#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hcr s ILE 4 N 0.00 5.11 -0.08 1.53 -1.16 -1.26 0.88 121.20 126.22 2hcr s ILE 4 Ca 0.00 1.21 0.00 0.00 -0.51 0.00 0.00 60.65 61.35 2hcr s ILE 4 Cb 0.00 -3.94 0.02 0.00 0.61 0.00 0.00 42.46 39.16 2hcr s ILE 4 CO 0.00 0.28 -0.06 -0.75 -2.81 0.00 0.00 174.94 171.60 2hcr s LYS 5 N 0.78 1.22 -0.18 3.50 2.47 -0.12 -4.94 119.74 122.47 2hcr s LYS 5 Ca 0.32 -0.17 -0.07 0.00 -1.56 0.00 0.00 55.97 54.48 2hcr s LYS 5 Cb -0.16 -1.28 -0.04 0.00 -1.46 0.00 0.00 37.83 34.89 2hcr s LYS 5 CO 0.14 -0.19 0.06 0.42 0.16 0.00 0.00 175.35 175.94 2hcr s ILE 6 N 1.44 4.80 0.10 5.43 1.01 -1.26 0.09 121.20 132.80 2hcr s ILE 6 Ca -0.01 -0.03 0.10 0.00 0.00 0.00 0.00 60.65 60.71 2hcr s ILE 6 Cb -0.13 -3.16 -0.04 0.00 0.01 0.00 0.00 42.46 39.14 2hcr s ILE 6 CO -0.04 0.46 -0.27 -0.36 0.00 0.00 0.00 174.94 174.74 2hcr s PHE 7 N 0.36 2.32 0.15 3.97 0.40 0.11 -0.26 117.98 125.01 2hcr s PHE 7 Ca 0.03 -0.39 0.08 0.00 -0.60 0.00 0.00 56.93 56.05 2hcr s PHE 7 Cb -0.12 -1.30 -0.04 0.00 0.51 0.00 0.00 43.02 42.06 2hcr s PHE 7 CO 0.00 0.26 -0.08 0.45 0.70 0.00 0.00 175.22 176.55 2hcr s SER 8 N -1.76 4.39 0.26 1.36 0.15 -1.26 -1.32 113.70 115.52 2hcr s SER 8 Ca 0.13 -0.47 -0.17 0.00 0.70 0.00 0.00 55.95 56.14 2hcr s SER 8 Cb -0.10 -0.81 -0.08 0.00 -1.71 0.00 0.00 66.02 63.32 2hcr s SER 8 CO 0.05 0.13 0.71 -0.83 1.20 0.00 0.00 173.24 174.50 2hcr s GLY 9 N -2.60 2.46 0.00 9.45 0.00 -0.78 -4.93 107.32 110.93 2hcr s GLY 9 Ca 0.24 0.07 0.00 0.00 0.00 0.00 0.00 44.72 45.03 2hcr s GLY 9 CO 0.15 0.35 0.00 -1.14 0.00 0.00 0.00 173.10 172.46 2hcr n SER 10 N 0.21 0.00 -0.91 1.64 3.41 -1.26 -3.58 113.62 113.13 2hcr n SER 10 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.70 2hcr n SER 10 Cb 0.52 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.67 2hcr n SER 10 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2hcr n SER 11 N -1.03 3.19 -3.78 4.04 2.88 -1.26 -4.61 113.62 113.05 2hcr n SER 11 Ca 0.00 -1.94 -0.42 0.00 -1.33 0.00 0.00 58.87 55.19 2hcr n SER 11 Cb 0.00 -0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 2hcr n SER 11 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2hcr n HIS 12 N 1.03 2.71 0.22 0.66 8.25 -1.23 -4.73 115.22 122.12 2hcr n HIS 12 Ca 0.16 -2.74 0.07 0.00 -0.26 0.00 0.00 57.72 54.94 2hcr n HIS 12 Cb 0.50 -1.77 0.50 0.00 1.12 0.00 0.00 29.99 30.34 2hcr n HIS 12 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 2hcr h GLN 13 N 5.33 0.00 0.00 -0.41 1.08 -1.82 -3.39 115.11 115.90 2hcr h GLN 13 Ca 0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.65 2hcr h GLN 13 Cb 0.53 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 2hcr h GLN 13 CO 1.52 0.26 0.00 -3.47 -0.95 0.00 0.00 178.83 176.19 2hcr n ASP 14 N -3.86 0.00 -0.23 1.46 2.03 -1.26 0.83 116.55 115.51 2hcr n ASP 14 Ca -0.02 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.22 2hcr n ASP 14 Cb 0.35 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.78 2hcr n ASP 14 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2hcr h LEU 15 N 0.00 0.89 -0.97 -2.67 6.46 -1.91 -2.46 115.31 114.65 2hcr h LEU 15 Ca 0.00 -0.17 -0.10 0.00 -0.12 0.00 0.00 57.88 57.48 2hcr h LEU 15 Cb 0.00 -0.23 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 2hcr h LEU 15 CO 0.00 0.82 -0.39 0.77 -0.62 0.00 0.00 178.44 179.03 2hcr h SER 16 N 0.90 0.26 -0.58 1.25 4.64 -0.75 -1.14 113.55 118.14 2hcr h SER 16 Ca 0.21 -0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.34 2hcr h SER 16 Cb 0.21 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.21 2hcr h SER 16 CO -0.02 0.63 0.02 -0.61 -0.87 0.00 0.00 176.83 175.99 2hcr h GLN 17 N 0.22 1.01 -0.41 4.77 5.75 0.58 -0.17 115.11 126.85 2hcr h GLN 17 Ca 0.02 -0.31 -0.01 0.00 -0.15 0.00 0.00 58.65 58.20 2hcr h GLN 17 Cb 0.78 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.22 2hcr h GLN 17 CO 0.06 0.99 0.20 0.87 -2.65 0.00 0.00 178.83 178.30 2hcr h LYS 18 N 0.90 0.59 0.16 1.69 1.57 -0.97 0.22 116.57 120.73 2hcr h LYS 18 Ca 0.17 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2hcr h LYS 18 Cb 0.52 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2hcr h LYS 18 CO 0.03 0.50 -0.14 0.82 -0.57 0.00 0.00 179.45 180.09 2hcr h ILE 19 N 0.52 0.70 -0.65 1.86 2.04 -1.15 -0.70 117.51 120.14 2hcr h ILE 19 Ca 0.14 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.05 2hcr h ILE 19 Cb 0.10 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 36.83 2hcr h ILE 19 CO -0.02 0.00 0.38 0.00 0.00 0.00 0.00 178.15 178.51 2hcr h ALA 20 N 0.50 0.86 -0.35 1.87 0.00 -0.89 -2.07 119.26 119.17 2hcr h ALA 20 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 2hcr h ALA 20 Cb 0.29 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.85 2hcr h ALA 20 CO -0.02 0.09 -0.07 -0.44 0.00 0.00 0.00 179.25 178.81 2hcr h ASP 21 N 0.72 -0.30 0.71 0.00 3.32 -0.35 -0.02 116.42 120.50 2hcr h ASP 21 Ca 0.28 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 2hcr h ASP 21 Cb 0.11 0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 2hcr h ASP 21 CO -0.14 -0.10 -0.04 0.03 -1.72 0.00 0.00 179.24 177.26 2hcr h ARG 22 N 0.02 0.00 -0.01 3.56 3.08 -0.61 -1.98 114.38 118.43 2hcr h ARG 22 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2hcr h ARG 22 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2hcr h ARG 22 CO -0.35 0.04 -0.32 1.28 -1.07 0.00 0.00 179.97 179.55 2hcr n LEU 23 N -3.19 1.65 -0.30 3.04 4.77 -0.83 -4.96 117.00 117.19 2hcr n LEU 23 Ca -0.01 -0.55 -0.03 0.00 -0.03 0.00 0.00 56.01 55.39 2hcr n LEU 23 Cb 0.26 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2hcr n LEU 23 CO 0.27 0.30 -0.03 0.61 -1.33 0.00 0.00 177.39 177.20 2hcr n GLY 24 N 1.36 0.32 3.29 -0.72 0.00 -0.75 -5.04 105.19 103.65 2hcr n GLY 24 Ca 0.12 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 45.10 2hcr n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hcr s LEU 25 N -0.77 2.33 0.16 0.99 1.43 -0.08 -5.03 118.68 117.71 2hcr s LEU 25 Ca 0.00 -0.72 -0.16 0.00 -1.03 0.00 0.00 54.13 52.22 2hcr s LEU 25 Cb 0.00 -0.86 -0.07 0.00 0.03 0.00 0.00 46.19 45.29 2hcr s LEU 25 CO 0.00 0.03 0.60 -1.61 0.23 0.00 0.00 176.35 175.60 2hcr s GLU 26 N -2.08 4.08 0.31 1.70 2.02 -1.26 -3.89 118.70 119.57 2hcr s GLU 26 Ca 0.08 0.62 -0.29 0.00 0.02 0.00 0.00 54.97 55.40 2hcr s GLU 26 Cb -0.09 -2.95 -0.11 0.00 0.10 0.00 0.00 34.13 31.08 2hcr s GLU 26 CO 0.05 0.47 1.44 -0.51 0.02 0.00 0.00 175.26 176.73 2hcr s LEU 27 N -1.87 4.37 0.70 1.80 1.43 -1.26 -4.69 118.68 119.16 2hcr s LEU 27 Ca 0.38 2.82 -0.16 0.00 -1.03 0.00 0.00 54.13 56.14 2hcr s LEU 27 Cb -0.16 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.44 2hcr s LEU 27 CO 0.20 -0.74 1.24 -0.83 0.23 0.00 0.00 176.35 176.45 2hcr s GLY 28 N 0.01 2.56 -0.16 -3.19 0.00 0.64 -4.95 107.32 102.22 2hcr s GLY 28 Ca 0.55 1.02 -0.29 0.00 0.00 0.00 0.00 44.72 46.00 2hcr s GLY 28 CO 0.52 1.44 1.24 0.54 0.00 0.00 0.00 173.10 176.84 2hcr s LYS 29 N -3.69 4.24 -0.04 2.90 1.02 -1.26 -4.74 119.74 118.18 2hcr s LYS 29 Ca 0.78 1.64 0.02 0.00 0.02 0.00 0.00 55.97 58.43 2hcr s LYS 29 Cb -0.33 -3.74 0.01 0.00 -0.52 0.00 0.00 37.83 33.26 2hcr s LYS 29 CO 0.43 -0.68 -0.08 0.08 -0.92 0.00 0.00 175.35 174.18 2hcr s VAL 30 N 3.36 0.73 -0.43 3.17 1.01 -1.26 0.39 120.40 127.38 2hcr s VAL 30 Ca 0.54 -0.28 -0.23 0.00 0.00 0.00 0.00 61.98 62.01 2hcr s VAL 30 Cb -0.21 -0.69 0.02 0.00 0.00 0.00 0.00 36.38 35.50 2hcr s VAL 30 CO 0.15 0.25 0.77 -0.69 0.00 0.00 0.00 175.10 175.58 2hcr s VAL 31 N 0.53 4.68 -0.34 2.92 1.01 -0.38 -4.94 120.40 123.88 2hcr s VAL 31 Ca -0.08 0.50 -0.01 0.00 0.00 0.00 0.00 61.98 62.39 2hcr s VAL 31 Cb -0.12 -4.28 0.12 0.00 0.00 0.00 0.00 36.38 32.10 2hcr s VAL 31 CO 0.01 -0.64 0.17 0.28 0.00 0.00 0.00 175.10 174.92 2hcr s THR 32 N 3.21 0.42 0.00 3.92 -1.32 -1.26 -1.06 115.64 119.54 2hcr s THR 32 Ca 0.29 -1.51 0.00 0.00 -1.21 0.00 0.00 61.69 59.27 2hcr s THR 32 Cb -0.12 -1.32 0.00 0.00 -1.51 0.00 0.00 72.50 69.55 2hcr s THR 32 CO 0.21 -0.84 0.00 2.29 -2.21 0.00 0.00 174.62 174.07 2hcr n LYS 33 N 4.47 0.00 -4.98 7.08 0.00 -0.29 -4.62 118.16 119.82 2hcr n LYS 33 Ca 0.04 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.03 2hcr n LYS 33 Cb 0.39 0.00 -0.14 0.00 -0.00 0.00 0.00 35.03 35.28 2hcr n LYS 33 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 2hcr s LYS 34 N 1.07 2.15 1.01 -1.58 1.02 -1.26 -0.20 119.74 121.95 2hcr s LYS 34 Ca 0.00 -0.91 -0.14 0.00 0.02 0.00 0.00 55.97 54.93 2hcr s LYS 34 Cb 0.00 -2.15 0.20 0.00 -0.52 0.00 0.00 37.83 35.36 2hcr s LYS 34 CO 0.00 0.56 1.14 -0.06 -0.92 0.00 0.00 175.35 176.07 2hcr s PHE 35 N -0.75 1.82 0.24 3.18 0.40 0.20 -4.85 117.98 118.23 2hcr s PHE 35 Ca 0.12 0.75 -0.06 0.00 -0.60 0.00 0.00 56.93 57.13 2hcr s PHE 35 Cb -0.10 -3.44 0.29 0.00 0.51 0.00 0.00 43.02 40.28 2hcr s PHE 35 CO 0.01 -2.92 1.88 1.03 0.70 0.00 0.00 175.22 175.92 2hcr h SER 36 N -1.89 0.93 -0.04 1.36 0.87 -2.01 -0.91 113.55 111.85 2hcr h SER 36 Ca -0.50 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 2hcr h SER 36 Cb 1.31 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 2hcr h SER 36 CO 0.52 0.62 0.00 -0.46 -0.53 0.00 0.00 176.83 176.98 2hcr n ASN 37 N -4.55 0.86 0.00 6.23 6.94 -1.26 -4.86 115.26 118.62 2hcr n ASN 37 Ca 0.12 -2.03 0.00 0.00 -0.02 0.00 0.00 54.58 52.64 2hcr n ASN 37 Cb 0.12 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.21 2hcr n ASN 37 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2hcr n GLN 38 N -0.13 -0.13 -1.99 -3.83 1.13 -0.35 -5.02 117.38 107.08 2hcr n GLN 38 Ca 0.01 0.03 -0.41 0.00 -1.94 0.00 0.00 57.00 54.70 2hcr n GLN 38 Cb 0.20 -3.10 -0.02 0.00 0.11 0.00 0.00 30.24 27.43 2hcr n GLN 38 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2hcr s GLU 39 N -0.30 4.25 0.12 -1.09 2.02 -1.26 -4.67 118.70 117.79 2hcr s GLU 39 Ca 0.00 2.35 -0.31 0.00 0.02 0.00 0.00 54.97 57.04 2hcr s GLU 39 Cb 0.00 -3.05 -0.08 0.00 0.10 0.00 0.00 34.13 31.11 2hcr s GLU 39 CO 0.00 -0.36 1.32 0.99 0.02 0.00 0.00 175.26 177.23 2hcr s THR 40 N -0.84 3.47 -0.23 3.63 2.01 -1.26 0.60 115.64 123.03 2hcr s THR 40 Ca 0.53 1.10 -0.05 0.00 0.31 0.00 0.00 61.69 63.58 2hcr s THR 40 Cb -0.43 -3.70 -0.01 0.00 0.01 0.00 0.00 72.50 68.37 2hcr s THR 40 CO 0.54 0.11 -0.01 0.00 -0.69 0.00 0.00 174.62 174.56 2hcr s VAL 42 N 1.49 0.55 -0.09 0.00 1.01 -1.26 -1.14 120.40 120.97 2hcr s VAL 42 Ca 0.06 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 61.72 2hcr s VAL 42 Cb -0.14 -0.48 0.05 0.00 0.00 0.00 0.00 