#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b5i s ASP 2 N 0.00 5.09 -0.14 0.00 1.01 -1.26 -4.82 116.67 116.55 1b5i s ASP 2 Ca 0.00 -2.82 -0.29 0.00 0.71 0.00 0.00 52.55 50.14 1b5i s ASP 2 Cb 0.00 -1.82 -0.02 0.00 1.01 0.00 0.00 42.92 42.10 1b5i s ASP 2 CO 0.00 -0.36 1.26 -0.69 0.21 0.00 0.00 175.17 175.59 1b5i s VAL 3 N -0.02 4.26 0.42 -1.27 1.01 -1.26 -5.00 120.40 118.54 1b5i s VAL 3 Ca 0.16 1.54 -0.25 0.00 0.00 0.00 0.00 61.98 63.43 1b5i s VAL 3 Cb -0.21 -3.99 -0.10 0.00 0.00 0.00 0.00 36.38 32.08 1b5i s VAL 3 CO -0.03 -0.11 1.26 -2.65 0.00 0.00 0.00 175.10 173.57 1b5i n PRO 4 N 6.31 1.90 -1.65 2.72 -0.02 -1.26 -4.92 135.00 138.09 1b5i n PRO 4 Ca 0.13 0.68 -0.44 0.00 -2.02 0.00 0.00 63.50 61.85 1b5i n PRO 4 Cb 0.45 -2.36 -0.01 0.00 -0.02 0.00 0.00 33.50 31.55 1b5i n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b5i n ALA 5 N -0.21 0.56 0.00 3.55 0.00 -1.26 -1.62 120.51 121.53 1b5i n ALA 5 Ca 0.07 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.89 1b5i n ALA 5 Cb 0.39 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.70 1b5i n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b5i n GLY 6 N 1.08 3.09 3.76 0.00 0.00 -1.26 -5.01 105.19 106.85 1b5i n GLY 6 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1b5i n GLY 6 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b5i s VAL 7 N -1.50 3.42 -0.20 1.61 -7.23 -0.64 -4.99 120.40 110.88 1b5i s VAL 7 Ca 0.00 1.40 -0.16 0.00 -1.81 0.00 0.00 61.98 61.41 1b5i s VAL 7 Cb 0.00 -3.89 -0.04 0.00 0.56 0.00 0.00 36.38 33.01 1b5i s VAL 7 CO 0.00 0.32 0.40 -1.10 -0.31 0.00 0.00 175.10 174.40 1b5i s GLN 8 N -1.31 4.18 0.28 4.82 -0.21 -1.26 -4.97 119.66 121.18 1b5i s GLN 8 Ca 0.46 0.20 -0.16 0.00 0.02 0.00 0.00 55.36 55.88 1b5i s GLN 8 Cb -0.33 -3.53 -0.09 0.00 1.00 0.00 0.00 33.01 30.06 1b5i s GLN 8 CO 0.42 -0.03 0.71 -0.51 -2.12 0.00 0.00 175.29 173.76 1b5i s LEU 9 N 1.27 4.16 0.60 2.90 1.43 -1.26 -0.88 118.68 126.90 1b5i s LEU 9 Ca 0.19 1.28 -0.19 0.00 -1.03 0.00 0.00 54.13 54.38 1b5i s LEU 9 Cb -0.15 -3.87 -0.03 0.00 0.03 0.00 0.00 46.19 42.17 1b5i s LEU 9 CO 0.08 -0.11 1.20 0.00 0.23 0.00 0.00 176.35 177.74 1b5i s ALA 10 N -1.82 2.54 0.15 4.21 0.00 0.03 -4.35 121.76 122.53 1b5i s ALA 10 Ca 0.50 0.97 -0.13 0.00 0.00 0.00 0.00 51.96 53.30 1b5i s ALA 10 Cb -0.12 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.59 1b5i s ALA 10 CO 0.19 -1.16 1.66 -0.44 0.00 0.00 0.00 175.76 176.02 1b5i h ASP 11 N 0.84 0.77 -3.68 0.00 5.19 -1.96 -3.40 116.42 114.18 1b5i h ASP 11 Ca -0.50 -0.23 -0.65 0.00 -0.62 0.00 0.00 57.03 55.03 1b5i h ASP 11 Cb 1.29 -0.20 -0.16 0.00 0.18 0.00 0.00 39.33 40.44 1b5i h ASP 11 CO 0.55 0.79 -0.24 -0.75 -3.12 0.00 0.00 179.24 176.47 1b5i s LYS 12 N -5.33 3.70 -1.04 3.56 2.20 -1.26 -5.01 119.74 116.56 1b5i s LYS 12 Ca -0.13 -0.25 -0.06 0.00 -0.36 0.00 0.00 55.97 55.17 1b5i s LYS 12 Cb 0.12 -3.76 0.27 0.00 -1.51 0.00 0.00 37.83 32.94 1b5i s LYS 12 CO 0.79 -0.47 1.06 1.04 -0.36 0.00 0.00 175.35 177.41 1b5i n GLN 13 N 5.42 3.37 -4.28 4.03 1.13 -1.26 -4.93 117.38 120.86 1b5i n GLN 13 Ca -0.08 -4.48 -0.20 0.00 -1.94 0.00 0.00 57.00 50.30 1b5i n GLN 13 Cb 0.50 -2.50 -0.11 0.00 0.11 0.00 0.00 30.24 28.24 1b5i n GLN 13 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1b5i s THR 14 N -1.52 1.55 0.01 5.09 -4.23 -1.26 -0.41 115.64 114.88 1b5i s THR 14 Ca 0.30 -1.82 0.01 0.00 -1.18 0.00 0.00 61.69 59.00 1b5i s THR 14 Cb -0.07 -1.68 -0.01 0.00 1.34 0.00 0.00 72.50 72.08 1b5i s THR 14 CO -0.07 -0.38 -0.03 -0.22 -0.54 0.00 0.00 174.62 173.38 1b5i s LEU 15 N -2.57 2.10 -0.13 4.79 2.96 -0.40 -4.96 118.68 120.47 1b5i s LEU 15 Ca 0.12 -0.24 0.00 0.00 -0.22 0.00 0.00 54.13 53.80 1b5i s LEU 15 Cb -0.05 -0.06 0.02 0.00 0.50 0.00 0.00 46.19 46.60 1b5i s LEU 15 CO 0.05 -0.10 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.16 1b5i s VAL 16 N -0.62 1.45 -0.04 1.68 1.01 -1.26 -1.06 120.40 121.56 1b5i s VAL 16 Ca -0.05 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.43 1b5i s VAL 16 Cb -0.05 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 1b5i s VAL 16 CO -0.00 0.44 -0.24 -0.13 0.00 0.00 0.00 175.10 175.16 1b5i s ARG 17 N 1.43 2.35 0.30 2.72 0.52 0.28 -1.38 118.95 125.17 1b5i s ARG 17 Ca 0.03 -0.89 -0.21 0.00 -0.52 0.00 0.00 55.73 54.13 1b5i s ARG 17 Cb -0.13 -2.13 -0.09 0.00 0.52 0.00 0.00 34.95 33.11 1b5i s ARG 17 CO -0.08 0.49 0.83 1.21 0.02 0.00 0.00 175.30 177.77 1b5i s ASN 18 N -0.43 7.09 -0.08 0.23 2.47 -0.25 -1.25 114.94 122.72 1b5i s ASN 18 Ca 0.05 1.58 0.12 0.00 0.42 0.00 0.00 52.86 55.03 1b5i s ASN 18 Cb -0.12 -2.48 0.19 0.00 -1.45 0.00 0.00 41.25 37.39 1b5i s ASN 18 CO 0.01 -0.10 1.08 -3.20 -3.72 0.00 0.00 177.10 171.18 1b5i n ASN 19 N 0.30 1.67 0.00 -4.21 5.15 0.15 -3.59 115.26 114.74 1b5i n ASN 19 Ca 0.01 -2.68 0.00 0.00 -0.60 0.00 0.00 54.58 51.32 1b5i n ASN 19 Cb 0.51 -0.33 0.00 0.00 -0.53 0.00 0.00 39.78 39.44 1b5i n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b5i n GLY 20 N -0.97 1.42 3.78 8.20 0.00 -1.25 -4.53 105.19 111.84 1b5i n GLY 20 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.12 1b5i n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b5i s SER 21 N 0.00 -0.06 0.19 1.61 1.04 -1.26 -3.00 113.70 112.22 1b5i s SER 21 Ca 0.00 -0.34 -0.30 0.00 0.48 0.00 0.00 55.95 55.79 1b5i s SER 21 Cb 0.00 0.32 -0.09 0.00 0.10 0.00 0.00 66.02 66.35 1b5i s SER 21 CO 0.00 -0.61 1.32 -0.70 0.98 0.00 0.00 173.24 174.23 1b5i s GLU 22 N -2.50 4.38 0.66 4.02 2.56 -1.26 -4.50 118.70 122.06 1b5i s GLU 22 Ca 0.18 2.05 -0.15 0.00 0.00 0.00 0.00 54.97 57.05 1b5i s GLU 22 Cb 0.01 -3.20 0.00 0.00 2.00 0.00 0.00 34.13 32.94 1b5i s GLU 22 CO 0.00 -0.27 1.12 0.14 -0.56 0.00 0.00 175.26 175.69 1b5i s VAL 23 N 0.23 3.14 0.21 3.70 -7.23 -1.26 -4.56 120.40 114.64 1b5i s VAL 23 Ca 0.58 0.54 -0.07 0.00 -1.81 0.00 0.00 61.98 61.22 1b5i s VAL 23 Cb -0.36 -3.07 0.15 0.00 0.56 0.00 0.00 36.38 33.65 1b5i s VAL 23 CO 0.37 -0.32 1.77 1.56 -0.31 0.00 0.00 175.10 178.17 1b5i h GLN 24 N 0.07 1.17 -1.77 4.82 4.20 -1.94 -3.48 115.11 118.19 1b5i h GLN 24 Ca -0.47 -0.23 0.26 0.00 0.06 0.00 0.00 58.65 58.27 1b5i h GLN 24 Cb 1.25 -0.18 -0.12 0.00 0.30 0.00 0.00 27.48 28.73 1b5i h GLN 24 CO 0.54 0.97 0.70 0.45 -0.67 0.00 0.00 178.83 180.82 1b5i s SER 25 N -6.39 -0.12 0.00 1.46 0.15 -1.26 -5.01 113.70 102.52 1b5i s SER 25 Ca -0.12 -0.19 0.16 0.00 0.70 0.00 0.00 55.95 56.49 1b5i s SER 25 Cb 0.15 0.27 0.24 0.00 -1.71 0.00 0.00 66.02 64.98 1b5i s SER 25 CO 0.84 -0.49 1.14 0.18 1.20 0.00 0.00 173.24 176.11 1b5i n LEU 26 N -0.42 2.70 -4.62 3.45 4.77 -1.26 -4.92 117.00 116.70 1b5i n LEU 26 Ca -0.07 -1.38 -0.42 0.00 -0.03 0.00 0.00 56.01 54.11 1b5i n LEU 26 Cb 0.62 -0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.54 1b5i n LEU 26 CO 0.12 0.57 0.72 -0.62 -1.33 0.00 0.00 177.39 176.85 1b5i s ASP 27 N -1.20 6.74 0.60 -1.43 -1.08 -1.26 -4.93 116.67 114.11 1b5i s ASP 27 Ca 0.24 0.75 0.29 0.00 -0.52 0.00 0.00 52.55 53.31 1b5i s ASP 27 Cb 0.15 -2.45 1.49 0.00 -1.46 0.00 0.00 42.92 40.65 1b5i s ASP 27 CO 0.21 -0.73 1.90 -0.65 0.52 0.00 0.00 175.17 176.42 1b5i h PRO 28 N 8.17 0.00 -0.01 4.34 0.11 -1.92 0.29 132.00 142.99 1b5i h PRO 28 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1b5i h PRO 28 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1b5i h PRO 28 CO 0.94 0.00 -0.03 0.72 -0.21 0.00 0.00 178.00 179.42 1b5i n HIS 29 N -3.63 0.00 -0.81 0.65 8.25 -1.26 -4.03 115.22 114.38 1b5i n HIS 29 Ca 0.07 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.61 1b5i n HIS 29 Cb 0.62 -0.01 0.15 0.00 1.12 0.00 0.00 29.99 31.87 1b5i n HIS 29 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1b5i n LYS 30 N 0.10 2.08 -4.39 -0.41 4.76 0.09 -4.24 118.16 116.15 1b5i n LYS 30 Ca 0.18 -2.43 -0.24 0.00 -2.87 0.00 0.00 58.31 52.95 1b5i n LYS 30 Cb 0.36 -1.49 -0.11 0.00 -1.84 0.00 0.00 35.03 31.95 1b5i n LYS 30 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1b5i s ILE 31 N -2.42 2.11 0.00 -0.18 -4.36 -1.23 -4.63 121.20 110.48 1b5i s ILE 31 Ca 0.29 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.65 1b5i s ILE 31 Cb 0.24 -2.02 0.00 0.00 1.25 0.00 0.00 42.46 41.93 1b5i s ILE 31 CO 0.05 -0.25 0.07 -1.84 0.24 0.00 0.00 174.94 173.20 1b5i n GLU 32 N 0.15 0.00 -4.25 0.37 0.28 -1.26 -4.54 120.64 111.39 1b5i n GLU 32 Ca -0.12 -0.07 -0.26 0.00 -0.16 0.00 0.00 57.16 56.55 1b5i n GLU 32 Cb 0.57 -0.36 -0.07 0.00 1.43 0.00 0.00 31.44 33.01 1b5i n GLU 32 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1b5i s GLY 33 N 0.00 2.44 0.09 -1.84 0.00 -1.26 -5.02 107.32 101.73 1b5i s GLY 33 Ca 0.00 -1.88 -0.20 0.00 0.00 0.00 0.00 44.72 42.64 1b5i s GLY 33 CO 0.00 -1.98 1.64 -2.08 0.00 0.00 0.00 173.10 170.68 1b5i h VAL 34 N 1.41 1.15 -0.98 1.40 2.07 -1.98 -0.44 116.25 118.88 1b5i h VAL 34 Ca -0.43 -0.44 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1b5i h VAL 34 Cb 1.26 1.11 -0.06 0.00 -1.52 0.00 0.00 31.29 32.08 1b5i h VAL 34 CO 0.71 0.14 0.64 -0.65 0.02 0.00 0.00 177.57 178.43 1b5i h PRO 35 N 0.15 1.16 -0.39 1.57 0.11 -1.95 0.13 132.00 132.78 1b5i h PRO 35 Ca 0.06 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.02 1b5i h PRO 35 Cb 0.15 -0.26 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 1b5i h PRO 35 CO -0.01 0.77 -0.09 0.93 -0.21 0.00 0.00 178.00 179.40 1b5i h GLU 36 N 1.20 0.75 0.00 1.05 3.07 -1.85 -3.02 114.58 115.77 1b5i h GLU 36 Ca 0.41 -0.28 -0.10 0.00 -0.50 0.00 0.00 59.36 58.88 1b5i h GLU 36 Cb 0.09 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1b5i h GLU 36 CO -0.14 0.88 -0.49 0.77 -1.40 0.00 0.00 179.01 178.62 1b5i h SER 37 N 0.56 0.00 -0.53 1.42 0.02 -0.48 -0.75 113.55 113.78 1b5i h SER 37 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1b5i h SER 37 Cb 0.60 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 1b5i h SER 37 CO 0.04 0.49 0.33 0.78 -1.14 0.00 0.00 176.83 177.33 1b5i h ASN 38 N 0.00 0.62 -0.08 3.07 2.35 -0.64 -1.55 115.58 119.36 1b5i h ASN 38 Ca -0.00 -0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.57 1b5i h ASN 38 Cb 0.94 -0.16 0.01 0.00 0.05 0.00 0.00 38.32 39.16 1b5i h ASN 38 CO 0.06 0.48 -0.48 0.58 -1.65 0.00 0.00 177.43 176.42 1b5i h VAL 39 N 0.71 1.39 -0.97 2.81 2.07 -1.47 -3.33 116.25 117.47 1b5i h VAL 39 Ca 0.19 -1.84 0.11 0.00 0.82 0.00 0.00 66.70 65.98 1b5i h VAL 39 Cb -0.04 2.28 -0.08 0.00 -1.52 0.00 0.00 31.29 31.93 1b5i h VAL 39 CO -0.04 0.55 0.62 -1.28 0.02 0.00 0.00 177.57 177.44 1b5i h SER 40 N 0.03 0.88 0.29 0.57 0.87 -0.83 -1.90 113.55 113.46 1b5i h SER 40 Ca -0.04 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 1b5i h SER 40 Cb 1.14 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1b5i h SER 40 CO 0.10 0.49 -0.15 0.03 -0.53 0.00 0.00 176.83 176.77 1b5i h ARG 41 N 0.96 0.00 0.00 2.24 3.08 -1.39 0.36 114.38 119.63 1b5i h ARG 41 Ca 0.47 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.40 1b5i h ARG 41 Cb 0.48 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 1b5i h ARG 41 CO -0.23 0.15 -0.61 -0.44 -1.07 0.00 0.00 179.97 177.76 1b5i h ASP 42 N 0.00 0.00 0.04 7.04 3.32 -1.48 -3.40 116.42 121.94 1b5i h ASP 42 Ca -0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 1b5i h ASP 42 Cb 0.33 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.83 1b5i h ASP 42 CO 0.02 0.56 -2.26 0.18 -1.72 0.00 0.00 179.24 176.01 1b5i n LEU 43 N -3.22 2.70 -4.19 1.55 4.77 -0.73 -1.59 117.00 116.29 1b5i n LEU 43 Ca 0.01 0.05 -0.30 0.00 -0.03 0.00 0.00 56.01 55.74 1b5i n LEU 43 Cb 0.76 -0.97 -0.17 0.00 -2.33 0.00 0.00 43.42 40.71 1b5i n LEU 43 CO 0.41 0.84 -0.54 -0.36 -1.33 0.00 0.00 177.39 176.41 1b5i s PHE 44 N -2.52 2.32 -0.14 -1.77 0.08 0.04 0.53 117.98 116.52 1b5i s PHE 44 Ca -0.31 -0.88 0.02 0.00 0.12 0.00 0.00 56.93 55.88 1b5i s PHE 44 Cb 0.09 -1.56 0.00 0.00 -0.57 0.00 0.00 43.02 40.98 1b5i s PHE 44 CO 0.64 -0.35 -0.20 -2.00 -0.10 0.00 0.00 175.22 173.21 1b5i s GLU 45 N 0.29 3.09 0.00 0.44 2.12 -1.26 -4.51 118.70 118.87 1b5i s GLU 45 Ca -0.15 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 54.36 1b5i s GLU 45 Cb -0.17 -2.48 0.00 0.00 0.26 0.00 0.00 34.13 31.74 1b5i s GLU 45 CO 0.07 0.02 0.00 0.41 -0.54 0.00 0.00 175.26 175.22 1b5i n GLY 46 N 4.00 0.39 0.15 -1.50 0.00 -1.26 -4.37 105.19 102.60 1b5i n GLY 46 Ca -0.20 -1.81 -0.09 0.00 0.00 0.00 0.00 46.02 43.92 1b5i n GLY 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1b5i h LEU 47 N 0.00 0.38 -9.18 0.99 3.38 -1.81 0.52 115.31 109.59 1b5i h LEU 47 Ca 0.00 -0.07 -0.54 0.00 0.09 0.00 0.00 57.88 57.36 1b5i h LEU 47 Cb 0.00 -0.10 -0.14 0.00 0.09 0.00 0.00 40.66 40.52 1b5i h LEU 47 CO 0.00 0.33 -0.70 -0.76 0.09 0.00 0.00 178.44 177.40 1b5i s LEU 48 N -10.04 2.58 0.17 1.67 1.02 -1.26 -1.11 118.68 111.72 1b5i s LEU 48 Ca -0.13 -1.13 0.01 0.00 0.02 0.00 0.00 54.13 52.90 1b5i s LEU 48 Cb 0.09 -0.83 -0.05 0.00 0.02 0.00 0.00 46.19 45.42 1b5i s LEU 48 CO 0.72 -0.19 0.02 0.27 0.02 0.00 0.00 176.35 177.18 1b5i s ILE 49 N -2.80 0.59 0.27 -0.59 -4.36 0.29 -4.07 121.20 110.53 1b5i s ILE 49 Ca 0.29 -1.97 -0.26 0.00 -0.26 0.00 0.00 60.65 58.45 1b5i s ILE 49 Cb 0.01 -2.14 -0.09 0.00 1.25 0.00 0.00 42.46 41.49 1b5i s ILE 49 CO 0.13 -0.44 0.89 -0.44 0.24 0.00 0.00 174.94 175.31 1b5i s SER 50 N -3.16 7.37 1.00 4.36 0.01 -1.26 0.13 113.70 122.15 1b5i s SER 50 Ca 0.25 1.77 -0.05 0.00 1.31 0.00 0.00 55.95 59.23 1b5i s SER 50 Cb 0.06 -2.55 0.06 0.00 0.21 0.00 0.00 66.02 63.81 1b5i s SER 50 CO 0.04 0.04 0.36 -0.90 0.41 0.00 0.00 173.24 173.19 1b5i n ASP 51 N 0.93 -0.01 0.19 2.44 5.68 0.35 -4.80 116.55 121.34 1b5i n ASP 51 Ca -0.01 -1.12 0.14 0.00 -0.50 0.00 0.00 54.79 53.30 1b5i n ASP 51 Cb 0.49 -0.28 0.68 0.00 -1.14 0.00 0.00 41.12 40.87 1b5i n ASP 51 CO 0.00 0.00 0.00 -0.37 -1.33 0.00 0.00 177.20 175.50 1b5i h VAL 52 N -1.23 0.00 -0.24 2.12 -1.51 -1.94 -0.14 116.25 113.31 1b5i h VAL 52 Ca -0.12 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.25 1b5i h VAL 52 Cb 0.32 0.77 0.00 0.00 -2.13 0.00 0.00 31.29 30.26 1b5i h VAL 52 CO 0.08 0.00 0.00 -0.62 -1.23 0.00 0.00 177.57 175.80 1b5i n GLU 53 N -2.46 1.97 -0.19 5.19 1.02 -1.26 -4.57 120.64 120.34 1b5i n GLU 53 Ca -0.01 -1.86 0.00 0.00 -0.02 0.00 0.00 57.16 55.27 1b5i n GLU 53 Cb 0.11 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1b5i n GLU 53 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b5i n GLY 54 N 0.98 0.69 3.76 0.62 0.00 -0.07 -3.62 105.19 107.55 1b5i n GLY 54 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1b5i n GLY 54 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1b5i s HIS 55 N -2.46 3.59 0.23 1.61 3.76 -1.26 -4.56 115.29 116.19 1b5i s HIS 55 Ca 0.00 1.69 -0.32 0.00 -0.15 0.00 0.00 55.06 56.28 1b5i s HIS 55 Cb 0.00 -3.28 -0.13 0.00 1.11 0.00 0.00 32.58 30.28 1b5i s HIS 55 CO 0.00 -0.54 1.61 -2.30 -0.85 0.00 0.00 174.74 172.65 1b5i n PRO 56 N 1.32 2.51 -4.06 8.40 -0.02 -1.26 -0.50 135.00 141.39 1b5i n PRO 56 Ca -0.01 0.90 -0.11 0.00 -2.02 0.00 0.00 63.50 62.26 1b5i n PRO 56 Cb 0.45 -2.68 -0.06 0.00 -0.02 0.00 0.00 33.50 31.19 1b5i n PRO 56 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1b5i s SER 57 N 0.78 0.19 0.17 2.55 1.04 0.12 -4.83 113.70 113.72 1b5i s SER 57 Ca 0.71 -1.16 -0.34 0.00 0.48 0.00 0.00 55.95 55.65 1b5i s SER 57 Cb -0.56 0.56 -0.14 0.00 0.10 0.00 0.00 66.02 65.98 1b5i s SER 57 CO 0.41 -1.12 1.52 -2.65 0.98 0.00 0.00 173.24 172.38 1b5i n PRO 58 N -0.40 2.03 0.00 4.02 -0.02 -1.26 -0.55 135.00 138.82 1b5i n PRO 58 Ca -0.00 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1b5i n PRO 58 Cb 0.63 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 1b5i n PRO 58 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b5i n GLY 59 N 3.06 1.36 0.19 -1.23 0.00 -0.26 -4.27 105.19 104.03 1b5i n GLY 59 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.18 1b5i n GLY 59 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1b5i h VAL 60 N 0.00 1.30 -3.18 1.61 2.07 -0.56 -3.41 116.25 114.07 1b5i h VAL 60 Ca 0.00 -1.43 -0.58 0.00 0.82 0.00 0.00 66.70 65.51 1b5i h VAL 60 Cb 0.00 1.68 -0.06 0.00 -1.52 0.00 0.00 31.29 31.39 1b5i h VAL 60 CO 0.00 0.42 0.64 0.00 0.02 0.00 0.00 177.57 178.65 1b5i s ALA 61 N -4.17 3.58 -0.18 1.67 0.00 -0.35 -1.11 121.76 121.21 1b5i s ALA 61 Ca -0.04 0.17 0.18 0.00 0.00 0.00 0.00 51.96 52.28 1b5i s ALA 61 Cb 0.14 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1b5i s ALA 61 CO 0.75 -0.86 1.09 1.05 0.00 0.00 0.00 175.76 177.79 1b5i h GLU 62 N 7.36 0.00 -2.93 0.00 4.11 -1.05 -3.41 114.58 118.66 1b5i h GLU 62 Ca -0.24 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.15 1b5i h GLU 62 Cb 1.10 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.21 1b5i h GLU 62 CO 0.91 0.26 0.10 -1.59 0.07 0.00 0.00 179.01 178.76 1b5i s LYS 63 N -3.05 1.15 0.10 1.06 -2.85 -1.18 -4.86 119.74 110.10 1b5i s LYS 63 Ca 0.00 -0.39 -0.20 0.00 -1.00 0.00 0.00 55.97 54.38 1b5i s LYS 63 Cb 0.08 0.52 0.05 0.00 -2.06 0.00 0.00 37.83 36.43 1b5i s LYS 63 CO 0.78 -0.46 0.49 1.67 0.10 0.00 0.00 175.35 177.94 1b5i s TRP 64 N -3.16 -0.37 0.11 1.78 -2.14 -1.26 -0.67 118.94 113.23 1b5i s TRP 64 Ca -0.01 0.24 -0.01 0.00 2.66 0.00 0.00 56.10 58.98 1b5i s TRP 64 Cb -0.00 0.36 -0.04 0.00 -3.10 0.00 0.00 33.47 30.69 1b5i s TRP 64 CO -0.08 -0.71 0.03 -1.21 -2.66 0.00 0.00 176.95 172.33 1b5i s GLU 65 N -3.18 0.85 0.08 3.25 8.01 -0.64 -4.99 118.70 122.07 1b5i s GLU 65 Ca -0.01 -1.38 0.03 0.00 0.01 0.00 0.00 54.97 53.61 1b5i s GLU 65 Cb 0.00 0.19 -0.03 0.00 -4.31 0.00 0.00 34.13 29.98 1b5i s GLU 65 CO -0.08 -0.21 -0.08 0.54 0.01 0.00 0.00 175.26 175.44 1b5i s ASN 66 N -3.02 1.17 -0.28 -0.19 2.20 -1.26 -0.91 114.94 112.64 1b5i s ASN 66 Ca 0.19 -0.77 -0.01 0.00 -0.94 0.00 0.00 52.86 51.33 1b5i s ASN 66 Cb 0.07 0.04 0.05 0.00 -2.00 0.00 0.00 41.25 39.41 1b5i s ASN 66 CO -0.01 -0.29 -0.03 -0.75 -2.94 0.00 0.00 177.10 173.07 1b5i s LYS 67 N -2.64 2.43 -1.79 3.55 2.47 -0.23 -4.68 119.74 118.86 1b5i s LYS 67 Ca 0.02 -1.25 0.00 0.00 -1.56 0.00 0.00 55.97 53.18 1b5i s LYS 67 Cb -0.03 -3.09 0.00 0.00 -1.46 0.00 0.00 37.83 33.25 1b5i s LYS 67 CO -0.01 -0.58 0.00 -0.25 0.16 0.00 0.00 175.35 174.67 1b5i n ASP 68 N 4.58 -5.22 -1.86 1.43 8.00 -1.26 -1.32 