78 2.81 -0.49 -3.44 117.12 113.87 1b5h n MET 430 Ca 0.04 -2.38 -0.40 0.00 -1.81 0.00 0.00 57.70 53.15 1b5h n MET 430 Cb 0.29 -1.53 -0.01 0.00 -0.71 0.00 0.00 33.22 31.27 1b5h n MET 430 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1b5h s LEU 431 N -1.37 4.30 0.25 4.03 1.43 -1.05 -4.75 118.68 121.52 1b5h s LEU 431 Ca 0.41 2.76 -0.08 0.00 -1.03 0.00 0.00 54.13 56.19 1b5h s LEU 431 Cb 0.23 -3.77 0.41 0.00 0.03 0.00 0.00 46.19 43.09 1b5h s LEU 431 CO 0.32 -0.77 1.61 0.28 0.23 0.00 0.00 176.35 178.02 1b5h h SER 432 N 2.96 -0.56 -0.53 2.29 0.02 -1.88 -1.13 113.55 114.72 1b5h h SER 432 Ca -0.50 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1b5h h SER 432 Cb 1.24 0.43 0.00 0.00 0.14 0.00 0.00 62.40 64.21 1b5h h SER 432 CO 0.64 -0.24 0.00 -0.90 -1.14 0.00 0.00 176.83 175.19 1b5h n ASP 433 N -5.45 3.67 -4.74 3.07 5.75 -1.26 -4.89 116.55 112.70 1b5h n ASP 433 Ca 0.13 -2.27 -0.41 0.00 -0.01 0.00 0.00 54.79 52.23 1b5h n ASP 433 Cb 0.46 -0.48 -0.03 0.00 -1.03 0.00 0.00 41.12 40.04 1b5h n ASP 433 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1b5h s SER 434 N -0.85 6.90 0.60 -1.12 0.15 -0.43 -4.91 113.70 114.03 1b5h s SER 434 Ca 0.40 2.44 0.38 0.00 0.70 0.00 0.00 55.95 59.87 1b5h s SER 434 Cb 0.25 -2.62 1.82 0.00 -1.71 0.00 0.00 66.02 63.76 1b5h s SER 434 CO 0.21 -0.51 2.15 0.77 1.20 0.00 0.00 173.24 177.07 1b5h h SER 435 N 4.99 0.00 -0.19 5.45 4.64 -1.90 -2.23 113.55 124.31 1b5h h SER 435 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1b5h h SER 435 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1b5h h SER 435 CO 0.75 0.01 0.00 0.59 -0.87 0.00 0.00 176.83 177.31 1b5h n ASN 436 N -3.12 1.85 -4.54 4.97 4.13 -1.24 -4.79 115.26 112.53 1b5h n ASN 436 Ca -0.01 -1.74 -0.43 0.00 1.68 0.00 0.00 54.58 54.08 1b5h n ASN 436 Cb 0.20 -0.12 -0.01 0.00 -1.54 0.00 0.00 39.78 38.32 1b5h n ASN 436 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 1b5h s ASN 437 N -1.56 6.83 0.00 6.41 3.84 -0.84 -4.70 114.94 124.92 1b5h s ASN 437 Ca 0.33 -2.40 0.28 0.00 0.21 0.00 0.00 52.86 51.28 1b5h s ASN 437 Cb 0.18 -2.52 1.03 0.00 -0.55 0.00 0.00 41.25 39.39 1b5h s ASN 437 CO 0.27 -1.11 1.74 0.35 -2.79 0.00 0.00 177.10 175.56 1b5h n THR 438 N 5.95 0.00 0.47 -5.21 -2.24 -1.26 -2.87 114.28 109.12 1b5h n THR 438 Ca 0.41 -0.10 0.13 0.00 -2.27 0.00 0.00 64.05 62.23 1b5h n THR 438 Cb 0.46 0.13 0.36 0.00 -2.10 0.00 0.00 70.33 69.18 1b5h n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b5h h ALA 439 N 3.68 1.00 -4.29 6.98 0.00 -1.84 -3.46 119.26 121.33 1b5h h ALA 439 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.50 1b5h h ALA 439 Cb 0.42 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.26 1b5h h ALA 439 CO 0.00 0.00 -0.60 0.72 0.00 0.00 0.00 179.25 179.37 1b5h n HIS 440 N -2.54 -1.83 -2.98 0.00 8.25 -1.14 -0.97 115.22 114.00 1b5h n HIS 440 Ca 0.05 0.44 -0.40 0.00 -0.26 0.00 0.00 57.72 57.55 1b5h n HIS 440 Cb 0.43 -4.39 -0.04 0.00 1.12 0.00 0.00 29.99 27.11 1b5h n HIS 440 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1b5h s TYR 441 N -3.15 3.61 -0.25 4.41 5.04 -1.26 -4.10 117.35 121.64 1b5h s TYR 441 Ca 0.26 1.35 -0.03 0.00 -2.44 0.00 0.00 57.07 56.21 1b5h s TYR 441 Cb -0.12 -2.86 0.08 0.00 0.35 0.00 0.00 41.96 39.42 1b5h s TYR 441 CO 0.32 0.10 0.09 0.15 -1.34 0.00 0.00 175.55 174.87 1b5h s LYS 442 N 0.73 0.44 -0.17 4.97 1.02 -1.26 -4.14 119.74 121.33 1b5h s LYS 442 Ca 0.40 -0.56 -0.01 0.00 0.02 0.00 0.00 55.97 55.81 1b5h s LYS 442 Cb -0.19 -1.76 0.05 0.00 -0.52 0.00 0.00 37.83 35.41 1b5h s LYS 442 CO 0.20 -0.84 -0.01 0.45 -0.92 0.00 0.00 175.35 174.23 1b5h s SER 443 N 1.91 2.81 0.27 2.83 0.15 -1.26 -5.01 113.70 115.41 1b5h s SER 443 Ca 0.05 -0.71 -0.02 0.00 0.70 0.00 0.00 55.95 55.97 1b5h s SER 443 Cb -0.17 -0.75 0.37 0.00 -1.71 0.00 0.00 66.02 63.76 1b5h s SER 443 CO -0.21 -0.24 1.84 -0.65 1.20 0.00 0.00 173.24 175.18 1b5h h PRO 444 N 8.18 0.94 -0.10 5.44 0.11 -1.99 0.24 132.00 144.82 1b5h h PRO 444 Ca -0.20 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 65.75 1b5h h PRO 444 Cb 1.11 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 1b5h h PRO 444 CO 0.36 0.78 0.06 0.00 -0.21 0.00 0.00 178.00 178.99 1b5h h ALA 445 N 1.34 0.13 -0.38 -0.75 0.00 -1.99 -0.28 119.26 117.34 1b5h h ALA 445 Ca 0.21 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1b5h h ALA 445 Cb 0.20 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1b5h h ALA 445 CO -0.02 -0.35 0.18 0.35 0.00 0.00 0.00 179.25 179.41 1b5h h PHE 446 N 0.10 0.54 -0.73 0.00 3.57 -1.81 -2.28 116.94 116.32 1b5h h PHE 446 Ca 0.04 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.54 1b5h h PHE 446 Cb 0.04 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 1b5h h PHE 446 CO -0.05 0.46 0.46 -0.44 -2.23 0.00 0.00 178.31 176.50 1b5h h ASP 447 N 0.47 0.76 -0.40 0.41 3.32 -0.07 -2.60 116.42 118.30 1b5h h ASP 447 Ca 0.13 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1b5h h ASP 447 Cb 0.12 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 1b5h h ASP 447 CO -0.02 0.52 0.21 0.50 -1.72 0.00 0.00 179.24 178.73 1b5h h LYS 448 N 0.90 0.57 -0.57 3.56 1.63 -0.95 -0.65 116.57 121.06 1b5h h LYS 448 Ca 0.30 -0.07 0.08 0.00 -0.85 0.00 0.00 60.65 60.10 1b5h h LYS 448 Cb 0.03 -0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 31.49 1b5h h LYS 448 CO -0.11 0.47 0.22 -0.07 -3.45 0.00 0.00 179.45 176.51 1b5h h LEU 449 N 0.52 0.24 -0.58 5.20 3.38 -1.03 -1.32 115.31 121.72 1b5h h LEU 449 Ca 0.14 0.06 -0.15 0.00 0.09 0.00 0.00 57.88 58.02 1b5h h LEU 449 Cb 0.08 0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1b5h h LEU 449 CO -0.02 0.16 -0.54 0.40 0.09 0.00 0.00 178.44 178.52 1b5h h ILE 450 N 0.42 1.33 -0.88 1.22 1.08 -1.36 -3.03 117.51 116.29 1b5h h ILE 450 Ca 0.28 -1.80 -0.01 0.00 -0.39 0.00 0.00 64.86 62.93 1b5h h ILE 450 Cb 0.30 1.80 -0.04 0.00 -3.07 0.00 0.00 36.82 35.81 1b5h h ILE 450 CO -0.26 0.55 0.51 0.00 -0.69 0.00 0.00 178.15 178.26 1b5h h ALA 451 N 1.05 1.24 0.00 1.87 0.00 -0.65 -1.60 119.26 121.16 1b5h h ALA 451 Ca 0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1b5h h ALA 451 Cb 1.07 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1b5h h ALA 451 