36.38 35.81 2hcr s VAL 42 CO -0.01 0.16 0.19 -0.70 0.00 0.00 0.00 175.10 174.74 2hcr s GLU 43 N -0.04 0.10 -0.30 2.72 2.12 -0.22 -4.99 118.70 118.09 2hcr s GLU 43 Ca 0.01 0.53 -0.29 0.00 0.36 0.00 0.00 54.97 55.58 2hcr s GLU 43 Cb -0.04 -0.18 -0.01 0.00 0.26 0.00 0.00 34.13 34.16 2hcr s GLU 43 CO -0.00 -0.24 1.45 0.42 -0.54 0.00 0.00 175.26 176.35 2hcr s ILE 44 N 1.81 3.92 -2.00 -3.70 -1.09 -1.26 -1.25 121.20 117.63 2hcr s ILE 44 Ca -0.03 1.02 0.29 0.00 -2.23 0.00 0.00 60.65 59.70 2hcr s ILE 44 Cb -0.12 -4.00 0.81 0.00 -1.58 0.00 0.00 42.46 37.58 2hcr s ILE 44 CO -0.07 -0.47 2.08 0.61 -1.23 0.00 0.00 174.94 175.86 2hcr n GLY 45 N 4.62 -0.95 3.25 6.18 0.00 0.16 -4.82 105.19 113.63 2hcr n GLY 45 Ca 0.17 -0.18 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 2hcr n GLY 45 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2hcr s GLU 46 N -2.00 0.94 0.30 1.61 -1.05 -1.25 -4.87 118.70 112.38 2hcr s GLU 46 Ca 0.43 -0.91 -0.30 0.00 -0.15 0.00 0.00 54.97 54.04 2hcr s GLU 46 Cb 0.20 0.38 -0.11 0.00 -0.44 0.00 0.00 34.13 34.16 2hcr s GLU 46 CO 0.33 -0.33 1.54 0.45 0.95 0.00 0.00 175.26 178.20 2hcr s SER 47 N -2.86 6.42 0.00 0.83 0.15 -1.26 -4.91 113.70 112.07 2hcr s SER 47 Ca 0.06 2.92 0.00 0.00 0.70 0.00 0.00 55.95 59.63 2hcr s SER 47 Cb 0.04 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2hcr s SER 47 CO -0.10 -0.86 0.97 1.33 1.20 0.00 0.00 173.24 175.77 2hcr n VAL 48 N 1.83 0.94 -1.67 4.45 0.24 -1.26 -5.02 118.33 117.84 2hcr n VAL 48 Ca 0.06 -0.96 -0.45 0.00 -2.04 0.00 0.00 64.34 60.95 2hcr n VAL 48 Cb 0.38 0.53 -0.04 0.00 -1.47 0.00 0.00 33.84 33.25 2hcr n VAL 48 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2hcr n ARG 49 N -0.47 2.46 -1.00 7.34 0.63 -1.24 -1.53 116.66 122.86 2hcr n ARG 49 Ca 0.00 0.89 0.00 0.00 -0.92 0.00 0.00 57.85 57.82 2hcr n ARG 49 Cb 0.24 -2.83 0.00 0.00 0.45 0.00 0.00 32.46 30.32 2hcr n ARG 49 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2hcr n GLY 50 N 4.57 0.36 3.91 5.14 0.00 -0.19 -4.88 105.19 114.10 2hcr n GLY 50 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2hcr n GLY 50 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hcr s GLU 51 N -0.57 3.56 -0.60 1.61 0.41 -0.58 -4.39 118.70 118.14 2hcr s GLU 51 Ca 0.00 -0.22 -0.23 0.00 -0.41 0.00 0.00 54.97 54.11 2hcr s GLU 51 Cb 0.00 -2.86 0.06 0.00 -1.78 0.00 0.00 34.13 29.54 2hcr s GLU 51 CO 0.00 0.46 0.93 0.34 -0.49 0.00 0.00 175.26 176.49 2hcr s ASP 52 N -2.71 6.25 -0.16 -0.19 2.15 0.25 -1.09 116.67 121.18 2hcr s ASP 52 Ca 0.39 -0.68 -0.08 0.00 0.43 0.00 0.00 52.55 52.61 2hcr s ASP 52 Cb -0.12 -2.42 -0.04 0.00 -0.30 0.00 0.00 42.92 40.04 2hcr s ASP 52 CO 0.27 -1.30 0.13 -0.69 -0.17 0.00 0.00 175.17 173.40 2hcr s VAL 53 N 3.92 5.41 -0.14 1.11 1.01 -0.11 -0.95 120.40 130.66 2hcr s VAL 53 Ca 0.25 0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.43 2hcr s VAL 53 Cb -0.15 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 32.83 2hcr s VAL 53 CO 0.14 0.52 -0.18 -0.31 0.00 0.00 0.00 175.10 175.28 2hcr s TYR 54 N -0.28 2.36 -0.23 5.22 1.51 0.11 -0.69 117.35 125.37 2hcr s TYR 54 Ca 0.11 -1.23 -0.03 0.00 -1.01 0.00 0.00 57.07 54.91 2hcr s TYR 54 Cb -0.11 -1.66 0.00 0.00 -0.11 0.00 0.00 41.96 40.08 2hcr s TYR 54 CO 0.01 -0.61 -0.06 0.42 -1.11 0.00 0.00 175.55 174.20 2hcr s ILE 55 N 1.06 3.15 -0.23 2.71 1.01 -0.49 0.04 121.20 128.45 2hcr s ILE 55 Ca -0.03 -0.67 -0.17 0.00 0.00 0.00 0.00 60.65 59.79 2hcr s ILE 55 Cb -0.14 -2.47 -0.03 0.00 0.01 0.00 0.00 42.46 39.82 2hcr s ILE 55 CO -0.05 0.37 0.45 -0.69 0.00 0.00 0.00 174.94 175.02 2hcr s VAL 56 N 1.43 5.13 0.25 2.92 1.01 -0.43 -0.68 120.40 130.02 2hcr s VAL 56 Ca 0.04 0.78 -0.31 0.00 0.00 0.00 0.00 61.98 62.50 2hcr s VAL 56 Cb -0.15 -3.78 -0.12 0.00 0.00 0.00 0.00 36.38 32.34 2hcr s VAL 56 CO -0.04 0.16 1.64 1.67 0.00 0.00 0.00 175.10 178.53 2hcr n GLN 57 N 5.06 2.67 -0.74 2.72 7.27 -0.73 -1.86 117.38 131.77 2hcr n GLN 57 Ca -0.06 0.96 -0.32 0.00 0.07 0.00 0.00 57.00 57.65 2hcr n GLN 57 Cb 0.50 -2.76 0.16 0.00 2.41 0.00 0.00 30.24 30.56 2hcr n GLN 57 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2hcr n SER 58 N 2.94 0.19 -1.36 1.69 2.88 -1.26 -4.73 113.62 113.97 2hcr n SER 58 Ca 0.12 0.43 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 2hcr n SER 58 Cb 0.35 -1.46 0.26 0.00 -0.75 0.00 0.00 64.21 62.62 2hcr n SER 58 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2hcr n GLY 59 N 0.42 4.11 0.22 0.46 0.00 -1.26 -4.81 105.19 104.34 2hcr n GLY 59 Ca 0.12 -1.07 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 2hcr n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hcr n GLY 61 N -1.32 1.31 3.54 0.00 0.00 -1.26 -5.04 105.19 102.43 2hcr n GLY 61 Ca -0.04 -0.39 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 2hcr n GLY 61 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hcr s GLU 62 N 0.00 3.38 0.25 1.61 -6.30 -1.26 -4.89 118.70 111.48 2hcr s GLU 62 Ca 0.00 -0.77 -0.06 0.00 -2.50 0.00 0.00 54.97 51.65 2hcr s GLU 62 Cb 0.00 -4.72 0.30 0.00 0.00 0.00 0.00 34.13 29.71 2hcr s GLU 62 CO 0.00 -2.12 1.89 0.97 0.02 0.00 0.00 175.26 176.02 2hcr h ILE 63 N 6.32 1.14 -0.33 -3.70 2.10 -1.98 -1.58 117.51 119.49 2hcr h ILE 63 Ca -0.05 -0.40 -0.15 0.00 1.08 0.00 0.00 64.86 65.34 2hcr h ILE 63 Cb 1.03 -0.11 -0.01 0.00 -1.09 0.00 0.00 36.82 36.65 2hcr h ILE 63 CO 1.32 0.21 -0.39 0.78 -1.08 0.00 0.00 178.15 178.99 2hcr h ASN 64 N 1.15 0.84 0.03 2.19 -0.26 -1.98 0.35 115.58 117.89 2hcr h ASN 64 Ca 0.37 -0.38 0.01 0.00 -0.56 0.00 0.00 56.30 55.75 2hcr h ASN 64 Cb 0.03 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 37.03 2hcr h ASN 64 CO -0.13 1.13 -0.09 0.44 -1.06 0.00 0.00 177.43 177.72 2hcr h ASP 65 N 0.64 -0.26 -0.75 5.81 3.32 -1.92 -1.07 116.42 122.19 2hcr h ASP 65 Ca 0.05 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 2hcr h ASP 65 Cb 0.95 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.58 2hcr h ASP 65 CO 0.09 -0.14 0.23 0.78 -1.72 0.00 0.00 179.24 178.48 2hcr h ASN 66 N -0.18 1.10 -0.15 6.45 2.35 -1.04 0.01 115.58 124.12 2hcr h ASN 66 Ca 0.03 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.56 2hcr h ASN 66 Cb 0.21 -0.29 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 2hcr h ASN 66 CO -0.07 1.02 0.05 0.25 -1.65 0.00 0.00 177.43 177.03 2hcr h LEU 67 N 1.12 0.21 -0.61 1.61 5.85 -0.28 -1.86 115.31 121.35 2hcr h LEU 67 Ca 0.24 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2hcr h LEU 67 Cb 0.31 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 2hcr h LEU 67 CO -0.01 0.34 0.25 0.24 -0.34 0.00 0.00 178.44 178.92 2hcr h MET 68 N 0.08 0.91 -0.69 1.25 2.86 -1.06 -1.50 114.93 116.77 2hcr h MET 68 Ca 0.05 -0.16 0.08 0.00 -2.06 0.00 0.00 59.70 57.61 2hcr h MET 68 Cb 0.20 -0.15 -0.07 0.00 0.06 0.00 0.00 31.60 31.64 2hcr h MET 68 CO -0.00 0.76 0.35 1.49 1.06 0.00 0.00 176.91 180.57 2hcr h GLU 69 N 0.85 0.59 -0.29 1.72 4.81 -0.94 0.11 114.58 121.43 2hcr h GLU 69 Ca 0.21 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2hcr h GLU 69 Cb 0.19 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2hcr h GLU 69 CO -0.02 0.39 0.08 1.25 -0.73 0.00 0.00 179.01 179.98 2hcr h LEU 70 N 0.61 0.44 -0.60 1.64 5.85 -1.04 -0.66 115.31 121.55 2hcr h LEU 70 Ca 0.33 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 2hcr h LEU 70 Cb 0.31 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 2hcr h LEU 70 CO -0.24 0.55 0.19 -0.07 -0.34 0.00 0.00 178.44 178.52 2hcr h LEU 71 N 0.31 0.87 -0.64 2.25 3.38 -0.84 -0.57 115.31 120.07 2hcr h LEU 71 Ca 0.09 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 2hcr h LEU 71 Cb 0.27 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2hcr h LEU 71 CO -0.00 0.84 0.20 0.40 0.09 0.00 0.00 178.44 179.98 2hcr h ILE 72 N 0.85 1.25 -0.48 1.22 2.04 -0.70 -1.15 117.51 120.54 2hcr h ILE 72 Ca 0.19 -0.85 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 2hcr h ILE 72 Cb 0.28 0.58 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2hcr h ILE 72 CO -0.01 0.33 0.15 0.24 0.00 0.00 0.00 178.15 178.86 2hcr h MET 73 N 0.93 0.74 -0.42 2.37 2.86 -0.84 -0.60 114.93 119.97 2hcr h MET 73 Ca 0.21 -0.16 0.04 0.00 -2.06 0.00 0.00 59.70 57.73 2hcr h MET 73 Cb 0.29 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.80 2hcr h MET 73 CO -0.01 0.70 0.19 0.82 1.06 0.00 0.00 176.91 179.67 2hcr h ILE 74 N 0.64 0.93 -0.39 -1.22 2.04 -0.98 -2.13 117.51 116.41 2hcr h ILE 74 Ca 0.16 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 2hcr h ILE 74 Cb 0.26 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 2hcr h ILE 74 CO -0.01 0.07 0.24 -1.13 0.00 0.00 0.00 178.15 177.32 2hcr h ASN 75 N 0.38 0.47 -0.70 1.72 -1.24 -0.98 -1.02 115.58 114.21 2hcr h ASN 75 Ca 0.19 -0.05 -0.03 0.00 0.71 0.00 0.00 56.30 57.12 2hcr h ASN 75 Cb 0.13 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 39.03 2hcr h ASN 75 CO -0.15 0.38 0.31 0.00 -1.29 0.00 0.00 177.43 176.67 2hcr h ALA 76 N 1.11 0.90 -0.43 1.57 0.00 -0.95 -2.08 119.26 119.38 2hcr h ALA 76 Ca 0.14 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 2hcr h ALA 76 Cb -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2hcr h ALA 76 CO -0.03 0.49 -0.31 0.00 0.00 0.00 0.00 179.25 179.40 2hcr h LYS 78 N 0.81 0.59 0.00 0.00 1.79 -1.02 -1.95 116.57 116.79 2hcr h LYS 78 Ca 0.08 -0.14 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 2hcr h LYS 78 Cb 0.90 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.47 2hcr h LYS 78 CO 0.08 0.62 0.00 0.44 -1.08 0.00 0.00 179.45 179.51 2hcr n ILE 79 N -4.60 0.16 -0.22 1.86 -5.35 -0.80 -2.37 119.36 108.04 2hcr n ILE 79 Ca -0.01 -0.04 0.05 0.00 -0.27 0.00 0.00 62.75 62.48 2hcr n ILE 79 Cb 0.19 -0.54 0.27 0.00 -1.74 0.00 0.00 39.64 37.83 2hcr n ILE 79 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2hcr n ALA 80 N -1.56 3.31 -1.99 -1.28 0.00 -0.77 -4.95 120.51 113.27 2hcr n ALA 80 Ca 0.07 -1.27 -0.13 0.00 0.00 0.00 0.00 53.44 52.11 2hcr n ALA 80 Cb 0.35 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 2hcr n ALA 80 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2hcr n SER 81 N 0.53 -4.21 -4.57 0.00 7.64 -1.00 -3.65 113.62 108.35 2hcr n SER 81 Ca 0.19 0.09 -0.43 0.00 1.01 0.00 0.00 58.87 59.73 2hcr n SER 81 Cb 0.84 -3.24 0.00 0.00 -1.01 0.00 0.00 64.21 60.80 2hcr n SER 81 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hcr n ALA 82 N -0.77 -0.35 -0.12 -0.43 0.00 -0.76 -1.03 120.51 117.06 2hcr n ALA 82 Ca -0.15 0.27 -0.12 0.00 0.00 0.00 0.00 53.44 53.45 