116.55 120.90 1b5i n ASP 68 Ca -0.14 0.23 -0.17 0.00 0.71 0.00 0.00 54.79 55.42 1b5i n ASP 68 Cb 0.43 -4.49 -0.05 0.00 -0.02 0.00 0.00 41.12 37.00 1b5i n ASP 68 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1b5i n PHE 69 N -3.13 -0.57 0.00 1.24 3.72 -1.26 -4.58 117.46 112.89 1b5i n PHE 69 Ca -0.21 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.19 1b5i n PHE 69 Cb 0.65 -3.23 0.00 0.00 -0.94 0.00 0.00 39.48 35.96 1b5i n PHE 69 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1b5i n LYS 70 N -2.46 1.75 -3.97 -1.08 5.02 -0.44 -1.39 118.16 115.60 1b5i n LYS 70 Ca -0.19 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 55.76 1b5i n LYS 70 Cb 0.60 -0.97 -0.14 0.00 -0.02 0.00 0.00 35.03 34.50 1b5i n LYS 70 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1b5i s VAL 71 N -1.94 2.84 -0.20 -0.18 1.01 -0.94 -0.17 120.40 120.83 1b5i s VAL 71 Ca 0.00 -0.99 -0.06 0.00 0.00 0.00 0.00 61.98 60.93 1b5i s VAL 71 Cb 0.00 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 1b5i s VAL 71 CO 0.00 0.23 0.01 0.26 0.00 0.00 0.00 175.10 175.61 1b5i s TRP 72 N 1.33 3.07 -0.25 5.22 0.52 0.97 -1.07 118.94 128.73 1b5i s TRP 72 Ca 0.01 -0.36 -0.02 0.00 0.02 0.00 0.00 56.10 55.74 1b5i s TRP 72 Cb -0.16 -2.09 0.02 0.00 -1.15 0.00 0.00 33.47 30.09 1b5i s TRP 72 CO -0.05 -0.18 -0.05 0.99 0.02 0.00 0.00 176.95 177.69 1b5i s THR 73 N 0.93 3.05 -0.23 2.01 2.01 -0.09 0.03 115.64 123.34 1b5i s THR 73 Ca 0.02 -0.91 -0.06 0.00 0.31 0.00 0.00 61.69 61.04 1b5i s THR 73 Cb -0.14 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.82 1b5i s THR 73 CO 0.02 0.22 0.04 -0.36 -0.69 0.00 0.00 174.62 173.85 1b5i s PHE 74 N 1.37 3.07 -0.53 4.92 0.08 0.12 -1.63 117.98 125.38 1b5i s PHE 74 Ca 0.01 -0.47 -0.20 0.00 0.12 0.00 0.00 56.93 56.39 1b5i s PHE 74 Cb -0.16 -2.18 0.06 0.00 -0.57 0.00 0.00 43.02 40.17 1b5i s PHE 74 CO -0.04 -0.33 0.70 -1.01 -0.10 0.00 0.00 175.22 174.44 1b5i s HIS 75 N 1.40 2.99 0.09 0.36 3.76 0.16 -1.16 115.29 122.88 1b5i s HIS 75 Ca 0.05 -0.47 -0.30 0.00 -0.15 0.00 0.00 55.06 54.19 1b5i s HIS 75 Cb -0.15 -3.69 -0.05 0.00 1.11 0.00 0.00 32.58 29.80 1b5i s HIS 75 CO 0.02 -1.13 0.99 -0.51 -0.85 0.00 0.00 174.74 173.27 1b5i s LEU 76 N 2.92 4.46 0.41 0.89 1.43 0.21 -0.55 118.68 128.45 1b5i s LEU 76 Ca 0.18 1.80 -0.27 0.00 -1.03 0.00 0.00 54.13 54.81 1b5i s LEU 76 Cb -0.18 -3.58 -0.10 0.00 0.03 0.00 0.00 46.19 42.36 1b5i s LEU 76 CO 0.13 -0.16 1.48 -2.11 0.23 0.00 0.00 176.35 175.91 1b5i n ARG 77 N 3.11 2.51 0.21 1.70 1.85 -0.27 -4.81 116.66 120.97 1b5i n ARG 77 Ca 0.04 0.89 0.06 0.00 -1.00 0.00 0.00 57.85 57.83 1b5i n ARG 77 Cb 0.49 -2.67 0.48 0.00 -1.05 0.00 0.00 32.46 29.71 1b5i n ARG 77 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1b5i h GLU 78 N 2.67 0.00 -0.53 2.89 5.08 -1.95 -3.00 114.58 119.75 1b5i h GLU 78 Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1b5i h GLU 78 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1b5i h GLU 78 CO 0.63 0.26 0.00 0.27 -1.00 0.00 0.00 179.01 179.17 1b5i n ASN 79 N -4.01 2.75 -4.72 1.42 6.94 -1.26 -4.92 115.26 111.46 1b5i n ASN 79 Ca -0.02 -2.15 -0.42 0.00 -0.02 0.00 0.00 54.58 51.97 1b5i n ASN 79 Cb 0.33 -0.38 -0.03 0.00 -2.36 0.00 0.00 39.78 37.34 1b5i n ASN 79 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1b5i s ALA 80 N -1.59 3.61 0.07 -2.53 0.00 -1.14 -4.41 121.76 115.78 1b5i s ALA 80 Ca 0.30 1.15 0.01 0.00 0.00 0.00 0.00 51.96 53.42 1b5i s ALA 80 Cb 0.18 -3.54 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1b5i s ALA 80 CO 0.17 -0.63 -0.05 0.15 0.00 0.00 0.00 175.76 175.40 1b5i s LYS 81 N 1.01 0.71 0.74 0.00 1.02 -1.26 -1.08 119.74 120.88 1b5i s LYS 81 Ca 0.65 -1.22 -0.08 0.00 0.02 0.00 0.00 55.97 55.34 1b5i s LYS 81 Cb -0.38 -0.06 0.07 0.00 -0.52 0.00 0.00 37.83 36.94 1b5i s LYS 81 CO 0.31 -0.04 1.07 -1.58 -0.92 0.00 0.00 175.35 174.18 1b5i s TRP 82 N -3.45 2.84 -0.35 3.18 0.52 0.39 -4.60 118.94 117.47 1b5i s TRP 82 Ca 0.07 0.49 0.25 0.00 0.02 0.00 0.00 56.10 56.93 1b5i s TRP 82 Cb 0.04 -3.30 1.08 0.00 -1.15 0.00 0.00 33.47 30.14 1b5i s TRP 82 CO -0.06 -1.56 1.75 0.66 0.02 0.00 0.00 176.95 177.76 1b5i h SER 83 N -0.75 0.00 -0.34 2.95 4.64 -0.35 -0.71 113.55 118.99 1b5i h SER 83 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1b5i h SER 83 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1b5i h SER 83 CO 0.60 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.66 1b5i n ASP 84 N -2.35 2.10 0.00 4.97 5.68 -1.26 -4.84 116.55 120.85 1b5i n ASP 84 Ca 0.01 -1.92 0.00 0.00 -0.50 0.00 0.00 54.79 52.38 1b5i n ASP 84 Cb 0.20 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 1b5i n ASP 84 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b5i n GLY 85 N 1.16 1.48 3.82 6.12 0.00 -0.27 -5.04 105.19 112.45 1b5i n GLY 85 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1b5i n GLY 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b5i s THR 86 N -2.89 4.40 0.48 2.61 -4.23 -1.26 -4.73 115.64 110.02 1b5i s THR 86 Ca 0.00 1.45 -0.23 0.00 -1.18 0.00 0.00 61.69 61.73 1b5i s THR 86 Cb 0.00 -3.61 -0.07 0.00 1.34 0.00 0.00 72.50 70.16 1b5i s THR 86 CO 0.00 -0.37 1.24 -2.84 -0.54 0.00 0.00 174.62 172.11 1b5i s PRO 87 N -3.30 3.60 -0.16 3.99 0.02 -1.26 -0.46 135.00 137.42 1b5i s PRO 87 Ca 0.62 1.96 -0.22 0.00 0.02 0.00 0.00 61.00 63.37 1b5i s PRO 87 Cb -0.09 -2.40 -0.03 0.00 0.02 0.00 0.00 34.50 32.00 1b5i s PRO 87 CO 0.16 -0.74 0.68 0.08 -0.33 0.00 0.00 177.00 176.85 1b5i s VAL 88 N -1.44 5.00 0.43 3.83 1.01 -0.24 -4.70 120.40 124.29 1b5i s VAL 88 Ca 0.65 1.33 0.03 0.00 0.00 0.00 0.00 61.98 63.99 1b5i s VAL 88 Cb -0.33 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.02 1b5i s VAL 88 CO 0.40 0.12 0.07 0.42 0.00 0.00 0.00 175.10 176.12 1b5i s THR 89 N 1.72 0.94 0.28 3.92 -4.23 -1.26 -4.78 115.64 112.22 1b5i s THR 89 Ca 0.32 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 59.10 1b5i s THR 89 Cb -0.16 -2.38 0.27 0.00 1.34 0.00 0.00 72.50 71.57 1b5i s THR 89 CO 0.12 0.00 1.96 0.00 -0.54 0.00 0.00 174.62 176.16 1b5i h ALA 90 N 1.68 1.14 -0.15 3.99 0.00 -1.20 -1.61 119.26 123.10 1b5i h ALA 90 Ca -0.39 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 1b5i h ALA 90 Cb 1.28 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1b5i h ALA 90 CO 0.65 0.21 -0.13 0.45 0.00 0.00 0.00 179.25 180.44 1b5i h HIS 91 N 0.00 0.25 -0.60 0.00 3.86 -1.84 -1.51 115.15 115.32 1b5i h HIS 91 Ca -0.00 -0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.11 1b5i h HIS 91 Cb 0.53 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 1b5i h HIS 91 CO 0.00 0.37 0.10 -0.44 0.86 0.00 0.00 177.93 178.82 1b5i h ASP 92 N 0.23 0.96 -0.47 2.45 3.32 -1.67 -1.29 116.42 119.95 1b5i h ASP 92 Ca 0.05 -0.26 -0.13 0.00 0.02 0.00 0.00 57.03 56.71 1b5i h ASP 92 Cb 0.37 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1b5i h ASP 92 CO 0.02 0.98 -0.21 -0.26 -1.72 0.00 0.00 179.24 178.04 1b5i h PHE 93 N 0.90 1.13 0.32 4.55 -1.00 -1.39 -0.25 116.94 121.20 1b5i h PHE 93 Ca 0.18 -0.27 -0.01 0.00 2.81 0.00 0.00 57.97 60.69 1b5i h PHE 93 Cb 0.43 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 1b5i h PHE 93 CO 0.03 1.09 -0.24 0.28 -1.61 0.00 0.00 178.31 177.87 1b5i h VAL 94 N 0.85 0.50 -0.31 -0.55 2.07 -1.10 0.13 116.25 117.85 1b5i h VAL 94 Ca 0.11 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.65 1b5i h VAL 94 Cb 0.79 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1b5i h VAL 94 CO 0.07 0.00 0.14 0.22 0.02 0.00 0.00 177.57 178.02 1b5i h TYR 95 N -0.56 0.26 -0.37 1.57 3.20 -1.20 -1.83 116.97 118.05 1b5i h TYR 95 Ca -0.02 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1b5i h TYR 95 Cb 0.48 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.66 1b5i h TYR 95 CO -0.13 0.14 0.18 0.77 -1.64 0.00 0.00 178.16 177.48 1b5i h SER 96 N 0.30 0.47 0.59 -2.11 0.02 -0.71 -1.07 113.55 111.04 1b5i h SER 96 Ca 0.13 -0.12 -0.08 0.00 -0.84 0.00 0.00 61.79 60.88 1b5i h SER 96 Cb 0.06 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1b5i h SER 96 CO -0.10 0.46 -0.38 -0.50 -1.14 0.00 0.00 176.83 175.17 1b5i h TRP 97 N 0.45 0.00 -0.42 3.45 4.06 -0.93 -0.68 115.95 121.89 1b5i h TRP 97 Ca 0.13 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.98 1b5i h TRP 97 Cb 0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.25 1b5i h TRP 97 CO -0.02 0.38 -0.12 1.96 -3.56 0.00 0.00 178.44 177.08 1b5i h GLN 98 N 0.00 0.82 -0.75 0.49 4.20 -1.09 -2.27 115.11 116.51 1b5i h GLN 98 Ca -0.00 -0.32 -0.06 0.00 0.06 0.00 0.00 58.65 58.32 1b5i h GLN 98 Cb 0.77 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.48 1b5i h GLN 98 CO 0.05 0.95 0.24 -0.09 -0.67 0.00 0.00 178.83 179.31 1b5i h ARG 99 N 0.64 1.17 -0.76 1.46 2.43 -0.75 -1.59 114.38 116.99 1b5i h ARG 99 Ca 0.10 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1b5i h ARG 99 Cb 0.66 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 30.00 1b5i h ARG 99 CO 0.05 0.99 0.48 1.25 -1.51 0.00 0.00 179.97 181.23 1b5i h LEU 100 N 1.12 0.89 -0.91 3.80 5.85 -1.06 -3.01 115.31 122.00 1b5i h LEU 100 Ca 0.24 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 1b5i h LEU 100 Cb 0.31 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1b5i h LEU 100 CO -0.01 0.67 -0.35 0.00 -0.34 0.00 0.00 178.44 178.41 1b5i h ALA 101 N 1.26 1.07 -2.33 1.25 0.00 -1.02 -3.41 119.26 116.09 1b5i h ALA 101 Ca 0.28 -0.39 -0.54 0.00 0.00 0.00 0.00 54.91 54.26 1b5i h ALA 101 Cb -0.08 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.62 1b5i h ALA 101 CO -0.06 0.58 1.19 0.34 0.00 0.00 0.00 179.25 181.31 1b5i s ASP 102 N -6.85 6.51 0.55 0.00 -1.08 -0.63 -4.35 116.67 110.82 1b5i s ASP 102 Ca -0.06 2.55 0.23 0.00 -0.52 0.00 0.00 52.55 54.75 1b5i s ASP 102 Cb 0.13 -2.53 1.50 0.00 -1.46 0.00 0.00 42.92 40.56 1b5i s ASP 102 CO 0.79 -1.02 2.14 1.55 0.52 0.00 0.00 175.17 179.14 1b5i h PRO 103 N 10.31 0.00 0.00 4.34 0.13 -1.86 0.93 132.00 145.85 1b5i h PRO 103 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 1b5i h PRO 103 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1b5i h PRO 103 CO 0.94 0.00 -0.11 -0.91 -0.23 0.00 0.00 178.00 177.70 1b5i h ASN 104 N 0.00 0.00 1.16 1.44 2.35 -1.93 -1.00 115.58 117.60 1b5i h ASN 104 Ca 0.06 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1b5i h ASN 104 Cb 0.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1b5i h ASN 104 CO -0.00 0.11 -0.18 0.74 -1.65 0.00 0.00 177.43 176.44 1b5i h THR 105 N 0.00 0.41 -6.49 2.81 2.02 -1.05 -3.47 112.91 107.13 1b5i h THR 105 Ca -0.00 -1.12 -0.50 0.00 0.77 0.00 0.00 66.41 65.56 1b5i h THR 105 Cb 0.25 1.83 -0.06 0.00 -1.74 0.00 0.00 68.15 68.43 1b5i h THR 105 CO 0.01 0.18 -0.88 0.00 0.37 0.00 0.00 175.52 175.21 1b5i n ALA 106 N -2.18 -1.95 -1.76 6.16 0.00 -0.38 -4.89 120.51 115.50 1b5i n ALA 106 Ca 0.01 -0.24 -0.40 0.00 0.00 0.00 0.00 53.44 52.81 1b5i n ALA 106 Cb 0.46 -1.68 -0.04 0.00 0.00 0.00 0.00 19.45 18.19 1b5i n ALA 106 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1b5i s SER 107 N -4.29 7.21 0.59 0.00 0.15 -1.26 -4.89 113.70 111.21 1b5i s SER 107 Ca 0.06 2.21 0.36 0.00 0.70 0.00 0.00 55.95 59.27 1b5i s SER 107 Cb -0.03 -2.62 1.85 0.00 -1.71 0.00 0.00 66.02 63.51 1b5i s SER 107 CO 0.89 -0.18 2.19 1.55 1.20 0.00 0.00 173.24 178.89 1b5i h PRO 108 N 3.61 0.00 -0.51 5.44 0.13 -1.85 -2.15 132.00 136.67 1b5i h PRO 108 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 1b5i h PRO 108 Cb 1.21 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1b5i h PRO 108 CO 0.66 0.04 0.06 0.66 -0.23 0.00 0.00 178.00 179.18 1b5i n TYR 109 N -3.34 1.80 -0.34 1.56 4.02 -1.26 -3.83 117.16 115.76 1b5i n TYR 109 Ca -0.02 -0.91 0.07 0.00 -0.01 0.00 0.00 57.90 57.03 1b5i n TYR 109 Cb 0.17 -0.49 0.25 0.00 -0.02 0.00 0.00 39.34 39.24 1b5i n TYR 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1b5i h ALA 110 N 2.95 1.54 0.00 -0.72 0.00 -1.61 -1.27 119.26 120.15 1b5i h ALA 110 Ca 0.07 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1b5i h ALA 110 Cb 1.89 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1b5i h ALA 110 CO 0.46 0.25 0.00 0.43 0.00 0.00 0.00 179.25 180.39 1b5i n SER 111 N -4.57 0.00 0.11 0.00 7.64 -1.26 -2.64 113.62 112.89 1b5i n SER 111 Ca 0.17 0.17 0.04 0.00 1.01 0.00 0.00 58.87 60.27 1b5i n SER 111 Cb 0.32 -0.33 0.47 0.00 -1.01 0.00 0.00 64.21 63.65 1b5i n SER 111 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1b5i h TYR 112 N 0.00 0.29 0.00 1.43 3.20 -1.58 0.90 116.97 121.22 1b5i h TYR 112 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1b5i h TYR 112 Cb 0.15 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.33 1b5i h TYR 112 CO 0.00 0.26 0.00 -0.07 -1.64 0.00 0.00 178.16 176.71 1b5i h LEU 113 N 0.30 0.00 -0.03 2.82 3.38 -1.71 -1.86 115.31 118.21 1b5i h LEU 113 Ca 0.07 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.85 1b5i h LEU 113 Cb 0.11 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.87 1b5i h LEU 113 CO -0.00 0.00 -0.72 1.56 0.09 0.00 0.00 178.44 179.36 1b5i h GLN 114 N 0.00 0.55 -0.69 1.13 4.20 -1.26 -1.52 115.11 117.52 1b5i h GLN 114 Ca 0.00 -0.55 0.02 0.00 0.06 0.00 0.00 58.65 58.19 1b5i h GLN 114 Cb 0.77 0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.65 1b5i h GLN 114 CO 0.00 1.17 0.46 1.88 -0.67 0.00 0.00 178.83 181.67 1b5i h TYR 115 N 0.13 0.83 -0.00 2.96 0.05 -0.48 -0.89 116.97 119.56 1b5i h TYR 115 Ca -0.08 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.72 1b5i h TYR 115 Cb 1.40 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 38.86 1b5i h TYR 115 CO 0.12 0.50 -0.14 0.41 -1.05 0.00 0.00 178.16 178.00 1b5i n GLY 116 N -1.44 -0.89 3.65 3.88 0.00 -0.74 -4.97 105.19 104.68 1b5i n GLY 116 Ca 0.08 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.57 1b5i n GLY 116 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1b5i n HIS 117 N -0.91 -2.67 -1.96 1.61 8.25 -0.34 -4.86 115.22 114.33 1b5i n HIS 117 Ca 0.14 0.98 -0.41 0.00 -0.26 0.00 0.00 57.72 58.17 1b5i n HIS 117 Cb 0.29 -4.81 -0.01 0.00 1.12 0.00 0.00 29.99 26.58 1b5i n HIS 117 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1b5i s ILE 118 N -3.33 2.42 0.40 1.59 1.09 -0.70 -1.14 121.20 121.53 1b5i s ILE 118 Ca 0.52 0.41 -0.26 0.00 -1.10 0.00 0.00 60.65 60.22 1b5i s ILE 118 Cb -0.24 -3.26 -0.10 0.00 -1.06 0.00 0.00 42.46 37.80 1b5i s ILE 118 CO 0.75 0.09 1.29 0.00 -0.10 0.00 0.00 174.94 176.98 1b5i n ALA 119 N 1.02 1.38 -0.99 9.38 0.00 0.37 -2.68 120.51 129.00 1b5i n ALA 119 Ca 0.02 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1b5i n ALA 119 Cb 0.40 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1b5i n ALA 119 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1b5i n ASN 120 N 0.33 -4.86 -0.19 0.00 3.02 -1.26 -1.37 115.26 110.92 1b5i n ASN 120 Ca 0.06 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.54 1b5i n ASN 120 Cb 0.39 -2.54 0.02 0.00 -0.61 0.00 0.00 39.78 37.04 1b5i n ASN 120 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1b5i h ILE 121 N 0.00 1.19 -0.39 2.41 6.09 -1.87 -2.29 117.51 122.65 1b5i h ILE 121 Ca 0.00 -0.50 0.06 0.00 -1.37 0.00 0.00 64.86 63.06 1b5i h ILE 121 Cb 0.66 0.51 -0.06 0.00 0.47 0.00 0.00 36.82 38.41 1b5i h ILE 121 CO 0.00 0.21 0.05 0.44 -3.07 0.00 0.00 178.15 175.78 1b5i h ASP 122 N 0.74 -0.05 -0.46 2.19 3.32 -1.92 -0.20 116.42 120.05 1b5i h ASP 122 Ca 0.19 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 1b5i h ASP 122 Cb 0.07 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1b5i h ASP 122 CO -0.03 0.01 0.20 0.44 -1.72 0.00 0.00 179.24 178.14 1b5i h ASP 123 N 0.17 0.65 -0.07 6.45 3.32 -1.93 -0.42 116.42 124.60 1b5i h ASP 123 Ca 0.19 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 1b5i h ASP 123 Cb 0.24 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1b5i h ASP 123 CO -0.27 0.59 -0.06 0.40 -1.72 0.00 0.00 179.24 178.18 1b5i h ILE 124 N 0.71 1.36 -0.79 0.35 2.04 -0.78 0.15 117.51 120.56 1b5i h ILE 124 Ca 0.17 -1.17 -0.00 0.00 1.00 0.00 0.00 64.86 64.86 1b5i h ILE 124 Cb 0.14 2.