CO 0.10 0.64 -0.13 -0.44 0.00 0.00 0.00 179.25 179.41 1b5h h ASP 452 N 1.23 0.00 -0.08 0.00 3.32 -1.14 -3.17 116.42 116.58 1b5h h ASP 452 Ca 0.32 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.39 1b5h h ASP 452 Cb -0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1b5h h ASP 452 CO -0.06 0.13 0.07 0.71 -1.72 0.00 0.00 179.24 178.37 1b5h h THR 453 N 0.00 0.86 -0.27 0.35 1.35 -1.19 -1.43 112.91 112.58 1b5h h THR 453 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1b5h h THR 453 Cb 0.34 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.72 1b5h h THR 453 CO 0.02 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 175.47 1b5h n LEU 454 N -4.37 3.31 -0.22 3.87 4.77 -1.20 -4.07 117.00 119.10 1b5h n LEU 454 Ca -0.01 -1.33 0.12 0.00 -0.03 0.00 0.00 56.01 54.76 1b5h n LEU 454 Cb 0.17 -0.17 0.25 0.00 -2.33 0.00 0.00 43.42 41.35 1b5h n LEU 454 CO 0.33 0.66 0.51 0.29 -1.33 0.00 0.00 177.39 177.85 1b5h n LYS 455 N 1.45 0.68 -4.21 3.23 5.02 -0.54 -4.71 118.16 119.07 1b5h n LYS 455 Ca 0.18 -0.45 -0.23 0.00 -2.02 0.00 0.00 58.31 55.79 1b5h n LYS 455 Cb 0.61 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 34.06 1b5h n LYS 455 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1b5h s VAL 456 N -2.63 3.86 -0.29 -0.18 -7.23 -1.19 -5.04 120.40 107.70 1b5h s VAL 456 Ca 0.20 -1.64 0.11 0.00 -1.81 0.00 0.00 61.98 58.83 1b5h s VAL 456 Cb 0.18 -3.05 0.47 0.00 0.56 0.00 0.00 36.38 34.54 1b5h s VAL 456 CO 0.59 -0.32 1.16 0.00 -0.31 0.00 0.00 175.10 176.22 1b5h n ALA 457 N -0.86 4.44 -3.73 1.32 0.00 -1.26 -4.99 120.51 115.44 1b5h n ALA 457 Ca -0.07 -3.57 -0.24 0.00 0.00 0.00 0.00 53.44 49.56 1b5h n ALA 457 Cb 0.58 -0.47 -0.17 0.00 0.00 0.00 0.00 19.45 19.39 1b5h n ALA 457 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1b5h s ASP 458 N -3.64 1.64 0.25 0.00 3.68 -1.26 -5.05 116.67 112.30 1b5h s ASP 458 Ca 0.45 -0.20 -0.05 0.00 2.13 0.00 0.00 52.55 54.89 1b5h s ASP 458 Cb 0.39 -0.63 0.29 0.00 -1.45 0.00 0.00 42.92 41.52 1b5h s ASP 458 CO 0.01 -0.10 1.83 0.44 0.13 0.00 0.00 175.17 177.48 1b5h h ASP 459 N 7.77 0.98 -0.13 -0.34 3.32 -1.98 -1.42 116.42 124.61 1b5h h ASP 459 Ca -0.29 -0.13 -0.19 0.00 0.02 0.00 0.00 57.03 56.43 1b5h h ASP 459 Cb 1.14 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.44 1b5h h ASP 459 CO 0.40 0.86 -0.61 0.74 -1.72 0.00 0.00 179.24 178.90 1b5h h THR 460 N 1.05 1.29 -0.58 0.35 2.02 -1.98 -1.12 112.91 113.94 1b5h h THR 460 Ca 0.25 -1.83 -0.09 0.00 0.77 0.00 0.00 66.41 65.50 1b5h h THR 460 Cb 0.18 1.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 1b5h h THR 460 CO -0.02 0.58 0.00 1.56 0.37 0.00 0.00 175.52 178.01 1b5h h GLN 461 N 0.55 1.00 -0.40 6.66 4.20 -1.97 0.59 115.11 125.74 1b5h h GLN 461 Ca -0.01 -0.30 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 1b5h h GLN 461 Cb 1.21 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.87 1b5h h GLN 461 CO 0.13 0.98 0.21 -0.09 -0.67 0.00 0.00 178.83 179.39 1b5h h ARG 462 N 0.92 0.56 -0.46 1.46 2.43 -1.13 -0.95 114.38 117.21 1b5h h ARG 462 Ca 0.17 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.22 