2hcr n ALA 82 Cb 0.56 -1.99 -0.03 0.00 0.00 0.00 0.00 19.45 17.99 2hcr n ALA 82 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2hcr h SER 83 N 1.52 0.72 -4.54 0.00 0.87 -1.28 -3.43 113.55 107.40 2hcr h SER 83 Ca -0.42 -0.39 -0.12 0.00 -1.23 0.00 0.00 61.79 59.64 2hcr h SER 83 Cb 1.35 -0.20 -0.22 0.00 -0.44 0.00 0.00 62.40 62.90 2hcr h SER 83 CO 0.57 0.94 -0.22 -0.60 -0.53 0.00 0.00 176.83 176.99 2hcr s ARG 84 N -4.70 0.62 -0.11 2.24 3.52 -1.14 -5.00 118.95 114.38 2hcr s ARG 84 Ca -0.13 0.15 0.02 0.00 -0.13 0.00 0.00 55.73 55.64 2hcr s ARG 84 Cb 0.09 0.29 0.01 0.00 -1.56 0.00 0.00 34.95 33.79 2hcr s ARG 84 CO 0.81 -0.14 -0.16 0.08 -0.81 0.00 0.00 175.30 175.08 2hcr s VAL 85 N -0.69 1.55 -0.12 7.11 1.01 -1.26 -0.93 120.40 127.07 2hcr s VAL 85 Ca -0.08 -0.67 0.01 0.00 0.00 0.00 0.00 61.98 61.24 2hcr s VAL 85 Cb -0.04 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 2hcr s VAL 85 CO 0.03 0.45 -0.14 -0.89 0.00 0.00 0.00 175.10 174.55 2hcr s THR 86 N 1.02 2.96 -0.33 3.92 2.01 0.14 -0.68 115.64 124.68 2hcr s THR 86 Ca -0.06 -0.70 -0.19 0.00 0.31 0.00 0.00 61.69 61.05 2hcr s THR 86 Cb -0.15 -2.23 -0.01 0.00 0.01 0.00 0.00 72.50 70.13 2hcr s THR 86 CO -0.02 0.53 0.57 0.00 -0.69 0.00 0.00 174.62 175.01 2hcr s ALA 87 N 0.27 3.49 -0.53 7.40 0.00 -0.51 -1.39 121.76 130.49 2hcr s ALA 87 Ca -0.10 -0.85 -0.18 0.00 0.00 0.00 0.00 51.96 50.83 2hcr s ALA 87 Cb -0.16 -3.06 0.09 0.00 0.00 0.00 0.00 23.12 19.99 2hcr s ALA 87 CO 0.06 -1.17 0.59 0.08 0.00 0.00 0.00 175.76 175.32 2hcr s VAL 88 N 2.51 4.97 -0.54 0.00 1.01 0.14 -0.66 120.40 127.83 2hcr s VAL 88 Ca 0.22 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.33 2hcr s VAL 88 Cb -0.15 -4.33 0.14 0.00 0.00 0.00 0.00 36.38 32.03 2hcr s VAL 88 CO 0.13 -0.88 0.29 -0.63 0.00 0.00 0.00 175.10 174.01 2hcr s ILE 89 N 2.32 2.69 0.19 2.22 1.01 0.15 -1.78 121.20 128.00 2hcr s ILE 89 Ca 0.10 -3.37 -0.12 0.00 0.00 0.00 0.00 60.65 57.26 2hcr s ILE 89 Cb -0.23 -2.85 0.11 0.00 0.01 0.00 0.00 42.46 39.49 2hcr s ILE 89 CO 0.08 -0.82 1.73 -0.65 0.00 0.00 0.00 174.94 175.28 2hcr h PRO 90 N 6.45 0.30 -4.88 2.79 0.11 -1.85 -3.34 132.00 131.57 2hcr h PRO 90 Ca -0.06 -0.02 -0.67 0.00 0.11 0.00 0.00 66.00 65.36 2hcr h PRO 90 Cb 0.88 -0.07 -0.34 0.00 0.11 0.00 0.00 31.00 31.58 2hcr h PRO 90 CO 0.69 0.20 -0.77 0.00 -0.21 0.00 0.00 178.00 177.91 2hcr s PHE 92 N 1.22 2.83 0.44 0.00 5.36 -1.26 -4.98 117.98 121.59 2hcr s PHE 92 Ca -0.04 0.96 -0.24 0.00 -0.96 0.00 0.00 56.93 56.65 2hcr s PHE 92 Cb -0.18 -3.53 -0.08 0.00 -0.34 0.00 0.00 43.02 38.89 2hcr s PHE 92 CO -0.05 -1.86 1.18 -1.25 -1.46 0.00 0.00 175.22 171.78 2hcr s PRO 93 N 3.27 3.82 -0.43 10.12 0.04 -1.26 -3.44 135.00 147.12 2hcr s PRO 93 Ca 0.57 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.44 2hcr s PRO 93 Cb -0.24 -2.49 0.00 0.00 0.04 0.00 0.00 34.50 31.81 2hcr s PRO 93 CO 0.18 -0.51 0.00 0.66 0.04 0.00 0.00 177.00 177.36 2hcr n TYR 94 N -0.33 0.00 0.13 0.56 4.02 -1.26 -4.80 117.16 115.49 2hcr n TYR 94 Ca 0.06 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 58.09 2hcr n TYR 94 Cb 0.47 -1.71 0.67 0.00 -0.02 0.00 0.00 39.34 38.75 2hcr n TYR 94 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2hcr h ALA 95 N 0.00 2.24 0.00 -0.72 0.00 -1.95 0.29 119.26 119.12 2hcr h ALA 95 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2hcr h ALA 95 Cb 0.76 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2hcr h ALA 95 CO 0.12 -0.32 0.00 0.54 0.00 0.00 0.00 179.25 179.59 2hcr n ARG 96 N -4.46 0.12 -2.87 0.00 1.74 -1.26 -3.50 116.66 106.43 2hcr n ARG 96 Ca 0.03 0.12 -0.38 0.00 -0.77 0.00 0.00 57.85 56.85 2hcr n ARG 96 Cb 0.34 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.28 2hcr n ARG 96 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2hcr n GLN 97 N -1.42 4.54 -0.21 5.56 1.13 0.09 -4.75 117.38 122.33 2hcr n GLN 97 Ca 0.07 -4.67 0.07 0.00 -1.94 0.00 0.00 57.00 50.53 2hcr n GLN 97 Cb 0.22 -2.42 0.19 0.00 0.11 0.00 0.00 30.24 28.33 2hcr n GLN 97 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 2hcr n ASP 98 N 0.38 3.11 -3.81 1.08 5.75 -1.23 -1.84 116.55 120.00 2hcr n ASP 98 Ca 0.37 -1.97 -0.08 0.00 -0.01 0.00 0.00 54.79 53.09 2hcr n ASP 98 Cb 0.32 -0.28 -0.02 0.00 -1.03 0.00 0.00 41.12 40.11 2hcr n ASP 98 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2hcr s LYS 99 N -1.01 1.68 0.13 0.11 -2.85 -1.26 -4.98 119.74 111.56 2hcr s LYS 99 Ca 0.29 -0.94 -0.03 0.00 -1.00 0.00 0.00 55.97 54.28 2hcr s LYS 99 Cb 0.15 0.59 -0.09 0.00 -2.06 0.00 0.00 37.83 36.42 2hcr s LYS 99 CO 0.20 -0.76 1.31 0.87 0.10 0.00 0.00 175.35 177.07 2hcr h LYS 100 N 2.04 0.36 -4.49 1.78 1.57 -1.86 -3.43 116.57 112.54 2hcr h LYS 100 Ca -0.22 -0.40 -0.23 0.00 -1.87 0.00 0.00 60.65 57.92 2hcr h LYS 100 Cb 1.26 0.12 0.11 0.00 0.08 0.00 0.00 32.23 33.80 2hcr h LYS 100 CO 0.27 1.08 -0.52 -0.25 -0.57 0.00 0.00 179.45 179.46 2hcr n ASP 101 N -3.72 -2.50 0.00 0.86 8.00 -1.26 -2.82 116.55 115.12 2hcr n ASP 101 Ca -0.06 -0.42 0.00 0.00 0.71 0.00 0.00 54.79 55.02 2hcr n ASP 101 Cb 0.84 -3.68 0.00 0.00 -0.02 0.00 0.00 41.12 38.26 2hcr n ASP 101 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2hcr n LYS 102 N -3.23 -1.84 -4.42 -1.24 5.02 -1.26 -4.94 118.16 106.25 2hcr n LYS 102 Ca -0.17 0.46 -0.23 0.00 -2.02 0.00 0.00 58.31 56.35 2hcr n LYS 102 Cb 0.61 -4.89 -0.11 0.00 -0.02 0.00 0.00 35.03 30.62 2hcr n LYS 102 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2hcr s SER 103 N -2.00 3.23 -1.18 4.39 0.15 -1.13 -5.03 113.70 112.13 2hcr s SER 103 Ca 0.00 -0.97 -0.08 0.00 0.70 0.00 0.00 55.95 55.60 2hcr s SER 103 Cb 0.00 -0.24 -0.11 0.00 -1.71 0.00 0.00 66.02 63.96 2hcr s SER 103 CO 0.00 0.01 2.85 -1.14 1.20 0.00 0.00 173.24 176.16 2hcr n ARG 104 N -0.25 3.02 -4.10 5.44 0.63 -1.26 -4.79 116.66 115.35 2hcr n ARG 104 Ca -0.08 -1.80 -0.22 0.00 -0.92 0.00 0.00 57.85 54.82 2hcr n ARG 104 Cb 0.59 -2.57 -0.04 0.00 0.45 0.00 0.00 32.46 30.88 2hcr n ARG 104 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2hcr s ALA 105 N 2.25 3.58 0.59 5.13 0.00 -1.26 -5.12 121.76 126.93 2hcr s ALA 105 Ca 0.62 -1.46 -0.10 0.00 0.00 0.00 0.00 51.96 51.01 2hcr s ALA 105 Cb 0.18 -1.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.01 2hcr s ALA 105 CO -0.04 0.23 0.98 -1.25 0.00 0.00 0.00 175.76 175.68 2hcr s PRO 106 N -3.85 3.61 -1.03 0.00 0.04 -1.26 -4.80 135.00 127.71 2hcr s PRO 106 Ca 0.34 0.66 -0.06 0.00 0.04 0.00 0.00 61.00 61.98 2hcr s PRO 106 Cb -0.07 -2.13 0.26 0.00 0.04 0.00 0.00 34.50 32.59 2hcr s PRO 106 CO 0.25 -0.49 0.98 0.42 0.04 0.00 0.00 177.00 178.20 2hcr s ILE 107 N -3.08 5.37 0.47 0.56 1.01 -1.26 -4.68 121.20 119.59 2hcr s ILE 107 Ca 0.54 -3.59 0.14 0.00 0.00 0.00 0.00 60.65 57.74 2hcr s ILE 107 Cb -0.11 -4.26 0.23 0.00 0.01 0.00 0.00 42.46 38.33 2hcr s ILE 107 CO 0.51 -1.15 2.06 0.28 0.00 0.00 0.00 174.94 176.65 2hcr h SER 108 N 6.42 0.05 0.10 3.58 0.02 -1.74 -1.23 113.55 120.74 2hcr h SER 108 Ca 0.17 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.05 2hcr h SER 108 Cb 0.85 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.37 2hcr h SER 108 CO 0.95 0.12 -0.21 0.00 -1.14 0.00 0.00 176.83 176.56 2hcr h ALA 109 N 1.88 1.42 -0.06 3.77 0.00 -1.42 0.13 119.26 124.99 2hcr h ALA 109 Ca 0.01 -0.26 -0.23 0.00 0.00 0.00 0.00 54.91 54.44 2hcr h ALA 109 Cb 0.16 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 17.88 2hcr h ALA 109 CO 0.01 0.41 -0.84 -0.22 0.00 0.00 0.00 179.25 178.60 2hcr h LYS 110 N 0.20 0.67 -0.41 0.00 1.63 -1.46 -2.24 116.57 114.96 2hcr h LYS 110 Ca 0.04 -0.65 0.01 0.00 -0.85 0.00 0.00 60.65 59.20 2hcr h LYS 110 Cb 0.49 0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 32.26 2hcr h LYS 110 CO 0.03 1.25 0.25 1.25 -3.45 0.00 0.00 179.45 178.78 2hcr h LEU 111 N 0.34 0.42 -0.69 5.20 5.85 -1.19 0.67 115.31 125.92 2hcr h LEU 111 Ca -0.09 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.69 2hcr h LEU 111 Cb 1.50 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.38 2hcr h LEU 111 CO 0.17 0.30 0.38 0.58 -0.34 0.00 0.00 178.44 179.54 2hcr h VAL 112 N 0.51 0.96 -0.58 1.05 2.07 -0.78 0.29 116.25 119.78 2hcr h VAL 112 Ca 0.16 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2hcr h VAL 112 Cb -0.02 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 29.93 2hcr h VAL 112 CO -0.06 0.13 0.38 0.00 0.02 0.00 0.00 177.57 178.03 2hcr h ALA 113 N 1.36 0.73 -0.49 1.67 0.00 -1.07 -0.79 119.26 120.66 2hcr h ALA 113 Ca 0.31 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 2hcr h ALA 113 Cb 0.20 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2hcr h ALA 113 CO -0.19 0.17 -0.08 -0.91 0.00 0.00 0.00 179.25 178.24 2hcr h ASN 114 N 0.78 0.88 -0.19 0.00 2.35 0.21 -1.71 115.58 117.92 2hcr h ASN 114 Ca 0.21 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 2hcr h ASN 114 Cb -0.08 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.04 2hcr h ASN 114 CO -0.04 0.99 0.07 0.24 -1.65 0.00 0.00 177.43 177.04 2hcr h MET 115 N 0.81 0.28 -0.50 0.81 2.86 -0.28 -0.77 114.93 118.14 2hcr h MET 115 Ca 0.14 -0.05 0.06 0.00 -2.06 0.00 0.00 59.70 57.78 2hcr h MET 115 Cb 0.60 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.16 2hcr h MET 115 CO 0.04 0.36 0.21 -0.07 1.06 0.00 0.00 176.91 178.50 2hcr h LEU 116 N 0.14 0.25 0.36 1.22 3.38 -1.00 -0.28 115.31 119.39 2hcr h LEU 116 Ca 0.06 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2hcr h LEU 116 Cb 0.18 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2hcr h LEU 116 CO -0.00 0.17 -0.19 0.28 0.09 0.00 0.00 178.44 178.79 2hcr h SER 117 N 0.40 -0.44 0.60 -0.43 0.02 -1.24 -1.85 113.55 110.61 2hcr h SER 117 Ca 0.23 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.18 2hcr h SER 117 Cb 0.22 0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.87 2hcr h SER 117 CO -0.21 -0.31 -0.09 -0.37 -1.14 0.00 0.00 176.83 174.71 2hcr h VAL 118 N -0.51 0.32 0.00 2.27 -1.51 -1.00 -2.01 116.25 113.81 2hcr h VAL 118 Ca -0.05 -0.56 -0.07 0.00 -1.23 0.00 0.00 66.70 64.79 2hcr h VAL 118 Cb 0.40 1.42 -0.01 0.00 -2.13 0.00 0.00 31.29 30.96 2hcr h VAL 118 CO 0.07 0.09 -0.34 0.00 -1.23 0.00 0.00 177.57 176.15 2hcr h ALA 119 N 1.91 1.06 0.00 5.19 0.00 -0.86 -3.47 119.26 123.09 2hcr h ALA 119 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2hcr h ALA 119 Cb 0.41 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2hcr h ALA 119 CO 0.01 0.43 0.00 0.41 0.00 0.00 0.00 179.25 180.10 2hcr n GLY 120 N 0.07 1.62 3.74 0.00 0.00 -0.75 -3.58 105.19 