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.18 1b5i h ILE 124 CO -0.02 0.32 0.49 0.40 0.00 0.00 0.00 178.15 179.34 1b5i h ILE 125 N -0.26 1.22 0.00 -0.67 2.04 -0.74 -1.80 117.51 117.29 1b5i h ILE 125 Ca 0.01 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1b5i h ILE 125 Cb 0.55 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1b5i h ILE 125 CO 0.01 0.23 0.00 0.00 0.00 0.00 0.00 178.15 178.39 1b5i n ALA 126 N -2.42 2.26 -0.89 1.87 0.00 -0.19 -4.76 120.51 116.38 1b5i n ALA 126 Ca 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1b5i n ALA 126 Cb 0.06 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.13 1b5i n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b5i n GLY 127 N 0.55 0.83 0.12 0.00 0.00 -0.68 -4.91 105.19 101.11 1b5i n GLY 127 Ca 0.14 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.05 1b5i n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b5i h LYS 128 N 2.67 0.24 -5.79 1.61 1.57 -1.21 -3.45 116.57 112.21 1b5i h LYS 128 Ca 0.00 -0.31 -0.49 0.00 -1.87 0.00 0.00 60.65 57.98 1b5i h LYS 128 Cb 0.00 0.10 -0.22 0.00 0.08 0.00 0.00 32.23 32.19 1b5i h LYS 128 CO 0.00 1.06 -0.81 0.15 -0.57 0.00 0.00 179.45 179.28 1b5i s LYS 129 N -3.02 1.00 0.72 3.15 1.02 -0.88 -4.99 119.74 116.75 1b5i s LYS 129 Ca -0.03 -1.05 -0.13 0.00 0.02 0.00 0.00 55.97 54.78 1b5i s LYS 129 Cb 0.09 -1.15 0.03 0.00 -0.52 0.00 0.00 37.83 36.29 1b5i s LYS 129 CO 0.85 0.27 1.11 -1.25 -0.92 0.00 0.00 175.35 175.41 1b5i s PRO 130 N -1.76 2.43 0.59 -1.68 0.04 -1.26 -4.20 135.00 129.15 1b5i s PRO 130 Ca 0.03 1.33 0.29 0.00 0.04 0.00 0.00 61.00 62.69 1b5i s PRO 130 Cb -0.10 -1.91 1.79 0.00 0.04 0.00 0.00 34.50 34.33 1b5i s PRO 130 CO 0.03 -1.53 2.25 0.00 0.04 0.00 0.00 177.00 177.79 1b5i h ALA 131 N -0.57 1.54 0.00 8.56 0.00 -1.90 -1.26 119.26 125.62 1b5i h ALA 131 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1b5i h ALA 131 Cb 1.24 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1b5i h ALA 131 CO 0.52 0.01 0.00 0.25 0.00 0.00 0.00 179.25 180.02 1b5i n THR 132 N -3.87 1.20 1.61 0.00 -2.24 -1.26 -1.81 114.28 107.92 1b5i n THR 132 Ca -0.03 0.41 0.15 0.00 -2.27 0.00 0.00 64.05 62.30 1b5i n THR 132 Cb 0.09 -1.31 0.75 0.00 -2.10 0.00 0.00 70.33 67.75 1b5i n THR 132 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1b5i n ASP 133 N -1.85 0.28 -4.76 3.42 9.92 -0.48 -4.92 116.55 118.17 1b5i n ASP 133 Ca 0.01 -0.68 -0.40 0.00 -0.53 0.00 0.00 54.79 53.19 1b5i n ASP 133 Cb 0.12 -0.10 0.02 0.00 -0.64 0.00 0.00 41.12 40.52 1b5i n ASP 133 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1b5i n LEU 134 N -0.96 5.02 -2.96 0.64 7.94 -0.75 -4.72 117.00 121.21 1b5i n LEU 134 Ca 0.18 1.12 -0.24 0.00 -1.11 0.00 0.00 56.01 55.97 1b5i n LEU 134 Cb 0.22 -1.60 -0.05 0.00 0.53 0.00 0.00 43.42 42.53 1b5i n LEU 134 CO 0.21 -0.18 2.41 0.61 -1.11 0.00 0.00 177.39 179.34 1b5i n GLY 135 N 0.59 3.28 3.09 -3.96 0.00 -0.47 -4.80 105.19 102.92 1b5i n GLY 135 Ca 0.05 -1.04 -0.19 0.00 0.00 0.00 0.00 46.02 44.84 1b5i n GLY 135 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b5i s VAL 136 N 2.60 0.92 -0.03 1.61 -7.23 -1.26 -0.80 120.40 116.22 1b5i s VAL 136 Ca 0.50 -0.72 -0.19 0.00 -1.81 0.00 0.00 61.98 59.77 1b5i s VAL 136 Cb 0.16 -0.81 0.04 0.00 0.56 0.00 0.00 36.38 36.32 1b5i s VAL 136 CO -0.03 0.10 0.40 -1.59 -0.31 0.00 0.00 175.10 173.67 1b5i s LYS 137 N -0.70 0.76 -0.31 4.82 -2.85 -0.46 -5.01 119.74 116.00 1b5i s LYS 137 Ca 0.02 -0.07 -0.16 0.00 -1.00 0.00 0.00 55.97 54.76 1b5i s LYS 137 Cb -0.06 0.35 -0.02 0.00 -2.06 0.00 0.00 37.83 36.04 1b5i s LYS 137 CO 0.00 -0.22 0.43 0.00 0.10 0.00 0.00 175.35 175.66 1b5i s ALA 138 N -1.27 3.53 0.05 0.59 0.00 -1.26 -1.34 121.76 122.05 1b5i s ALA 138 Ca -0.13 -0.93 0.14 0.00 0.00 0.00 0.00 51.96 51.04 1b5i s ALA 138 Cb -0.04 -2.84 0.20 0.00 0.00 0.00 0.00 23.12 20.44 1b5i s ALA 138 CO 0.06 -0.92 1.50 -0.07 0.00 0.00 0.00 175.76 176.33 1b5i h LEU 139 N 8.80 0.00 0.00 0.00 3.38 -1.22 -3.48 115.31 122.79 1b5i h LEU 139 Ca -0.30 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.68 1b5i h LEU 139 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1b5i h LEU 139 CO 0.70 0.60 0.16 -0.90 0.09 0.00 0.00 178.44 179.09 1b5i n ASP 140 N -3.40 -0.98 0.28 -0.43 5.68 -1.23 -4.98 116.55 111.49 1b5i n ASP 140 Ca 0.01 -1.64 0.14 0.00 -0.50 0.00 0.00 54.79 52.80 1b5i n ASP 140 Cb 0.71 1.62 0.79 0.00 -1.14 0.00 0.00 41.12 43.10 1b5i n ASP 140 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1b5i h ASP 141 N 0.89 0.00 -0.09 -1.12 3.32 -1.99 -2.99 116.42 114.44 1b5i h ASP 141 Ca -0.14 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 1b5i h ASP 141 Cb 0.55 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1b5i h ASP 141 CO 0.18 0.09 -0.09 1.41 -1.72 0.00 0.00 179.24 179.11 1b5i n HIS 142 N -3.54 0.30 -3.71 4.55 8.25 -1.26 -0.85 115.22 118.96 1b5i n HIS 142 Ca -0.02 -1.12 -0.23 0.00 -0.26 0.00 0.00 57.72 56.09 1b5i n HIS 142 Cb 0.21 -0.23 -0.17 0.00 1.12 0.00 0.00 29.99 30.92 1b5i n HIS 142 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1b5i s THR 143 N -2.97 0.17 -0.17 1.59 2.01 -1.13 -0.62 115.64 114.52 1b5i s THR 143 Ca 0.36 0.08 -0.03 0.00 0.31 0.00 0.00 61.69 62.42 1b5i s THR 143 Cb 0.32 -0.49 -0.02 0.00 0.01 0.00 0.00 72.50 72.33 1b5i s THR 143 CO 0.02 0.08 -0.06 0.12 -0.69 0.00 0.00 174.62 174.10 1b5i s PHE 144 N 2.05 2.95 -0.15 4.92 5.36 -0.31 -0.58 117.98 132.22 1b5i s PHE 144 Ca 0.04 -0.60 0.02 0.00 -0.96 0.00 0.00 56.93 55.43 1b5i s PHE 144 Cb -0.13 -1.99 0.01 0.00 -0.34 0.00 0.00 43.02 40.57 1b5i s PHE 144 CO -0.06 -0.26 -0.21 -2.00 -1.46 0.00 0.00 175.22 171.23 1b5i s GLU 145 N 0.77 2.99 -0.11 10.12 2.12 -0.45 0.11 118.70 134.25 1b5i s GLU 145 Ca -0.02 -0.84 -0.00 0.00 0.36 0.00 0.00 54.97 54.47 1b5i s GLU 145 Cb -0.15 -2.47 -0.02 0.00 0.26 0.00 0.00 34.13 31.76 1b5i s GLU 145 CO 0.02 -0.08 -0.11 0.08 -0.54 0.00 0.00 175.26 174.62 1b5i s VAL 146 N 0.98 3.26 -0.21 3.70 1.01 0.10 -1.35 120.40 127.89 1b5i s VAL 146 Ca -0.03 -0.60 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 1b5i s VAL 146 Cb -0.15 -2.36 0.00 0.00 0.00 0.00 0.00 36.38 33.88 1b5i s VAL 146 CO -0.06 0.54 -0.09 -0.89 0.00 0.00 0.00 175.10 174.60 1b5i s THR 147 N 0.06 2.96 0.21 3.92 2.01 0.02 -0.02 115.64 124.79 1b5i s THR 147 Ca -0.04 -0.66 0.01 0.00 0.31 0.00 0.00 61.69 61.31 1b5i s THR 147 Cb -0.14 -2.33 -0.04 0.00 0.01 0.00 0.00 72.50 70.00 1b5i s THR 147 CO 0.04 0.44 0.37 -0.76 -0.69 0.00 0.00 174.62 174.03 1b5i s LEU 148 N 1.41 4.25 0.00 4.42 1.43 0.76 -0.48 118.68 130.48 1b5i s LEU 148 Ca 0.05 0.30 0.29 0.00 -1.03 0.00 0.00 54.13 53.74 1b5i s LEU 148 Cb -0.14 -3.08 1.20 0.00 0.03 0.00 0.00 46.19 44.20 1b5i s LEU 148 CO -0.06 -0.04 1.86 -1.54 0.23 0.00 0.00 176.35 176.79 1b5i n SER 149 N -0.83 0.28 -3.43 2.29 3.41 -0.29 -4.73 113.62 110.31 1b5i n SER 149 Ca -0.06 -0.21 -0.12 0.00 -0.26 0.00 0.00 58.87 58.22 1b5i n SER 149 Cb 0.54 -0.17 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 1b5i n SER 149 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1b5i s GLU 150 N -2.67 1.23 0.18 4.33 -1.05 -1.26 -5.09 118.70 114.36 1b5i s GLU 150 Ca 0.23 -0.44 -0.31 0.00 -0.15 0.00 0.00 54.97 54.30 1b5i s GLU 150 Cb 0.20 0.57 -0.10 0.00 -0.44 0.00 0.00 34.13 34.35 1b5i s GLU 150 CO 0.51 -0.53 1.55 -2.14 0.95 0.00 0.00 175.26 175.60 1b5i s PRO 151 N -3.64 4.22 -0.38 -4.83 0.02 -1.26 -4.67 135.00 124.46 1b5i s PRO 151 Ca 0.01 2.36 0.01 0.00 0.02 0.00 0.00 61.00 63.39 1b5i s PRO 151 Cb -0.01 -3.15 0.13 0.00 0.02 0.00 0.00 34.50 31.49 1b5i s PRO 151 CO -0.12 -0.59 0.20 0.08 -0.33 0.00 0.00 177.00 176.24 1b5i s VAL 152 N 1.00 0.83 0.46 3.83 1.01 -0.48 -4.92 120.40 122.12 1b5i s VAL 152 Ca 0.69 -1.99 0.22 0.00 0.00 0.00 0.00 61.98 60.91 1b5i s VAL 152 Cb -0.44 -1.60 0.26 0.00 0.00 0.00 0.00 36.38 34.61 1b5i s VAL 152 CO 0.33 -0.88 2.07 -0.65 0.00 0.00 0.00 175.10 175.97 1b5i h PRO 153 N 7.15 0.00 -0.46 2.72 0.11 -1.94 -1.84 132.00 137.74 1b5i h PRO 153 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1b5i h PRO 153 Cb 0.96 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1b5i h PRO 153 CO 0.41 0.12 0.00 2.48 -0.21 0.00 0.00 178.00 180.80 1b5i n TYR 154 N -3.96 0.61 -0.24 0.65 0.18 -1.26 -4.65 117.16 108.49 1b5i n TYR 154 Ca -0.02 -0.30 0.03 0.00 1.88 0.00 0.00 57.90 59.48 1b5i n TYR 154 Cb 0.21 0.00 0.12 0.00 -0.38 0.00 0.00 39.34 39.30 1b5i n TYR 154 CO 0.00 0.00 0.00 0.35 -2.08 0.00 0.00 176.86 175.13 1b5i h PHE 155 N 3.00 -0.11 -0.07 -3.48 3.57 -1.72 -0.71 116.94 117.43 1b5i h PHE 155 Ca 0.00 0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.57 1b5i h PHE 155 Cb 0.68 0.16 -0.00 0.00 2.79 0.00 0.00 35.95 39.58 1b5i h PHE 155 CO 0.30 -0.23 0.06 0.10 -2.23 0.00 0.00 178.31 176.31 1b5i h TYR 156 N 0.08 0.00 -0.04 0.41 -0.00 -1.85 -1.09 116.97 114.49 1b5i h TYR 156 Ca 0.37 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 59.10 1b5i h TYR 156 Cb 0.62 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.35 1b5i h TYR 156 CO -0.43 0.00 0.01 0.87 -0.00 0.00 0.00 178.16 178.60 1b5i h LYS 157 N 0.00 0.05 0.00 0.10 1.57 -1.48 -1.95 116.57 114.86 1b5i h LYS 157 Ca 0.03 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1b5i h LYS 157 Cb 0.14 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1b5i h LYS 157 CO -0.00 0.05 -0.22 -0.07 -0.57 0.00 0.00 179.45 178.64 1b5i h LEU 158 N 0.05 0.00 0.00 2.94 4.07 -1.29 -3.35 115.31 117.74 1b5i h LEU 158 Ca 0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1b5i h LEU 158 Cb 0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.77 1b5i h LEU 158 CO -0.00 0.22 0.00 0.18 -1.08 0.00 0.00 178.44 177.76 1b5i n LEU 159 N -3.55 0.00 -0.09 1.67 4.77 -0.73 -2.41 117.00 116.66 1b5i n LEU 159 Ca -0.01 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.10 1b5i n LEU 159 Cb 0.37 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.84 1b5i n LEU 159 CO 0.33 0.00 0.63 1.33 -1.33 0.00 0.00 177.39 178.35 1b5i n VAL 160 N -0.87 0.00 -2.45 4.08 0.24 -1.26 -4.01 118.33 114.06 1b5i n VAL 160 Ca 0.11 -0.05 -0.39 0.00 -2.04 0.00 0.00 64.34 61.98 1b5i n VAL 160 Cb 0.05 0.16 -0.04 0.00 -1.47 0.00 0.00 33.84 32.55 1b5i n VAL 160 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1b5i s HIS 161 N -2.77 3.34 0.54 6.34 5.04 -1.01 -4.89 115.29 121.88 1b5i s HIS 161 Ca 0.18 1.64 0.21 0.00 -1.54 0.00 0.00 55.06 55.56 1b5i s HIS 161 Cb 0.19 -3.26 1.41 0.00 0.04 0.00 0.00 32.58 30.95 1b5i s HIS 161 CO 0.59 -0.78 2.12 -1.35 -2.34 0.00 0.00 174.74 172.98 1b5i h PRO 162 N 3.08 0.00 0.00 2.88 0.11 -1.92 -2.32 132.00 133.83 1b5i h PRO 162 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1b5i h PRO 162 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1b5i h PRO 162 CO 0.64 0.00 -0.04 0.66 -0.21 0.00 0.00 178.00 179.06 1b5i h SER 163 N 0.00 0.00 -0.50 -2.05 4.64 -1.93 -1.75 113.55 111.97 1b5i h SER 163 Ca 0.07 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.31 1b5i h SER 163 Cb 0.31 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.36 1b5i h SER 163 CO -0.00 0.04 0.08 1.33 -0.87 0.00 0.00 176.83 177.40 1b5i n VAL 164 N -3.54 2.65 -2.92 0.95 0.24 -0.87 -4.78 118.33 110.06 1b5i n VAL 164 Ca -0.02 -1.75 -0.30 0.00 -2.04 0.00 0.00 64.34 60.22 1b5i n VAL 164 Cb 0.14 -0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.18 1b5i n VAL 164 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1b5i s SER 165 N -1.39 6.53 0.46 -1.34 0.01 -0.66 -4.57 113.70 112.75 1b5i s SER 165 Ca 0.50 1.11 -0.20 0.00 1.31 0.00 0.00 55.95 58.67 1b5i s SER 165 Cb 0.40 -2.31 -0.09 0.00 0.21 0.00 0.00 66.02 64.22 1b5i s SER 165 CO 0.12 -0.37 1.00 -2.16 0.41 0.00 0.00 173.24 172.24 1b5i s PRO 166 N -3.75 3.99 0.10 12.44 0.04 -1.26 -4.88 135.00 141.67 1b5i s PRO 166 Ca 0.51 1.23 0.09 0.00 0.04 0.00 0.00 61.00 62.88 1b5i s PRO 166 Cb -0.10 -2.13 -0.03 0.00 0.04 0.00 0.00 34.50 32.27 1b5i s PRO 166 CO 0.30 -0.25 -0.24 0.14 0.04 0.00 0.00 177.00 176.98 1b5i s VAL 167 N -2.10 2.01 -0.54 -0.36 -7.23 -1.26 -4.84 120.40 106.08 1b5i s VAL 167 Ca 0.65 -1.57 -0.26 0.00 -1.81 0.00 0.00 61.98 58.99 1b5i s VAL 167 Cb -0.13 -1.78 0.04 0.00 0.56 0.00 0.00 36.38 35.07 1b5i s VAL 167 CO 0.18 0.11 1.02 -2.16 -0.31 0.00 0.00 175.10 173.94 1b5i s PRO 168 N -1.78 3.43 0.22 4.82 0.04 -1.26 -4.75 135.00 135.72 1b5i s PRO 168 Ca 0.11 -0.00 -0.09 0.00 0.04 0.00 0.00 61.00 61.05 1b5i s PRO 168 Cb -0.10 -4.01 0.32 0.00 0.04 0.00 0.00 34.50 30.75 1b5i s PRO 168 CO 0.04 -1.50 1.70 -0.22 0.04 0.00 0.00 177.00 177.07 1b5i h LYS 169 N 9.34 0.25 -0.70 4.56 3.64 -1.99 -2.27 116.57 129.41 1b5i h LYS 169 Ca -0.25 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.09 1b5i h LYS 169 Cb 1.07 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.80 1b5i h LYS 169 CO 1.11 0.17 0.37 0.66 -2.27 0.00 0.00 179.45 179.48 1b5i h SER 170 N 0.26 0.88 -0.23 4.20 4.64 -1.99 -0.04 113.55 121.28 1b5i h SER 170 Ca 0.33 -0.08 -0.12 0.00 -0.47 0.00 0.00 61.79 61.46 1b5i h SER 170 Cb 0.51 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1b5i h SER 170 CO -0.42 0.72 -0.32 0.00 -0.87 0.00 0.00 176.83 175.94 1b5i h ALA 171 N 1.42 0.34 0.17 5.18 0.00 -1.86 0.98 119.26 125.49 1b5i h ALA 171 Ca 0.25 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1b5i h ALA 171 Cb 0.05 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1b5i h ALA 171 CO -0.04 0.38 -0.15 0.28 0.00 0.00 0.00 179.25 179.72 1b5i h VAL 172 N 0.31 0.66 -0.66 0.00 2.07 -1.13 0.11 116.25 117.61 1b5i h VAL 172 Ca 0.02 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.48 1b5i h VAL 172 Cb 0.90 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1b5i h VAL 172 CO 0.07 0.00 0.15 -0.33 0.02 0.00 0.00 177.57 177.48 1b5i h GLU 173 N -0.34 1.05 -0.03 1.57 5.08 -0.98 0.12 114.58 121.05 1b5i h GLU 173 Ca -0.00 -0.25 -0.19 0.00 -1.00 0.00 0.00 59.36 57.92 1b5i h GLU 173 Cb 0.32 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.44 1b5i h GLU 173 CO -0.03 0.94 -0.71 -0.22 -1.00 0.00 0.00 179.01 177.99 1b5i h LYS 174 N 1.00 0.54 -0.02 2.33 3.64 -0.64 -3.37 116.57 120.05 1b5i h LYS 174 Ca 0.21 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1b5i h LYS 174 Cb 0.37 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1b5i h LYS 174 CO 0.00 1.17 -0.12 1.19 -2.27 0.00 0.00 179.45 179.42 1b5i n PHE 175 N -4.11 0.00 0.00 1.91 3.72 0.39 -5.07 117.46 114.30 1b5i n PHE 175 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 1b5i n PHE 175 Cb 0.72 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.26 1b5i n PHE 175 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b5i n GLY 176 N 0.95 3.47 0.00 1.37 0.00 0.41 -1.84 105.19 109.56 1b5i n GLY 176 Ca 0.08 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1b5i n GLY 176 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1b5i n ASP 177 N 4.51 0.00 -1.12 1.61 5.68 -1.26 -2.08 116.55 123.88 1b5i n ASP 177 Ca 0.00 -0.93 0.10 0.00 -0.50 0.00 0.00 54.79 53.46 1b5i n ASP 177 Cb 0.00 0.00 0.27 0.00 -1.14 0.00 0.00 41.12 40.25 1b5i n ASP 177 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1b5i n LYS 178 N -0.92 2.84 0.25 0.11 5.02 -0.77 -4.53 118.16 120.16 1b5i n LYS 178 Ca 0.16 -2.48 0.11 0.00 -2.02 0.00 0.00 58.31 54.08 1b5i n LYS 178 Cb 0.07 -1.49 0.73 0.00 -0.02 0.00 0.00 35.03 34.32 1b5i n LYS 178 CO 0.00 0.00 0.00 0.11 -0.52 0.00 0.00 177.40 176.99 1b5i h TRP 179 N 3.49 0.00 -0.09 2.13 5.08 -1.51 -2.17 115.95 122.88 1b5i h TRP 179 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1b5i h TRP 179 Cb 0.94 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.10 1b5i h TRP 179 CO 0.42 0.00 0.00 0.25 -1.28 0.00 0.00 178.44 177.83 1b5i n THR 180 N -4.31 0.11 -1.98 0.12 -2.24 -1.26 -1.65 114.28 103.08 1b5i n THR 180 Ca -0.02 -0.21 -0.34 0.00 -2.27 0.00 0.00 64.05 61.21 1b5i n THR 180 Cb 0.13 0.14 0.03 0.00 -2.10 0.00 0.00 70.33 68.53 1b5i n THR 180 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1b5i s GLN 181 N -1.89 3.04 0.37 -0.78 -1.52 -0.82 -4.65 119.66 113.43 1b5i s GLN 181 Ca 0.32 1.51 0.06 0.00 -1.95 0.00 0.00 55.36 55.31 1b5i s GLN 181 Cb 0.17 -1.97 0.77 0.00 -0.22 0.00 0.00 33.01 31.76 1b5i s GLN 181 CO 0.26 -1.08 1.98 -1.35 -0.25 0.00 0.00 175.29 174.86 1b5i h PRO 182 N 0.57 0.69 0.00 2.91 0.11 -1.90 0.11 132.00 134.50 1b5i h PRO 182 Ca -0.48 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 1b5i h PRO 182 Cb 1.26 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1b5i h PRO 182 CO 0.55 0.45 -0.16 0.00 -0.21 0.00 0.00 178.00 178.63 1b5i h ALA 183 N 1.63 1.08 0.00 -0.75 0.00 -1.92 -3.33 119.26 115.97 1b5i h ALA 183 Ca 0.27 -0.15 -0.24 0.00 0.00 0.00 0.00 54.91 54.80 1b5i h ALA 183 Cb 0.19 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1b5i h ALA 183 CO -0.08 0.21 -1.90 0.09 0.00 0.00 0.00 179.25 177.57 1b5i n ASN 184 N -3.40 2.01 -4.73 0.00 3.02 -0.26 -5.05 115.26 106.85 1b5i n ASN 184 Ca -0.00 -0.02 -0.35 0.00 -0.03 0.00 0.00 54.58 54.18 1b5i n ASN 184 Cb 0.36 0.58 0.07 0.00 -0.61 0.00 0.00 39.78 40.18 1b5i n ASN 184 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1b5i s ILE 185 N -2.32 2.34 -0.05 2.41 2.07 0.23 -4.91 121.20 120.98 1b5i s ILE 185 Ca -0.10 0.19 0.02 0.00 -1.41 0.00 0.00 60.65 59.34 1b5i s ILE 185 Cb 0.04 -2.88 0.02 0.00 0.13 0.00 0.00 42.46 39.77 1b5i s ILE 185 CO 0.50 -0.07 -0.08 -0.69 -1.91 0.00 0.00 174.94 172.69 1b5i s VAL 186 N -1.79 0.78 0.17 4.00 1.01 -1.26 -4.99 120.40 118.32 1b5i s VAL 186 Ca 0.76 -0.28 0.07 0.00 0.00 0.00 0.00 61.98 62.54 1b5i s VAL 186 Cb -0.31 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 1b5i s VAL 186 CO 0.41 0.28 -0.14 0.42 0.00 0.00 0.00 175.10 176.07 1b5i s THR 187 N 0.77 1.52 -0.01 3.92 -4.23 -1.26 -4.70 115.64 111.65 1b5i s THR 187 Ca -0.13 -2.01 0.01 0.00 -1.18 0.00 0.00 61.69 58.39 1b5i s THR 187 Cb -0.15 -1.84 0.01 0.00 1.34 0.00 0.00 72.50 71.87 1b5i s THR 187 CO 0.02 -0.54 0.91 -0.46 -0.54 0.00 0.00 174.62 174.01 1b5i n ASN 188 N -0.00 1.62 -1.98 3.99 6.94 -0.80 0.43 115.26 125.45 1b5i n ASN 188 Ca -0.11 -1.86 0.00 0.00 -0.02 0.00 0.00 54.58 52.59 1b5i n ASN 188 Cb 0.59 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.99 1b5i n ASN 188 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1b5i n GLY 189 N -0.44 0.06 0.26 4.83 0.00 0.19 -4.44 105.19 105.64 1b5i n GLY 189 Ca 0.01 -1.84 0.17 0.00 0.00 0.00 0.00 46.02 44.36 1b5i n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5i h ALA 190 N -1.11 1.00 -2.03 4.61 0.00 -1.77 -3.42 119.26 116.54 1b5i h ALA 190 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 1b5i h ALA 190 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.65 1b5i h ALA 190 CO 0.00 0.00 -0.68 0.71 0.00 0.00 0.00 179.25 179.28 1b5i s TYR 191 N -3.70 2.09 0.17 0.00 2.02 -0.62 -0.27 117.35 117.04 1b5i s TYR 191 Ca 0.00 -0.64 0.07 0.00 -0.37 0.00 0.00 57.07 56.14 1b5i s TYR 191 Cb 0.10 -1.20 -0.04 0.00 -0.40 0.00 0.00 41.96 40.41 1b5i s TYR 191 CO 0.46 0.37 -0.15 0.15 -1.57 0.00 0.00 175.55 174.81 1b5i s LYS 192 N -3.69 1.24 -0.12 -0.62 1.02 0.12 -4.51 119.74 113.18 1b5i s LYS 192 Ca 0.31 -1.46 -0.26 0.00 0.02 0.00 0.00 55.97 54.57 1b5i s LYS 192 Cb 0.03 -1.12 -0.02 0.00 -0.52 0.00 0.00 37.83 36.20 1b5i s LYS 192 CO 0.13 0.21 0.86 -1.17 -0.92 0.00 0.00 175.35 174.46 1b5i s LEU 193 N -2.94 4.23 -0.21 3.17 2.96 -1.26 -0.97 118.68 123.65 1b5i s LEU 193 Ca 0.17 1.30 -0.16 0.00 -0.22 0.00 0.00 54.13 55.22 1b5i s LEU 193 Cb -0.03 -3.31 -0.09 0.00 0.50 0.00 0.00 46.19 43.26 1b5i s LEU 193 CO 0.06 -0.35 -0.26 1.17 -1.32 0.00 0.00 176.35 175.65 1b5i n LYS 194 N 4.84 0.55 -4.07 1.98 4.81 -0.09 -4.84 118.16 121.33 1b5i n LYS 194 Ca 0.05 0.32 -0.13 0.00 -0.87 0.00 0.00 58.31 57.68 1b5i n LYS 194 Cb 0.49 -1.53 -0.12 0.00 0.02 0.00 0.00 35.03 33.89 1b5i n LYS 194 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 1b5i s ASN 195 N -6.59 0.73 -0.30 3.14 0.01 -0.76 -4.90 114.94 106.26 1b5i s ASN 195 Ca -0.31 -0.45 -0.01 0.00 -0.71 0.00 0.00 52.86 51.39 1b5i s ASN 195 Cb 0.08 0.02 0.13 0.00 0.41 0.00 0.00 41.25 41.89 1b5i s ASN 195 CO 0.44 -0.16 0.27 0.86 -1.51 0.00 0.00 177.10 177.00 1b5i s TRP 196 N -1.12 -0.23 -0.33 2.20 -0.00 -1.26 -0.37 118.94 117.83 1b5i s TRP 196 Ca -0.08 -0.48 -0.06 0.00 -0.00 0.00 0.00 56.10 55.48 1b5i s TRP 196 Cb -0.08 -0.56 0.03 0.00 -0.00 0.00 0.00 33.47 32.86 