1b5h h ARG 462 Cb 0.53 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1b5h h ARG 462 CO 0.03 0.47 0.08 0.77 -1.51 0.00 0.00 179.97 179.81 1b5h h SER 463 N 0.51 0.66 -0.42 -3.80 0.02 -0.81 -1.02 113.55 108.68 1b5h h SER 463 Ca 0.14 -0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 60.88 1b5h h SER 463 Cb 0.08 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1b5h h SER 463 CO -0.02 0.67 -0.05 -0.33 -1.14 0.00 0.00 176.83 175.96 1b5h h GLU 464 N 0.68 0.85 -0.50 3.45 5.08 -0.68 -1.33 114.58 122.13 1b5h h GLU 464 Ca 0.15 -0.26 -0.12 0.00 -1.00 0.00 0.00 59.36 58.12 1b5h h GLU 464 Cb 0.30 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1b5h h GLU 464 CO 0.00 0.89 -0.17 -0.07 -1.00 0.00 0.00 179.01 178.66 1b5h h LEU 465 N 0.78 1.00 -0.51 1.33 3.38 -0.64 -0.37 115.31 120.27 1b5h h LEU 465 Ca 0.14 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1b5h h LEU 465 Cb 0.54 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1b5h h LEU 465 CO 0.03 1.14 0.23 1.88 0.09 0.00 0.00 178.44 181.81 1b5h h TYR 466 N 0.86 0.76 -0.43 1.13 0.99 -0.99 0.12 116.97 119.41 1b5h h TYR 466 Ca 0.12 -0.05 0.05 0.00 2.00 0.00 0.00 58.73 60.85 1b5h h TYR 466 Cb 0.73 -0.23 -0.04 0.00 1.00 0.00 0.00 36.73 38.19 1b5h h TYR 466 CO 0.05 0.61 0.18 0.00 -0.00 0.00 0.00 178.16 178.99 1b5h h ALA 467 N 1.07 0.52 -0.56 3.88 0.00 -1.03 -0.11 119.26 123.04 1b5h h ALA 467 Ca 0.17 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1b5h h ALA 467 Cb 0.15 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1b5h h ALA 467 CO -0.02 -0.20 0.14 0.87 0.00 0.00 0.00 179.25 180.04 1b5h h LYS 468 N 0.36 0.86 -0.71 0.00 1.57 -0.72 -1.15 116.57 116.78 1b5h h LYS 468 Ca 0.19 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1b5h h LYS 468 Cb 0.15 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 1b5h h LYS 468 CO -0.17 0.77 0.33 0.00 -0.57 0.00 0.00 179.45 179.81 1b5h h ALA 469 N 1.33 0.92 -0.72 3.86 0.00 -0.36 0.19 119.26 124.47 1b5h h ALA 469 Ca 0.18 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1b5h h ALA 469 Cb 0.29 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1b5h h ALA 469 CO -0.00 0.50 0.23 0.93 0.00 0.00 0.00 179.25 180.91 1b5h h GLU 470 N 1.00 1.11 -0.54 0.00 4.39 -0.56 -0.94 114.58 119.04 1b5h h GLU 470 Ca 0.24 -0.23 -0.06 0.00 0.34 0.00 0.00 59.36 59.66 1b5h h GLU 470 Cb 0.14 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1b5h h GLU 470 CO -0.03 0.94 0.11 1.96 -1.16 0.00 0.00 179.01 180.83 1b5h h GLN 471 N 1.07 0.84 -0.35 2.33 4.20 -0.71 -0.48 115.11 122.01 1b5h h GLN 471 Ca 0.23 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 1b5h h GLN 471 Cb 0.29 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 1b5h h GLN 471 CO -0.01 0.77 0.14 0.37 -0.67 0.00 0.00 178.83 179.43 1b5h h GLN 472 N 0.80 0.52 -0.34 1.46 5.75 0.04 0.37 115.11 123.72 1b5h h GLN 472 Ca 0.17 -0.09 0.04 0.00 -0.15 0.00 0.00 58.65 58.62 1b5h h GLN 472 Cb 0.33 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 28.75 1b5h h GLN 472 CO 0.00 0.51 0.09 1.25 -2.65 0.00 0.00 