106.28 2hcr n GLY 120 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 2hcr n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hcr s ALA 121 N -1.86 3.57 -0.30 4.61 0.00 -0.72 -4.65 121.76 122.41 2hcr s ALA 121 Ca 0.00 1.23 0.16 0.00 0.00 0.00 0.00 51.96 53.35 2hcr s ALA 121 Cb 0.00 -3.52 -0.22 0.00 0.00 0.00 0.00 23.12 19.39 2hcr s ALA 121 CO 0.00 -0.65 0.47 -0.25 0.00 0.00 0.00 175.76 175.33 2hcr n ASP 122 N 2.31 1.12 -3.60 0.00 8.00 0.15 -4.71 116.55 119.81 2hcr n ASP 122 Ca 0.06 -0.34 -0.14 0.00 0.71 0.00 0.00 54.79 55.08 2hcr n ASP 122 Cb 0.41 1.44 -0.07 0.00 -0.02 0.00 0.00 41.12 42.89 2hcr n ASP 122 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2hcr s HIS 123 N -2.85 -0.70 -0.09 1.24 2.46 -1.20 -4.30 115.29 109.85 2hcr s HIS 123 Ca -0.01 1.60 0.04 0.00 0.47 0.00 0.00 55.06 57.16 2hcr s HIS 123 Cb 0.11 0.32 -0.01 0.00 -0.13 0.00 0.00 32.58 32.87 2hcr s HIS 123 CO 0.65 -0.41 -0.23 0.42 -2.47 0.00 0.00 174.74 172.70 2hcr s ILE 124 N -0.06 2.19 -0.19 0.89 -1.09 -0.66 -1.42 121.20 120.86 2hcr s ILE 124 Ca -0.02 -0.99 -0.01 0.00 -2.23 0.00 0.00 60.65 57.40 2hcr s ILE 124 Cb -0.04 -1.83 0.00 0.00 -1.58 0.00 0.00 42.46 39.02 2hcr s ILE 124 CO 0.02 0.56 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.53 2hcr s ILE 125 N 0.14 2.70 0.16 2.92 1.01 0.17 -0.23 121.20 128.07 2hcr s ILE 125 Ca -0.12 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 2hcr s ILE 125 Cb -0.16 -2.18 -0.04 0.00 0.01 0.00 0.00 42.46 40.09 2hcr s ILE 125 CO 0.07 0.49 0.09 0.28 0.00 0.00 0.00 174.94 175.86 2hcr s THR 126 N 1.22 0.08 -0.12 2.92 -1.32 -0.26 0.32 115.64 118.49 2hcr s THR 126 Ca 0.02 -1.95 0.03 0.00 -1.21 0.00 0.00 61.69 58.58 2hcr s THR 126 Cb -0.14 -2.25 0.01 0.00 -1.51 0.00 0.00 72.50 68.61 2hcr s THR 126 CO -0.06 -0.26 -0.20 -0.32 -2.21 0.00 0.00 174.62 171.57 2hcr s MET 127 N -4.09 2.71 -1.09 7.08 1.75 -1.03 -0.61 119.30 124.02 2hcr s MET 127 Ca 0.31 -0.75 -0.18 0.00 -1.25 0.00 0.00 55.69 53.82 2hcr s MET 127 Cb 0.07 -2.17 -0.01 0.00 2.84 0.00 0.00 34.83 35.56 2hcr s MET 127 CO 0.06 0.02 0.79 -0.25 -0.65 0.00 0.00 175.02 174.99 2hcr n ASP 128 N 3.95 -5.54 -4.53 1.11 8.00 0.57 -4.71 116.55 115.40 2hcr n ASP 128 Ca -0.20 -0.94 -0.49 0.00 0.71 0.00 0.00 54.79 53.87 2hcr n ASP 128 Cb 0.52 -3.48 -0.04 0.00 -0.02 0.00 0.00 41.12 38.10 2hcr n ASP 128 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2hcr n LEU 129 N -3.90 0.75 -0.34 0.64 4.77 -1.26 -4.84 117.00 112.81 2hcr n LEU 129 Ca -0.10 1.15 0.08 0.00 -0.03 0.00 0.00 56.01 57.11 2hcr n LEU 129 Cb 0.59 -1.13 0.27 0.00 -2.33 0.00 0.00 43.42 40.82 2hcr n LEU 129 CO 0.66 -1.78 1.23 -0.74 -1.33 0.00 0.00 177.39 175.43 2hcr h HIS 130 N 2.54 1.07 -3.53 -1.77 -0.00 -1.91 -3.37 115.15 108.18 2hcr h HIS 130 Ca -0.40 0.03 -0.37 0.00 -0.00 0.00 0.00 60.37 59.63 2hcr h HIS 130 Cb 1.38 -0.34 -0.33 0.00 -0.00 0.00 0.00 27.41 28.11 2hcr h HIS 130 CO 0.50 0.41 -0.76 0.00 -0.00 0.00 0.00 177.93 178.09 2hcr s ALA 131 N -5.89 0.50 0.60 5.26 0.00 -1.26 -5.04 121.76 115.93 2hcr s ALA 131 Ca -0.11 0.02 0.29 0.00 0.00 0.00 0.00 51.96 52.16 2hcr s ALA 131 Cb 0.22 -0.34 1.66 0.00 0.00 0.00 0.00 23.12 24.67 2hcr s ALA 131 CO 0.80 -0.01 2.07 0.77 0.00 0.00 0.00 175.76 179.39 2hcr h SER 132 N 7.05 0.00 0.28 0.00 0.02 -1.98 -1.94 113.55 116.97 2hcr h SER 132 Ca -0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 2hcr h SER 132 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2hcr h SER 132 CO 0.48 0.00 0.00 1.56 -1.14 0.00 0.00 176.83 177.73 2hcr h GLN 133 N 0.00 0.00 0.00 3.45 7.50 -1.96 -2.38 115.11 121.72 2hcr h GLN 133 Ca 0.09 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.23 2hcr h GLN 133 Cb 0.58 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 28.11 2hcr h GLN 133 CO -0.00 0.00 -0.08 0.82 -1.50 0.00 0.00 178.83 178.07 2hcr h ILE 134 N 0.00 0.65 -1.00 2.54 2.04 -1.76 -0.73 117.51 119.25 2hcr h ILE 134 Ca 0.00 -0.34 0.09 0.00 1.00 0.00 0.00 64.86 65.61 2hcr h ILE 134 Cb 0.14 1.21 -0.07 0.00 -0.74 0.00 0.00 36.82 37.36 2hcr h ILE 134 CO 0.00 0.08 0.64 1.56 0.00 0.00 0.00 178.15 180.43 2hcr h GLN 135 N 0.00 1.07 0.00 2.37 4.20 -1.66 -0.26 115.11 120.84 2hcr h GLN 135 Ca -0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.64 2hcr h GLN 135 Cb 0.20 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.74 2hcr h GLN 135 CO 0.01 0.71 0.00 0.41 -0.67 0.00 0.00 178.83 179.29 2hcr n GLY 136 N -1.36 -0.81 0.01 3.46 0.00 -0.28 -2.49 105.19 103.72 2hcr n GLY 136 Ca 0.17 -0.08 0.12 0.00 0.00 0.00 0.00 46.02 46.23 2hcr n GLY 136 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2hcr n PHE 137 N -1.26 0.08 -4.10 1.61 0.99 -0.11 -4.80 117.46 109.86 2hcr n PHE 137 Ca 0.08 0.02 -0.22 0.00 -0.00 0.00 0.00 57.45 57.33 2hcr n PHE 137 Cb 0.13 -0.54 -0.05 0.00 -1.00 0.00 0.00 39.48 38.01 2hcr n PHE 137 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 2hcr s PHE 138 N -3.01 2.85 -0.08 1.38 0.40 -1.04 -4.65 117.98 113.84 2hcr s PHE 138 Ca 0.12 -0.25 0.14 0.00 -0.60 0.00 0.00 56.93 56.34 2hcr s PHE 138 Cb 0.16 -1.48 -0.21 0.00 0.51 0.00 0.00 43.02 41.99 2hcr s PHE 138 CO 0.46 0.44 0.20 -0.25 0.70 0.00 0.00 175.22 176.77 2hcr n ASP 139 N -1.13 1.41 -4.79 1.36 8.00 -1.26 -4.99 116.55 115.14 2hcr n ASP 139 Ca -0.05 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.12 2hcr n ASP 139 Cb 0.59 1.31 0.01 0.00 -0.02 0.00 0.00 41.12 43.01 2hcr n ASP 139 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 2hcr s ILE 140 N -2.74 3.52 0.33 0.53 -4.36 -1.26 -5.00 121.20 112.23 2hcr s ILE 140 Ca -0.06 0.79 -0.29 0.00 -0.26 0.00 0.00 60.65 60.83 2hcr s ILE 140 Cb 0.07 -3.30 -0.11 0.00 1.25 0.00 0.00 42.46 40.38 2hcr s ILE 140 CO 0.63 -0.36 1.49 -2.16 0.24 0.00 0.00 174.94 174.78 2hcr s PRO 141 N -3.80 4.17 -0.07 0.37 0.04 -1.26 -4.88 135.00 129.57 2hcr s PRO 141 Ca 0.67 2.49 0.05 0.00 0.04 0.00 0.00 61.00 64.26 2hcr s PRO 141 Cb -0.19 -3.01 -0.01 0.00 0.04 0.00 0.00 34.50 31.33 2hcr s PRO 141 CO 0.34 -0.50 -0.24 0.08 0.04 0.00 0.00 177.00 176.71 2hcr s VAL 142 N -0.68 2.03 -0.38 -0.36 1.01 -1.26 -1.65 120.40 119.11 2hcr s VAL 142 Ca 0.56 -1.04 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 2hcr s VAL 142 Cb -0.45 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.23 2hcr s VAL 142 CO 0.55 0.56 0.21 -1.81 0.00 0.00 0.00 175.10 174.61 2hcr s ASP 143 N -0.02 5.73 -0.69 3.32 1.01 0.67 -4.97 116.67 121.73 2hcr s ASP 143 Ca -0.08 -1.03 -0.16 0.00 0.71 0.00 0.00 52.55 51.99 2hcr s ASP 143 Cb -0.15 -2.02 0.16 0.00 1.01 0.00 0.00 42.92 41.92 2hcr s ASP 143 CO 0.05 -0.40 0.69 0.21 0.21 0.00 0.00 175.17 175.93 2hcr s ASN 144 N 1.57 6.43 0.57 0.27 2.47 -1.26 -1.10 114.94 123.90 2hcr s ASN 144 Ca 0.02 -2.07 -0.17 0.00 0.42 0.00 0.00 52.86 51.05 2hcr s ASN 144 Cb -0.19 -2.24 -0.04 0.00 -1.45 0.00 0.00 41.25 37.32 2hcr s ASN 144 CO 0.06 -0.82 1.08 -0.76 -3.72 0.00 0.00 177.10 172.94 2hcr s LEU 145 N 1.37 3.61 -0.08 3.21 1.43 0.22 -4.78 118.68 123.67 2hcr s LEU 145 Ca 0.12 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.18 2hcr s LEU 145 Cb -0.20 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.44 2hcr s LEU 145 CO -0.02 -1.19 -0.06 -0.31 0.23 0.00 0.00 176.35 175.01 2hcr s TYR 146 N -2.17 2.97 -0.70 0.29 1.51 -1.26 -0.32 117.35 117.67 2hcr s TYR 146 Ca 0.67 0.00 0.26 0.00 -1.01 0.00 0.00 57.07 56.99 2hcr s TYR 146 Cb -0.19 -1.74 0.80 0.00 -0.11 0.00 0.00 41.96 40.72 2hcr s TYR 146 CO 0.32 0.30 1.77 0.00 -1.11 0.00 0.00 175.55 176.83 2hcr h ALA 147 N 5.40 1.00 -0.81 3.71 0.00 -1.95 -3.40 119.26 123.21 2hcr h ALA 147 Ca -0.47 0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.57 2hcr h ALA 147 Cb 1.18 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.83 2hcr h ALA 147 CO 0.54 0.00 -0.36 1.49 0.00 0.00 0.00 179.25 180.91 2hcr h GLU 148 N 0.00 -0.07 -0.58 0.00 4.81 -1.94 0.40 114.58 117.20 2hcr h GLU 148 Ca 0.00 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 2hcr h GLU 148 Cb 0.73 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.05 2hcr h GLU 148 CO 0.00 -0.05 0.21 -1.35 -0.73 0.00 0.00 179.01 177.09 2hcr h PRO 149 N -0.07 0.37 0.00 0.92 0.11 -1.80 0.20 132.00 131.73 2hcr h PRO 149 Ca 0.30 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.30 2hcr h PRO 149 Cb 0.58 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 2hcr h PRO 149 CO -0.85 0.25 -0.40 0.00 -0.21 0.00 0.00 178.00 176.79 2hcr h ALA 150 N 1.40 1.15 -0.02 -0.75 0.00 -1.48 -1.59 119.26 117.97 2hcr h ALA 150 Ca 0.29 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2hcr h ALA 150 Cb 0.34 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2hcr h ALA 150 CO -0.29 0.51 -0.07 0.28 0.00 0.00 0.00 179.25 179.68 2hcr h VAL 151 N 0.00 1.49 -0.46 0.00 2.07 0.02 -1.26 116.25 118.12 2hcr h VAL 151 Ca -0.00 -1.55 0.08 0.00 0.82 0.00 0.00 66.70 66.05 2hcr h VAL 151 Cb 0.81 2.49 -0.07 0.00 -1.52 0.00 0.00 31.29 32.99 2hcr h VAL 151 CO 0.05 0.41 0.04 -0.07 0.02 0.00 0.00 177.57 178.02 2hcr h LEU 152 N -0.53 -0.12 -0.52 2.57 3.38 -0.63 0.71 115.31 120.17 2hcr h LEU 152 Ca -0.00 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.10 2hcr h LEU 152 Cb 0.71 0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.58 2hcr h LEU 152 CO 0.01 -0.03 0.29 0.50 0.09 0.00 0.00 178.44 179.31 2hcr h LYS 153 N 0.15 0.56 -0.54 1.13 3.64 -1.33 -1.12 116.57 119.05 2hcr h LYS 153 Ca 0.23 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 2hcr h LYS 153 Cb 0.32 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 2hcr h LYS 153 CO -0.35 0.37 0.26 2.35 -2.27 0.00 0.00 179.45 179.80 2hcr h TRP 154 N 0.57 0.79 0.43 1.91 7.01 -0.53 -2.59 115.95 123.55 2hcr h TRP 154 Ca 0.22 -0.04 -0.02 0.00 2.11 0.00 0.00 58.89 61.15 2hcr h TRP 154 Cb 0.07 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 26.89 2hcr h TRP 154 CO -0.08 0.62 -0.21 0.82 -2.79 0.00 0.00 178.44 176.80 2hcr h ILE 155 N 0.73 0.58 -0.18 2.65 2.04 -0.62 -1.66 117.51 121.05 2hcr h ILE 155 Ca 0.19 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 66.03 2hcr h ILE 155 Cb 0.13 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 2hcr h ILE 155 CO -0.02 0.01 0.12 0.03 0.00 0.00 0.00 178.15 178.29 2hcr h ARG 156 N -0.60 0.18 -0.03 2.37 3.08 -1.17 -0.46 114.38 117.76 2hcr h ARG 156 Ca -0.06 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2hcr h ARG 156 Cb 0.45 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2hcr h ARG 156 CO 0.10 0.12 -0.02 -0.85 -1.07 0.00 0.00 179.97 178.25 2hcr n GLU 