1b5i s TRP 196 CO 0.00 -0.91 0.09 0.08 -0.00 0.00 0.00 176.95 176.22 1b5i s VAL 197 N 2.11 3.75 0.14 5.86 1.01 0.11 -5.01 120.40 128.36 1b5i s VAL 197 Ca 0.11 -1.06 -0.34 0.00 0.00 0.00 0.00 61.98 60.68 1b5i s VAL 197 Cb -0.15 -3.09 -0.14 0.00 0.00 0.00 0.00 36.38 33.00 1b5i s VAL 197 CO -0.28 -0.12 1.56 0.52 0.00 0.00 0.00 175.10 176.78 1b5i n VAL 198 N 4.81 0.03 -1.42 2.92 0.31 -1.26 -0.84 118.33 122.87 1b5i n VAL 198 Ca -0.13 -0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.05 1b5i n VAL 198 Cb 0.45 -1.44 -0.06 0.00 -0.91 0.00 0.00 33.84 31.88 1b5i n VAL 198 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1b5i n ASN 199 N 3.42 -4.84 0.09 4.52 5.03 -1.26 -4.76 115.26 117.47 1b5i n ASN 199 Ca 0.17 0.36 0.00 0.00 0.87 0.00 0.00 54.58 55.98 1b5i n ASN 199 Cb 0.27 -3.62 0.00 0.00 -1.02 0.00 0.00 39.78 35.42 1b5i n ASN 199 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 1b5i n GLU 200 N -2.47 0.00 -3.51 3.52 2.13 -0.02 -4.92 120.64 115.38 1b5i n GLU 200 Ca -0.15 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.59 1b5i n GLU 200 Cb 0.49 -0.15 -0.02 0.00 0.27 0.00 0.00 31.44 32.03 1b5i n GLU 200 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1b5i s ARG 201 N -1.81 0.79 -0.12 5.31 1.70 -0.38 -4.42 118.95 120.03 1b5i s ARG 201 Ca 0.00 -0.28 0.02 0.00 -0.47 0.00 0.00 55.73 55.00 1b5i s ARG 201 Cb 0.00 0.37 0.01 0.00 -0.57 0.00 0.00 34.95 34.76 1b5i s ARG 201 CO 0.00 -0.34 -0.18 0.42 -1.08 0.00 0.00 175.30 174.11 1b5i s ILE 202 N -3.04 1.73 -0.13 4.99 1.01 -0.22 -0.71 121.20 124.83 1b5i s ILE 202 Ca 0.05 -0.78 0.02 0.00 0.00 0.00 0.00 60.65 59.94 1b5i s ILE 202 Cb -0.01 -1.55 0.00 0.00 0.01 0.00 0.00 42.46 40.91 1b5i s ILE 202 CO -0.09 0.49 -0.21 -0.69 0.00 0.00 0.00 174.94 174.44 1b5i s VAL 203 N 0.89 2.25 0.08 2.92 1.01 0.50 0.33 120.40 128.38 1b5i s VAL 203 Ca -0.07 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.04 1b5i s VAL 203 Cb -0.15 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1b5i s VAL 203 CO -0.01 0.55 -0.13 -0.76 0.00 0.00 0.00 175.10 174.74 1b5i s LEU 204 N 0.58 2.90 0.09 3.92 1.43 -0.03 -0.92 118.68 126.64 1b5i s LEU 204 Ca -0.12 -0.40 0.07 0.00 -1.03 0.00 0.00 54.13 52.65 1b5i s LEU 204 Cb -0.17 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.32 1b5i s LEU 204 CO 0.03 0.21 -0.18 -1.83 0.23 0.00 0.00 176.35 174.81 1b5i s GLU 205 N -1.95 0.99 0.22 1.70 -1.05 -0.14 -1.91 118.70 116.56 1b5i s GLU 205 Ca 0.19 -1.06 -0.28 0.00 -0.15 0.00 0.00 54.97 53.66 1b5i s GLU 205 Cb -0.11 -1.13 -0.16 0.00 -0.44 0.00 0.00 34.13 32.29 1b5i s GLU 205 CO 0.10 0.26 0.70 -2.13 0.95 0.00 0.00 175.26 175.14 1b5i n ARG 206 N 1.20 0.43 -3.43 -4.83 0.63 -0.61 0.15 116.66 110.20 1b5i n ARG 206 Ca -0.20 0.15 -0.44 0.00 -0.92 0.00 0.00 57.85 56.44 1b5i n ARG 206 Cb 0.54 -1.29 -0.08 0.00 0.45 0.00 0.00 32.46 32.08 1b5i n ARG 206 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1b5i s ASN 207 N -0.82 6.03 0.41 6.15 2.47 0.62 -4.55 114.94 125.25 1b5i s ASN 207 Ca 0.63 -1.42 0.29 0.00 0.42 0.00 0.00 52.86 52.78 1b5i s ASN 207 Cb -0.87 -2.14 1.39 0.00 -1.45 0.00 0.00 41.25 38.19 1b5i s ASN 207 CO 0.57 -0.64 1.87 1.55 -3.72 0.00 0.00 177.10 176.73 1b5i h PRO 208 N 8.68 0.00 0.00 0.43 0.13 -1.92 -1.95 132.00 137.38 1b5i h PRO 208 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1b5i h PRO 208 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1b5i h PRO 208 CO 0.87 0.00 -0.31 1.04 -0.23 0.00 0.00 178.00 179.37 1b5i n GLN 209 N -2.55 0.18 -1.64 0.86 1.13 -1.26 -4.87 117.38 109.22 1b5i n GLN 209 Ca -0.00 0.09 -0.47 0.00 -1.94 0.00 0.00 57.00 54.68 1b5i n GLN 209 Cb 0.15 -1.65 -0.04 0.00 0.11 0.00 0.00 30.24 28.80 1b5i n GLN 209 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 1b5i n TYR 210 N -1.94 1.90 -0.24 1.08 9.36 -0.73 -4.26 117.16 122.33 1b5i n TYR 210 Ca 0.05 0.48 0.11 0.00 3.32 0.00 0.00 57.90 61.86 1b5i n TYR 210 Cb 0.40 -2.42 0.39 0.00 -0.63 0.00 0.00 39.34 37.08 1b5i n TYR 210 CO 0.00 0.00 0.00 0.11 0.22 0.00 0.00 176.86 177.19 1b5i h TRP 211 N 4.53 0.76 -0.71 2.98 5.08 -1.85 -1.48 115.95 125.26 1b5i h TRP 211 Ca -0.45 0.02 -0.21 0.00 1.08 0.00 0.00 58.89 59.33 1b5i h TRP 211 Cb 1.29 -0.24 -0.12 0.00 -3.00 0.00 0.00 29.16 27.09 1b5i h TRP 211 CO 0.58 0.31 0.25 -3.47 -1.28 0.00 0.00 178.44 174.83 1b5i n ASP 212 N -4.53 4.76 -0.21 0.11 2.03 -1.26 -4.68 116.55 112.76 1b5i n ASP 212 Ca 0.15 -3.24 0.13 0.00 0.52 0.00 0.00 54.79 52.36 1b5i n ASP 212 Cb 0.42 -0.74 0.43 0.00 -0.72 0.00 0.00 41.12 40.52 1b5i n ASP 212 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 1b5i h ASN 213 N 2.61 0.53 -0.29 1.67 -1.24 -1.58 -1.41 115.58 115.87 1b5i h ASN 213 Ca 0.26 0.03 0.09 0.00 0.71 0.00 0.00 56.30 57.38 1b5i h ASN 213 Cb 2.29 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 41.25 1b5i h ASN 213 CO 0.71 0.28 0.22 0.00 -1.29 0.00 0.00 177.43 177.36 1b5i h ALA 214 N 1.62 2.21 -0.00 1.57 0.00 -1.84 -0.98 119.26 121.84 1b5i h ALA 214 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1b5i h ALA 214 Cb 0.72 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1b5i h ALA 214 CO -0.15 -0.38 -0.38 1.63 0.00 0.00 0.00 179.25 179.97 1b5i n LYS 215 N -4.32 0.35 -2.28 0.00 5.02 -0.53 -4.88 118.16 111.51 1b5i n LYS 215 Ca 0.04 -0.20 -0.41 0.00 -2.02 0.00 0.00 58.31 55.72 1b5i n LYS 215 Cb 0.39 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.87 1b5i n LYS 215 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1b5i s THR 216 N -2.78 3.30 -0.11 -0.18 2.01 -0.37 0.25 115.64 117.75 1b5i s THR 216 Ca 0.17 1.12 -0.06 0.00 0.31 0.00 0.00 61.69 63.24 1b5i s THR 216 Cb 0.18 -3.72 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 1b5i s THR 216 CO 0.62 0.19 -0.14 0.52 -0.69 0.00 0.00 174.62 175.12 1b5i n VAL 217 N 2.24 0.64 -2.09 3.82 0.31 -1.26 -4.90 118.33 117.08 1b5i n VAL 217 Ca 0.04 -0.14 -0.42 0.00 -0.01 0.00 0.00 64.34 63.81 1b5i n VAL 217 Cb 0.43 -1.66 -0.03 0.00 -0.91 0.00 0.00 33.84 31.68 1b5i n VAL 217 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1b5i s ILE 218 N -2.21 3.37 -0.23 2.52 -1.09 -1.26 -4.85 121.20 117.45 1b5i s ILE 218 Ca -0.16 0.82 0.20 0.00 -2.23 0.00 0.00 60.65 59.29 1b5i s ILE 218 Cb 0.06 -3.53 0.04 0.00 -1.58 0.00 0.00 42.46 37.45 1b5i s ILE 218 CO 0.20 0.01 1.15 0.78 -1.23 0.00 0.00 174.94 175.84 1b5i h ASN 219 N 7.87 0.00 -3.16 3.58 2.35 -1.11 -3.43 115.58 121.68 1b5i h ASN 219 Ca -0.40 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.29 1b5i h ASN 219 Cb 1.19 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 39.32 1b5i h ASN 219 CO 0.91 0.23 -0.15 -1.58 -1.65 0.00 0.00 177.43 175.18 1b5i s GLN 220 N -3.16 0.54 -0.03 0.81 0.74 -1.21 -1.57 119.66 115.78 1b5i s GLN 220 Ca 0.01 0.97 0.04 0.00 0.05 0.00 0.00 55.36 56.43 1b5i s GLN 220 Cb 0.08 0.06 -0.00 0.00 1.10 0.00 0.00 33.01 34.25 1b5i s GLN 220 CO 0.77 -0.15 -0.14 0.54 -0.55 0.00 0.00 175.29 175.76 1b5i s VAL 221 N 1.45 1.14 -0.12 1.34 0.11 -0.80 -1.27 120.40 122.24 1b5i s VAL 221 Ca -0.09 -0.58 -0.01 0.00 -2.93 0.00 0.00 61.98 58.37 1b5i s VAL 221 Cb -0.07 -0.97 -0.02 0.00 -1.53 0.00 0.00 36.38 33.78 1b5i s VAL 221 CO -0.15 0.33 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.98 1b5i s THR 222 N -0.07 3.58 -0.19 5.04 2.01 -0.22 -0.85 115.64 124.93 1b5i s THR 222 Ca 0.00 -0.49 -0.05 0.00 0.31 0.00 0.00 61.69 61.46 1b5i s THR 222 Cb -0.08 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 1b5i s THR 222 CO 0.01 0.54 0.00 -0.31 -0.69 0.00 0.00 174.62 174.16 1b5i s TYR 223 N -0.04 3.05 0.23 4.92 2.02 0.15 -0.55 117.35 127.13 1b5i s TYR 223 Ca -0.00 -0.39 0.05 0.00 -0.37 0.00 0.00 57.07 56.36 1b5i s TYR 223 Cb -0.14 -2.06 -0.03 0.00 -0.40 0.00 0.00 41.96 39.33 1b5i s TYR 223 CO 0.03 -0.17 0.29 -0.51 -1.57 0.00 0.00 175.55 173.61 1b5i s LEU 224 N 0.85 4.13 -0.54 -1.29 1.43 -0.38 -1.05 118.68 121.83 1b5i s LEU 224 Ca 0.01 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 1b5i s LEU 224 Cb -0.14 -2.68 0.43 0.00 0.03 0.00 0.00 46.19 43.83 1b5i s LEU 224 CO 0.02 -0.04 1.60 -0.81 0.23 0.00 0.00 176.35 177.35 1b5i n PRO 225 N -1.17 3.13 -2.86 1.29 -0.04 -1.26 0.34 135.00 134.44 1b5i n PRO 225 Ca -0.08 -3.83 -0.43 0.00 -0.04 0.00 0.00 63.50 59.12 1b5i n PRO 225 Cb 0.57 -2.28 -0.04 0.00 -0.04 0.00 0.00 33.50 31.71 1b5i n PRO 225 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1b5i s ILE 226 N -4.92 4.58 -0.45 0.52 1.01 -1.26 -4.00 121.20 116.68 1b5i s ILE 226 Ca 0.55 0.91 0.23 0.00 0.00 0.00 0.00 60.65 62.34 1b5i s ILE 226 Cb 0.45 -4.34 0.00 0.00 0.01 0.00 0.00 42.46 38.57 1b5i s ILE 226 CO -0.10 -0.63 1.15 -1.54 0.00 0.00 0.00 174.94 173.82 1b5i n SER 227 N 6.83 0.75 -4.62 3.58 3.41 -1.16 -3.96 113.62 118.44 1b5i n SER 227 Ca 0.05 0.16 -0.43 0.00 -0.26 0.00 0.00 58.87 58.40 1b5i n SER 227 Cb 0.48 0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 64.80 1b5i n SER 227 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1b5i s SER 228 N -4.68 6.64 0.42 4.04 0.15 -1.26 -4.15 113.70 114.86 1b5i s SER 228 Ca 0.03 1.08 0.16 0.00 0.70 0.00 0.00 55.95 57.92 1b5i s SER 228 Cb 0.12 -2.54 0.93 0.00 -1.71 0.00 0.00 66.02 62.82 1b5i s SER 228 CO 0.76 -1.13 1.91 -0.33 1.20 0.00 0.00 173.24 175.65 1b5i h GLU 229 N 9.41 0.00 -0.27 5.44 3.07 -1.88 -1.13 114.58 129.22 1b5i h GLU 229 Ca -0.26 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.57 1b5i h GLU 229 Cb 1.09 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.99 1b5i h GLU 229 CO 1.05 0.27 0.03 0.28 -1.40 0.00 0.00 179.01 179.24 1b5i h VAL 230 N 0.00 1.24 -0.65 3.13 2.07 -1.94 -1.84 116.25 118.26 1b5i h VAL 230 Ca -0.00 -0.83 -0.06 0.00 0.82 0.00 0.00 66.70 66.62 1b5i h VAL 230 Cb 0.52 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1b5i h VAL 230 CO 0.04 0.27 0.17 0.74 0.02 0.00 0.00 177.57 178.80 1b5i h THR 231 N 0.26 1.25 0.04 2.57 2.02 -1.82 0.35 112.91 117.58 1b5i h THR 231 Ca 0.08 -0.90 0.01 0.00 0.77 0.00 0.00 66.41 66.37 1b5i h THR 231 Cb 0.37 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1b5i h THR 231 CO 0.01 0.35 -0.07 -0.78 0.37 0.00 0.00 175.52 175.39 1b5i h ASP 232 N 0.98 -0.20 -0.84 4.18 3.58 -1.13 0.72 116.42 123.70 1b5i h ASP 232 Ca 0.21 0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.70 1b5i h ASP 232 Cb 0.33 0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.41 1b5i h ASP 232 CO -0.00 -0.11 0.55 0.58 -2.88 0.00 0.00 179.24 177.38 1b5i h VAL 233 N -0.15 1.19 -0.39 2.25 2.07 -1.06 0.12 116.25 120.28 1b5i h VAL 233 Ca 0.02 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 1b5i h VAL 233 Cb 0.17 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 1b5i h VAL 233 CO -0.05 0.20 0.24 0.78 0.02 0.00 0.00 177.57 178.77 1b5i h ASN 234 N 1.11 0.46 1.35 0.57 2.35 -0.24 0.97 115.58 122.15 1b5i h ASN 234 Ca 0.32 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1b5i h ASN 234 Cb -0.09 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.17 1b5i h ASN 234 CO -0.08 0.36 0.00 0.03 -1.65 0.00 0.00 177.43 176.09 1b5i h ARG 235 N 0.51 0.00 0.02 0.81 3.08 -0.53 -0.03 114.38 118.25 1b5i h ARG 235 Ca 0.14 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 1b5i h ARG 235 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1b5i h ARG 235 CO -0.03 0.00 -0.01 -0.92 -1.07 0.00 0.00 179.97 177.94 1b5i h TYR 236 N 0.00 -0.03 0.00 3.04 5.03 -0.35 -0.43 116.97 124.22 1b5i h TYR 236 Ca 0.00 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 1b5i h TYR 236 Cb 0.67 0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.96 1b5i h TYR 236 CO 0.00 0.61 0.00 0.00 -1.32 0.00 0.00 178.16 177.45 1b5i h ARG 237 N -0.71 0.00 0.00 1.82 3.08 -0.55 -1.34 114.38 116.68 1b5i h ARG 237 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1b5i h ARG 237 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1b5i h ARG 237 CO 0.01 0.00 0.00 0.66 -1.07 0.00 0.00 179.97 179.57 1b5i h SER 238 N 0.00 0.00 0.00 7.04 4.64 -1.07 -3.47 113.55 120.70 1b5i h SER 238 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1b5i h SER 238 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1b5i h SER 238 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1b5i n GLY 239 N 0.69 1.83 0.23 -0.77 0.00 -0.51 -4.99 105.19 101.67 1b5i n GLY 239 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.95 1b5i n GLY 239 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1b5i h GLU 240 N 1.68 0.65 -5.34 1.61 4.81 -1.41 -3.44 114.58 113.13 1b5i h GLU 240 Ca 0.00 -0.38 -0.63 0.00 -0.13 0.00 0.00 59.36 58.22 1b5i h GLU 240 Cb 0.00 0.03 -0.17 0.00 0.63 0.00 0.00 28.75 29.25 1b5i h GLU 240 CO 0.00 1.00 -0.59 0.42 -0.73 0.00 0.00 179.01 179.11 1b5i s ILE 241 N -4.11 4.58 -0.06 2.32 1.01 -0.29 -4.74 121.20 119.92 1b5i s ILE 241 Ca -0.08 -0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.49 1b5i s ILE 241 Cb 0.11 -3.04 -0.25 0.00 0.01 0.00 0.00 42.46 39.29 1b5i s ILE 241 CO 0.85 0.48 0.62 0.44 0.00 0.00 0.00 174.94 177.33 1b5i h ASP 242 N 6.54 0.20 -3.26 3.58 3.32 -1.53 -3.40 116.42 121.86 1b5i h ASP 242 Ca -0.37 -0.40 -0.42 0.00 0.02 0.00 0.00 57.03 55.87 1b5i h ASP 242 Cb 1.18 -0.06 -0.39 0.00 0.22 0.00 0.00 39.33 40.27 1b5i h ASP 242 CO 0.68 1.35 -0.75 -0.04 -1.72 0.00 0.00 179.24 178.75 1b5i s MET 243 N -2.59 0.29 1.02 3.56 -1.94 -1.02 -1.82 119.30 116.79 1b5i s MET 243 Ca -0.11 0.17 -0.14 0.00 -1.71 0.00 0.00 55.69 53.90 1b5i s MET 243 Cb 0.07 -0.93 0.20 0.00 2.01 0.00 0.00 34.83 36.18 1b5i s MET 243 CO 0.81 -0.37 1.13 0.95 -0.01 0.00 0.00 175.02 177.53 1b5i s THR 244 N 2.06 1.91 0.87 2.05 -4.23 -0.60 -1.09 115.64 116.60 1b5i s THR 244 Ca 0.04 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 60.43 1b5i s THR 244 Cb -0.13 -2.61 0.11 0.00 1.34 0.00 0.00 72.50 71.22 1b5i s THR 244 CO -0.05 0.00 1.12 -0.47 -0.54 0.00 0.00 174.62 174.68 1b5i s TYR 245 N -3.14 2.62 -0.94 3.99 5.04 -1.24 -4.52 117.35 119.16 1b5i s TYR 245 Ca 0.67 0.99 -0.02 0.00 -2.44 0.00 0.00 57.07 56.26 1b5i s TYR 245 Cb -0.14 -3.27 0.29 0.00 0.35 0.00 0.00 41.96 39.18 1b5i s TYR 245 CO 0.56 -2.16 2.03 0.27 -1.34 0.00 0.00 175.55 174.91 1b5i n ASN 246 N -3.65 7.43 -3.84 4.32 6.94 -1.26 -4.62 115.26 120.58 1b5i n ASN 246 Ca 0.07 -3.66 -0.25 0.00 -0.02 0.00 0.00 54.58 50.72 1b5i n ASN 246 Cb 0.58 -1.16 -0.17 0.00 -2.36 0.00 0.00 39.78 36.67 1b5i n ASN 246 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1b5i s ASN 247 N -0.95 1.96 -0.01 0.53 0.01 -1.25 -4.60 114.94 110.62 1b5i s ASN 247 Ca 0.47 -0.23 0.01 0.00 -0.71 0.00 0.00 52.86 52.39 1b5i s ASN 247 Cb 0.30 -0.65 -0.04 0.00 0.41 0.00 0.00 41.25 41.27 1b5i s ASN 247 CO -0.24 -0.16 0.02 -0.04 -1.51 0.00 0.00 177.10 175.16 1b5i s MET 248 N 1.83 2.87 0.23 -0.60 -1.94 -1.26 -4.83 119.30 115.60 1b5i s MET 248 Ca 0.05 -0.56 -0.30 0.00 -1.71 0.00 0.00 55.69 53.17 1b5i s MET 248 Cb -0.13 -2.72 -0.09 0.00 2.01 0.00 0.00 34.83 33.90 1b5i s MET 248 CO -0.07 0.64 1.11 -1.25 -0.01 0.00 0.00 175.02 175.45 1b5i s PRO 249 N -1.51 4.60 0.26 2.03 0.04 -1.26 -4.80 135.00 134.36 1b5i s PRO 249 Ca 0.19 1.78 -0.03 0.00 0.04 0.00 0.00 61.00 62.99 1b5i s PRO 249 Cb -0.12 -3.23 0.32 0.00 0.04 0.00 0.00 34.50 31.51 1b5i s PRO 249 CO 0.10 0.11 1.77 0.82 0.04 0.00 0.00 177.00 179.84 1b5i h ILE 250 N 3.44 1.24 -0.74 0.56 2.04 -1.93 -2.42 117.51 119.70 1b5i h ILE 250 Ca -0.45 -0.96 0.13 0.00 1.00 0.00 0.00 64.86 64.58 1b5i h ILE 250 Cb 1.21 0.79 -0.09 0.00 -0.74 0.00 0.00 36.82 37.99 1b5i h ILE 250 CO 0.70 0.35 0.30 -0.33 0.00 0.00 0.00 178.15 179.17 1b5i h GLU 251 N 0.80 0.45 0.00 2.37 3.07 -1.97 -3.35 114.58 115.95 1b5i h GLU 251 Ca 0.16 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.99 1b5i h GLU 251 Cb 0.41 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 1b5i h GLU 251 CO 0.01 0.30 -1.02 1.28 -1.40 0.00 0.00 179.01 178.18 1b5i n LEU 252 N -4.98 0.17 -0.21 1.33 4.77 -1.15 -4.81 117.00 112.12 1b5i n LEU 252 Ca 0.13 -0.20 0.01 0.00 -0.03 0.00 0.00 56.01 55.93 1b5i n LEU 252 Cb 0.38 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.60 1b5i n LEU 252 CO 0.19 0.04 0.94 0.15 -1.33 0.00 0.00 177.39 177.39 1b5i h PHE 253 N 0.00 0.27 -0.59 -1.77 3.57 -1.58 -0.72 116.94 116.13 1b5i h PHE 253 Ca 0.00 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1b5i h PHE 253 Cb 0.34 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 1b5i h PHE 253 CO 0.00 -0.00 0.36 1.96 -2.23 0.00 0.00 178.31 178.40 1b5i h GLN 254 N 0.31 0.79 -0.48 1.11 1.08 -1.87 -1.06 115.11 114.99 1b5i h GLN 254 Ca 0.33 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.47 1b5i h GLN 254 Cb 0.49 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 27.73 1b5i h GLN 254 CO -0.40 0.56 0.31 0.87 -0.95 0.00 0.00 178.83 179.22 1b5i h LYS 255 N 0.79 0.65 -0.94 1.46 1.57 -1.77 -2.79 116.57 115.54 1b5i h LYS 255 Ca 0.21 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1b5i h LYS 255 Cb -0.03 -0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.09 1b5i h LYS 255 CO -0.04 0.45 0.59 -0.07 -0.57 0.00 0.00 179.45 179.80 1b5i h LEU 256 N 0.65 1.12 -1.52 2.94 3.38 -0.59 0.11 115.31 121.40 1b5i h LEU 256 Ca 0.18 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1b5i h LEU 256 Cb -0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.41 1b5i h LEU 256 CO -0.04 0.84 0.00 0.50 0.09 0.00 0.00 178.44 179.84 1b5i h LYS 257 N 1.29 0.31 0.00 1.13 1.63 -0.94 0.26 116.57 120.25 1b5i h LYS 257 Ca 0.34 -0.05 -0.25 0.00 -0.85 0.00 0.00 60.65 59.85 1b5i h LYS 257 Cb -0.09 -0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 31.45 1b5i h LYS 257 CO -0.07 0.33 -1.41 0.87 -3.45 0.00 0.00 179.45 175.73 1b5i h LYS 258 N 0.31 0.00 0.17 1.90 1.79 -1.19 -3.25 116.57 116.30 1b5i h LYS 258 Ca 0.07 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.25 1b5i h LYS 258 Cb 0.20 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.87 1b5i h LYS 258 CO 0.00 0.63 -1.38 0.93 -1.08 0.00 0.00 179.45 178.55 1b5i h GLU 259 N 0.00 0.36 -2.07 3.15 5.08 -0.34 -3.41 114.58 117.34 1b5i h GLU 259 Ca -0.18 -0.61 -0.51 0.00 -1.00 0.00 0.00 59.36 57.06 1b5i h GLU 259 Cb 1.87 0.23 -0.40 0.00 0.50 0.00 0.00 28.75 30.95 1b5i h GLU 259 CO 0.09 1.29 -1.04 0.44 -1.00 0.00 0.00 179.01 178.79 1b5i n