178.83 178.03 1b5h h LEU 473 N 0.42 0.06 -0.35 -2.39 5.85 -0.87 -1.63 115.31 116.39 1b5h h LEU 473 Ca 0.12 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 1b5h h LEU 473 Cb 0.18 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1b5h h LEU 473 CO -0.01 0.07 0.12 -0.78 -0.34 0.00 0.00 178.44 177.50 1b5h h ASP 474 N 0.21 0.50 -1.00 1.25 3.58 -0.94 -0.78 116.42 119.25 1b5h h ASP 474 Ca 0.16 -0.19 0.10 0.00 0.42 0.00 0.00 57.03 57.51 1b5h h ASP 474 Cb 0.16 -0.13 -0.08 0.00 1.72 0.00 0.00 39.33 41.00 1b5h h ASP 474 CO -0.19 0.55 0.64 0.50 -2.88 0.00 0.00 179.24 177.86 1b5h h LYS 475 N 0.42 1.04 -0.00 0.28 3.64 -0.72 0.09 116.57 121.31 1b5h h LYS 475 Ca 0.11 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1b5h h LYS 475 Cb 0.22 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1b5h h LYS 475 CO -0.01 0.68 -0.20 -0.25 -2.27 0.00 0.00 179.45 177.41 1b5h n ASP 476 N -4.57 0.31 -3.87 4.20 10.43 -0.63 -4.94 116.55 117.46 1b5h n ASP 476 Ca 0.17 -0.07 -0.25 0.00 2.57 0.00 0.00 54.79 57.22 1b5h n ASP 476 Cb 0.28 -0.13 -0.00 0.00 1.84 0.00 0.00 41.12 43.11 1b5h n ASP 476 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1b5h n SER 477 N -1.34 -1.04 -0.30 -2.24 7.64 0.02 -4.84 113.62 111.52 1b5h n SER 477 Ca 0.09 -0.97 -0.03 0.00 1.01 0.00 0.00 58.87 58.96 1b5h n SER 477 Cb 0.32 -3.28 0.08 0.00 -1.01 0.00 0.00 64.21 60.33 1b5h n SER 477 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b5h h ALA 478 N 0.84 1.05 -1.85 -0.43 0.00 -1.75 -3.43 119.26 113.69 1b5h h ALA 478 Ca -0.63 -0.05 -0.55 0.00 0.00 0.00 0.00 54.91 53.68 1b5h h ALA 478 Cb 1.37 -0.31 -0.13 0.00 0.00 0.00 0.00 17.79 18.71 1b5h h ALA 478 CO 0.59 0.41 -0.50 0.96 0.00 0.00 0.00 179.25 180.72 1b5h s ILE 479 N -6.12 0.43 -0.47 0.00 -4.36 -1.26 -3.95 121.20 105.47 1b5h s ILE 479 Ca -0.13 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.27 1b5h s ILE 479 Cb 0.16 -2.34 0.12 0.00 1.25 0.00 0.00 42.46 41.66 1b5h s ILE 479 CO 0.79 0.00 0.23 -0.69 0.24 0.00 0.00 174.94 175.51 1b5h s VAL 480 N -3.23 2.95 0.29 8.37 1.01 -0.27 -4.88 120.40 124.64 1b5h s VAL 480 Ca 0.26 -2.66 -0.30 0.00 0.00 0.00 0.00 61.98 59.29 1b5h s VAL 480 Cb 0.02 -3.03 -0.11 0.00 0.00 0.00 0.00 36.38 33.26 1b5h s VAL 480 CO 0.17 -0.74 1.55 -2.84 0.00 0.00 0.00 175.10 173.25 1b5h s PRO 481 N 0.45 4.15 0.01 2.72 0.02 -1.26 0.09 135.00 141.18 1b5h s PRO 481 Ca 0.13 2.52 -0.04 0.00 0.02 0.00 0.00 61.00 63.63 1b5h s PRO 481 Cb -0.22 -3.04 -0.01 0.00 0.02 0.00 0.00 34.50 31.25 1b5h s PRO 481 CO -0.04 -0.58 -0.07 0.28 -0.33 0.00 0.00 177.00 176.26 1b5h n VAL 482 N 2.10 0.87 -3.68 3.83 0.31 0.45 -4.71 118.33 117.49 1b5h n VAL 482 Ca 0.07 0.27 -0.10 0.00 -0.01 0.00 0.00 64.34 64.57 1b5h n VAL 482 Cb 0.38 -1.59 -0.05 0.00 -0.91 0.00 0.00 33.84 31.67 1b5h n VAL 482 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1b5h s TYR 483 N -1.84 -0.13 -0.12 3.52 -0.85 -0.94 -1.57 117.35 115.41 1b5h s TYR 483 Ca -0.06 -0.20 -0.15 0.00 -0.52 0.00 0.00 57.07 56.15 1b5h s TYR 483 Cb 0.01 0.25 -0.05 0.00 0.38 0.00 0.00 41.96 42.55 1b5h s TYR 483 CO 0.09 -0.74 