157 N -4.51 1.92 0.00 0.04 0.28 -0.98 -4.58 120.64 112.81 2hcr n GLU 157 Ca 0.00 -1.73 0.00 0.00 -0.16 0.00 0.00 57.16 55.27 2hcr n GLU 157 Cb 0.13 -1.41 0.00 0.00 1.43 0.00 0.00 31.44 31.59 2hcr n GLU 157 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2hcr n ASN 158 N 1.14 4.70 -4.16 -1.84 3.02 -0.63 -4.97 115.26 112.53 2hcr n ASN 158 Ca 0.12 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.33 2hcr n ASN 158 Cb 0.53 0.85 -0.14 0.00 -0.61 0.00 0.00 39.78 40.41 2hcr n ASN 158 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2hcr s ILE 159 N -1.89 2.89 0.29 2.41 1.01 -0.21 -4.99 121.20 120.70 2hcr s ILE 159 Ca 0.00 -1.43 -0.02 0.00 0.00 0.00 0.00 60.65 59.20 2hcr s ILE 159 Cb 0.00 -2.67 0.27 0.00 0.01 0.00 0.00 42.46 40.07 2hcr s ILE 159 CO 0.00 -0.10 1.94 0.28 0.00 0.00 0.00 174.94 177.06 2hcr h SER 160 N 7.97 0.99 -0.14 3.58 0.02 -1.89 -2.48 113.55 121.59 2hcr h SER 160 Ca -0.21 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 2hcr h SER 160 Cb 1.06 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.36 2hcr h SER 160 CO 0.52 0.69 0.00 -0.62 -1.14 0.00 0.00 176.83 176.29 2hcr n GLU 161 N -4.43 1.74 0.16 3.45 4.71 -1.26 -4.48 120.64 120.53 2hcr n GLU 161 Ca 0.11 -0.67 0.13 0.00 -0.01 0.00 0.00 57.16 56.72 2hcr n GLU 161 Cb 0.07 -1.53 0.66 0.00 -1.01 0.00 0.00 31.44 29.63 2hcr n GLU 161 CO 0.00 0.00 0.00 0.11 0.09 0.00 0.00 177.13 177.33 2hcr h TRP 162 N 0.91 0.00 0.00 -0.32 5.08 -1.77 0.11 115.95 119.96 2hcr h TRP 162 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2hcr h TRP 162 Cb 0.67 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.83 2hcr h TRP 162 CO 0.21 0.00 0.00 0.54 -1.28 0.00 0.00 178.44 177.91 2hcr n ARG 163 N -4.47 0.18 -0.80 0.12 1.74 -1.26 -3.24 116.66 108.93 2hcr n ARG 163 Ca 0.02 0.35 0.05 0.00 -0.77 0.00 0.00 57.85 57.50 2hcr n ARG 163 Cb 0.30 -1.81 0.13 0.00 -1.02 0.00 0.00 32.46 30.06 2hcr n ARG 163 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2hcr n ASN 164 N -2.14 1.45 -4.92 0.55 3.02 0.34 -4.84 115.26 108.72 2hcr n ASN 164 Ca 0.03 -3.11 -0.21 0.00 -0.03 0.00 0.00 54.58 51.26 2hcr n ASN 164 Cb 0.27 -0.43 0.05 0.00 -0.61 0.00 0.00 39.78 39.06 2hcr n ASN 164 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hcr s THR 166 N -2.78 2.26 -0.21 0.00 2.01 0.24 -3.48 115.64 113.67 2hcr s THR 166 Ca 0.59 -0.94 -0.21 0.00 0.31 0.00 0.00 61.69 61.45 2hcr s THR 166 Cb -0.09 -1.89 -0.02 0.00 0.01 0.00 0.00 72.50 70.51 2hcr s THR 166 CO 0.39 0.55 0.63 -0.63 -0.69 0.00 0.00 174.62 174.87 2hcr s ILE 167 N 0.46 5.01 -0.10 1.82 -1.09 -0.59 -0.87 121.20 125.82 2hcr s ILE 167 Ca -0.15 1.18 0.03 0.00 -2.23 0.00 0.00 60.65 59.48 2hcr s ILE 167 Cb -0.17 -3.95 -0.01 0.00 -1.58 0.00 0.00 42.46 36.76 2hcr s ILE 167 CO 0.06 0.08 -0.20 -0.69 -1.23 0.00 0.00 174.94 172.96 2hcr s VAL 168 N 2.09 2.44 -0.03 2.92 1.01 0.66 -1.12 120.40 128.37 2hcr s VAL 168 Ca 0.28 -0.89 -0.25 0.00 0.00 0.00 0.00 61.98 61.12 2hcr s VAL 168 Cb -0.16 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2hcr s VAL 168 CO 0.10 0.55 0.75 -0.55 0.00 0.00 0.00 175.10 175.95 2hcr s SER 169 N 0.22 7.09 0.29 3.32 0.15 -0.20 -1.10 113.70 123.48 2hcr s SER 169 Ca -0.13 1.31 0.25 0.00 0.70 0.00 0.00 55.95 58.09 2hcr s SER 169 Cb -0.16 -2.45 0.99 0.00 -1.71 0.00 0.00 66.02 62.69 2hcr s SER 169 CO 0.07 -0.11 1.75 1.55 1.20 0.00 0.00 173.24 177.71 2hcr h PRO 170 N 6.52 0.00 -4.28 5.44 0.13 -1.83 0.46 132.00 138.43 2hcr h PRO 170 Ca -0.42 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.42 2hcr h PRO 170 Cb 1.20 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.23 2hcr h PRO 170 CO 0.74 0.00 -0.29 0.16 -0.23 0.00 0.00 178.00 178.39 2hcr s ASP 171 N -4.51 0.91 0.18 1.44 1.47 -1.15 -4.50 116.67 110.50 2hcr s ASP 171 Ca 0.05 -1.48 -0.06 0.00 1.18 0.00 0.00 52.55 52.23 2hcr s ASP 171 Cb 0.10 0.61 0.09 0.00 -0.34 0.00 0.00 42.92 43.38 2hcr s ASP 171 CO 0.45 -1.19 1.55 0.00 0.68 0.00 0.00 175.17 176.66 2hcr h ALA 172 N 2.18 0.74 0.00 2.11 0.00 -1.90 -3.16 119.26 119.22 2hcr h ALA 172 Ca -0.28 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2hcr h ALA 172 Cb 1.24 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2hcr h ALA 172 CO 0.39 0.66 0.00 0.78 0.00 0.00 0.00 179.25 181.08 2hcr h GLY 173 N 0.92 0.00 -1.69 0.00 0.00 -1.97 -3.10 103.07 97.23 2hcr h GLY 173 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2hcr h GLY 173 CO 0.08 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.23 2hcr n GLY 174 N -0.54 1.17 0.26 4.60 0.00 -1.20 -4.60 105.19 104.89 2hcr n GLY 174 Ca -0.01 -0.55 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 2hcr n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hcr h ALA 175 N 4.05 -0.40 -0.33 4.61 0.00 -1.71 -2.37 119.26 123.11 2hcr h ALA 175 Ca 0.00 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.94 2hcr h ALA 175 Cb 0.68 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 2hcr h ALA 175 CO 0.00 -0.76 -0.18 0.87 0.00 0.00 0.00 179.25 179.18 2hcr h LYS 176 N -0.43 -0.13 -0.38 0.00 1.57 -1.87 -0.94 116.57 114.38 2hcr h LYS 176 Ca 0.02 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.88 2hcr h LYS 176 Cb 0.44 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.72 2hcr h LYS 176 CO -0.11 -0.09 -0.00 -0.09 -0.57 0.00 0.00 179.45 178.59 2hcr h ARG 177 N -0.13 0.10 -0.38 3.15 2.43 -1.84 -1.57 114.38 116.13 2hcr h ARG 177 Ca 0.17 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.18 2hcr h ARG 177 Cb 0.39 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2hcr h ARG 177 CO -0.41 0.06 -0.34 -0.39 -1.51 0.00 0.00 179.97 177.38 2hcr h VAL 178 N 0.10 1.28 -0.54 0.20 -1.51 -0.96 -2.34 116.25 112.48 2hcr h VAL 178 Ca 0.19 -1.51 -0.03 0.00 -1.23 0.00 0.00 66.70 64.11 2hcr h VAL 178 Cb 0.26 1.38 -0.03 0.00 -2.13 0.00 0.00 31.29 30.78 2hcr h VAL 178 CO -0.32 0.51 0.21 0.71 -1.23 0.00 0.00 177.57 177.45 2hcr h THR 179 N 0.72 1.20 -0.52 7.19 1.35 -1.06 0.15 112.91 121.94 2hcr h THR 179 Ca 0.06 -0.62 -0.02 0.00 -0.55 0.00 0.00 66.41 65.29 2hcr h THR 179 Cb 0.93 0.56 -0.02 0.00 -1.73 0.00 0.00 68.15 67.89 2hcr h THR 179 CO 0.09 0.24 0.24 -1.28 -0.25 0.00 0.00 175.52 174.56 2hcr h SER 180 N 0.77 0.69 -0.29 5.36 0.87 -1.15 0.36 113.55 120.15 2hcr h SER 180 Ca 0.18 -0.14 -0.15 0.00 -1.23 0.00 0.00 61.79 60.45 2hcr h SER 180 Cb 0.16 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2hcr h SER 180 CO -0.02 0.63 -0.42 0.40 -0.53 0.00 0.00 176.83 176.90 2hcr h ILE 181 N 0.69 1.29 -0.89 2.23 2.04 -1.03 -2.76 117.51 119.08 2hcr h ILE 181 Ca 0.18 -1.61 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 2hcr h ILE 181 Cb 0.14 1.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 2hcr h ILE 181 CO -0.02 0.52 0.50 0.00 0.00 0.00 0.00 178.15 179.15 2hcr h ALA 182 N 0.69 1.14 -0.25 1.87 0.00 -0.56 -1.75 119.26 120.39 2hcr h ALA 182 Ca 0.03 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 2hcr h ALA 182 Cb 1.02 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2hcr h ALA 182 CO 0.10 0.64 -0.20 -0.44 0.00 0.00 0.00 179.25 179.35 2hcr h ASP 183 N 1.24 0.61 -0.53 0.00 3.32 -0.96 0.39 116.42 120.49 2hcr h ASP 183 Ca 0.31 -0.45 0.04 0.00 0.02 0.00 0.00 57.03 56.95 2hcr h ASP 183 Cb 0.01 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 2hcr h ASP 183 CO -0.05 0.93 0.30 0.03 -1.72 0.00 0.00 179.24 178.73 2hcr h ARG 184 N 0.29 0.57 0.00 3.56 3.08 -1.41 -1.98 114.38 118.49 2hcr h ARG 184 Ca 0.05 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2hcr h ARG 184 Cb 0.74 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.66 2hcr h ARG 184 CO 0.05 0.38 0.00 1.28 -1.07 0.00 0.00 179.97 180.61 2hcr n LEU 185 N -4.82 0.80 -3.17 3.04 4.77 -0.67 -4.94 117.00 112.00 2hcr n LEU 185 Ca 0.05 0.61 -0.15 0.00 -0.03 0.00 0.00 56.01 56.48 2hcr n LEU 185 Cb 0.11 -0.39 0.08 0.00 -2.33 0.00 0.00 43.42 40.88 2hcr n LEU 185 CO 0.31 -0.30 0.10 -3.20 -1.33 0.00 0.00 177.39 172.96 2hcr n ASN 186 N -2.28 -2.05 -3.29 -1.43 4.05 0.41 -4.91 115.26 105.77 2hcr n ASN 186 Ca 0.04 -0.56 -0.19 0.00 0.45 0.00 0.00 54.58 54.33 2hcr n ASN 186 Cb 0.37 -4.64 -0.05 0.00 1.23 0.00 0.00 39.78 36.69 2hcr n ASN 186 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 177.26 175.54 2hcr n VAL 187 N -3.80 0.00 -2.26 3.44 0.24 0.11 -4.98 118.33 111.08 2hcr n VAL 187 Ca -0.26 -1.75 -0.28 0.00 -2.04 0.00 0.00 64.34 60.01 2hcr n VAL 187 Cb 0.65 0.61 0.02 0.00 -1.47 0.00 0.00 33.84 33.65 2hcr n VAL 187 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2hcr s ASP 188 N -2.86 5.87 0.18 -1.34 1.01 -1.23 -4.46 116.67 113.85 2hcr s ASP 188 Ca 0.14 0.99 0.07 0.00 0.71 0.00 0.00 52.55 54.46 2hcr s ASP 188 Cb 0.01 -2.05 -0.04 0.00 1.01 0.00 0.00 42.92 41.85 2hcr s ASP 188 CO 0.10 -0.95 -0.15 0.72 0.21 0.00 0.00 175.17 175.11 2hcr s PHE 189 N -3.03 1.63 0.12 4.23 -0.12 -1.26 -1.55 117.98 118.00 2hcr s PHE 189 Ca 0.53 -0.57 -0.04 0.00 -0.05 0.00 0.00 56.93 56.80 2hcr s PHE 189 Cb -0.11 -0.79 -0.03 0.00 -0.63 0.00 0.00 43.02 41.47 2hcr s PHE 189 CO 0.48 0.29 0.11 0.00 -0.05 0.00 0.00 175.22 176.05 2hcr s ALA 190 N -2.73 0.47 -0.03 1.99 0.00 -0.28 -4.53 121.76 116.65 2hcr s ALA 190 Ca 0.19 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.96 2hcr s ALA 190 Cb -0.02 0.72 0.03 0.00 0.00 0.00 0.00 23.12 23.85 2hcr s ALA 190 CO 0.05 -0.51 -0.00 -1.17 0.00 0.00 0.00 175.76 174.13 2hcr s LEU 191 N -2.99 1.16 -0.07 0.00 0.20 -0.14 -1.03 118.68 115.81 2hcr s LEU 191 Ca 0.17 -0.03 -0.09 0.00 0.69 0.00 0.00 54.13 54.87 2hcr s LEU 191 Cb 0.06 -0.24 -0.05 0.00 -0.43 0.00 0.00 46.19 45.54 2hcr s LEU 191 CO -0.02 -0.10 0.23 -0.63 -0.29 0.00 0.00 176.35 175.54 2hcr s ILE 192 N 1.04 5.36 -0.04 6.68 1.01 0.15 -1.10 121.20 134.29 2hcr s ILE 192 Ca -0.10 0.38 0.01 0.00 0.00 0.00 0.00 60.65 60.94 2hcr s ILE 192 Cb -0.14 -3.50 0.02 0.00 0.01 0.00 0.00 42.46 38.85 2hcr s ILE 192 CO -0.02 0.59 -0.03 -2.28 0.00 0.00 0.00 174.94 173.20 2hcr s HIS 193 N -1.07 0.65 -0.19 3.97 5.65 0.10 -2.94 115.29 121.46 2hcr s HIS 193 Ca 0.19 -0.16 -0.19 0.00 0.25 0.00 0.00 55.06 55.14 2hcr s HIS 193 Cb -0.13 -0.62 -0.03 0.00 -1.18 0.00 0.00 32.58 30.61 2hcr s HIS 193 CO 0.08 -0.19 0.54 0.21 -0.65 0.00 0.00 174.74 174.73 2hcr s LYS 194 N 1.03 4.20 -0.10 2.88 2.20 -1.26 -0.44 119.74 128.25 2hcr s LYS 194 Ca -0.09 0.47 -0.02 0.00 -0.36 0.00 0.00 55.97 55.96 2hcr s LYS 194 Cb -0.14 -3.56 -0.01 0.00 -1.51 0.00 0.00 37.83 32.62 2hcr s LYS 194 CO -0.01 -0.15 -0.03 0.93 -0.36 0.00 0.00 175.35 175.72 2hcr