ILE 260 N -3.84 0.64 -0.30 3.13 -5.35 0.86 -4.97 119.36 109.52 1b5i n ILE 260 Ca -0.21 -4.81 0.11 0.00 -0.27 0.00 0.00 62.75 57.57 1b5i n ILE 260 Cb 0.97 -0.69 0.28 0.00 -1.74 0.00 0.00 39.64 38.46 1b5i n ILE 260 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 1b5i h PRO 261 N 3.09 0.49 0.00 6.28 0.13 -1.65 0.69 132.00 141.02 1b5i h PRO 261 Ca 0.11 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1b5i h PRO 261 Cb 0.84 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1b5i h PRO 261 CO 0.58 0.32 0.00 -0.91 -0.23 0.00 0.00 178.00 177.76 1b5i h ASN 262 N 0.50 0.00 0.37 1.44 2.35 -1.93 -2.82 115.58 115.49 1b5i h ASN 262 Ca 0.52 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.27 1b5i h ASN 262 Cb 0.90 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.27 1b5i h ASN 262 CO -0.46 0.00 -1.21 -0.62 -1.65 0.00 0.00 177.43 173.50 1b5i n GLU 263 N -2.74 0.36 -2.76 0.81 1.02 0.22 -4.80 120.64 112.74 1b5i n GLU 263 Ca 0.01 -0.03 -0.42 0.00 -0.02 0.00 0.00 57.16 56.70 1b5i n GLU 263 Cb 0.24 -1.59 -0.03 0.00 -0.02 0.00 0.00 31.44 30.04 1b5i n GLU 263 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1b5i s VAL 264 N -3.26 4.15 -0.17 2.62 1.01 -1.07 -1.50 120.40 122.19 1b5i s VAL 264 Ca 0.01 -0.22 -0.17 0.00 0.00 0.00 0.00 61.98 61.60 1b5i s VAL 264 Cb 0.14 -4.78 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 1b5i s VAL 264 CO 0.83 -1.60 0.45 -0.13 0.00 0.00 0.00 175.10 174.64 1b5i s ARG 265 N 4.52 4.24 -0.19 2.72 1.81 -0.20 -4.96 118.95 126.89 1b5i s ARG 265 Ca 0.28 0.33 -0.02 0.00 -1.72 0.00 0.00 55.73 54.60 1b5i s ARG 265 Cb -0.13 -3.50 0.05 0.00 -0.45 0.00 0.00 34.95 30.93 1b5i s ARG 265 CO 0.09 0.02 -0.00 0.08 -0.68 0.00 0.00 175.30 174.82 1b5i s VAL 266 N 1.09 0.81 0.15 3.52 1.01 -1.26 -1.44 120.40 124.29 1b5i s VAL 266 Ca 0.22 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.58 1b5i s VAL 266 Cb -0.15 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 1b5i s VAL 266 CO 0.09 -0.09 -0.00 -1.81 0.00 0.00 0.00 175.10 173.29 1b5i s ASP 267 N 1.74 1.07 0.57 3.32 1.01 -0.80 -4.94 116.67 118.65 1b5i s ASP 267 Ca -0.01 -1.14 -0.21 0.00 0.71 0.00 0.00 52.55 51.90 1b5i s ASP 267 Cb -0.17 0.14 -0.04 0.00 1.01 0.00 0.00 42.92 43.86 1b5i s ASP 267 CO -0.07 -0.57 1.30 -2.65 0.21 0.00 0.00 175.17 173.39 1b5i n PRO 268 N -0.18 1.47 -3.72 8.23 -0.02 -1.26 0.66 135.00 140.18 1b5i n PRO 268 Ca -0.08 0.55 -0.12 0.00 -2.02 0.00 0.00 63.50 61.84 1b5i n PRO 268 Cb 0.63 -2.52 -0.12 0.00 -0.02 0.00 0.00 33.50 31.47 1b5i n PRO 268 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1b5i s TYR 269 N -1.33 -0.39 -1.34 6.00 5.04 -1.25 -4.44 117.35 119.64 1b5i s TYR 269 Ca 0.74 0.91 -0.09 0.00 -2.44 0.00 0.00 57.07 56.19 1b5i s TYR 269 Cb -0.41 0.10 0.12 0.00 0.35 0.00 0.00 41.96 42.12 1b5i s TYR 269 CO 0.47 -0.26 2.11 1.28 -1.34 0.00 0.00 175.55 177.81 1b5i n LEU 270 N 4.16 7.12 -4.06 6.97 4.77 0.10 -4.49 117.00 131.56 1b5i n LEU 270 Ca -0.24 -4.60 -0.12 0.00 -0.03 0.00 0.00 56.01 51.02 1b5i n LEU 270 Cb 0.54 -1.49 -0.11 0.00 -2.33 0.00 0.00 43.42 40.03 1b5i n LEU 270 CO 0.13 1.52 -0.39 0.00 -1.33 0.00 0.00 177.39 177.32 1b5i s THR 272 N -1.83 1.49 -0.14 0.00 2.01 -0.13 -1.40 115.64 115.64 1b5i s THR 272 Ca -0.07 -0.71 -0.15 0.00 0.31 0.00 0.00 61.69 61.07 1b5i s THR 272 Cb -0.07 -1.30 -0.05 0.00 0.01 0.00 0.00 72.50 71.09 1b5i s THR 272 CO -0.01 0.43 0.35 -0.47 -0.69 0.00 0.00 174.62 174.23 1b5i s TYR 273 N 0.36 3.48 0.23 4.92 6.14 0.23 -1.92 117.35 130.79 1b5i s TYR 273 Ca -0.12 0.70 -0.14 0.00 0.64 0.00 0.00 57.07 58.14 1b5i s TYR 273 Cb -0.15 -2.40 0.01 0.00 0.42 0.00 0.00 41.96 39.83 1b5i s TYR 273 CO 0.05 0.23 0.49 1.52 0.64 0.00 0.00 175.55 178.47 1b5i s TYR 274 N 0.47 0.19 -0.29 4.97 1.13 -0.43 -0.88 117.35 122.51 1b5i s TYR 274 Ca 0.20 -0.56 -0.09 0.00 -1.41 0.00 0.00 57.07 55.21 1b5i s TYR 274 Cb -0.14 0.26 -0.02 0.00 -1.10 0.00 0.00 41.96 40.96 1b5i s TYR 274 CO 0.06 -0.96 0.14 0.71 -2.51 0.00 0.00 175.55 172.99 1b5i s TYR 275 N -3.97 3.16 -0.19 -3.49 2.02 0.70 -0.64 117.35 114.95 1b5i s TYR 275 Ca 0.17 -0.36 -0.28 0.00 -0.37 0.00 0.00 57.07 56.23 1b5i s TYR 275 Cb -0.01 -2.33 -0.00 0.00 -0.40 0.00 0.00 41.96 39.22 1b5i s TYR 275 CO 0.05 -0.36 0.96 -2.00 -1.57 0.00 0.00 175.55 172.63 1b5i s GLU 276 N 1.65 4.30 -0.08 -0.62 2.12 0.13 -1.07 118.70 125.13 1b5i s GLU 276 Ca 0.06 1.24 -0.11 0.00 0.36 0.00 0.00 54.97 56.52 1b5i s GLU 276 Cb -0.16 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.58 1b5i s GLU 276 CO 0.07 -0.47 0.26 0.42 -0.54 0.00 0.00 175.26 174.99 1b5i s ILE 277 N 2.63 5.30 -0.77 -3.70 1.01 -1.26 -0.51 121.20 123.91 1b5i s ILE 277 Ca 0.43 0.48 -0.25 0.00 0.00 0.00 0.00 60.65 61.31 1b5i s ILE 277 Cb -0.16 -3.54 0.05 0.00 0.01 0.00 0.00 42.46 38.81 1b5i s ILE 277 CO 0.11 0.58 1.21 0.21 0.00 0.00 0.00 174.94 177.04 1b5i s ASN 278 N -0.87 6.24 0.48 3.58 2.47 -0.46 -4.67 114.94 121.72 1b5i s ASN 278 Ca 0.18 -0.84 0.33 0.00 0.42 0.00 0.00 52.86 52.95 1b5i s ASN 278 Cb -0.14 -2.51 1.51 0.00 -1.45 0.00 0.00 41.25 38.66 1b5i s ASN 278 CO 0.07 -1.64 1.98 0.78 -3.72 0.00 0.00 177.10 174.57 1b5i h ASN 279 N 9.80 0.00 0.01 -4.21 2.35 -1.43 -3.02 115.58 119.08 1b5i h ASN 279 Ca -0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 1b5i h ASN 279 Cb 1.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.42 1b5i h ASN 279 CO 1.27 0.00 -0.06 0.00 -1.65 0.00 0.00 177.43 176.99 1b5i n GLN 280 N -2.79 1.72 -4.73 0.81 6.02 -1.25 -3.86 117.38 113.29 1b5i n GLN 280 Ca -0.00 -1.18 -0.33 0.00 -0.01 0.00 0.00 57.00 55.49 1b5i n GLN 280 Cb 0.20 -1.48 -0.16 0.00 1.02 0.00 0.00 30.24 29.83 1b5i n GLN 280 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1b5i s LYS 281 N -2.09 3.17 0.48 -1.09 2.20 -1.14 -4.89 119.74 116.38 1b5i s LYS 281 Ca 0.32 -0.79 -0.23 0.00 -0.36 0.00 0.00 55.97 54.91 1b5i s LYS 281 Cb 0.20 -2.52 -0.07 0.00 -1.51 0.00 0.00 37.83 33.93 1b5i s LYS 281 CO 0.36 0.07 1.29 0.00 -0.36 0.00 0.00 175.35 176.72 1b5i s ALA 282 N 0.65 3.01 -1.39 3.13 0.00 -1.26 0.94 121.76 126.84 1b5i s ALA 282 Ca -0.09 1.20 0.09 0.00 0.00 0.00 0.00 51.96 53.16 1b5i s ALA 282 Cb -0.16 -3.49 0.34 0.00 0.00 0.00 0.00 23.12 19.81 1b5i s ALA 282 CO 0.02 -1.01 1.18 -0.35 0.00 0.00 0.00 175.76 175.61 1b5i n PRO 283 N -0.51 2.28 0.00 0.00 -0.04 -1.26 -4.89 135.00 130.58 1b5i n PRO 283 Ca 0.07 -1.36 0.12 0.00 -0.04 0.00 0.00 63.50 62.29 1b5i n PRO 283 Cb 0.45 -1.54 0.73 0.00 -0.04 0.00 0.00 33.50 33.11 1b5i n PRO 283 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1b5i n PHE 284 N 0.42 0.00 1.50 0.54 3.72 0.27 -2.38 117.46 121.54 1b5i n PHE 284 Ca 0.12 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.65 1b5i n PHE 284 Cb 0.48 0.00 0.52 0.00 -0.94 0.00 0.00 39.48 39.54 1b5i n PHE 284 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1b5i n ASN 285 N -0.92 1.26 -4.57 4.37 6.94 -1.14 -4.60 115.26 116.61 1b5i n ASN 285 Ca 0.18 -1.51 -0.40 0.00 -0.02 0.00 0.00 54.58 52.84 1b5i n ASN 285 Cb 0.08 -0.04 -0.10 0.00 -2.36 0.00 0.00 39.78 37.37 1b5i n ASN 285 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1b5i s ASP 286 N -1.82 6.15 0.45 0.53 -1.08 -1.00 -4.97 116.67 114.93 1b5i s ASP 286 Ca 0.36 -0.04 0.15 0.00 -0.52 0.00 0.00 52.55 52.50 1b5i s ASP 286 Cb 0.19 -2.18 1.08 0.00 -1.46 0.00 0.00 42.92 40.55 1b5i s ASP 286 CO 0.30 -0.21 2.01 1.62 0.52 0.00 0.00 175.17 179.41 1b5i h VAL 287 N 5.45 0.91 -0.74 1.11 3.04 -1.89 -2.09 116.25 122.04 1b5i h VAL 287 Ca -0.32 -0.12 -0.01 0.00 -1.01 0.00 0.00 66.70 65.25 1b5i h VAL 287 Cb 1.16 0.54 -0.04 0.00 -2.01 0.00 0.00 31.29 30.95 1b5i h VAL 287 CO 0.64 0.06 0.42 0.03 -1.01 0.00 0.00 177.57 177.71 1b5i h ARG 288 N 0.34 1.02 -0.24 4.17 3.08 -1.93 0.14 114.38 120.95 1b5i h ARG 288 Ca 0.23 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 60.13 1b5i h ARG 288 Cb 0.48 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1b5i h ARG 288 CO -0.06 0.74 -0.04 0.28 -1.07 0.00 0.00 179.97 179.82 1b5i h VAL 289 N 1.01 1.28 -0.60 2.04 2.07 -1.68 -1.80 116.25 118.57 1b5i h VAL 289 Ca 0.26 -1.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.70 1b5i h VAL 289 Cb 0.00 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 1b5i h VAL 289 CO -0.05 0.32 0.13 0.03 0.02 0.00 0.00 177.57 178.03 1b5i h ARG 290 N 0.21 0.97 -0.74 1.57 3.08 -1.20 -2.10 114.38 116.17 1b5i h ARG 290 Ca 0.06 -0.24 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 1b5i h ARG 290 Cb 0.49 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.39 1b5i h ARG 290 CO 0.02 0.90 0.40 1.15 -1.07 0.00 0.00 179.97 181.37 1b5i h THR 291 N 0.88 1.23 -0.32 2.04 2.02 -0.70 -1.61 112.91 116.45 1b5i h THR 291 Ca 0.19 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.79 1b5i h THR 291 Cb 0.37 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 1b5i h THR 291 CO 0.00 0.25 0.20 0.00 0.37 0.00 0.00 175.52 176.35 1b5i h ALA 292 N 1.20 0.40 -0.57 6.16 0.00 -1.12 0.34 119.26 125.68 1b5i h ALA 292 Ca 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1b5i h ALA 292 Cb 0.05 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1b5i h ALA 292 CO -0.04 -0.11 0.36 -0.07 0.00 0.00 0.00 179.25 179.38 1b5i h LEU 293 N 0.42 0.67 -0.25 0.00 3.38 -1.19 -1.51 115.31 116.82 1b5i h LEU 293 Ca 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1b5i h LEU 293 Cb -0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1b5i h LEU 293 CO -0.02 0.51 0.13 0.50 0.09 0.00 0.00 178.44 179.65 1b5i h LYS 294 N 0.77 0.35 -0.07 1.13 3.64 -0.90 -3.01 116.57 118.47 1b5i h LYS 294 Ca 0.21 -0.04 -0.18 0.00 -1.27 0.00 0.00 60.65 59.37 1b5i h LYS 294 Cb -0.04 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1b5i h LYS 294 CO -0.04 0.32 -0.71 -0.07 -2.27 0.00 0.00 179.45 176.67 1b5i h LEU 295 N 0.29 0.41 -0.71 5.20 3.38 -0.80 -3.30 115.31 119.78 1b5i h LEU 295 Ca 0.09 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1b5i h LEU 295 Cb 0.07 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1b5i h LEU 295 CO -0.01 0.99 0.00 0.00 0.09 0.00 0.00 178.44 179.51 1b5i h ALA 296 N 1.00 1.00 -2.52 1.53 0.00 -1.30 -3.41 119.26 115.56 1b5i h ALA 296 Ca -0.03 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.35 1b5i h ALA 296 Cb 1.28 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.09 1b5i h ALA 296 CO 0.12 0.00 0.85 -1.17 0.00 0.00 0.00 179.25 179.05 1b5i s LEU 297 N -6.12 4.36 -0.68 0.00 0.20 -1.14 -4.74 118.68 110.56 1b5i s LEU 297 Ca 0.04 2.41 -0.19 0.00 0.69 0.00 0.00 54.13 57.09 1b5i s LEU 297 Cb 0.07 -3.58 0.12 0.00 -0.43 0.00 0.00 46.19 42.37 1b5i s LEU 297 CO 0.60 -0.77 0.80 -0.62 -0.29 0.00 0.00 176.35 176.08 1b5i s ASP 298 N 1.53 6.32 0.35 3.68 -1.08 -1.26 -4.92 116.67 121.29 1b5i s ASP 298 Ca 0.68 -1.64 0.04 0.00 -0.52 0.00 0.00 52.55 51.11 1b5i s ASP 298 Cb -0.39 -2.32 0.64 0.00 -1.46 0.00 0.00 42.92 39.40 1b5i s ASP 298 CO 0.30 -1.07 1.93 0.03 0.52 0.00 0.00 175.17 176.88 1b5i h ARG 299 N 9.00 0.62 -0.59 4.34 3.08 -1.92 -2.25 114.38 126.66 1b5i h ARG 299 Ca -0.18 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 59.74 1b5i h ARG 299 Cb 1.07 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.98 1b5i h ARG 299 CO 1.07 0.53 0.22 0.22 -1.07 0.00 0.00 179.97 180.94 1b5i h ASP 300 N 0.61 0.82 0.02 7.04 3.58 -1.95 0.36 116.42 126.91 1b5i h ASP 300 Ca 0.15 -0.18 -0.00 0.00 0.42 0.00 0.00 57.03 57.41 1b5i h ASP 300 Cb 0.16 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.00 1b5i h ASP 300 CO -0.01 0.78 -0.01 0.40 -2.88 0.00 0.00 179.24 177.52 1b5i h ILE 301 N 0.82 1.08 0.35 2.25 2.04 -1.85 -0.87 117.51 121.34 1b5i h ILE 301 Ca 0.19 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1b5i h ILE 301 Cb 0.22 1.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1b5i h ILE 301 CO -0.01 0.08 -0.17 0.40 0.00 0.00 0.00 178.15 178.45 1b5i h ILE 302 N -0.16 0.66 0.12 -0.67 2.04 -1.25 0.58 117.51 118.82 1b5i h ILE 302 Ca -0.00 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1b5i h ILE 302 Cb 0.15 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1b5i h ILE 302 CO 0.00 0.01 -0.06 0.58 0.00 0.00 0.00 178.15 178.69 1b5i h VAL 303 N -0.50 1.07 0.00 1.67 2.07 -0.32 -0.39 116.25 119.85 1b5i h VAL 303 Ca -0.05 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.53 1b5i h VAL 303 Cb 0.38 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.79 1b5i h VAL 303 CO 0.08 0.22 -1.47 0.59 0.02 0.00 0.00 177.57 177.01 1b5i n ASN 304 N -4.96 0.43 -0.10 0.57 5.03 -0.34 -0.55 115.26 115.33 1b5i n ASN 304 Ca -0.09 -0.20 -0.18 0.00 0.87 0.00 0.00 54.58 54.99 1b5i n ASN 304 Cb 0.25 1.35 -0.06 0.00 -1.02 0.00 0.00 39.78 40.30 1b5i n ASN 304 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1b5i n LYS 305 N -2.09 0.51 0.06 3.52 5.02 -0.09 -4.33 118.16 120.76 1b5i n LYS 305 Ca -0.01 0.21 -0.10 0.00 -2.02 0.00 0.00 58.31 56.40 1b5i n LYS 305 Cb 0.49 -1.38 -0.13 0.00 -0.02 0.00 0.00 35.03 33.99 1b5i n LYS 305 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1b5i h VAL 306 N -0.92 1.55 0.00 -0.18 -1.51 0.14 -3.41 116.25 111.92 1b5i h VAL 306 Ca -0.31 -3.23 0.00 0.00 -1.23 0.00 0.00 66.70 61.93 1b5i h VAL 306 Cb 1.23 2.83 0.00 0.00 -2.13 0.00 0.00 31.29 33.22 1b5i h VAL 306 CO -0.19 0.91 -0.70 1.17 -1.23 0.00 0.00 177.57 177.52 1b5i n LYS 307 N -3.38 0.37 -3.77 5.19 3.00 -0.16 -4.98 118.16 114.43 1b5i n LYS 307 Ca -0.05 0.15 -0.29 0.00 -0.00 0.00 0.00 58.31 58.12 1b5i n LYS 307 Cb 0.98 -1.15 0.02 0.00 0.00 0.00 0.00 35.03 34.88 1b5i n LYS 307 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1b5i n ASN 308 N -3.88 -3.52 -0.19 3.14 4.05 0.28 -4.92 115.26 110.22 1b5i n ASN 308 Ca -0.10 -1.00 0.02 0.00 0.45 0.00 0.00 54.58 53.95 1b5i n ASN 308 Cb 0.36 -3.32 0.04 0.00 1.23 0.00 0.00 39.78 38.09 1b5i n ASN 308 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1b5i n GLN 309 N -4.27 1.98 0.00 1.20 6.02 -1.26 -4.96 117.38 116.08 1b5i n GLN 309 Ca -0.17 -1.41 0.00 0.00 -0.01 0.00 0.00 57.00 55.41 1b5i n GLN 309 Cb 0.62 -1.08 0.00 0.00 1.02 0.00 0.00 30.24 30.80 1b5i n GLN 309 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b5i n GLY 310 N -0.06 0.72 3.75 1.08 0.00 -1.26 -4.97 105.19 104.45 1b5i n GLY 310 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1b5i n GLY 310 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1b5i s ASP 311 N -1.90 4.19 -0.07 1.61 1.01 -1.26 -4.75 116.67 115.50 1b5i s ASP 311 Ca 0.00 1.84 0.04 0.00 0.71 0.00 0.00 52.55 55.14 1b5i s ASP 311 Cb 0.00 -2.49 -0.02 0.00 1.01 0.00 0.00 42.92 41.42 1b5i s ASP 311 CO 0.00 -2.24 -0.19 -0.76 0.21 0.00 0.00 175.17 172.19 1b5i s LEU 312 N -6.04 2.44 0.23 1.23 1.02 -0.91 -4.92 118.68 111.73 1b5i s LEU 312 Ca 0.62 -0.36 -0.31 0.00 0.02 0.00 0.00 54.13 54.10 1b5i s LEU 312 Cb -0.18 -1.49 -0.14 0.00 0.02 0.00 0.00 46.19 44.41 1b5i s LEU 312 CO 0.56 0.27 1.32 -2.65 0.02 0.00 0.00 176.35 175.87 1b5i n PRO 313 N 2.83 1.79 -4.35 1.29 -0.02 -1.26 0.15 135.00 135.43 1b5i n PRO 313 Ca -0.17 0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 61.61 1b5i n PRO 313 Cb 0.52 -2.23 -0.09 0.00 -0.02 0.00 0.00 33.50 31.68 1b5i n PRO 313 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1b5i s ALA 314 N -0.22 3.20 0.00 3.55 0.00 -0.83 -4.69 121.76 122.77 1b5i s ALA 314 Ca 0.68 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1b5i s ALA 314 Cb -0.70 -1.28 0.00 0.00 0.00 0.00 0.00 23.12 21.14 1b5i s ALA 314 CO 0.52 0.63 0.53 2.48 0.00 0.00 0.00 175.76 179.92 1b5i n TYR 315 N 1.49 0.00 -4.14 0.00 0.18 -1.26 -4.47 117.16 108.96 1b5i n TYR 315 Ca -0.15 -0.13 -0.14 0.00 1.88 0.00 0.00 57.90 59.35 1b5i n TYR 315 Cb 0.53 -0.01 -0.06 0.00 -0.38 0.00 0.00 39.34 39.41 1b5i n TYR 315 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1b5i s SER 316 N -0.27 0.75 -0.14 9.48 1.04 -1.26 -4.84 113.70 118.46 1b5i s SER 316 Ca 0.00 -1.44 -0.10 0.00 0.48 0.00 0.00 55.95 54.89 1b5i s SER 316 Cb 0.00 0.56 -0.06 0.00 0.10 0.00 0.00 66.02 66.62 1b5i s SER 316 CO 0.00 -1.12 -0.04 0.22 0.98 0.00 0.00 173.24 173.29 1b5i h TYR 317 N 2.25 0.00 -2.85 5.02 3.20 -1.98 -3.45 116.97 119.17 1b5i h TYR 317 Ca -0.29 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.05 1b5i h TYR 317 Cb 1.24 0.00 0.03 0.00 1.54 0.00 0.00 36.73 39.54 1b5i h TYR 317 CO 1.11 0.30 0.86 0.99 -1.64 0.00 0.00 178.16 179.77 1b5i s THR 318 N -2.13 2.90 0.36 1.81 2.01 -1.26 -4.71 115.64 114.62 1b5i s THR 318 Ca -0.15 0.60 -0.28 0.00 0.31 0.00 0.00 61.69 62.17 1b5i s THR 318 Cb 0.02 -3.39 -0.11 0.00 0.01 0.00 0.00 72.50 69.04 1b5i s THR 318 CO 0.26 0.04 1.40 -2.84 -0.69 0.00 0.00 174.62 172.79 1b5i s PRO 319 N 1.43 4.22 0.16 4.92 0.02 -1.26 -4.88 135.00 139.61 1b5i s PRO 319 Ca 0.69 2.40 0.19 0.00 0.02 0.00 0.00 61.00 64.30 1b5i s PRO 319 Cb -0.41 -3.01 0.82 0.00 0.02 0.00 0.00 34.50 31.92 1b5i s PRO 319 CO 0.31 -0.37 1.58 -0.35 -0.33 0.00 0.00 177.00 177.84 1b5i n PRO 320 N 0.61 0.11 -0.38 5.54 -0.04 -1.26 -1.86 135.00 137.71 1b5i n PRO 320 Ca 0.01 0.38 0.12 0.00 -0.04 0.00 0.00 63.50 63.97 1b5i n PRO 320 Cb 0.41 -1.73 0.33 0.00 -0.04 0.00 0.00 33.50 32.46 1b5i n PRO 320 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1b5i n TYR 321 N -1.94 1.01 -2.07 0.54 4.11 -1.26 -4.66 117.16 112.89 1b5i n TYR 321 Ca 0.02 -0.50 -0.39 0.00 -0.00 0.00 0.00 57.90 57.02 1b5i n TYR 321 Cb 0.18 -0.01 -0.01 0.00 -0.00 0.00 0.00 39.34 39.51 1b5i n TYR 321 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 1b5i s THR 322 N -1.03 2.64 -0.04 -3.48 2.01 -0.78 -4.90 115.64 110.07 1b5i s THR 322 Ca 0.50 0.58 -0.29 0.00 0.31 0.00 0.00 61.69 62.78 1b5i s THR 322 Cb 0.26 -3.34 -0.08 0.00 0.01 0.00 0.00 72.50 69.35 1b5i s THR 322 CO 0.33 0.09 2.05 -0.67 -0.69 0.00 0.00 174.62 175.74 1b5i n ASP 323 N 0.17 3.91 0.00 3.53 -0.08 -1.26 -1.65 116.55 121.17 1b5i n ASP 323 Ca 0.03 0.69 0.00 0.00 -1.51 0.00 0.00 54.79 54.00 1b5i n ASP 323 Cb 0.43 -1.54 0.00 0.00 2.34 0.00 0.00 41.12 42.36 1b5i n ASP 323 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1b5i n GLY 324 N 4.93 0.47 3.68 0.27 0.00 -1.26 -3.99 105.19 109.28 1b5i n GLY 324 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 1b5i n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b5i s