0.35 0.71 -1.52 0.00 0.00 175.55 174.44 1b5h s TYR 484 N -3.83 3.52 0.67 -3.49 1.51 0.12 -0.41 117.35 115.44 1b5h s TYR 484 Ca 0.05 0.73 -0.13 0.00 -1.01 0.00 0.00 57.07 56.71 1b5h s TYR 484 Cb 0.01 -2.37 0.00 0.00 -0.11 0.00 0.00 41.96 39.50 1b5h s TYR 484 CO -0.09 0.30 1.08 0.71 -1.11 0.00 0.00 175.55 176.44 1b5h s TYR 485 N 0.21 2.87 0.15 2.71 1.51 -0.50 -2.15 117.35 122.15 1b5h s TYR 485 Ca 0.20 1.50 0.06 0.00 -1.01 0.00 0.00 57.07 57.82 1b5h s TYR 485 Cb -0.14 -3.01 -0.04 0.00 -0.11 0.00 0.00 41.96 38.66 1b5h s TYR 485 CO 0.07 -1.40 0.05 0.14 -1.11 0.00 0.00 175.55 173.30 1b5h s VAL 486 N -2.69 4.09 -0.87 0.71 -7.23 -1.26 -3.88 120.40 109.26 1b5h s VAL 486 Ca 0.62 -1.19 -0.18 0.00 -1.81 0.00 0.00 61.98 59.42 1b5h s VAL 486 Cb -0.17 -3.04 0.14 0.00 0.56 0.00 0.00 36.38 33.87 1b5h s VAL 486 CO 0.47 -0.05 1.03 0.21 -0.31 0.00 0.00 175.10 176.45 1b5h s ASN 487 N -2.85 6.58 -0.24 4.85 2.47 0.12 -4.89 114.94 120.98 1b5h s ASN 487 Ca 0.28 -2.00 -0.07 0.00 0.42 0.00 0.00 52.86 51.49 1b5h s ASN 487 Cb -0.10 -2.37 -0.03 0.00 -1.45 0.00 0.00 41.25 37.30 1b5h s ASN 487 CO 0.20 -1.03 0.06 0.00 -3.72 0.00 0.00 177.10 172.62 1b5h s ALA 488 N 2.45 3.17 0.22 1.71 0.00 -1.26 -2.14 121.76 125.92 1b5h s ALA 488 Ca 0.28 -1.08 -0.16 0.00 0.00 0.00 0.00 51.96 51.01 1b5h s ALA 488 Cb -0.08 -2.04 0.01 0.00 0.00 0.00 0.00 23.12 21.02 1b5h s ALA 488 CO -0.07 -0.39 0.51 -0.98 0.00 0.00 0.00 175.76 174.83 1b5h s ARG 489 N 1.44 1.47 -0.09 0.00 1.70 -0.83 -3.94 118.95 118.70 1b5h s ARG 489 Ca 0.05 -1.04 -0.04 0.00 -0.47 0.00 0.00 55.73 54.24 1b5h s ARG 489 Cb -0.15 0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 34.70 1b5h s ARG 489 CO 0.03 -0.62 0.07 -0.51 -1.08 0.00 0.00 175.30 173.19 1b5h s LEU 490 N -2.94 3.96 -0.04 -1.89 1.43 -1.26 -0.76 118.68 117.19 1b5h s LEU 490 Ca 0.15 0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.52 1b5h s LEU 490 Cb -0.01 -1.96 0.03 0.00 0.03 0.00 0.00 46.19 44.27 1b5h s LEU 490 CO 0.03 0.38 0.03 -0.69 0.23 0.00 0.00 176.35 176.33 1b5h s VAL 491 N -0.97 0.04 0.70 -1.59 1.01 -0.54 -1.46 120.40 117.59 1b5h s VAL 491 Ca 0.15 0.27 -0.16 0.00 0.00 0.00 0.00 61.98 62.24 1b5h s VAL 491 Cb -0.12 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.07 1b5h s VAL 491 CO 0.04 0.17 1.20 -0.54 0.00 0.00 0.00 175.10 175.97 1b5h s LYS 492 N 1.69 2.32 0.59 2.72 -0.14 -0.70 -4.60 119.74 121.63 1b5h s LYS 492 Ca -0.01 1.75 0.37 0.00 -1.36 0.00 0.00 55.97 56.72 1b5h s LYS 492 Cb -0.13 -1.86 1.84 0.00 -1.68 0.00 0.00 37.83 36.01 1b5h s LYS 492 CO -0.03 -1.69 2.18 -1.35 -0.76 0.00 0.00 175.35 173.69 1b5h h PRO 493 N -0.07 0.00 -0.01 -1.68 0.11 -1.92 -1.76 132.00 126.66 1b5h h PRO 493 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1b5h h PRO 493 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1b5h h PRO 493 CO 0.51 0.03 -0.02 -2.67 -0.21 0.00 0.00 178.00 175.64 1b5h n TRP 494 N -3.25 0.00 -2.95 0.65 2.14 -1.26 -4.74 117.44 108.03 1b5h n TRP 494 Ca -0.02 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.12 1b5h n TRP 494 Cb 0.19 -0.01 -0.05 0.00 -0.81 0.00 0.00 31.31 30.62 1b5h n TRP 494 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1b5h s VAL 495 N -2.05 4.62 0.35 -1.67 1.01 -0.66 -0.09 120.40 121.91 1b5h s VAL 495 Ca 0.38 0.42 0.01 0.00 0.00 0.00 0.00 61.98 62.78 1b5h s VAL 495 Cb 0.21 -4.