h GLU 195 N 7.43 0.00 -2.58 4.03 5.08 -1.97 -3.47 114.58 123.08 2hcr h GLU 195 Ca -0.34 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.44 2hcr h GLU 195 Cb 1.15 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.34 2hcr h GLU 195 CO 0.75 0.00 2.25 -3.47 -1.00 0.00 0.00 179.01 177.54 2hcr n ASP 203 N -4.57 7.66 -3.67 1.42 -0.08 -1.26 -4.94 116.55 111.11 2hcr n ASP 203 Ca -0.01 -2.81 -0.13 0.00 -1.51 0.00 0.00 54.79 50.33 2hcr n ASP 203 Cb 0.05 -1.43 -0.08 0.00 2.34 0.00 0.00 41.12 41.99 2hcr n ASP 203 CO 0.00 0.00 0.00 -0.60 0.12 0.00 0.00 177.20 176.72 2hcr s ARG 204 N 0.46 0.68 0.11 -0.67 3.52 -1.26 -5.17 118.95 116.63 2hcr s ARG 204 Ca 0.63 0.87 -0.13 0.00 -0.13 0.00 0.00 55.73 56.97 2hcr s ARG 204 Cb 0.23 0.30 -0.06 0.00 -1.56 0.00 0.00 34.95 33.86 2hcr s ARG 204 CO -0.08 -0.09 0.49 -1.64 -0.81 0.00 0.00 175.30 173.17 2hcr s MET 205 N 0.50 3.91 -0.02 5.12 -1.94 -1.26 -4.40 119.30 121.19 2hcr s MET 205 Ca -0.01 0.39 0.05 0.00 -1.71 0.00 0.00 55.69 54.40 2hcr s MET 205 Cb -0.04 -2.98 -0.01 0.00 2.01 0.00 0.00 34.83 33.81 2hcr s MET 205 CO -0.02 0.52 -0.17 0.14 -0.01 0.00 0.00 175.02 175.48 2hcr s VAL 206 N -1.41 1.39 -0.14 -6.03 -7.23 0.41 -4.97 120.40 102.42 2hcr s VAL 206 Ca 0.35 -0.73 -0.01 0.00 -1.81 0.00 0.00 61.98 59.78 2hcr s VAL 206 Cb -0.15 -1.17 -0.01 0.00 0.56 0.00 0.00 36.38 35.60 2hcr s VAL 206 CO 0.18 0.40 -0.12 -0.22 -0.31 0.00 0.00 175.10 175.04 2hcr s LEU 207 N -0.23 2.76 -0.11 1.32 2.96 -1.26 -0.72 118.68 123.40 2hcr s LEU 207 Ca 0.03 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 2hcr s LEU 207 Cb -0.09 -1.63 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 2hcr s LEU 207 CO 0.00 0.14 -0.11 0.68 -1.32 0.00 0.00 176.35 175.74 2hcr s VAL 208 N 0.48 3.23 0.00 1.68 -7.23 -0.26 -4.99 120.40 113.32 2hcr s VAL 208 Ca -0.08 -0.61 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 2hcr s VAL 208 Cb -0.16 -2.34 0.00 0.00 0.56 0.00 0.00 36.38 34.44 2hcr s VAL 208 CO 0.04 0.54 0.00 0.61 -0.31 0.00 0.00 175.10 175.98 2hcr n GLY 209 N 3.18 2.88 3.70 2.32 0.00 -1.26 -0.96 105.19 115.04 2hcr n GLY 209 Ca -0.18 -1.83 -0.38 0.00 0.00 0.00 0.00 46.02 43.63 2hcr n GLY 209 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2hcr s ASP 210 N 0.00 6.54 0.00 1.61 3.68 -1.26 -4.91 116.67 122.33 2hcr s ASP 210 Ca 0.00 0.64 0.00 0.00 2.13 0.00 0.00 52.55 55.32 2hcr s ASP 210 Cb 0.00 -2.25 0.00 0.00 -1.45 0.00 0.00 42.92 39.22 2hcr s ASP 210 CO 0.00 -0.03 0.36 1.33 0.13 0.00 0.00 175.17 176.96 2hcr n VAL 211 N 3.99 0.00 -1.70 1.11 0.24 -1.26 -4.88 118.33 115.82 2hcr n VAL 211 Ca -0.08 -0.38 -0.43 0.00 -2.04 0.00 0.00 64.34 61.40 2hcr n VAL 211 Cb 0.51 1.22 -0.03 0.00 -1.47 0.00 0.00 33.84 34.07 2hcr n VAL 211 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2hcr n LYS 212 N -0.05 2.62 -2.28 7.34 4.81 -1.25 -2.10 118.16 127.26 2hcr n LYS 212 Ca 0.00 0.95 -0.16 0.00 -0.87 0.00 0.00 58.31 58.23 2hcr n LYS 212 Cb 0.05 -2.79 -0.02 0.00 0.02 0.00 0.00 35.03 32.30 2hcr n LYS 212 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2hcr n ASP 213 N 4.24 -4.63 -4.31 3.14 9.92 0.38 -4.90 116.55 120.39 2hcr n ASP 213 Ca 0.17 0.15 -0.21 0.00 -0.53 0.00 0.00 54.79 54.38 2hcr n ASP 213 Cb 0.34 -3.94 -0.11 0.00 -0.64 0.00 0.00 41.12 36.77 2hcr n ASP 213 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2hcr s ARG 214 N -4.78 1.22 0.11 -1.24 0.52 -0.89 -4.80 118.95 109.08 2hcr s ARG 214 Ca 0.00 -1.38 -0.31 0.00 -0.52 0.00 0.00 55.73 53.52 2hcr s ARG 214 Cb 0.00 -1.21 -0.07 0.00 0.52 0.00 0.00 34.95 34.19 2hcr s ARG 214 CO 0.00 0.24 1.30 0.08 0.02 0.00 0.00 175.30 176.94 2hcr s VAL 215 N -2.15 3.59 -0.17 3.52 1.01 -1.26 -0.44 120.40 124.50 2hcr s VAL 215 Ca 0.15 1.16 -0.06 0.00 0.00 0.00 0.00 61.98 63.23 2hcr s VAL 215 Cb -0.05 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2hcr s VAL 215 CO 0.06 0.10 0.03 0.00 0.00 0.00 0.00 175.10 175.29 2hcr s ALA 216 N 0.93 3.29 -0.29 5.51 0.00 0.05 -0.59 121.76 130.66 2hcr s ALA 216 Ca 0.61 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.81 2hcr s ALA 216 Cb -0.34 -1.79 0.06 0.00 0.00 0.00 0.00 23.12 21.05 2hcr s ALA 216 CO 0.31 0.23 -0.04 0.42 0.00 0.00 0.00 175.76 176.68 2hcr s ILE 217 N 0.25 2.61 -0.08 0.00 1.01 -0.05 -0.35 121.20 124.58 2hcr s ILE 217 Ca 0.02 -1.57 -0.30 0.00 0.00 0.00 0.00 60.65 58.80 2hcr s ILE 217 Cb -0.13 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 2hcr s ILE 217 CO 0.01 -0.12 1.35 -0.76 0.00 0.00 0.00 174.94 175.43 2hcr s LEU 218 N 1.16 4.26 -0.14 2.97 1.43 0.15 -0.24 118.68 128.28 2hcr s LEU 218 Ca -0.06 1.93 0.01 0.00 -1.03 0.00 0.00 54.13 54.98 2hcr s LEU 218 Cb -0.20 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.49 2hcr s LEU 218 CO -0.03 -0.74 -0.15 -0.69 0.23 0.00 0.00 176.35 174.97 2hcr s VAL 219 N 3.02 1.59 0.21 -1.59 1.01 -0.26 0.24 120.40 124.63 2hcr s VAL 219 Ca 0.61 -0.66 -0.03 0.00 0.00 0.00 0.00 61.98 61.90 2hcr s VAL 219 Cb -0.27 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 2hcr s VAL 219 CO 0.22 0.46 0.21 -0.62 0.00 0.00 0.00 175.10 175.37 2hcr s ASP 220 N 1.36 0.15 0.30 3.32 2.15 -1.09 -4.44 116.67 118.41 2hcr s ASP 220 Ca 0.02 -1.30 0.16 0.00 0.43 0.00 0.00 52.55 51.86 2hcr s ASP 220 Cb -0.13 0.43 0.15 0.00 -0.30 0.00 0.00 42.92 43.07 2hcr s ASP 220 CO -0.09 -0.91 1.48 -2.24 -0.17 0.00 0.00 175.17 173.24 2hcr h ASP 221 N 2.53 0.00 -5.04 -0.34 2.03 -1.95 -3.17 116.42 110.48 2hcr h ASP 221 Ca -0.34 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 55.91 2hcr h ASP 221 Cb 1.25 0.00 -0.15 0.00 -0.83 0.00 0.00 39.33 39.60 2hcr h ASP 221 CO 0.49 0.47 -0.01 0.00 -1.03 0.00 0.00 179.24 179.16 2hcr s MET 222 N -3.04 1.04 -0.12 4.15 0.23 -1.26 -1.04 119.30 119.26 2hcr s MET 222 Ca 0.04 -0.40 -0.00 0.00 -1.03 0.00 0.00 55.69 54.29 2hcr s MET 222 Cb 0.08 0.47 0.02 0.00 -1.53 0.00 0.00 34.83 33.87 2hcr s MET 222 CO 0.73 -0.39 -0.10 0.00 -2.03 0.00 0.00 175.02 173.24 2hcr s ALA 223 N -2.92 1.49 0.00 3.16 0.00 -0.26 -4.93 121.76 118.30 2hcr s ALA 223 Ca -0.03 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.28 2hcr s ALA 223 Cb -0.00 -0.95 0.00 0.00 0.00 0.00 0.00 23.12 22.17 2hcr s ALA 223 CO -0.06 -0.40 0.00 -3.47 0.00 0.00 0.00 175.76 171.84 2hcr n ASP 224 N 4.88 0.00 0.23 0.00 -0.08 -1.26 -1.21 116.55 119.10 2hcr n ASP 224 Ca -0.14 0.00 0.16 0.00 -1.51 0.00 0.00 54.79 53.30 2hcr n ASP 224 Cb 0.50 0.00 0.69 0.00 2.34 0.00 0.00 41.12 44.65 2hcr n ASP 224 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 2hcr h THR 225 N 0.00 0.00 0.00 5.18 1.35 -1.94 -2.90 112.91 114.61 2hcr h THR 225 Ca 0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 2hcr h THR 225 Cb 0.00 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 2hcr h THR 225 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 2hcr h GLY 227 N 0.00 1.08 0.59 0.00 0.00 -1.96 -2.42 103.07 100.36 2hcr h GLY 227 Ca 0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 2hcr h GLY 227 CO 0.00 -0.06 -0.17 -0.84 0.00 0.00 0.00 176.54 175.47 2hcr h THR 228 N 0.46 1.43 -0.21 4.70 2.02 -1.99 -2.43 112.91 116.89 2hcr h THR 228 Ca 0.39 -1.54 -0.09 0.00 0.77 0.00 0.00 66.41 65.94 2hcr h THR 228 Cb 0.54 2.28 -0.01 0.00 -1.74 0.00 0.00 68.15 69.22 2hcr h THR 228 CO -0.37 0.43 -0.25 0.16 0.37 0.00 0.00 175.52 175.86 2hcr h ILE 229 N -0.28 1.26 -0.34 3.11 3.07 -1.94 -1.19 117.51 121.19 2hcr h ILE 229 Ca -0.00 -1.23 -0.08 0.00 1.55 0.00 0.00 64.86 65.10 2hcr h ILE 229 Cb 0.78 1.38 -0.01 0.00 -0.27 0.00 0.00 36.82 38.70 2hcr h ILE 229 CO 0.04 0.38 -0.09 0.00 -1.05 0.00 0.00 178.15 177.43 2hcr h HIS 231 N 0.46 1.07 -0.87 0.00 3.86 -1.36 -2.87 115.15 115.44 2hcr h HIS 231 Ca 0.09 -0.31 -0.02 0.00 -1.16 0.00 0.00 60.37 58.97 2hcr h HIS 231 Cb 0.60 -0.23 -0.04 0.00 1.06 0.00 0.00 27.41 28.80 2hcr h HIS 231 CO 0.05 1.12 0.47 0.00 0.86 0.00 0.00 177.93 180.43 2hcr h ALA 232 N 0.85 1.19 -0.69 2.45 0.00 -1.17 -1.73 119.26 120.15 2hcr h ALA 232 Ca 0.07 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2hcr h ALA 232 Cb 0.93 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2hcr h ALA 232 CO 0.09 0.65 0.34 0.00 0.00 0.00 0.00 179.25 180.32 2hcr h ALA 233 N 1.30 0.89 -0.25 0.00 0.00 -1.02 -0.69 119.26 119.48 2hcr h ALA 233 Ca 0.31 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2hcr h ALA 233 Cb 0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2hcr h ALA 233 CO -0.05 0.44 0.15 -0.44 0.00 0.00 0.00 179.25 179.35 2hcr h ASP 234 N 0.96 0.31 -0.99 0.00 3.32 -1.31 -2.04 116.42 116.68 2hcr h ASP 234 Ca 0.24 -0.07 0.06 0.00 0.02 0.00 0.00 57.03 57.28 2hcr h ASP 234 Cb 0.11 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 39.51 2hcr h ASP 234 CO -0.03 0.29 0.63 0.50 -1.72 0.00 0.00 179.24 178.92 2hcr h LYS 235 N 0.31 1.13 -0.16 3.56 1.63 -1.10 0.02 116.57 121.95 2hcr h LYS 235 Ca 0.09 -0.07 -0.09 0.00 -0.85 0.00 0.00 60.65 59.73 2hcr h LYS 235 Cb 0.04 -0.25 -0.00 0.00 -0.60 0.00 0.00 32.23 31.42 2hcr h LYS 235 CO -0.02 0.74 -0.26 -0.07 -3.45 0.00 0.00 179.45 176.40 2hcr h LEU 236 N 1.16 0.50 -0.65 5.20 3.38 -0.95 -1.65 115.31 122.31 2hcr h LEU 236 Ca 0.42 -0.53 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2hcr h LEU 236 Cb 0.15 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.71 2hcr h LEU 236 CO -0.17 0.94 0.37 -0.07 0.09 0.00 0.00 178.44 179.60 2hcr h LEU 237 N 0.09 0.55 -2.23 1.67 3.38 -1.15 -1.13 115.31 116.49 2hcr h LEU 237 Ca 0.01 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.04 2hcr h LEU 237 Cb 0.84 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 2hcr h LEU 237 CO 0.06 0.36 0.12 0.28 0.09 0.00 0.00 178.44 179.35 2hcr h SER 238 N 0.68 0.00 -0.15 -0.43 0.02 -0.86 -0.70 113.55 112.11 2hcr h SER 238 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2hcr h SER 238 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2hcr h SER 238 CO -0.17 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.52 2hcr n ALA 239 N -2.40 2.51 -0.02 3.77 0.00 -0.52 -4.94 120.51 118.90 2hcr n ALA 239 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2hcr n ALA 239 Cb 0.23 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.64 2hcr n ALA 239 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hcr n GLY 240 N 1.22 0.84 3.70 0.00 0.00 -0.27 -3.89 105.19 106.79 2hcr n GLY 240 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2hcr n GLY 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hcr n ALA 241 N -1.93 1.25 0.04 4.61 0.00 -0.64 -0.47 120.51 123.37 2hcr