ALA 325 N -2.00 3.51 -0.45 4.61 0.00 -0.66 -4.63 121.76 122.14 1b5i s ALA 325 Ca 0.00 -0.27 0.07 0.00 0.00 0.00 0.00 51.96 51.76 1b5i s ALA 325 Cb 0.00 -2.83 0.24 0.00 0.00 0.00 0.00 23.12 20.53 1b5i s ALA 325 CO 0.00 -0.35 0.55 1.63 0.00 0.00 0.00 175.76 177.59 1b5i n LYS 326 N 4.53 1.05 -2.96 0.00 5.02 -1.26 -4.81 118.16 119.73 1b5i n LYS 326 Ca -0.04 -3.53 -0.33 0.00 -2.02 0.00 0.00 58.31 52.39 1b5i n LYS 326 Cb 0.51 -1.47 -0.07 0.00 -0.02 0.00 0.00 35.03 33.98 1b5i n LYS 326 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1b5i s LEU 327 N -1.36 4.03 -0.35 -0.35 1.43 -1.26 -4.64 118.68 116.18 1b5i s LEU 327 Ca 0.36 1.52 -0.15 0.00 -1.03 0.00 0.00 54.13 54.83 1b5i s LEU 327 Cb 0.15 -4.28 -0.01 0.00 0.03 0.00 0.00 46.19 42.08 1b5i s LEU 327 CO -0.10 -0.27 0.33 -0.69 0.23 0.00 0.00 176.35 175.85 1b5i s VAL 328 N -2.04 5.20 -0.09 -1.59 1.01 -1.26 -5.04 120.40 116.58 1b5i s VAL 328 Ca 0.57 -0.08 -0.29 0.00 0.00 0.00 0.00 61.98 62.18 1b5i s VAL 328 Cb -0.10 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1b5i s VAL 328 CO 0.16 -0.09 1.57 -0.70 0.00 0.00 0.00 175.10 176.03 1b5i s GLU 329 N 1.92 4.15 0.68 2.72 2.12 -1.26 -4.96 118.70 124.07 1b5i s GLU 329 Ca 0.10 2.03 -0.17 0.00 0.36 0.00 0.00 54.97 57.29 1b5i s GLU 329 Cb -0.17 -3.95 0.01 0.00 0.26 0.00 0.00 34.13 30.29 1b5i s GLU 329 CO 0.11 -0.87 1.24 -1.25 -0.54 0.00 0.00 175.26 173.95 1b5i s PRO 330 N 4.00 2.39 0.35 4.30 0.04 -1.26 -4.93 135.00 139.88 1b5i s PRO 330 Ca 0.69 1.88 0.04 0.00 0.04 0.00 0.00 61.00 63.65 1b5i s PRO 330 Cb -0.30 -1.85 0.65 0.00 0.04 0.00 0.00 34.50 33.04 1b5i s PRO 330 CO 0.26 -1.67 1.93 0.93 0.04 0.00 0.00 177.00 178.49 1b5i h GLU 331 N 0.15 0.59 -0.26 4.56 4.39 -2.02 -2.47 114.58 119.53 1b5i h GLU 331 Ca -0.49 -0.09 0.08 0.00 0.34 0.00 0.00 59.36 59.19 1b5i h GLU 331 Cb 1.31 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.84 1b5i h GLU 331 CO 0.52 0.52 0.24 0.11 -1.16 0.00 0.00 179.01 179.24 1b5i h TRP 332 N 0.59 0.00 0.00 4.33 5.08 -1.98 -1.79 115.95 122.17 1b5i h TRP 332 Ca 0.14 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 60.04 1b5i h TRP 332 Cb 0.18 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.33 1b5i h TRP 332 CO 0.01 0.00 -0.33 0.35 -1.28 0.00 0.00 178.44 177.19 1b5i h PHE 333 N 0.00 0.00 0.00 0.12 3.57 -1.81 -2.96 116.94 115.86 1b5i h PHE 333 Ca 0.12 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.62 1b5i h PHE 333 Cb 0.60 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1b5i h PHE 333 CO 0.00 0.33 -0.79 1.63 -2.23 0.00 0.00 178.31 177.25 1b5i n LYS 334 N -3.50 0.32 -0.52 1.11 5.02 -0.68 -4.94 118.16 114.98 1b5i n LYS 334 Ca -0.00 0.06 -0.30 0.00 -2.02 0.00 0.00 58.31 56.05 1b5i n LYS 334 Cb 0.49 -1.67 0.28 0.00 -0.02 0.00 0.00 35.03 34.10 1b5i n LYS 334 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1b5i s TRP 335 N -3.20 -0.32 0.47 2.13 0.51 -1.12 -5.02 118.94 112.39 1b5i s TRP 335 Ca 0.05 0.59 -0.04 0.00 -2.12 0.00 0.00 56.10 54.57 1b5i s TRP 335 Cb 0.13 -3.02 -0.03 0.00 -0.81 0.00 0.00 33.47 29.74 1b5i s TRP 335 CO 0.75 -4.73 0.76 -1.54 -0.51 0.00 0.00 176.95 171.69 1b5i s SER 336 N -3.26 6.20 0.38 2.95 1.04 -1.26 -4.95 113.70 114.80 1b5i s SER 336 Ca 0.69 0.83 0.09 0.00 0.48 0.00 0.00 55.95 58.04 1b5i s SER 336 Cb -0.13 -2.15 0.74 0.00 0.10 0.00 0.00 66.02 64.58 1b5i s SER 336 CO 0.58 -0.59 1.90 -0.61 0.98 0.00 0.00 173.24 175.50 1b5i h GLN 337 N 0.26 0.27 -0.32 4.02 5.75 -1.95 -0.84 115.11 122.30 1b5i h GLN 337 Ca -0.47 -0.06 0.03 0.00 -0.15 0.00 0.00 58.65 57.99 1b5i h GLN 337 Cb 1.21 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.70 1b5i h GLN 337 CO 0.61 0.41 0.15 0.37 -2.65 0.00 0.00 178.83 177.72 1b5i h GLN 338 N 0.26 0.30 -0.52 1.69 4.15 -1.98 0.58 115.11 119.59 1b5i h GLN 338 Ca 0.05 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.37 1b5i h GLN 338 Cb 0.39 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.99 1b5i h GLN 338 CO 0.02 0.20 -0.03 -0.22 -1.93 0.00 0.00 178.83 176.87 1b5i h LYS 339 N 0.31 0.91 -0.58 1.69 3.64 -1.77 -1.64 116.57 119.13 1b5i h LYS 339 Ca 0.13 -0.28 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 1b5i h LYS 339 Cb 0.06 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 1b5i h LYS 339 CO -0.10 0.92 0.26 0.00 -2.27 0.00 0.00 179.45 178.25 1b5i h ARG 340 N 0.83 0.84 -0.47 1.90 3.08 -0.41 -2.47 114.38 117.69 1b5i h ARG 340 Ca 0.15 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 60.08 1b5i h ARG 340 Cb 0.53 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1b5i h ARG 340 CO 0.03 0.70 0.28 -0.91 -1.07 0.00 0.00 179.97 179.01 1b5i h ASN 341 N 0.79 0.47 -0.42 7.04 2.35 0.66 -0.83 115.58 125.63 1b5i h ASN 341 Ca 0.20 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1b5i h ASN 341 Cb 0.15 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1b5i h ASN 341 CO -0.02 0.33 0.25 -0.33 -1.65 0.00 0.00 177.43 176.01 1b5i h GLU 342 N 0.57 0.58 -0.50 0.81 5.08 -1.24 0.03 114.58 119.91 1b5i h GLU 342 Ca 0.18 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1b5i h GLU 342 Cb -0.00 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 1b5i h GLU 342 CO -0.08 0.44 0.31 1.49 -1.00 0.00 0.00 179.01 180.17 1b5i h GLU 343 N 0.56 0.60 -0.00 2.33 4.57 -1.19 0.16 114.58 121.60 1b5i h GLU 343 Ca 0.15 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.30 1b5i h GLU 343 Cb 0.02 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.46 1b5i h GLU 343 CO -0.03 0.39 -0.04 0.00 -1.18 0.00 0.00 179.01 178.16 1b5i h ALA 344 N 1.21 -0.03 -0.36 2.92 0.00 -0.81 -0.74 119.26 121.45 1b5i h ALA 344 Ca 0.20 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1b5i h ALA 344 Cb -0.00 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1b5i h ALA 344 CO -0.08 -0.53 0.19 0.87 0.00 0.00 0.00 179.25 179.70 1b5i h LYS 345 N -0.07 0.37 -0.44 0.00 1.57 -0.72 -0.89 116.57 116.40 1b5i h LYS 345 Ca 0.02 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1b5i h LYS 345 Cb 0.09 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.26 1b5i h LYS 345 CO -0.04 0.25 0.10 -0.22 -0.57 0.00 0.00 179.45 178.96 1b5i h LYS 346 N 0.38 0.23 -0.81 3.15 3.64 -0.38 -0.36 116.57 122.43 1b5i h LYS 346 Ca 0.15 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1b5i h LYS 346 Cb 0.05 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.78 1b5i h LYS 346 CO -0.10 0.16 0.35 -0.07 -2.27 0.00 0.00 179.45 177.52 1b5i h LEU 347 N 0.24 1.10 -0.67 5.20 3.38 -0.70 -0.21 115.31 123.66 1b5i h LEU 347 Ca 0.21 -0.16 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 1b5i h LEU 347 Cb 0.25 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1b5i h LEU 347 CO -0.26 0.95 -0.48 -0.07 0.09 0.00 0.00 178.44 178.67 1b5i h LEU 348 N 1.17 0.50 -0.59 1.67 3.38 -0.73 0.55 115.31 121.25 1b5i h LEU 348 Ca 0.27 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1b5i h LEU 348 Cb 0.17 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1b5i h LEU 348 CO -0.03 0.90 -0.04 0.00 0.09 0.00 0.00 178.44 179.37 1b5i h ALA 349 N 1.12 0.80 -0.50 1.53 0.00 -0.77 -1.54 119.26 119.90 1b5i h ALA 349 Ca 0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1b5i h ALA 349 Cb 0.98 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1b5i h ALA 349 CO 0.09 0.67 0.27 0.93 0.00 0.00 0.00 179.25 181.20 1b5i h GLU 350 N 0.96 0.68 0.00 0.00 5.08 -0.68 -2.20 114.58 118.42 1b5i h GLU 350 Ca 0.16 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1b5i h GLU 350 Cb 0.60 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1b5i h GLU 350 CO 0.04 0.50 0.00 0.00 -1.00 0.00 0.00 179.01 178.55 1b5i n ALA 351 N -2.46 2.37 -0.03 3.43 0.00 0.15 -4.87 120.51 119.10 1b5i n ALA 351 Ca 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1b5i n ALA 351 Cb 0.10 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.15 1b5i n ALA 351 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b5i n GLY 352 N 0.59 0.98 3.85 0.00 0.00 -0.83 -5.06 105.19 104.72 1b5i n GLY 352 Ca 0.17 -0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1b5i n GLY 352 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1b5i s PHE 353 N -2.00 3.68 0.35 1.61 0.08 -0.65 -4.99 117.98 116.05 1b5i s PHE 353 Ca 0.00 0.84 0.04 0.00 0.12 0.00 0.00 56.93 57.92 1b5i s PHE 353 Cb 0.00 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.24 1b5i s PHE 353 CO 0.00 0.66 0.13 0.95 -0.10 0.00 0.00 175.22 176.86 1b5i s THR 354 N -1.10 0.56 0.25 0.64 -4.23 -0.96 -4.25 115.64 106.54 1b5i s THR 354 Ca 0.22 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.68 1b5i s THR 354 Cb -0.15 -2.50 0.25 0.00 1.34 0.00 0.00 72.50 71.45 1b5i s THR 354 CO 0.11 0.00 1.92 0.00 -0.54 0.00 0.00 174.62 176.12 1b5i h ALA 355 N 2.04 1.27 -0.04 3.99 0.00 -1.98 -2.31 119.26 122.23 1b5i h ALA 355 Ca -0.35 -0.08 -0.14 0.00 0.00 0.00 0.00 54.91 54.34 1b5i h ALA 355 Cb 1.26 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1b5i h ALA 355 CO 0.56 0.66 -0.63 0.22 0.00 0.00 0.00 179.25 180.06 1b5i h ASP 356 N 1.33 0.16 -2.37 0.00 3.58 -2.01 -3.36 116.42 113.75 1b5i h ASP 356 Ca 0.36 -0.10 -0.59 0.00 0.42 0.00 0.00 57.03 57.12 1b5i h ASP 356 Cb -0.13 -0.05 -0.40 0.00 1.72 0.00 0.00 39.33 40.48 1b5i h ASP 356 CO -0.07 0.75 -0.86 0.29 -2.88 0.00 0.00 179.24 176.47 1b5i n LYS 357 N -3.83 1.12 -1.75 0.28 5.02 -1.03 -5.12 118.16 112.85 1b5i n LYS 357 Ca -0.02 -3.74 -0.30 0.00 -2.02 0.00 0.00 58.31 52.23 1b5i n LYS 357 Cb 0.63 -1.77 0.17 0.00 -0.02 0.00 0.00 35.03 34.04 1b5i n LYS 357 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1b5i s PRO 358 N -1.10 0.70 -0.22 1.97 0.04 -0.90 -2.28 135.00 133.22 1b5i s PRO 358 Ca 0.33 -0.16 -0.17 0.00 0.04 0.00 0.00 61.00 61.03 1b5i s PRO 358 Cb 0.08 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 1b5i s PRO 358 CO -0.13 -2.41 0.48 -1.17 0.04 0.00 0.00 177.00 173.81 1b5i s LEU 359 N -6.00 4.12 -0.05 -3.56 2.96 -1.26 -4.90 118.68 110.00 1b5i s LEU 359 Ca 0.70 0.58 0.02 0.00 -0.22 0.00 0.00 54.13 55.21 1b5i s LEU 359 Cb -0.08 -2.63 0.01 0.00 0.50 0.00 0.00 46.19 44.00 1b5i s LEU 359 CO 0.53 -0.18 -0.09 -0.89 -1.32 0.00 0.00 176.35 174.41 1b5i s THR 360 N 1.72 0.81 0.28 3.68 2.01 -1.26 -0.93 115.64 121.96 1b5i s THR 360 Ca 0.22 -0.32 -0.17 0.00 0.31 0.00 0.00 61.69 61.73 1b5i s THR 360 Cb -0.15 -0.76 0.01 0.00 0.01 0.00 0.00 72.50 71.61 1b5i s THR 360 CO 0.09 0.27 0.63 0.72 -0.69 0.00 0.00 174.62 175.64 1b5i s PHE 361 N 0.60 0.11 0.28 4.92 -0.12 -0.75 -5.00 117.98 118.02 1b5i s PHE 361 Ca -0.10 -0.54 -0.15 0.00 -0.05 0.00 0.00 56.93 56.08 1b5i s PHE 361 Cb -0.13 0.50 -0.09 0.00 -0.63 0.00 0.00 43.02 42.67 1b5i s PHE 361 CO 0.02 -1.18 0.70 -0.51 -0.05 0.00 0.00 175.22 174.19 1b5i s ASP 362 N -2.99 6.81 -0.31 1.98 1.01 -1.26 -1.17 116.67 120.75 1b5i s ASP 362 Ca 0.17 1.25 0.02 0.00 0.71 0.00 0.00 52.55 54.70 1b5i s ASP 362 Cb -0.04 -2.36 0.09 0.00 1.01 0.00 0.00 42.92 41.62 1b5i s ASP 362 CO 0.09 -0.13 0.03 -0.22 0.21 0.00 0.00 175.17 175.15 1b5i s LEU 363 N -2.71 3.71 -0.03 1.23 0.20 0.63 -2.57 118.68 119.14 1b5i s LEU 363 Ca 0.50 -1.81 -0.19 0.00 0.69 0.00 0.00 54.13 53.33 1b5i s LEU 363 Cb -0.12 -1.38 -0.05 0.00 -0.43 0.00 0.00 46.19 44.21 1b5i s LEU 363 CO 0.19 -0.35 0.52 -0.22 -0.29 0.00 0.00 176.35 176.20 1b5i s LEU 364 N 1.16 4.40 0.05 -0.68 2.96 -0.24 -0.54 118.68 125.79 1b5i s LEU 364 Ca 0.06 1.03 -0.09 0.00 -0.22 0.00 0.00 54.13 54.92 1b5i s LEU 364 Cb -0.19 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.71 1b5i s LEU 364 CO -0.11 0.13 0.18 -0.72 -1.32 0.00 0.00 176.35 174.50 1b5i s TYR 365 N -0.20 0.09 -0.00 5.38 1.13 0.81 -0.26 117.35 124.30 1b5i s TYR 365 Ca 0.28 -0.36 -0.26 0.00 -1.41 0.00 0.00 57.07 55.32 1b5i s TYR 365 Cb -0.17 -0.06 -0.04 0.00 -1.10 0.00 0.00 41.96 40.59 1b5i s TYR 365 CO 0.15 -0.43 0.82 0.54 -2.51 0.00 0.00 175.55 174.11 1b5i s ASN 366 N -2.19 7.20 -0.38 -0.18 4.22 -1.26 -1.32 114.94 121.03 1b5i s ASN 366 Ca -0.04 1.45 -0.35 0.00 -2.14 0.00 0.00 52.86 51.78 1b5i s ASN 366 Cb -0.00 -2.49 -0.15 0.00 1.28 0.00 0.00 41.25 39.89 1b5i s ASN 366 CO -0.05 -0.11 1.32 0.41 -2.04 0.00 0.00 177.10 176.63 1b5i n THR 367 N 3.45 0.00 -3.64 0.54 -1.04 -0.71 -4.80 114.28 108.09 1b5i n THR 367 Ca 0.01 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.97 1b5i n THR 367 Cb 0.51 -0.38 -0.07 0.00 -1.82 0.00 0.00 70.33 68.57 1b5i n THR 367 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1b5i s SER 368 N 2.89 -0.18 0.03 8.00 0.15 -1.26 -4.77 113.70 118.55 1b5i s SER 368 Ca 0.83 0.32 -0.25 0.00 0.70 0.00 0.00 55.95 57.54 1b5i s SER 368 Cb -1.14 0.31 -0.17 0.00 -1.71 0.00 0.00 66.02 63.31 1b5i s SER 368 CO 0.59 -0.08 1.43 0.44 1.20 0.00 0.00 173.24 176.82 1b5i h ASP 369 N 3.25 -0.17 -0.13 5.45 3.32 -1.91 -1.86 116.42 124.37 1b5i h ASP 369 Ca -0.25 -0.20 0.03 0.00 0.02 0.00 0.00 57.03 56.64 1b5i h ASP 369 Cb 1.19 0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.75 1b5i h ASP 369 CO 0.17 0.11 -0.07 0.25 -1.72 0.00 0.00 179.24 177.98 1b5i h LEU 370 N -0.46 -0.22 -0.81 1.55 5.85 -1.90 -1.19 115.31 118.14 1b5i h LEU 370 Ca -0.02 0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.64 1b5i h LEU 370 Cb 0.36 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 1b5i h LEU 370 CO 0.03 -0.09 -0.39 0.45 -0.34 0.00 0.00 178.44 178.11 1b5i h HIS 371 N -0.06 0.51 -0.10 1.25 -0.00 -1.87 -1.56 115.15 113.32 1b5i h HIS 371 Ca 0.07 -0.14 -0.01 0.00 -0.00 0.00 0.00 60.37 60.30 1b5i h HIS 371 Cb 0.17 -0.11 -0.00 0.00 -0.00 0.00 0.00 27.41 27.46 1b5i h HIS 371 CO -0.20 0.76 0.04 -0.22 -0.00 0.00 0.00 177.93 178.31 1b5i h LYS 372 N 0.36 0.16 -0.53 2.45 3.64 -1.20 0.10 116.57 121.55 1b5i h LYS 372 Ca 0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1b5i h LYS 372 Cb 0.84 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.61 1b5i h LYS 372 CO 0.07 0.27 0.33 0.87 -2.27 0.00 0.00 179.45 178.72 1b5i h LYS 373 N 0.01 0.70 -0.69 1.90 1.57 -1.01 0.13 116.57 119.18 1b5i h LYS 373 Ca 0.03 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.71 1b5i h LYS 373 Cb 0.17 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 1b5i h LYS 373 CO -0.00 0.49 0.21 -0.07 -0.57 0.00 0.00 179.45 179.50 1b5i h LEU 374 N 0.71 0.99 -0.64 2.94 3.38 -1.26 -2.27 115.31 119.16 1b5i h LEU 374 Ca 0.19 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 57.87 1b5i h LEU 374 Cb -0.05 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1b5i h LEU 374 CO -0.04 0.92 -0.09 0.00 0.09 0.00 0.00 178.44 179.32 1b5i h ALA 375 N 1.20 0.84 -0.52 1.53 0.00 -0.25 -0.57 119.26 121.50 1b5i h ALA 375 Ca 0.22 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1b5i h ALA 375 Cb 0.29 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1b5i h ALA 375 CO -0.01 0.66 0.24 0.82 0.00 0.00 0.00 179.25 180.96 1b5i h ILE 376 N 0.87 1.20 -0.72 0.00 2.04 -0.89 0.43 117.51 120.44 1b5i h ILE 376 Ca 0.14 -0.58 -0.05 0.00 1.00 0.00 0.00 64.86 65.37 1b5i h ILE 376 Cb 0.64 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 1b5i h ILE 376 CO 0.04 0.23 0.24 0.00 0.00 0.00 0.00 178.15 178.66 1b5i h ALA 377 N 1.08 1.06 -0.52 1.87 0.00 -1.12 -1.93 119.26 119.70 1b5i h ALA 377 Ca 0.18 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1b5i h ALA 377 Cb 0.14 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1b5i h ALA 377 CO -0.02 0.64 -0.11 0.28 0.00 0.00 0.00 179.25 180.05 1b5i h VAL 378 N 1.07 1.27 -0.56 0.00 2.07 -0.89 -0.46 116.25 118.74 1b5i h VAL 378 Ca 0.24 -1.25 0.04 0.00 0.82 0.00 0.00 66.70 66.54 1b5i h VAL 378 Cb 0.28 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1b5i h VAL 378 CO -0.01 0.44 0.32 0.00 0.02 0.00 0.00 177.57 178.34 1b5i h ALA 379 N 0.91 0.73 -0.40 1.67 0.00 -0.63 -0.12 119.26 121.42 1b5i h ALA 379 Ca 0.13 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1b5i h ALA 379 Cb 0.67 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1b5i h ALA 379 CO 0.05 0.02 -0.35 1.03 0.00 0.00 0.00 179.25 180.00 1b5i h SER 380 N 0.63 0.98 -0.19 0.00 0.87 -1.20 0.10 113.55 114.74 1b5i h SER 380 Ca 0.24 -0.43 -0.02 0.00 -1.23 0.00 0.00 61.79 60.35 1b5i h SER 380 Cb 0.07 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1b5i h SER 380 CO -0.12 1.22 0.06 0.40 -0.53 0.00 0.00 176.83 177.85 1b5i h ILE 381 N 0.77 1.19 -0.52 2.23 2.04 -0.84 -0.19 117.51 122.18 1b5i h ILE 381 Ca 0.07 -0.60 -0.06 0.00 1.00 0.00 0.00 64.86 65.27 1b5i h ILE 381 Cb 0.93 1.24 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 1b5i h ILE 381 CO 0.09 0.19 0.07 -0.50 0.00 0.00 0.00 178.15 177.99 1b5i h TRP 382 N 0.12 0.88 0.16 1.37 6.55 -0.98 0.32 115.95 124.37 1b5i h TRP 382 Ca 0.06 -0.10 -0.01 0.00 0.95 0.00 0.00 58.89 59.79 1b5i h TRP 382 Cb 0.24 -0.25 0.00 0.00 -0.86 0.00 0.00 29.16 28.29 1b5i h TRP 382 CO 0.00 0.77 -0.08 -0.22 -1.05 0.00 0.00 178.44 177.87 1b5i h LYS 383 N 0.79 -0.21 -0.41 0.49 1.63 -0.78 0.31 116.57 118.39 1b5i h LYS 383 Ca 0.16 0.01 -0.06 0.00 -0.85 0.00 0.00 60.65 59.92 1b5i h LYS 383 Cb 0.38 0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.04 1b5i h LYS 383 CO 0.01 0.03 0.01 -0.22 -3.45 0.00 0.00 179.45 175.83 1b5i h LYS 384 N -0.43 0.72 0.00 1.90 3.64 -0.82 0.76 116.57 122.35 1b5i h LYS 384 Ca -0.02 -0.22 -0.10 0.00 -1.27 0.00 0.00 60.65 59.04 1b5i h LYS 384 Cb 0.33 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1b5i h LYS 384 CO 0.04 0.80 -0.90 -0.91 -2.27 0.00 0.00 179.45 176.20 1b5i h ASN 385 N 0.56 0.00 0.00 4.20 2.35 -0.43 -3.40 115.58 118.85 1b5i h ASN 385 Ca 0.12 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1b5i h ASN 385 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 1b5i h ASN 385 CO 0.02 0.38 0.00 -0.11 -1.65 0.00 0.00 177.43 176.07 1b5i n LEU 386 N -2.98 0.23 -0.76 1.61 7.94 0.06 -4.79 117.00 118.31 1b5i n LEU 386 Ca -0.03 -0.28 -0.09 0.00 -1.11 0.00 0.00 56.01 54.50 1b5i n LEU 386 Cb 0.72 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.63 1b5i n LEU 386 CO 0.41 0.06 -0.09 0.61 -1.11 0.00 0.00 177.39 177.26 1b5i n GLY 387 N 0.10 0.99 3.90 -3.96 0.00 0.26 -4.95 105.19 101.52 1b5i n GLY 387 Ca 0.00 -0.59 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 1b5i n GLY 387 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b5i