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1b5h s VAL 495 CO 0.36 -0.76 0.55 -0.83 0.00 0.00 0.00 175.10 174.42 1b5h s GLY 496 N 2.20 1.34 0.00 4.51 0.00 0.14 -4.60 107.32 110.90 1b5h s GLY 496 Ca 0.30 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 44.11 1b5h s GLY 496 CO 0.23 -0.85 0.00 0.61 0.00 0.00 0.00 173.10 173.08 1b5h n GLY 497 N -1.79 0.13 3.36 0.20 0.00 -1.26 -1.64 105.19 104.19 1b5h n GLY 497 Ca -0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.52 1b5h n GLY 497 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b5h s TYR 498 N -2.04 3.19 0.06 1.61 6.14 -1.26 -4.79 117.35 120.26 1b5h s TYR 498 Ca 0.00 -1.02 -0.15 0.00 0.64 0.00 0.00 57.07 56.54 1b5h s TYR 498 Cb 0.00 -3.58 -0.25 0.00 0.42 0.00 0.00 41.96 38.55 1b5h s TYR 498 CO 0.00 -0.98 1.15 1.79 0.64 0.00 0.00 175.55 178.15 1b5h h THR 499 N 5.84 1.30 0.00 4.34 1.35 -1.97 -3.47 112.91 120.31 1b5h h THR 499 Ca -0.29 -2.28 0.00 0.00 -0.55 0.00 0.00 66.41 63.29 1b5h h THR 499 Cb 1.10 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 70.02 1b5h h THR 499 CO 0.98 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 177.56 1b5h n GLY 500 N 1.17 0.75 0.19 5.82 0.00 -1.26 -4.92 105.19 106.94 1b5h n GLY 500 Ca -0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.02 1b5h n GLY 500 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b5h h LYS 501 N 2.55 0.00 -6.09 1.61 1.79 -1.87 -3.43 116.57 111.12 1b5h h LYS 501 Ca 0.00 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.88 1b5h h LYS 501 Cb 0.00 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.56 1b5h h LYS 501 CO 0.00 0.00 0.63 0.34 -1.08 0.00 0.00 179.45 179.34 1b5h s ASP 502 N -5.89 6.74 0.09 0.86 2.15 -1.22 -4.81 116.67 114.60 1b5h s ASP 502 Ca 0.07 0.72 0.19 0.00 0.43 0.00 0.00 52.55 53.95 1b5h s ASP 502 Cb 0.06 -2.48 0.78 0.00 -0.30 0.00 0.00 42.92 40.99 1b5h s ASP 502 CO 0.67 -0.82 1.58 -0.81 -0.17 0.00 0.00 175.17 175.62 1b5h n PRO 503 N 6.71 0.07 0.01 4.34 -0.04 -1.26 -1.20 135.00 143.62 1b5h n PRO 503 Ca 0.08 0.29 0.11 0.00 -0.04 0.00 0.00 63.50 63.94 1b5h n PRO 503 Cb 0.48 -1.64 0.07 0.00 -0.04 0.00 0.00 33.50 32.37 1b5h n PRO 503 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1b5h n LEU 504 N -1.77 0.67 -3.72 1.53 4.77 -1.26 -0.59 117.00 116.62 1b5h n LEU 504 Ca 0.03 -0.13 -0.23 0.00 -0.03 0.00 0.00 56.01 55.65 1b5h n LEU 504 Cb 0.21 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.21 1b5h n LEU 504 CO 0.17 0.12 -0.01 -0.67 -1.33 0.00 0.00 177.39 175.67 1b5h n ASP 505 N -1.69 -2.10 -4.21 -1.43 2.03 -0.34 -4.89 116.55 103.91 1b5h n ASP 505 Ca 0.04 -0.79 -0.43 0.00 0.52 0.00 0.00 54.79 54.12 1b5h n ASP 505 Cb 0.38 -4.12 0.00 0.00 -0.72 0.00 0.00 41.12 36.65 1b5h n ASP 505 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1b5h n ASN 506 N -3.02 5.04 -4.77 