n ALA 241 Ca 0.00 0.28 -0.12 0.00 0.00 0.00 0.00 53.44 53.59 2hcr n ALA 241 Cb 0.00 -2.26 -0.09 0.00 0.00 0.00 0.00 19.45 17.10 2hcr n ALA 241 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2hcr h THR 242 N 2.13 1.09 -3.25 0.00 2.02 -0.98 -3.42 112.91 110.50 2hcr h THR 242 Ca -0.47 -1.04 -0.06 0.00 0.77 0.00 0.00 66.41 65.61 2hcr h THR 242 Cb 1.29 1.72 -0.14 0.00 -1.74 0.00 0.00 68.15 69.28 2hcr h THR 242 CO 0.60 0.24 -0.09 0.00 0.37 0.00 0.00 175.52 176.64 2hcr s ARG 243 N -4.08 1.00 -0.09 6.66 1.70 -1.26 -5.02 118.95 117.86 2hcr s ARG 243 Ca -0.15 -0.57 0.03 0.00 -0.47 0.00 0.00 55.73 54.58 2hcr s ARG 243 Cb 0.01 0.44 -0.01 0.00 -0.57 0.00 0.00 34.95 34.83 2hcr s ARG 243 CO 0.59 -0.37 -0.20 0.08 -1.08 0.00 0.00 175.30 174.32 2hcr s VAL 244 N -3.26 2.47 0.17 4.99 1.01 -1.26 -0.77 120.40 123.75 2hcr s VAL 244 Ca -0.00 -0.89 0.09 0.00 0.00 0.00 0.00 61.98 61.17 2hcr s VAL 244 Cb 0.01 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 2hcr s VAL 244 CO -0.08 0.55 -0.09 -0.31 0.00 0.00 0.00 175.10 175.17 2hcr s TYR 245 N 0.11 2.66 -0.09 5.22 1.51 0.53 -0.74 117.35 126.55 2hcr s TYR 245 Ca -0.10 -0.21 0.02 0.00 -1.01 0.00 0.00 57.07 55.77 2hcr s TYR 245 Cb -0.16 -1.31 0.01 0.00 -0.11 0.00 0.00 41.96 40.40 2hcr s TYR 245 CO 0.06 0.50 -0.14 0.00 -1.11 0.00 0.00 175.55 174.86 2hcr s ALA 246 N -1.63 1.53 -0.22 3.71 0.00 -0.98 0.35 121.76 124.53 2hcr s ALA 246 Ca 0.24 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.60 2hcr s ALA 246 Cb -0.09 -0.74 0.05 0.00 0.00 0.00 0.00 23.12 22.34 2hcr s ALA 246 CO 0.15 -0.01 -0.08 0.42 0.00 0.00 0.00 175.76 176.24 2hcr s ILE 247 N 0.89 1.59 0.17 0.00 1.01 0.14 -0.26 121.20 124.73 2hcr s ILE 247 Ca -0.09 -1.14 0.10 0.00 0.00 0.00 0.00 60.65 59.52 2hcr s ILE 247 Cb -0.15 -1.77 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 2hcr s ILE 247 CO 0.01 0.02 -0.19 -0.76 0.00 0.00 0.00 174.94 174.01 2hcr s LEU 248 N 1.39 2.63 -0.11 2.97 2.01 0.66 -2.67 118.68 125.57 2hcr s LEU 248 Ca -0.04 -0.71 -0.28 0.00 0.01 0.00 0.00 54.13 53.11 2hcr s LEU 248 Cb -0.18 -1.40 -0.25 0.00 0.01 0.00 0.00 46.19 44.38 2hcr s LEU 248 CO -0.07 0.13 0.88 0.00 1.01 0.00 0.00 176.35 178.31 2hcr h THR 249 N 3.22 1.69 -3.56 5.49 1.03 -1.47 -3.23 112.91 116.09 2hcr h THR 249 Ca -0.48 -2.06 -0.71 0.00 -0.01 0.00 0.00 66.41 63.16 2hcr h THR 249 Cb 1.19 3.09 -0.20 0.00 -1.07 0.00 0.00 68.15 71.16 2hcr h THR 249 CO 0.48 0.53 -0.43 -1.00 -0.01 0.00 0.00 175.52 175.10 2hcr s HIS 250 N -2.70 3.23 -1.01 0.00 3.76 -0.21 -1.28 115.29 117.09 2hcr s HIS 250 Ca -0.18 -0.47 -0.16 0.00 -0.15 0.00 0.00 55.06 54.10 2hcr s HIS 250 Cb -0.02 -2.58 0.17 0.00 1.11 0.00 0.00 32.58 31.26 2hcr s HIS 250 CO 0.68 -0.54 1.16 0.20 -0.85 0.00 0.00 174.74 175.39 2hcr s GLY 251 N 1.70 2.28 -0.11 -2.22 0.00 -1.26 -1.10 107.32 106.61 2hcr s GLY 251 Ca 0.06 -3.11 -0.28 0.00 0.00 0.00 0.00 44.72 41.40 2hcr s GLY 251 CO 0.10 1.86 0.89 -2.22 0.00 0.00 0.00 173.10 173.73 2hcr h ILE 252 N 5.17 1.64 -6.35 0.90 2.04 -1.47 -3.46 117.51 115.98 2hcr h ILE 252 Ca 0.20 -1.99 -0.47 0.00 1.00 0.00 0.00 64.86 63.60 2hcr h ILE 252 Cb 0.97 2.98 -0.02 0.00 -0.74 0.00 0.00 36.82 40.02 2hcr h ILE 252 CO 1.09 0.51 -0.86 0.49 0.00 0.00 0.00 178.15 179.37 2hcr n PHE 253 N -4.68 -1.75 -2.30 1.37 0.99 -0.75 -4.97 117.46 105.36 2hcr n PHE 253 Ca -0.09 0.78 -0.26 0.00 -0.00 0.00 0.00 57.45 57.88 2hcr n PHE 253 Cb 0.41 -3.97 0.10 0.00 -1.00 0.00 0.00 39.48 35.02 2hcr n PHE 253 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2hcr s SER 254 N -4.33 4.33 1.64 4.37 1.04 -1.18 -4.61 113.70 114.95 2hcr s SER 254 Ca 0.03 0.12 0.00 0.00 0.48 0.00 0.00 55.95 56.57 2hcr s SER 254 Cb -0.01 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.54 2hcr s SER 254 CO 0.86 -1.90 0.00 0.61 0.98 0.00 0.00 173.24 173.79 2hcr n GLY 255 N -3.03 3.44 1.32 7.32 0.00 -1.26 -2.24 105.19 110.74 2hcr n GLY 255 Ca 0.12 -0.07 0.01 0.00 0.00 0.00 0.00 46.02 46.08 2hcr n GLY 255 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2hcr n PRO 256 N 14.00 2.93 -0.11 1.61 -0.04 -1.26 -4.61 135.00 147.52 2hcr n PRO 256 Ca 0.00 -1.71 -0.06 0.00 -0.04 0.00 0.00 63.50 61.69 2hcr n PRO 256 Cb 0.00 -1.88 0.02 0.00 -0.04 0.00 0.00 33.50 31.60 2hcr n PRO 256 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hcr h ALA 257 N 2.86 0.45 -0.65 0.55 0.00 -1.48 0.39 119.26 121.38 2hcr h ALA 257 Ca 0.05 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 2hcr h ALA 257 Cb 1.41 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 2hcr h ALA 257 CO 0.32 -0.23 0.09 0.82 0.00 0.00 0.00 179.25 180.24 2hcr h ILE 258 N 0.32 1.26 -0.55 0.00 1.08 -1.83 0.97 117.51 118.77 2hcr h ILE 258 Ca 0.17 -1.06 -0.04 0.00 -0.39 0.00 0.00 64.86 63.54 2hcr h ILE 258 Cb 0.12 0.67 -0.02 0.00 -3.07 0.00 0.00 36.82 34.52 2hcr h ILE 258 CO -0.15 0.40 0.19 0.28 -0.69 0.00 0.00 178.15 178.17 2hcr h SER 259 N 1.01 0.78 -0.75 1.72 0.02 -1.86 -2.16 113.55 112.31 2hcr h SER 259 Ca 0.20 -0.19 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 2hcr h SER 259 Cb 0.47 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 2hcr h SER 259 CO 0.02 0.76 0.36 -0.09 -1.14 0.00 0.00 176.83 176.74 2hcr h ARG 260 N 0.76 1.08 -0.23 3.45 9.65 -0.44 -2.78 114.38 125.87 2hcr h ARG 260 Ca 0.18 -0.16 -0.19 0.00 -1.10 0.00 0.00 59.98 58.71 2hcr h ARG 260 Cb 0.24 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 2hcr h ARG 260 CO -0.01 0.84 -0.61 0.82 2.80 0.00 0.00 179.97 183.81 2hcr h ILE 261 N 1.05 1.29 0.00 1.20 2.04 -0.76 -2.26 117.51 120.07 2hcr h ILE 261 Ca 0.26 -1.82 -0.01 0.00 1.00 0.00 0.00 64.86 64.29 2hcr h ILE 261 Cb 0.12 1.76 -0.00 0.00 -0.74 0.00 0.00 36.82 37.96 2hcr h ILE 261 CO -0.03 0.58 -0.03 0.78 0.00 0.00 0.00 178.15 179.45 2hcr h ASN 262 N 0.58 0.00 -0.02 1.72 2.35 -1.35 -2.88 115.58 115.97 2hcr h ASN 262 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2hcr h ASN 262 Cb 1.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.59 2hcr h ASN 262 CO 0.13 0.03 -0.04 0.59 -1.65 0.00 0.00 177.43 176.48 2hcr n ASN 263 N -3.35 2.18 -4.96 5.81 5.03 -1.05 -5.01 115.26 113.91 2hcr n ASN 263 Ca -0.02 -1.59 -0.23 0.00 0.87 0.00 0.00 54.58 53.61 2hcr n ASN 263 Cb 0.15 0.07 0.02 0.00 -1.02 0.00 0.00 39.78 39.00 2hcr n ASN 263 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2hcr s ALA 264 N -1.36 3.77 -0.25 5.41 0.00 -0.87 -5.01 121.76 123.46 2hcr s ALA 264 Ca 0.17 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 51.05 2hcr s ALA 264 Cb 0.13 -2.14 0.31 0.00 0.00 0.00 0.00 23.12 21.42 2hcr s ALA 264 CO 0.22 -0.46 1.58 0.00 0.00 0.00 0.00 175.76 177.10 2hcr s PHE 266 N -1.69 3.66 0.08 0.00 0.40 -1.26 -4.47 117.98 114.69 2hcr s PHE 266 Ca 0.29 1.70 -0.17 0.00 -0.60 0.00 0.00 56.93 58.15 2hcr s PHE 266 Cb 0.24 -3.22 -0.11 0.00 0.51 0.00 0.00 43.02 40.44 2hcr s PHE 266 CO 0.04 -0.38 1.37 1.49 0.70 0.00 0.00 175.22 178.45 2hcr h GLU 267 N 4.47 0.59 -1.95 0.44 4.57 -1.30 -3.47 114.58 117.93 2hcr h GLU 267 Ca -0.45 -0.34 -0.04 0.00 -1.18 0.00 0.00 59.36 57.35 2hcr h GLU 267 Cb 1.21 0.02 -0.20 0.00 -0.16 0.00 0.00 28.75 29.63 2hcr h GLU 267 CO 0.70 0.94 0.23 0.00 -1.18 0.00 0.00 179.01 179.69 2hcr s ALA 268 N -4.24 -1.79 -0.24 2.92 0.00 -1.26 -4.95 121.76 112.20 2hcr s ALA 268 Ca -0.13 1.40 -0.03 0.00 0.00 0.00 0.00 51.96 53.21 2hcr s ALA 268 Cb 0.07 -0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.03 2hcr s ALA 268 CO 0.81 -0.36 -0.05 0.08 0.00 0.00 0.00 175.76 176.24 2hcr s VAL 269 N -1.06 3.11 -0.18 0.00 1.01 -0.15 -2.31 120.40 120.83 2hcr s VAL 269 Ca -0.09 -0.80 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 2hcr s VAL 269 Cb -0.00 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2hcr s VAL 269 CO 0.08 0.29 -0.02 -0.69 0.00 0.00 0.00 175.10 174.76 2hcr s VAL 270 N 1.40 3.91 0.24 2.92 1.01 0.64 -1.59 120.40 128.93 2hcr s VAL 270 Ca 0.03 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.69 2hcr s VAL 270 Cb -0.16 -2.74 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 2hcr s VAL 270 CO -0.04 0.47 0.05 0.68 0.00 0.00 0.00 175.10 176.26 2hcr s VAL 271 N 0.64 0.71 0.69 2.92 -7.23 -0.75 -0.24 120.40 117.14 2hcr s VAL 271 Ca -0.02 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.12 2hcr s VAL 271 Cb -0.14 -2.46 0.08 0.00 0.56 0.00 0.00 36.38 34.42 2hcr s VAL 271 CO 0.02 -0.18 0.97 0.42 -0.31 0.00 0.00 175.10 176.02 2hcr s THR 272 N -3.64 2.32 -0.40 5.32 -4.23 -0.40 -0.44 115.64 114.16 2hcr s THR 272 Ca 0.33 -0.44 0.01 0.00 -1.18 0.00 0.00 61.69 60.40 2hcr s THR 272 Cb 0.07 -2.87 0.39 0.00 1.34 0.00 0.00 72.50 71.43 2hcr s THR 272 CO 0.10 0.00 1.85 -0.46 -0.54 0.00 0.00 174.62 175.57 2hcr n ASN 273 N -2.81 5.36 0.27 3.99 6.94 -0.94 -4.33 115.26 123.74 2hcr n ASN 273 Ca 0.11 -3.27 0.13 0.00 -0.02 0.00 0.00 54.58 51.52 2hcr n ASN 273 Cb 0.60 -0.89 0.77 0.00 -2.36 0.00 0.00 39.78 37.90 2hcr n ASN 273 CO 0.00 0.00 0.00 0.71 -1.03 0.00 0.00 177.26 176.94 2hcr h THR 274 N 0.86 0.59 -4.08 5.53 1.35 -1.88 -3.41 112.91 111.87 2hcr h THR 274 Ca 0.44 -0.37 -0.54 0.00 -0.55 0.00 0.00 66.41 65.40 2hcr h THR 274 Cb 1.57 1.23 -0.30 0.00 -1.73 0.00 0.00 68.15 68.92 2hcr h THR 274 CO 0.97 0.08 -0.83 -0.63 -0.25 0.00 0.00 175.52 174.87 2hcr s ILE 275 N -4.37 1.32 0.24 6.82 1.01 -1.26 -4.39 121.20 120.57 2hcr s ILE 275 Ca -0.04 -0.68 -0.31 0.00 0.00 0.00 0.00 60.65 59.62 2hcr s ILE 275 Cb 0.14 -1.12 -0.13 0.00 0.01 0.00 0.00 42.46 41.36 2hcr s ILE 275 CO 0.58 0.38 1.50 -0.81 0.00 0.00 0.00 174.94 176.59 2hcr n PRO 276 N 2.93 2.28 0.00 2.79 -0.04 -1.26 -4.89 135.00 136.80 2hcr n PRO 276 Ca -0.16 0.81 0.00 0.00 -0.04 0.00 0.00 63.50 64.11 2hcr n PRO 276 Cb 0.54 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 2hcr n PRO 276 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2hcr n GLN 277 N 2.35 4.47 -0.05 0.54 -0.06 -1.26 -4.84 117.38 118.53 2hcr n GLN 277 Ca 0.12 0.00 -0.08 0.00 -2.00 0.00 0.00 57.00 55.04 2hcr n GLN 277 Cb 0.33 -0.46 -0.01 0.00 -4.06 0.00 0.00 30.24 26.04 2hcr n GLN 277 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 2hcr h GLU 278 N 0.00 -0.14 -0.70 3.69 3.07 -1.99 -0.16 114.58 118.35 2hcr h GLU 278 Ca 0.00 0.01 -0.06 0.00 -0.50 0.00 0.00 59.36 58.81 2hcr h GLU 278 Cb 0.00 0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 2hcr h GLU 278 CO 0.00 -0.09 0.19 -0.44 -1.40 0.00 0.00 179.01 177.26 2hcr h ASP 279 N -0.15 1.04 -0.25 1.42 3.32 -2.01 -2.74 116.42 117.05 2hcr h ASP 279 Ca 0.14 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 