s VAL 388 N -2.36 5.30 -0.19 1.61 -7.23 -1.11 -4.51 120.40 111.91 1b5i s VAL 388 Ca 0.00 -0.02 -0.06 0.00 -1.81 0.00 0.00 61.98 60.09 1b5i s VAL 388 Cb 0.00 -3.59 -0.03 0.00 0.56 0.00 0.00 36.38 33.32 1b5i s VAL 388 CO 0.00 0.24 0.02 0.20 -0.31 0.00 0.00 175.10 175.25 1b5i s ASN 389 N -2.07 5.20 0.05 4.85 0.01 -0.10 -3.47 114.94 119.42 1b5i s ASN 389 Ca 0.32 -0.06 0.08 0.00 -0.71 0.00 0.00 52.86 52.49 1b5i s ASN 389 Cb -0.13 -1.89 -0.03 0.00 0.41 0.00 0.00 41.25 39.62 1b5i s ASN 389 CO 0.21 0.13 -0.23 0.68 -1.51 0.00 0.00 177.10 176.38 1b5i s VAL 390 N 0.62 1.87 -0.30 1.60 -7.23 -1.26 -1.81 120.40 113.88 1b5i s VAL 390 Ca 0.01 -1.29 -0.07 0.00 -1.81 0.00 0.00 61.98 58.81 1b5i s VAL 390 Cb -0.14 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.20 1b5i s VAL 390 CO 0.02 0.26 0.10 0.20 -0.31 0.00 0.00 175.10 175.37 1b5i s ASN 391 N -1.24 5.22 0.26 4.85 0.02 -0.32 -4.93 114.94 118.80 1b5i s ASN 391 Ca 0.09 -0.74 -0.30 0.00 -1.02 0.00 0.00 52.86 50.90 1b5i s ASN 391 Cb -0.09 -1.90 -0.09 0.00 0.02 0.00 0.00 41.25 39.18 1b5i s ASN 391 CO 0.02 -0.21 1.07 -0.76 0.02 0.00 0.00 177.10 177.24 1b5i s LEU 392 N 1.51 4.56 -0.02 0.60 1.02 -1.26 -0.27 118.68 124.81 1b5i s LEU 392 Ca 0.02 2.19 -0.00 0.00 0.02 0.00 0.00 54.13 56.36 1b5i s LEU 392 Cb -0.17 -3.62 0.03 0.00 0.02 0.00 0.00 46.19 42.44 1b5i s LEU 392 CO 0.03 -0.10 0.03 -1.61 0.02 0.00 0.00 176.35 174.72 1b5i s GLU 393 N -1.26 0.01 0.03 1.70 2.02 0.30 -4.87 118.70 116.63 1b5i s GLU 393 Ca 0.44 0.20 0.01 0.00 0.02 0.00 0.00 54.97 55.64 1b5i s GLU 393 Cb -0.31 -0.33 -0.04 0.00 0.10 0.00 0.00 34.13 33.56 1b5i s GLU 393 CO 0.39 -0.19 0.10 0.54 0.02 0.00 0.00 175.26 176.12 1b5i s ASN 394 N 1.23 5.74 -0.00 -0.19 4.22 -1.26 -0.13 114.94 124.55 1b5i s ASN 394 Ca -0.07 0.12 -0.03 0.00 -2.14 0.00 0.00 52.86 50.74 1b5i s ASN 394 Cb -0.13 -1.64 -0.00 0.00 1.28 0.00 0.00 41.25 40.76 1b5i s ASN 394 CO -0.03 0.22 0.05 -1.10 -2.04 0.00 0.00 177.10 174.21 1b5i s GLN 395 N -2.07 0.28 0.75 3.55 -0.21 -0.44 -4.87 119.66 116.66 1b5i s GLN 395 Ca 0.27 -0.30 -0.14 0.00 0.02 0.00 0.00 55.36 55.20 1b5i s GLN 395 Cb -0.12 0.11 0.05 0.00 1.00 0.00 0.00 33.01 34.05 1b5i s GLN 395 CO 0.19 -0.05 1.20 -1.21 -2.12 0.00 0.00 175.29 173.29 1b5i s GLU 396 N -0.91 2.00 0.16 2.91 0.41 -1.26 -1.73 118.70 120.28 1b5i s GLU 396 Ca -0.10 1.71 -0.29 0.00 -0.41 0.00 0.00 54.97 55.88 1b5i s GLU 396 Cb -0.06 -1.82 -0.03 0.00 -1.78 0.00 0.00 34.13 30.44 1b5i s GLU 396 CO 0.00 -1.93 1.55 2.35 -0.49 0.00 0.00 175.26 176.74 1b5i h TRP 397 N -0.52 -1.59 -0.55 1.61 2.91 -1.91 -0.92 115.95 114.98 1b5i h TRP 397 Ca -0.47 0.10 0.03 0.00 1.13 0.00 0.00 58.89 59.68 1b5i h TRP 397 Cb 1.29 0.78 -0.04 0.00 -0.51 0.00 0.00 29.16 30.68 1b5i h TRP 397 CO 0.48 -0.43 0.31 -0.22 -1.03 0.00 0.00 178.44 177.55 1b5i h LYS 398 N -0.21 0.59 -0.65 2.65 3.64 -1.92 -1.88 116.57 118.78 1b5i h LYS 398 Ca 0.15 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.42 1b5i h LYS 398 Cb 0.54 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.20 1b5i h LYS 398 CO -0.75 0.39 0.12 1.15 -2.27 0.00 0.00 179.45 178.10 1b5i h THR 399 N 0.61 1.26 -0.40 1.00 2.02 -1.80 -2.55 112.91 113.06 1b5i h THR 399 Ca 0.23 -1.00 0.05 0.00 0.77 0.00 0.00 66.41 66.46 1b5i h THR 399 Cb 0.07 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 1b5i h THR 399 CO -0.12 0.38 0.13 0.15 0.37 0.00 0.00 175.52 176.42 1b5i h PHE 400 N 0.99 0.22 -0.68 3.16 3.57 -0.95 0.08 116.94 123.33 1b5i h PHE 400 Ca 0.20 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.65 1b5i h PHE 400 Cb 0.41 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 1b5i h PHE 400 CO 0.03 0.08 0.15 -0.07 -2.23 0.00 0.00 178.31 176.27 1b5i h LEU 401 N 0.28 1.04 -0.79 0.59 3.38 -1.26 -2.49 115.31 116.06 1b5i h LEU 401 Ca 0.19 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1b5i h LEU 401 Cb 0.18 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1b5i h LEU 401 CO -0.20 1.01 0.45 0.44 0.09 0.00 0.00 178.44 180.24 1b5i h ASP 402 N 1.03 0.98 -0.46 -0.43 3.32 -1.03 -1.27 116.42 118.55 1b5i h ASP 402 Ca 0.21 -0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.19 1b5i h ASP 402 Cb 0.39 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1b5i h ASP 402 CO 0.00 0.78 0.28 0.74 -1.72 0.00 0.00 179.24 179.32 1b5i h THR 403 N 1.09 1.07 -0.46 0.35 2.02 -0.81 0.68 112.91 116.86 1b5i h THR 403 Ca 0.28 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 67.22 1b5i h THR 403 Cb 0.00 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 1b5i h THR 403 CO -0.05 0.10 0.13 0.03 0.37 0.00 0.00 175.52 176.10 1b5i h ARG 404 N 0.57 0.72 -0.89 6.66 3.08 -1.16 -0.96 114.38 122.41 1b5i h ARG 404 Ca 0.18 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1b5i h ARG 404 Cb -0.01 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 29.89 1b5i h ARG 404 CO -0.07 0.71 0.51 0.45 -1.07 0.00 0.00 179.97 180.50 1b5i h HIS 405 N 0.61 1.19 0.00 3.04 3.86 -0.97 -2.41 115.15 120.48 1b5i h HIS 405 Ca 0.15 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.32 1b5i h HIS 405 Cb 0.30 -0.39 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 1b5i h HIS 405 CO 0.02 0.81 -0.10 1.96 0.86 0.00 0.00 177.93 181.47 1b5i h GLN 406 N 1.23 0.00 -5.02 2.45 4.20 -0.26 -3.47 115.11 114.24 1b5i h GLN 406 Ca 0.32 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.72 1b5i h GLN 406 Cb -0.02 0.00 0.13 0.00 0.30 0.00 0.00 27.48 27.89 1b5i h GLN 406 CO -0.06 0.10 -0.60 0.41 -0.67 0.00 0.00 178.83 178.02 1b5i n GLY 407 N -0.70 -0.26 2.78 3.46 0.00 -0.42 -4.92 105.19 105.12 1b5i n GLY 407 Ca -0.02 0.06 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1b5i n GLY 407 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b5i n THR 408 N -4.16 4.27 -3.82 2.61 -2.24 -1.03 -4.84 114.28 105.06 1b5i n THR 408 Ca -0.10 -5.72 -0.07 0.00 -2.27 0.00 0.00 64.05 55.89 1b5i n THR 408 Cb 0.59 -1.61 0.01 0.00 -2.10 0.00 0.00 70.33 67.23 1b5i n THR 408 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1b5i s PHE 409 N -3.58 0.03 0.00 4.78 -0.71 -1.26 -4.92 117.98 112.32 1b5i s PHE 409 Ca 0.43 -0.61 0.00 0.00 -1.04 0.00 0.00 56.93 55.71 1b5i s PHE 409 Cb 0.21 0.79 0.00 0.00 -1.21 0.00 0.00 43.02 42.81 1b5i s PHE 409 CO -0.10 -1.39 0.00 -0.25 -1.34 0.00 0.00 175.22 172.15 1b5i n ASP 410 N -1.13 0.00 -4.14 1.98 8.00 -1.26 -4.71 116.55 115.29 1b5i n ASP 410 Ca -0.07 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.21 1b5i n ASP 410 Cb 0.60 -0.19 -0.15 0.00 -0.02 0.00 0.00 41.12 41.36 1b5i n ASP 410 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1b5i s VAL 411 N -0.57 1.23 0.02 2.53 1.01 -1.06 -1.35 120.40 122.21 1b5i s VAL 411 Ca 0.00 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1b5i s VAL 411 Cb 0.00 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 1b5i s VAL 411 CO 0.00 0.27 -0.09 0.00 0.00 0.00 0.00 175.10 175.28 1b5i s ALA 412 N -0.48 0.77 0.47 5.51 0.00 0.34 -1.07 121.76 127.29 1b5i s ALA 412 Ca 0.05 -0.60 -0.24 0.00 0.00 0.00 0.00 51.96 51.17 1b5i s ALA 412 Cb -0.06 -0.10 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 1b5i s ALA 412 CO -0.00 0.12 1.34 0.50 0.00 0.00 0.00 175.76 177.72 1b5i s ARG 413 N -0.89 3.61 0.18 0.00 3.00 0.64 0.19 118.95 125.68 1b5i s ARG 413 Ca -0.01 2.22 -0.19 0.00 -1.00 0.00 0.00 55.73 56.75 1b5i s ARG 413 Cb -0.06 -2.53 0.04 0.00 0.00 0.00 0.00 34.95 32.39 1b5i s ARG 413 CO 0.00 -0.81 0.53 0.00 0.00 0.00 0.00 175.30 175.02 1b5i s ALA 414 N -1.29 -1.11 -0.22 6.12 0.00 0.18 -4.75 121.76 120.70 1b5i s ALA 414 Ca 0.63 -0.02 -0.15 0.00 0.00 0.00 0.00 51.96 52.42 1b5i s ALA 414 Cb -0.39 0.83 0.06 0.00 0.00 0.00 0.00 23.12 23.62 1b5i s ALA 414 CO 0.49 -0.78 0.55 0.20 0.00 0.00 0.00 175.76 176.22 1b5i s GLY 415 N -2.83 -0.45 -0.08 0.00 0.00 -1.26 -1.32 107.32 101.38 1b5i s GLY 415 Ca 0.06 1.81 0.04 0.00 0.00 0.00 0.00 44.72 46.64 1b5i s GLY 415 CO -0.07 1.78 -0.22 0.86 0.00 0.00 0.00 173.10 175.45 1b5i s TRP 416 N 1.06 2.27 -0.05 1.90 -0.11 -0.81 -4.96 118.94 118.24 1b5i s TRP 416 Ca -0.06 -0.81 0.05 0.00 1.22 0.00 0.00 56.10 56.49 1b5i s TRP 416 Cb -0.06 -1.52 -0.02 0.00 -1.50 0.00 0.00 33.47 30.37 1b5i s TRP 416 CO -0.10 -0.31 -0.18 0.00 -4.62 0.00 0.00 176.95 171.74 1b5i n ALA 418 N 2.51 1.27 -0.03 0.00 0.00 -0.28 -4.92 120.51 119.05 1b5i n ALA 418 Ca -0.17 0.20 0.03 0.00 0.00 0.00 0.00 53.44 53.50 1b5i n ALA 418 Cb 0.52 -2.28 -0.15 0.00 0.00 0.00 0.00 19.45 17.54 1b5i n ALA 418 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1b5i n ASP 419 N -0.19 0.09 -3.81 0.00 8.00 -1.26 -4.92 116.55 114.47 1b5i n ASP 419 Ca 0.08 0.04 -0.12 0.00 0.71 0.00 0.00 54.79 55.50 1b5i n ASP 419 Cb 0.42 1.46 -0.10 0.00 -0.02 0.00 0.00 41.12 42.88 1b5i n ASP 419 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1b5i s TYR 420 N -3.12 -0.15 -1.23 1.24 1.13 -1.26 -4.73 117.35 109.23 1b5i s TYR 420 Ca -0.08 0.33 -0.19 0.00 -1.41 0.00 0.00 57.07 55.72 1b5i s TYR 420 Cb 0.11 0.05 0.08 0.00 -1.10 0.00 0.00 41.96 41.10 1b5i s TYR 420 CO 0.87 -0.24 1.64 1.21 -2.51 0.00 0.00 175.55 176.52 1b5i s ASN 421 N -0.68 6.79 -0.28 -0.18 3.84 -1.26 -4.60 114.94 118.57 1b5i s ASN 421 Ca -0.08 -2.30 -0.25 0.00 0.21 0.00 0.00 52.86 50.44 1b5i s ASN 421 Cb -0.04 -2.56 0.11 0.00 -0.55 0.00 0.00 41.25 38.21 1b5i s ASN 421 CO 0.02 -1.19 0.96 -0.70 -2.79 0.00 0.00 177.10 173.39 1b5i s GLU 422 N 4.08 0.59 0.49 0.43 -6.30 -1.26 -4.33 118.70 112.39 1b5i s GLU 422 Ca 0.51 0.70 0.26 0.00 -2.50 0.00 0.00 54.97 53.93 1b5i s GLU 422 Cb 0.02 0.29 1.31 0.00 0.00 0.00 0.00 34.13 35.75 1b5i s GLU 422 CO 0.03 -0.07 1.87 -1.35 0.02 0.00 0.00 175.26 175.77 1b5i h PRO 423 N 4.39 0.17 0.00 4.30 0.11 -1.88 -1.51 132.00 137.58 1b5i h PRO 423 Ca -0.28 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 1b5i h PRO 423 Cb 1.17 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1b5i h PRO 423 CO 0.09 0.11 -0.05 1.79 -0.21 0.00 0.00 178.00 179.74 1b5i h THR 424 N 0.17 0.25 -0.06 -1.15 1.35 -1.95 -0.46 112.91 111.07 1b5i h THR 424 Ca 0.45 -0.32 0.01 0.00 -0.55 0.00 0.00 66.41 65.99 1b5i h THR 424 Cb 1.49 1.25 -0.00 0.00 -1.73 0.00 0.00 68.15 69.15 1b5i h THR 424 CO -0.09 0.05 0.04 -1.28 -0.25 0.00 0.00 175.52 173.99 1b5i h SER 425 N 0.00 0.05 0.00 5.36 0.87 -1.52 0.01 113.55 118.31 1b5i h SER 425 Ca -0.00 -0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 1b5i h SER 425 Cb 0.25 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 1b5i h SER 425 CO 0.01 0.03 -0.70 -0.26 -0.53 0.00 0.00 176.83 175.38 1b5i h PHE 426 N 0.05 0.00 -0.48 2.24 -1.00 -1.49 -3.42 116.94 112.84 1b5i h PHE 426 Ca 0.02 0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.84 1b5i h PHE 426 Cb 0.02 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.56 1b5i h PHE 426 CO -0.00 0.52 0.32 -0.07 -1.61 0.00 0.00 178.31 177.47 1b5i h LEU 427 N -1.00 0.46 -2.19 1.54 3.38 -0.94 -2.03 115.31 114.52 1b5i h LEU 427 Ca -0.11 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1b5i h LEU 427 Cb 0.74 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1b5i h LEU 427 CO -0.07 0.31 -0.06 0.78 0.09 0.00 0.00 178.44 179.50 1b5i h ASN 428 N 0.53 0.00 1.04 -0.43 2.35 -1.25 -1.70 115.58 116.12 1b5i h ASN 428 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 1b5i h ASN 428 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1b5i h ASN 428 CO -0.05 0.06 0.00 0.35 -1.65 0.00 0.00 177.43 176.14 1b5i n THR 429 N -3.49 0.70 0.53 2.81 -2.24 -0.76 -2.75 114.28 109.07 1b5i n THR 429 Ca -0.02 0.01 0.12 0.00 -2.27 0.00 0.00 64.05 61.88 1b5i n THR 429 Cb 0.18 -0.89 0.23 0.00 -2.10 0.00 0.00 70.33 67.76 1b5i n THR 429 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1b5i n MET 430 N -2.18 2.37 -1.86 -0.78 2.81 -0.64 -3.46 117.12 113.38 1b5i n MET 430 Ca 0.04 -2.06 -0.41 0.00 -1.81 0.00 0.00 57.70 53.46 1b5i n MET 430 Cb 0.31 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.32 1b5i n MET 430 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1b5i s LEU 431 N -1.55 4.35 0.25 4.03 1.43 -1.11 -4.74 118.68 121.34 1b5i s LEU 431 Ca 0.37 2.95 -0.08 0.00 -1.03 0.00 0.00 54.13 56.33 1b5i s LEU 431 Cb 0.22 -3.66 0.41 0.00 0.03 0.00 0.00 46.19 43.19 1b5i s LEU 431 CO 0.31 -0.81 1.61 0.28 0.23 0.00 0.00 176.35 177.96 1b5i h SER 432 N 3.53 -0.55 -0.48 2.29 0.02 -1.89 -0.84 113.55 115.63 1b5i h SER 432 Ca -0.50 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1b5i h SER 432 Cb 1.23 0.43 0.00 0.00 0.14 0.00 0.00 62.40 64.20 1b5i h SER 432 CO 0.68 -0.24 0.00 -0.90 -1.14 0.00 0.00 176.83 175.23 1b5i n ASP 433 N -5.44 3.33 -4.74 3.07 5.75 -1.26 -4.89 116.55 112.37 1b5i n ASP 433 Ca 0.13 -2.23 -0.41 0.00 -0.01 0.00 0.00 54.79 52.27 1b5i n ASP 433 Cb 0.46 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 40.07 1b5i n ASP 433 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1b5i s SER 434 N -0.84 6.98 0.63 -1.12 0.15 -0.32 -4.91 113.70 114.27 1b5i s SER 434 Ca 0.36 2.32 0.41 0.00 0.70 0.00 0.00 55.95 59.74 1b5i s SER 434 Cb 0.22 -2.61 2.08 0.00 -1.71 0.00 0.00 66.02 64.00 1b5i s SER 434 CO 0.19 -0.46 2.24 0.77 1.20 0.00 0.00 173.24 177.19 1b5i h SER 435 N 5.30 0.00 -0.12 5.45 4.64 -1.91 -1.45 113.55 125.46 1b5i h SER 435 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1b5i h SER 435 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1b5i h SER 435 CO 0.76 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 177.31 1b5i n ASN 436 N -3.08 1.68 -4.54 4.97 4.13 -1.25 -4.81 115.26 112.36 1b5i n ASN 436 Ca -0.02 -1.65 -0.42 0.00 1.68 0.00 0.00 54.58 54.17 1b5i n ASN 436 Cb 0.15 -0.07 -0.02 0.00 -1.54 0.00 0.00 39.78 38.30 1b5i n ASN 436 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 1b5i s ASN 437 N -1.72 6.64 0.00 6.41 3.84 -0.55 -4.70 114.94 124.86 1b5i s ASN 437 Ca 0.34 -1.88 0.27 0.00 0.21 0.00 0.00 52.86 51.80 1b5i s ASN 437 Cb 0.19 -2.53 0.82 0.00 -0.55 0.00 0.00 41.25 39.17 1b5i s ASN 437 CO 0.29 -1.31 1.61 0.35 -2.79 0.00 0.00 177.10 175.25 1b5i n THR 438 N 6.40 0.00 0.43 -5.21 -2.24 -1.26 -3.12 114.28 109.27 1b5i n THR 438 Ca 0.36 -0.19 0.12 0.00 -2.27 0.00 0.00 64.05 62.07 1b5i n THR 438 Cb 0.49 0.50 0.26 0.00 -2.10 0.00 0.00 70.33 69.48 1b5i n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b5i h ALA 439 N 3.97 0.93 -5.73 6.98 0.00 -1.84 -3.46 119.26 120.11 1b5i h ALA 439 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.48 1b5i h ALA 439 Cb 0.53 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.37 1b5i h ALA 439 CO 0.00 0.00 -0.68 0.72 0.00 0.00 0.00 179.25 179.29 1b5i n HIS 440 N -2.61 -2.45 -3.23 0.00 8.25 -1.18 -1.39 115.22 112.61 1b5i n HIS 440 Ca 0.04 0.85 -0.39 0.00 -0.26 0.00 0.00 57.72 57.97 1b5i n HIS 440 Cb 0.48 -4.42 -0.06 0.00 1.12 0.00 0.00 29.99 27.11 1b5i n HIS 440 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1b5i s TYR 441 N -3.26 3.57 -0.29 4.41 5.04 -1.26 -3.94 117.35 121.62 1b5i s TYR 441 Ca 0.55 1.05 -0.02 0.00 -2.44 0.00 0.00 57.07 56.21 1b5i s TYR 441 Cb -0.26 -2.62 0.09 0.00 0.35 0.00 0.00 41.96 39.53 1b5i s TYR 441 CO 0.68 0.20 0.10 0.15 -1.34 0.00 0.00 175.55 175.34 1b5i s LYS 442 N 0.43 0.59 -0.21 4.97 1.02 -1.26 -4.11 119.74 121.17 1b5i s LYS 442 Ca 0.30 -0.85 -0.00 0.00 0.02 0.00 0.00 55.97 55.43 1b5i s LYS 442 Cb -0.16 -1.82 0.05 0.00 -0.52 0.00 0.00 37.83 35.38 1b5i s LYS 442 CO 0.14 -0.94 -0.04 0.45 -0.92 0.00 0.00 175.35 174.03 1b5i s SER 443 N 1.76 3.42 0.37 2.83 0.15 -1.26 -4.99 113.70 115.98 1b5i s SER 443 Ca 0.08 -0.98 0.06 0.00 0.70 0.00 0.00 55.95 55.81 1b5i s SER 443 Cb -0.17 -1.02 0.76 0.00 -1.71 0.00 0.00 66.02 63.88 1b5i s SER 443 CO -0.25 -0.23 1.99 -0.65 1.20 0.00 0.00 173.24 175.30 1b5i h PRO 444 N 8.04 0.70 -0.41 5.44 0.11 -1.98 0.14 132.00 144.04 1b5i h PRO 444 Ca -0.20 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.82 1b5i h PRO 444 Cb 1.09 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.03 1b5i h PRO 444 CO 0.40 0.46 0.05 0.00 -0.21 0.00 0.00 178.00 178.71 1b5i h ALA 445 N 1.63 0.55 -0.33 -0.75 0.00 -1.99 -0.54 119.26 117.83 1b5i h ALA 445 Ca 0.27 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1b5i h ALA 445 Cb 0.15 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1b5i h ALA 445 CO -0.08 0.28 0.10 0.35 0.00 0.00 0.00 179.25 179.91 1b5i h PHE 446 N 0.54 0.53 -0.92 0.00 3.04 -1.73 -2.09 116.94 116.30 1b5i h PHE 446 Ca 0.12 -0.05 0.02 0.00 3.98 0.00 0.00 57.97 62.04 1b5i h PHE 446 Cb 0.40 -0.15 -0.05 0.00 2.56 0.00 0.00 35.95 38.71 1b5i h PHE 446 CO 0.03 0.53 0.61 -0.44 -2.02 0.00 0.00 178.31 177.01 1b5i h ASP 447 N 0.38 1.04 -0.24 0.41 3.32 -0.48 -2.78 116.42 118.07 1b5i h ASP 447 Ca 0.11 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 1b5i h ASP 447 Cb 0.25 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1b5i h ASP 447 CO -0.00 0.74 0.11 0.50 -1.72 0.00 0.00 179.24 178.87 1b5i h LYS 448 N 1.22 0.35 -0.47 3.56 1.63 -0.90 -1.48 116.57 120.48 1b5i h LYS 448 Ca 0.34 -0.06 0.08 0.00 -0.85 0.00 0.00 60.65 60.17 1b5i h LYS 448 Cb -0.11 -0.06 -0.07 0.00 -0.60 0.00 0.00 32.23 31.40 1b5i h LYS 448 CO -0.09 0.37 0.09 -0.07 -3.45 0.00 0.00 179.45 176.31 1b5i h LEU 449 N 0.25 -0.01 -0.59 5.20 3.38 -1.12 -1.14 115.31 121.28 1b5i h LEU 449 Ca 0.08 0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 1b5i h LEU 449 Cb 0.14 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1b5i h LEU 449 CO -0.01 0.03 -0.02 0.40 0.09 0.00 0.00 178.44 178.93 1b5i h ILE 450 N 0.22 1.27 -1.00 1.22 1.08 -1.34 -2.98 117.51 115.98 1b5i h ILE 450 Ca 0.24 -1.16 0.03 0.00 -0.39 0.00 0.00 64.86 63.58 1b5i h ILE 450 Cb 0.31 0.84 -0.06 0.00 -3.07 0.00 0.00 36.82 34.85 1b5i h ILE 450 CO -0.31 0.42 0.66 0.00 -0.69 0.00 0.00 178.15 178.22 1b5i h ALA 451 N 0.97 1.34 0.00 1.87 0.00 -0.86 -1.14 119.26 121.44 1b5i h ALA 451 Ca 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1b5i h ALA 451 Cb 0.57 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1b5i h ALA 451 CO 0.03 0.57 -0.06 -0.44 0.00 0.00 0.00 179.25 179.35 1b5i h ASP 452 N 1.28 0.00 0.30 0.00 3.32 -1.07 -3.15 116.42 117.10 1b5i h ASP 452 Ca 0.40 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.41 1b5i h ASP 452 Cb -0.01 