1.67 3.02 -1.26 -4.98 115.26 110.96 1b5h n ASN 506 Ca -0.22 -3.01 -0.38 0.00 -0.03 0.00 0.00 54.58 50.94 1b5h n ASN 506 Cb 0.64 -1.57 -0.06 0.00 -0.61 0.00 0.00 39.78 38.19 1b5h n ASN 506 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1b5h s ILE 507 N 1.58 4.20 -0.16 2.41 -1.09 -1.26 -4.85 121.20 122.02 1b5h s ILE 507 Ca 0.43 1.88 0.01 0.00 -2.23 0.00 0.00 60.65 60.74 1b5h s ILE 507 Cb 0.04 -4.14 0.01 0.00 -1.58 0.00 0.00 42.46 36.79 1b5h s ILE 507 CO 0.01 0.33 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.54 1b5h s TYR 508 N -1.39 2.74 0.39 3.97 1.51 -1.26 -4.82 117.35 118.49 1b5h s TYR 508 Ca 0.45 -1.33 0.38 0.00 -1.01 0.00 0.00 57.07 55.56 1b5h s TYR 508 Cb -0.22 -1.87 1.86 0.00 -0.11 0.00 0.00 41.96 41.62 1b5h s TYR 508 CO 0.27 -0.63 2.17 0.28 -1.11 0.00 0.00 175.55 176.54 1b5h h VAL 509 N 5.81 0.06 0.00 0.71 2.07 -1.94 -0.78 116.25 122.18 1b5h h VAL 509 Ca -0.36 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1b5h h VAL 509 Cb 1.18 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 1b5h h VAL 509 CO 0.58 0.01 0.00 0.07 0.02 0.00 0.00 177.57 178.25 1b5h h LYS 510 N 0.00 0.00 -0.01 1.57 2.10 -1.95 -1.58 116.57 116.70 1b5h h LYS 510 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1b5h h LYS 510 Cb 0.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.59 1b5h h LYS 510 CO 0.00 0.00 -0.32 0.09 -2.00 0.00 0.00 179.45 177.23 1b5h n ASN 511 N -2.76 1.50 -4.99 7.07 3.02 -0.30 -0.08 115.26 118.73 1b5h n ASN 511 Ca -0.02 -1.20 -0.18 0.00 -0.03 0.00 0.00 54.58 53.15 1b5h n ASN 511 Cb 0.10 0.25 0.01 0.00 -0.61 0.00 0.00 39.78 39.54 1b5h n ASN 511 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b5h s LEU 512 N -2.44 3.54 -0.03 3.41 1.43 -0.60 -4.49 118.68 119.51 1b5h s LEU 512 Ca 0.23 -0.53 -0.28 0.00 -1.03 0.00 0.00 54.13 52.52 1b5h s LEU 512 Cb 0.19 -2.43 0.06 0.00 0.03 0.00 0.00 46.19 44.04 1b5h s LEU 512 CO 0.52 -0.82 0.63 -0.72 0.23 0.00 0.00 176.35 176.19 1b5h s TYR 513 N -2.41 -0.59 -0.28 0.29 -0.85 -0.65 -4.15 117.35 108.70 1b5h s TYR 513 Ca 0.55 0.95 -0.11 0.00 -0.52 0.00 0.00 57.07 57.94 1b5h s TYR 513 Cb -0.08 0.39 -0.04 0.00 0.38 0.00 0.00 41.96 42.60 1b5h s TYR 513 CO 0.33 -0.61 0.17 0.42 -1.52 0.00 0.00 175.55 174.34 1b5h s ILE 514 N -1.46 5.10 0.24 -3.49 -1.09 -1.26 0.25 121.20 119.49 1b5h s ILE 514 Ca -0.10 0.03 -0.29 0.00 -2.23 0.00 0.00 60.65 58.06 1b5h s ILE 514 Cb -0.01 -3.46 -0.09 0.00 -1.58 0.00 0.00 42.46 37.33 1b5h s ILE 514 CO 0.07 0.22 0.92 -0.63 -1.23 0.00 0.00 174.94 174.30 1b5h s ILE 515 N 1.72 4.12 0.18 2.92 1.01 0.87 -0.92 121.20 131.10 1b5h s ILE 515 Ca 0.07 2.02 -0.33 0.00 0.00 0.00 0.00 60.65 62.41 1b5h s ILE 515 Cb -0.16 -4.28 -0.14 0.00 0.01 0.00 0.00 42.46 37.88 1b5h s ILE 515 CO 0.09 0.48 1.43 1.17 0.00 0.00 0.00 174.94 178.11 1b5h n LYS 516 N 1.43 1.85 0.00 2.79 4.81 -0.14 -4.41 118.16 124.49 1b5h n LYS 516 Ca -0.02 0.66 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 1b5h n LYS 516 Cb 0.47 -2.34 0.00 0.00 0.02 0.00 0.00 35.03 33.18 1b5h n LYS 516 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18