56.88 2hcr h ASP 279 Cb 0.35 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2hcr h ASP 279 CO -0.34 0.98 -0.17 0.11 -1.72 0.00 0.00 179.24 178.10 2hcr h LYS 280 N 1.05 0.69 -0.15 3.56 1.79 -1.71 -2.93 116.57 118.87 2hcr h LYS 280 Ca 0.22 -0.25 -0.07 0.00 -2.18 0.00 0.00 60.65 58.38 2hcr h LYS 280 Cb 0.34 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 2hcr h LYS 280 CO -0.00 0.82 -0.23 0.52 -1.08 0.00 0.00 179.45 179.47 2hcr h MET 281 N 0.61 0.26 -0.37 3.15 2.86 -0.87 -2.44 114.93 118.12 2hcr h MET 281 Ca 0.10 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2hcr h MET 281 Cb 0.64 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.26 2hcr h MET 281 CO 0.04 0.49 0.15 0.87 1.06 0.00 0.00 176.91 179.52 2hcr h LYS 282 N 0.24 0.52 -0.58 1.72 1.57 -1.29 -2.56 116.57 116.19 2hcr h LYS 282 Ca 0.04 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2hcr h LYS 282 Cb 0.55 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.76 2hcr h LYS 282 CO 0.04 0.44 0.00 0.72 -0.57 0.00 0.00 179.45 180.08 2hcr n HIS 283 N -4.39 0.77 -3.25 -1.35 8.25 -1.10 -4.85 115.22 109.31 2hcr n HIS 283 Ca 0.02 -0.42 -0.04 0.00 -0.26 0.00 0.00 57.72 57.02 2hcr n HIS 283 Cb 0.14 -0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.21 2hcr n HIS 283 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2hcr h SER 285 N 8.08 0.00 0.85 0.00 4.64 -1.88 -3.15 113.55 122.10 2hcr h SER 285 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2hcr h SER 285 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2hcr h SER 285 CO 0.22 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 176.29 2hcr h LYS 286 N 0.00 0.00 -6.25 4.77 1.57 -1.92 -3.44 116.57 111.30 2hcr h LYS 286 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 2hcr h LYS 286 Cb 0.64 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.91 2hcr h LYS 286 CO 0.00 0.00 0.32 0.42 -0.57 0.00 0.00 179.45 179.62 2hcr s ILE 287 N -3.41 4.91 0.09 1.86 1.01 -1.19 -0.97 121.20 123.50 2hcr s ILE 287 Ca 0.04 1.85 0.09 0.00 0.00 0.00 0.00 60.65 62.63 2hcr s ILE 287 Cb 0.09 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.30 2hcr s ILE 287 CO 0.45 0.15 -0.24 -1.10 0.00 0.00 0.00 174.94 174.20 2hcr s GLN 288 N 1.17 1.37 -0.08 2.79 -0.21 -0.62 -4.96 119.66 119.12 2hcr s GLN 288 Ca 0.46 -1.18 0.03 0.00 0.02 0.00 0.00 55.36 54.69 2hcr s GLN 288 Cb -0.19 -1.68 -0.02 0.00 1.00 0.00 0.00 33.01 32.12 2hcr s GLN 288 CO 0.23 0.41 -0.17 0.08 -2.12 0.00 0.00 175.29 173.71 2hcr s VAL 289 N -1.01 2.78 -0.23 1.09 1.01 -1.26 -1.81 120.40 120.98 2hcr s VAL 289 Ca 0.10 -0.80 -0.14 0.00 0.00 0.00 0.00 61.98 61.14 2hcr s VAL 289 Cb -0.10 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 2hcr s VAL 289 CO 0.04 0.56 0.34 -0.63 0.00 0.00 0.00 175.10 175.42 2hcr s ILE 290 N -0.23 5.22 -0.23 2.22 1.01 0.42 -4.96 121.20 124.64 2hcr s ILE 290 Ca 0.00 0.56 -0.29 0.00 0.00 0.00 0.00 60.65 60.92 2hcr s ILE 290 Cb -0.13 -3.67 -0.01 0.00 0.01 0.00 0.00 42.46 38.66 2hcr s ILE 290 CO 0.03 0.24 1.34 -0.62 0.00 0.00 0.00 174.94 175.94 2hcr s ASP 291 N 1.22 6.73 0.00 3.58 2.15 -1.26 -2.21 116.67 126.88 2hcr s ASP 291 Ca 0.15 1.48 0.13 0.00 0.43 0.00 0.00 52.55 54.75 2hcr s ASP 291 Cb -0.15 -2.54 0.39 0.00 -0.30 0.00 0.00 42.92 40.32 2hcr s ASP 291 CO 0.08 -0.98 1.32 2.30 -0.17 0.00 0.00 175.17 177.72 2hcr n ILE 292 N 5.89 0.99 -0.03 4.11 -6.64 -1.26 -4.63 119.36 117.79 2hcr n ILE 292 Ca 0.15 -1.00 0.10 0.00 -1.77 0.00 0.00 62.75 60.24 2hcr n ILE 292 Cb 0.46 0.50 0.51 0.00 -1.44 0.00 0.00 39.64 39.67 2hcr n ILE 292 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 2hcr h SER 293 N 2.56 0.34 -0.04 7.28 4.64 -1.93 -2.01 113.55 124.40 2hcr h SER 293 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 2hcr h SER 293 Cb 0.79 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.80 2hcr h SER 293 CO 0.00 0.22 -0.39 0.00 -0.87 0.00 0.00 176.83 175.78 2hcr h MET 294 N 0.39 0.55 -0.42 4.77 -0.00 -1.93 0.12 114.93 118.41 2hcr h MET 294 Ca 0.23 -0.28 -0.09 0.00 -0.00 0.00 0.00 59.70 59.55 2hcr h MET 294 Cb 0.39 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.98 2hcr h MET 294 CO -0.06 0.86 -0.11 0.82 -0.00 0.00 0.00 176.91 178.42 2hcr h ILE 295 N 0.46 1.27 -0.11 -0.10 2.04 -1.72 -1.04 117.51 118.31 2hcr h ILE 295 Ca 0.04 -1.22 -0.02 0.00 1.00 0.00 0.00 64.86 64.67 2hcr h ILE 295 Cb 0.89 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2hcr h ILE 295 CO 0.08 0.41 -0.01 -0.07 0.00 0.00 0.00 178.15 178.56 2hcr h LEU 296 N 0.63 0.21 -0.69 1.44 3.38 -1.34 -1.91 115.31 117.03 2hcr h LEU 296 Ca 0.10 -0.33 0.04 0.00 0.09 0.00 0.00 57.88 57.78 2hcr h LEU 296 Cb 0.64 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 2hcr h LEU 296 CO 0.04 0.49 0.42 0.00 0.09 0.00 0.00 178.44 179.48 2hcr h ALA 297 N 0.72 0.91 -0.44 1.53 0.00 -0.77 -1.55 119.26 119.65 2hcr h ALA 297 Ca 0.03 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 2hcr h ALA 297 Cb 0.39 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2hcr h ALA 297 CO 0.01 0.17 0.14 1.49 0.00 0.00 0.00 179.25 181.05 2hcr h GLU 298 N 0.81 0.69 -0.49 0.00 4.57 -1.21 -0.76 114.58 118.18 2hcr h GLU 298 Ca 0.29 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2hcr h GLU 298 Cb 0.07 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 2hcr h GLU 298 CO -0.13 0.67 0.29 0.00 -1.18 0.00 0.00 179.01 178.66 2hcr h ALA 299 N 0.99 1.59 -0.08 2.92 0.00 -1.02 0.46 119.26 124.12 2hcr h ALA 299 Ca 0.14 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2hcr h ALA 299 Cb 0.26 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2hcr h ALA 299 CO -0.00 0.36 -0.12 0.82 0.00 0.00 0.00 179.25 180.30 2hcr h ILE 300 N 0.67 1.39 -0.53 0.00 2.04 -1.06 -1.08 117.51 118.93 2hcr h ILE 300 Ca 0.18 -1.35 0.04 0.00 1.00 0.00 0.00 64.86 64.72 2hcr h ILE 300 Cb -0.02 2.09 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 2hcr h ILE 300 CO -0.03 0.38 0.30 -0.09 0.00 0.00 0.00 178.15 178.70 2hcr h ARG 301 N -0.22 0.56 -0.14 2.37 2.43 -0.95 -0.06 114.38 118.37 2hcr h ARG 301 Ca 0.01 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 2hcr h ARG 301 Cb 0.67 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 2hcr h ARG 301 CO 0.03 0.37 0.01 0.00 -1.51 0.00 0.00 179.97 178.87 2hcr h ARG 302 N 0.58 0.23 -0.57 0.20 2.47 -0.95 -1.95 114.38 114.39 2hcr h ARG 302 Ca 0.23 -0.07 0.12 0.00 -1.26 0.00 0.00 59.98 59.00 2hcr h ARG 302 Cb 0.09 -0.02 -0.11 0.00 -1.65 0.00 0.00 29.97 28.28 2hcr h ARG 302 CO -0.13 0.44 -0.11 1.15 0.56 0.00 0.00 179.97 181.87 2hcr h THR 303 N -0.01 0.45 -0.59 2.04 2.02 -0.98 0.23 112.91 116.08 2hcr h THR 303 Ca 0.04 -0.01 -0.07 0.00 0.77 0.00 0.00 66.41 67.15 2hcr h THR 303 Cb 0.32 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 2hcr h THR 303 CO 0.00 0.00 0.10 -0.74 0.37 0.00 0.00 175.52 175.26 2hcr h HIS 304 N 0.02 0.98 -0.00 3.16 -0.00 -0.92 -3.16 115.15 115.23 2hcr h HIS 304 Ca 0.28 -0.12 0.00 0.00 -0.00 0.00 0.00 60.37 60.53 2hcr h HIS 304 Cb 0.43 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.56 2hcr h HIS 304 CO -0.45 0.84 -0.44 0.09 -0.00 0.00 0.00 177.93 177.97 2hcr n ASN 305 N -4.24 0.77 -0.65 3.26 3.02 -0.72 -4.95 115.26 111.76 2hcr n ASN 305 Ca 0.04 -0.57 -0.07 0.00 -0.03 0.00 0.00 54.58 53.95 2hcr n ASN 305 Cb 0.26 0.26 -0.01 0.00 -0.61 0.00 0.00 39.78 39.68 2hcr n ASN 305 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2hcr n GLY 306 N 1.44 0.45 3.96 7.41 0.00 0.68 -5.04 105.19 114.09 2hcr n GLY 306 Ca 0.08 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 45.21 2hcr n GLY 306 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hcr s GLU 307 N -3.54 3.45 0.07 1.61 2.02 -0.37 -5.03 118.70 116.92 2hcr s GLU 307 Ca 0.00 -0.65 -0.30 0.00 0.02 0.00 0.00 54.97 54.03 2hcr s GLU 307 Cb 0.00 -2.83 -0.09 0.00 0.10 0.00 0.00 34.13 31.31 2hcr s GLU 307 CO 0.00 0.36 1.86 0.45 0.02 0.00 0.00 175.26 177.95 2hcr s SER 308 N -3.99 6.47 0.09 -0.19 0.15 -1.26 -4.38 113.70 110.58 2hcr s SER 308 Ca 0.36 2.66 0.24 0.00 0.70 0.00 0.00 55.95 59.90 2hcr s SER 308 Cb -0.09 -2.55 0.26 0.00 -1.71 0.00 0.00 66.02 61.93 2hcr s SER 308 CO 0.31 -1.01 1.23 0.52 1.20 0.00 0.00 173.24 175.49 2hcr n VAL 309 N 5.14 0.27 0.11 4.45 0.31 -1.26 -4.22 118.33 123.14 2hcr n VAL 309 Ca 0.18 -0.25 0.07 0.00 -0.01 0.00 0.00 64.34 64.34 2hcr n VAL 309 Cb 0.40 0.00 0.54 0.00 -0.91 0.00 0.00 33.84 33.87 2hcr n VAL 309 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2hcr h SER 310 N 0.00 0.23 -0.94 4.52 0.02 -2.03 -1.88 113.55 113.47 2hcr h SER 310 Ca 0.00 -0.00 0.24 0.00 -0.84 0.00 0.00 61.79 61.18 2hcr h SER 310 Cb 0.73 -0.05 -0.13 0.00 0.14 0.00 0.00 62.40 63.08 2hcr h SER 310 CO 0.00 0.16 0.46 0.22 -1.14 0.00 0.00 176.83 176.53 2hcr h TYR 311 N 0.27 0.77 0.00 3.45 3.20 -1.97 -2.32 116.97 120.36 2hcr h TYR 311 Ca 0.10 0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.01 2hcr h TYR 311 Cb 0.08 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.16 2hcr h TYR 311 CO -0.00 -0.04 0.00 -0.07 -1.64 0.00 0.00 178.16 176.41 2hcr h LEU 312 N 0.43 0.00 -1.40 2.82 3.38 -1.55 -2.57 115.31 116.42 2hcr h LEU 312 Ca 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.55 2hcr h LEU 312 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 2hcr h LEU 312 CO -0.53 0.00 -0.09 -0.26 0.09 0.00 0.00 178.44 177.65 2hcr h PHE 313 N 0.00 0.00 0.00 1.13 0.04 -1.56 -3.27 116.94 113.28 2hcr h PHE 313 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2hcr h PHE 313 Cb 0.47 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.62 2hcr h PHE 313 CO 0.00 0.09 0.00 -1.13 -0.60 0.00 0.00 178.31 176.67 2hcr n SER 314 N -3.24 0.20 -4.08 2.17 3.41 -1.23 -4.55 113.62 106.30 2hcr n SER 314 Ca 0.00 -1.07 -0.23 0.00 -0.26 0.00 0.00 58.87 57.31 2hcr n SER 314 Cb 0.34 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.13 2hcr n SER 314 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2hcr s HIS 315 N -0.07 1.32 -0.21 7.33 5.04 -0.97 -4.87 115.29 122.85 2hcr s HIS 315 Ca 0.00 -0.32 -0.15 0.00 -1.54 0.00 0.00 55.06 53.05 2hcr s HIS 315 Cb 0.00 -0.89 -0.04 0.00 0.04 0.00 0.00 32.58 31.69 2hcr s HIS 315 CO 0.00 -0.09 0.34 0.08 -2.34 0.00 0.00 174.74 172.73 2hcr s VAL 316 N -0.04 5.24 -2.00 0.89 1.01 -1.26 -4.41 120.40 119.82 2hcr s VAL 316 Ca -0.00 0.58 0.11 0.00 0.00 0.00 0.00 61.98 62.67 2hcr s VAL 316 Cb -0.08 -3.67 0.32 0.00 0.00 0.00 0.00 36.38 32.94 2hcr s VAL 316 CO 0.01 0.28 1.11 -0.81 0.00 0.00 0.00 175.10 175.68