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1b5i h ASP 452 CO -0.12 0.06 -0.16 0.71 -1.72 0.00 0.00 179.24 178.01 1b5i h THR 453 N 0.00 0.80 -0.21 0.35 1.35 -1.10 -2.36 112.91 111.73 1b5i h THR 453 Ca -0.00 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 1b5i h THR 453 Cb 0.23 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 1b5i h THR 453 CO 0.01 0.15 0.00 0.18 -0.25 0.00 0.00 175.52 175.61 1b5i n LEU 454 N -3.90 3.12 -0.09 3.87 4.77 -1.19 -4.10 117.00 119.49 1b5i n LEU 454 Ca -0.02 -1.21 0.12 0.00 -0.03 0.00 0.00 56.01 54.87 1b5i n LEU 454 Cb 0.25 -0.13 0.28 0.00 -2.33 0.00 0.00 43.42 41.50 1b5i n LEU 454 CO 0.33 0.61 0.51 0.29 -1.33 0.00 0.00 177.39 177.79 1b5i n LYS 455 N 1.34 0.31 -4.17 3.23 5.02 -0.89 -4.74 118.16 118.26 1b5i n LYS 455 Ca 0.17 -0.19 -0.26 0.00 -2.02 0.00 0.00 58.31 56.01 1b5i n LYS 455 Cb 0.58 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.03 1b5i n LYS 455 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1b5i s VAL 456 N -2.82 3.94 -0.36 -0.18 -7.23 -1.23 -5.03 120.40 107.50 1b5i s VAL 456 Ca 0.16 -1.36 0.07 0.00 -1.81 0.00 0.00 61.98 59.04 1b5i s VAL 456 Cb 0.18 -3.00 0.44 0.00 0.56 0.00 0.00 36.38 34.56 1b5i s VAL 456 CO 0.64 -0.13 1.15 0.00 -0.31 0.00 0.00 175.10 176.45 1b5i n ALA 457 N -0.26 4.97 -3.68 1.32 0.00 -1.26 -4.99 120.51 116.62 1b5i n ALA 457 Ca -0.09 -4.00 -0.20 0.00 0.00 0.00 0.00 53.44 49.15 1b5i n ALA 457 Cb 0.55 -0.44 -0.17 0.00 0.00 0.00 0.00 19.45 19.40 1b5i n ALA 457 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1b5i s ASP 458 N -3.57 0.97 0.24 0.00 -1.08 -1.26 -5.05 116.67 106.93 1b5i s ASP 458 Ca 0.49 -0.09 -0.03 0.00 -0.52 0.00 0.00 52.55 52.39 1b5i s ASP 458 Cb 0.40 -0.39 0.28 0.00 -1.46 0.00 0.00 42.92 41.75 1b5i s ASP 458 CO -0.06 -0.10 1.72 0.44 0.52 0.00 0.00 175.17 177.69 1b5i h ASP 459 N 7.48 0.80 -0.44 -0.34 3.32 -1.98 -1.59 116.42 123.67 1b5i h ASP 459 Ca -0.34 -0.21 -0.06 0.00 0.02 0.00 0.00 57.03 56.43 1b5i h ASP 459 Cb 1.14 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.46 1b5i h ASP 459 CO 0.42 0.89 0.03 0.74 -1.72 0.00 0.00 179.24 179.60 1b5i h THR 460 N 0.76 1.25 -0.45 0.35 2.02 -1.99 0.02 112.91 114.87 1b5i h THR 460 Ca 0.14 -0.97 -0.08 0.00 0.77 0.00 0.00 66.41 66.27 1b5i h THR 460 Cb 0.51 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.93 1b5i h THR 460 CO 0.03 0.34 -0.02 1.56 0.37 0.00 0.00 175.52 177.80 1b5i h GLN 461 N 0.61 0.81 -0.36 6.66 4.20 -1.96 -0.99 115.11 124.06 1b5i h GLN 461 Ca 0.13 -0.27 0.03 0.00 0.06 0.00 0.00 58.65 58.60 1b5i h GLN 461 Cb 0.44 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 1b5i h GLN 461 CO 0.02 0.88 0.18 0.00 -0.67 0.00 0.00 178.83 179.24 1b5i h ARG 462 N 0.65 0.37 -0.69 1.46 3.08 -1.12 -0.39 114.38 117.73 1b5i h ARG 462 Ca 0.13 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1b5i h ARG 462 Cb 0.52 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1b5i h ARG 462 CO 0.03 0.24 0.37 0.77 -1.07 0.00 0.00 179.97 180.31 1b5i h SER 463 N 0.38 0.86 -0.57 7.04 0.02 -0.77 -0.67 113.55 119.84 1b5i h SER 463 Ca 0.15 -0.07 -0.08 0.00 -0.84 0.00 0.00 61.79 60.95 1b5i h SER 463 Cb 0.06 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 1b5i h SER 463 CO -0.10 0.70 0.05 -0.33 -1.14 0.00 0.00 176.83 176.01 1b5i h GLU 464 N 0.97 1.01 -0.46 3.45 5.08 -0.96 -0.55 114.58 123.12 1b5i h GLU 464 Ca 0.24 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 58.21 1b5i h GLU 464 Cb 0.04 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1b5i h GLU 464 CO -0.04 0.96 -0.14 -0.07 -1.00 0.00 0.00 179.01 178.72 1b5i h LEU 465 N 0.94 0.86 -0.48 1.33 3.38 -0.44 -1.39 115.31 119.51 1b5i h LEU 465 Ca 0.18 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1b5i h LEU 465 Cb 0.48 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1b5i h LEU 465 CO 0.02 1.01 -0.01 1.88 0.09 0.00 0.00 178.44 181.42 1b5i h TYR 466 N 0.77 0.94 -0.42 1.13 0.05 -0.93 -0.40 116.97 118.10 1b5i h TYR 466 Ca 0.12 -0.17 0.05 0.00 0.05 0.00 0.00 58.73 58.78 1b5i h TYR 466 Cb 0.66 -0.24 -0.05 0.00 1.01 0.00 0.00 36.73 38.11 1b5i h TYR 466 CO 0.04 0.90 0.15 0.00 -1.05 0.00 0.00 178.16 178.20 1b5i h ALA 467 N 0.92 0.51 -0.35 3.88 0.00 -0.90 -1.03 119.26 122.30 1b5i h ALA 467 Ca 0.14 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1b5i h ALA 467 Cb 0.53 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1b5i h ALA 467 CO 0.03 -0.23 -0.03 0.87 0.00 0.00 0.00 179.25 179.88 1b5i h LYS 468 N 0.32 0.55 -0.68 0.00 1.57 -1.06 -0.87 116.57 116.41 1b5i h LYS 468 Ca 0.20 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1b5i h LYS 468 Cb 0.18 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 1b5i h LYS 468 CO -0.19 0.60 0.25 0.00 -0.57 0.00 0.00 179.45 179.53 1b5i h ALA 469 N 1.45 0.88 -0.52 3.86 0.00 -0.58 0.87 119.26 125.21 1b5i h ALA 469 Ca 0.11 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1b5i h ALA 469 Cb 0.39 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1b5i h ALA 469 CO 0.02 0.53 -0.09 0.93 0.00 0.00 0.00 179.25 180.63 1b5i h GLU 470 N 0.97 0.97 -0.87 0.00 4.39 -0.72 -1.20 114.58 118.12 1b5i h GLU 470 Ca 0.22 -0.34 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 1b5i h GLU 470 Cb 0.25 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.78 1b5i h GLU 470 CO -0.01 1.01 0.52 1.96 -1.16 0.00 0.00 179.01 181.33 1b5i h GLN 471 N 0.87 1.17 -0.60 2.33 4.20 -0.65 -0.17 115.11 122.26 1b5i h GLN 471 Ca 0.14 -0.11 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1b5i h GLN 471 Cb 0.64 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 1b5i h GLN 471 CO 0.04 0.82 0.25 0.37 -0.67 0.00 0.00 178.83 179.65 1b5i h GLN 472 N 1.19 0.89 -0.18 1.46 5.75 -0.42 0.15 115.11 123.95 1b5i h GLN 472 Ca 0.31 -0.15 0.02 0.00 -0.15 0.00 0.00 58.65 58.67 1b5i h GLN 472 Cb -0.05 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 1b5i h GLN 472 CO -0.06 0.75 0.06 -0.07 -2.65 0.00 0.00 178.83 176.86 1b5i h LEU 473 N 0.83 0.07 -0.34 -2.39 3.38 -0.72 -1.39 115.31 114.75 1b5i h LEU 473 Ca 0.20 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1b5i h LEU 473 Cb 0.18 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1b5i h LEU 473 CO -0.02 0.07 0.16 -0.78 0.09 0.00 0.00 178.44 177.96 1b5i h ASP 474 N 0.15 0.45 -0.72 -0.43 3.58 -0.86 -0.62 116.42 117.97 1b5i h ASP 474 Ca 0.08 -0.14 0.09 0.00 0.42 0.00 0.00 57.03 57.48 1b5i h ASP 474 Cb 0.04 -0.12 -0.07 0.00 1.72 0.00 0.00 39.33 40.91 1b5i h ASP 474 CO -0.08 0.46 0.37 0.50 -2.88 0.00 0.00 179.24 177.62 1b5i h LYS 475 N 0.41 0.61 -0.00 0.28 3.64 -0.51 0.52 116.57 121.52 1b5i h LYS 475 Ca 0.12 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1b5i h LYS 475 Cb 0.13 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1b5i h LYS 475 CO -0.01 0.40 -0.07 -0.25 -2.27 0.00 0.00 179.45 177.25 1b5i n ASP 476 N -4.84 0.20 -3.94 4.20 8.00 -0.54 -4.94 116.55 114.68 1b5i n ASP 476 Ca 0.11 -0.25 -0.32 0.00 0.71 0.00 0.00 54.79 55.04 1b5i n ASP 476 Cb 0.27 -0.20 -0.00 0.00 -0.02 0.00 0.00 41.12 41.17 1b5i n ASP 476 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1b5i n SER 477 N -1.19 -2.47 -0.16 -2.24 7.64 0.17 -4.85 113.62 110.52 1b5i n SER 477 Ca 0.13 -1.10 -0.04 0.00 1.01 0.00 0.00 58.87 58.87 1b5i n SER 477 Cb 0.27 -2.70 0.15 0.00 -1.01 0.00 0.00 64.21 60.92 1b5i n SER 477 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b5i h ALA 478 N 0.99 1.13 -4.84 -0.43 0.00 -1.73 -3.43 119.26 110.95 1b5i h ALA 478 Ca -0.66 -0.23 -0.51 0.00 0.00 0.00 0.00 54.91 53.52 1b5i h ALA 478 Cb 1.38 -0.23 -0.12 0.00 0.00 0.00 0.00 17.79 18.82 1b5i h ALA 478 CO 0.57 0.58 -0.45 0.44 0.00 0.00 0.00 179.25 180.39 1b5i n ILE 479 N -4.25 0.00 -3.98 0.00 -5.35 -1.26 -4.03 119.36 100.49 1b5i n ILE 479 Ca 0.04 -2.29 -0.31 0.00 -0.27 0.00 0.00 62.75 59.92 1b5i n ILE 479 Cb 0.25 0.93 -0.14 0.00 -1.74 0.00 0.00 39.64 38.93 1b5i n ILE 479 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1b5i s VAL 480 N -3.11 2.46 0.30 7.28 1.01 -0.23 -4.87 120.40 123.24 1b5i s VAL 480 Ca 0.26 -2.66 -0.29 0.00 0.00 0.00 0.00 61.98 59.29 1b5i s VAL 480 Cb 0.01 -2.77 -0.10 0.00 0.00 0.00 0.00 36.38 33.52 1b5i s VAL 480 CO 0.18 -0.67 1.43 -2.84 0.00 0.00 0.00 175.10 173.20 1b5i s PRO 481 N 0.51 4.25 0.02 2.72 0.02 -1.26 -0.22 135.00 141.05 1b5i s PRO 481 Ca 0.13 2.35 -0.03 0.00 0.02 0.00 0.00 61.00 63.47 1b5i s PRO 481 Cb -0.21 -3.07 -0.01 0.00 0.02 0.00 0.00 34.50 31.23 1b5i s PRO 481 CO -0.05 -0.40 -0.07 0.28 -0.33 0.00 0.00 177.00 176.43 1b5i n VAL 482 N 1.57 1.00 -3.56 3.83 0.31 -0.06 -4.74 118.33 116.68 1b5i n VAL 482 Ca 0.04 0.29 -0.11 0.00 -0.01 0.00 0.00 64.34 64.55 1b5i n VAL 482 Cb 0.40 -1.63 -0.04 0.00 -0.91 0.00 0.00 33.84 31.67 1b5i n VAL 482 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1b5i s TYR 483 N -1.94 -0.32 -0.12 3.52 -0.85 -1.03 -1.97 117.35 114.63 1b5i s TYR 483 Ca -0.06 0.04 -0.17 0.00 -0.52 0.00 0.00 57.07 56.37 1b5i s TYR 483 Cb 0.01 0.36 -0.04 0.00 0.38 0.00 0.00 41.96 42.66 1b5i s TYR 483 CO 0.08 -0.75 0.42 0.71 -1.52 0.00 0.00 175.55 174.49 1b5i s TYR 484 N -3.77 3.51 0.69 -3.49 2.02 0.12 -0.60 117.35 115.83 1b5i s TYR 484 Ca 0.02 0.81 -0.12 0.00 -0.37 0.00 0.00 57.07 57.41 1b5i s TYR 484 Cb 0.01 -2.48 0.01 0.00 -0.40 0.00 0.00 41.96 39.10 1b5i s TYR 484 CO -0.12 0.22 1.07 0.71 -1.57 0.00 0.00 175.55 175.86 1b5i s TYR 485 N 0.47 2.92 0.18 2.71 1.51 -0.49 -2.14 117.35 122.52 1b5i s TYR 485 Ca 0.23 1.48 0.07 0.00 -1.01 0.00 0.00 57.07 57.84 1b5i s TYR 485 Cb -0.15 -2.97 -0.04 0.00 -0.11 0.00 0.00 41.96 38.69 1b5i s TYR 485 CO 0.09 -1.37 0.03 0.14 -1.11 0.00 0.00 175.55 173.33 1b5i s VAL 486 N -2.82 3.85 -0.73 0.71 -7.23 -1.26 -3.78 120.40 109.15 1b5i s VAL 486 Ca 0.61 -1.41 -0.19 0.00 -1.81 0.00 0.00 61.98 59.18 1b5i s VAL 486 Cb -0.16 -2.96 0.12 0.00 0.56 0.00 0.00 36.38 33.94 1b5i s VAL 486 CO 0.50 -0.14 0.88 0.21 -0.31 0.00 0.00 175.10 176.24 1b5i s ASN 487 N -3.07 6.37 -0.23 4.85 3.84 0.21 -4.86 114.94 122.06 1b5i s ASN 487 Ca 0.29 -1.66 -0.05 0.00 0.21 0.00 0.00 52.86 51.64 1b5i s ASN 487 Cb -0.09 -2.34 -0.02 0.00 -0.55 0.00 0.00 41.25 38.25 1b5i s ASN 487 CO 0.20 -1.11 0.01 0.00 -2.79 0.00 0.00 177.10 173.41 1b5i s ALA 488 N 2.68 2.97 0.25 1.71 0.00 -1.26 -1.91 121.76 126.21 1b5i s ALA 488 Ca 0.20 -1.14 -0.15 0.00 0.00 0.00 0.00 51.96 50.87 1b5i s ALA 488 Cb -0.16 -1.86 0.00 0.00 0.00 0.00 0.00 23.12 21.11 1b5i s ALA 488 CO 0.01 -0.43 0.55 -0.98 0.00 0.00 0.00 175.76 174.91 1b5i s ARG 489 N 1.49 1.60 -0.09 0.00 1.70 -0.52 -3.94 118.95 119.19 1b5i s ARG 489 Ca 0.06 -1.15 -0.04 0.00 -0.47 0.00 0.00 55.73 54.13 1b5i s ARG 489 Cb -0.15 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.71 1b5i s ARG 489 CO -0.00 -0.69 0.06 -0.51 -1.08 0.00 0.00 175.30 173.08 1b5i s LEU 490 N -2.98 3.90 -0.05 -1.89 1.43 -1.26 -1.04 118.68 116.79 1b5i s LEU 490 Ca 0.18 0.26 -0.00 0.00 -1.03 0.00 0.00 54.13 53.54 1b5i s LEU 490 Cb -0.02 -1.94 0.03 0.00 0.03 0.00 0.00 46.19 44.28 1b5i s LEU 490 CO 0.08 0.38 -0.00 -0.69 0.23 0.00 0.00 176.35 176.35 1b5i s VAL 491 N -0.96 0.30 0.70 -1.59 1.01 -0.56 -1.56 120.40 117.74 1b5i s VAL 491 Ca 0.15 0.09 -0.16 0.00 0.00 0.00 0.00 61.98 62.06 1b5i s VAL 491 Cb -0.12 -0.42 0.02 0.00 0.00 0.00 0.00 36.38 35.87 1b5i s VAL 491 CO 0.04 0.21 1.19 -0.54 0.00 0.00 0.00 175.10 176.00 1b5i s LYS 492 N 1.48 2.37 0.56 2.72 -0.14 -0.76 -4.59 119.74 121.38 1b5i s LYS 492 Ca -0.03 1.72 0.27 0.00 -1.36 0.00 0.00 55.97 56.56 1b5i s LYS 492 Cb -0.13 -1.87 1.64 0.00 -1.68 0.00 0.00 37.83 35.79 1b5i s LYS 492 CO -0.03 -1.65 2.20 -1.35 -0.76 0.00 0.00 175.35 173.75 1b5i h PRO 493 N -0.06 0.00 -0.01 -1.68 0.11 -1.92 -1.58 132.00 126.85 1b5i h PRO 493 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1b5i h PRO 493 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1b5i h PRO 493 CO 0.51 0.03 -0.12 -2.67 -0.21 0.00 0.00 178.00 175.55 1b5i n TRP 494 N -3.93 0.00 -2.82 0.65 2.14 -1.26 -4.74 117.44 107.48 1b5i n TRP 494 Ca -0.03 0.00 -0.43 0.00 2.07 0.00 0.00 57.50 59.11 1b5i n TRP 494 Cb 0.12 -0.10 -0.04 0.00 -0.81 0.00 0.00 31.31 30.48 1b5i n TRP 494 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1b5i s VAL 495 N -2.32 4.46 0.31 -1.67 1.01 -0.60 -0.49 120.40 121.10 1b5i s VAL 495 Ca 0.31 0.72 0.01 0.00 0.00 0.00 0.00 61.98 63.02 1b5i s VAL 495 Cb 0.20 -4.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 1b5i s VAL 495 CO 0.44 -0.86 0.51 -0.83 0.00 0.00 0.00 175.10 174.36 1b5i s GLY 496 N 2.31 1.41 0.00 4.51 0.00 0.83 -4.61 107.32 111.76 1b5i s GLY 496 Ca 0.37 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 44.17 1b5i s GLY 496 CO 0.26 -0.87 0.00 0.61 0.00 0.00 0.00 173.10 173.10 1b5i n GLY 497 N -1.55 1.26 3.49 0.20 0.00 -1.26 -1.71 105.19 105.62 1b5i n GLY 497 Ca -0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1b5i n GLY 497 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b5i s TYR 498 N -2.35 3.04 -0.02 1.61 5.04 -1.26 -4.82 117.35 118.60 1b5i s TYR 498 Ca 0.00 -0.24 -0.11 0.00 -2.44 0.00 0.00 57.07 54.28 1b5i s TYR 498 Cb 0.00 -3.45 -0.31 0.00 0.35 0.00 0.00 41.96 38.55 1b5i s TYR 498 CO 0.00 -0.96 0.78 1.79 -1.34 0.00 0.00 175.55 175.82 1b5i h THR 499 N 5.88 1.06 0.00 4.34 1.35 -1.97 -3.48 112.91 120.08 1b5i h THR 499 Ca -0.26 -2.61 0.00 0.00 -0.55 0.00 0.00 66.41 62.99 1b5i h THR 499 Cb 1.09 2.83 0.00 0.00 -1.73 0.00 0.00 68.15 70.34 1b5i h THR 499 CO 0.93 0.84 0.00 0.61 -0.25 0.00 0.00 175.52 177.65 1b5i n GLY 500 N 1.79 0.61 0.05 5.82 0.00 -1.26 -4.91 105.19 107.30 1b5i n GLY 500 Ca -0.21 0.00 0.12 0.00 0.00 0.00 0.00 46.02 45.93 1b5i n GLY 500 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b5i n LYS 501 N -2.77 0.21 -2.95 1.61 4.76 -1.26 -4.61 118.16 113.14 1b5i n LYS 501 Ca 0.00 0.09 -0.42 0.00 -2.87 0.00 0.00 58.31 55.10 1b5i n LYS 501 Cb 0.00 -1.66 -0.05 0.00 -1.84 0.00 0.00 35.03 31.48 1b5i n LYS 501 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1b5i s ASP 502 N -3.96 6.53 0.27 4.39 2.15 -1.24 -4.77 116.67 120.05 1b5i s ASP 502 Ca 0.08 0.29 0.23 0.00 0.43 0.00 0.00 52.55 53.58 1b5i s ASP 502 Cb 0.14 -2.40 1.02 0.00 -0.30 0.00 0.00 42.92 41.39 1b5i s ASP 502 CO 0.68 -0.76 1.69 -0.81 -0.17 0.00 0.00 175.17 175.80 1b5i n PRO 503 N 6.48 0.18 0.05 4.34 -0.04 -1.26 -1.22 135.00 143.52 1b5i n PRO 503 Ca 0.03 0.48 0.12 0.00 -0.04 0.00 0.00 63.50 64.08 1b5i n PRO 503 Cb 0.48 -1.89 0.06 0.00 -0.04 0.00 0.00 33.50 32.11 1b5i n PRO 503 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1b5i n LEU 504 N -2.24 0.66 -3.68 1.53 4.77 -1.26 -0.73 117.00 116.05 1b5i n LEU 504 Ca 0.01 0.13 -0.22 0.00 -0.03 0.00 0.00 56.01 55.89 1b5i n LEU 504 Cb 0.18 -0.11 0.05 0.00 -2.33 0.00 0.00 43.42 41.20 1b5i n LEU 504 CO 0.17 -0.03 0.02 -0.67 -1.33 0.00 0.00 177.39 175.55 1b5i n ASP 505 N -2.16 -2.45 -4.32 -1.43 2.03 -0.36 -4.88 116.55 102.97 1b5i n ASP 505 Ca 0.02 -0.75 -0.43 0.00 0.52 0.00 0.00 54.79 54.14 1b5i n ASP 505 Cb 0.46 -4.30 0.00 0.00 -0.72 0.00 0.00 41.12 36.56 1b5i n ASP 505 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1b5i n ASN 506 N -3.02 5.12 -4.78 1.67 3.02 -1.26 -4.99 115.26 111.02 1b5i n ASN 506 Ca -0.21 -3.00 -0.37 0.00 -0.03 0.00 0.00 54.58 50.97 1b5i n ASN 506 Cb 0.64 -1.57 -0.06 0.00 -0.61 0.00 0.00 39.78 38.17 1b5i n ASN 506 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1b5i s ILE 507 N 1.65 4.21 -0.17 2.41 -1.09 -1.26 -4.85 121.20 122.10 1b5i s ILE 507 Ca 0.44 1.83 0.01 0.00 -2.23 0.00 0.00 60.65 60.70 1b5i s ILE 507 Cb 0.01 -4.04 0.02 0.00 -1.58 0.00 0.00 42.46 36.87 1b5i s ILE 507 CO 0.01 0.19 -0.20 -0.31 -1.23 0.00 0.00 174.94 173.40 1b5i s TYR 508 N -1.56 2.69 0.52 3.97 1.51 -1.26 -4.82 117.35 118.41 1b5i s TYR 508 Ca 0.49 -1.56 0.35 0.00 -1.01 0.00 0.00 57.07 55.33 1b5i s TYR 508 Cb -0.19 -1.87 1.89 0.00 -0.11 0.00 0.00 41.96 41.68 1b5i s TYR 508 CO 0.25 -0.77 2.22 0.28 -1.11 0.00 0.00 175.55 176.42 1b5i h VAL 509 N 5.94 0.31 0.00 0.71 2.07 -1.93 -0.23 116.25 123.11 1b5i h VAL 509 Ca -0.44 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.89 1b5i h VAL 509 Cb 1.15 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1b5i h VAL 509 CO 0.62 0.03 0.00 0.07 0.02 0.00 0.00 177.57 178.31 1b5i h LYS 510 N 0.00 0.00 -0.01 1.57 2.10 -1.95 -1.52 116.57 116.76 1b5i h LYS 510 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1b5i h LYS 510 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 1b5i h LYS 510 CO 0.00 0.00 -0.33 0.09 -2.00 0.00 0.00 179.45 177.22 1b5i n ASN 511 N -2.59 1.42 -5.00 7.07 3.02 -0.10 0.37 115.26 119.46 1b5i n ASN 511 Ca -0.02 -1.14 -0.18 0.00 -0.03 0.00 0.00 54.58 53.21 1b5i n ASN 511 Cb 0.07 0.25 0.02 0.00 -0.61 0.00 0.00 39.78 39.51 1b5i n ASN 511 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b5i s LEU 512 N -2.47 3.52 0.04 3.41 1.43 -0.57 -4.50 118.68 119.54 1b5i s LEU 512 Ca 0.23 -0.37 -0.21 0.00 -1.03 0.00 0.00 54.13 52.75 1b5i s LEU 512 Cb 0.19 -2.61 0.05 0.00 0.03 0.00 0.00 46.19 43.85 1b5i s LEU 512 CO 0.53 -0.91 0.50 -0.72 0.23 0.00 0.00 176.35 175.97 1b5i s TYR 513 N -2.48 -0.39 -0.24 0.29 1.13 -0.70 -4.16 117.35 110.81 1b5i s TYR 513 Ca 0.56 0.43 -0.08 0.00 -1.41 0.00 0.00 57.07 56.57 1b5i s TYR 513 Cb -0.10 0.31 -0.03 0.00 -1.10 0.00 0.00 41.96 41.04 1b5i s TYR 513 CO 0.35 -0.62 0.09 0.42 -2.51 0.00 0.00 175.55 173.27 1b5i s ILE 514 N -2.40 4.52 0.24 -3.49 -1.09 -1.26 -0.12 121.20 117.59 1b5i s ILE 514 Ca -0.06 -0.11 -0.26 0.00 -2.23 0.00 0.00 60.65 58.00 1b5i s ILE 514 Cb -0.01 -3.11 -0.09 0.00 -1.58 0.00 0.00 42.46 37.68 1b5i s ILE 514 CO -0.01 0.34 0.86 -0.63 -1.23 0.00 0.00 174.94 174.27 1b5i s ILE 515 N 1.45 4.28 0.19 2.92 1.01 0.35 -0.79 121.20 130.62 1b5i s ILE 515 Ca 0.06 1.76 -0.33 0.00 0.00 0.00 0.00 60.65 62.14 1b5i s ILE 515 Cb -0.15 -4.10 -0.13 0.00 0.01 0.00 0.00 42.46 38.09 1b5i s ILE 515 CO 0.04 0.35 1.63 1.17 0.00 0.00 0.00 174.94 178.14 1b5i n LYS 516 N 1.12 2.42 0.00 2.79 4.81 -0.06 -4.34 118.16 124.90 1b5i n LYS 516 Ca -0.02 0.87 0.00 0.00 -0.87 0.00 0.00 58.31 58.29 1b5i n LYS 516 Cb 0.49 -2.67 0.00 0.00 0.02 0.00 0.00 35.03 32.87 1b5i n LYS 516 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18