#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b3d n THR 2 N 0.00 4.91 -0.03 3.17 -2.24 -1.26 -4.65 114.28 114.17 3b3d n THR 2 Ca 0.00 -5.27 0.03 0.00 -2.27 0.00 0.00 64.05 56.53 3b3d n THR 2 Cb 0.00 -2.21 -0.15 0.00 -2.10 0.00 0.00 70.33 65.88 3b3d n THR 2 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3b3d n THR 3 N 2.22 0.64 -3.57 4.28 -1.04 -1.26 -4.93 114.28 110.63 3b3d n THR 3 Ca 0.32 -0.65 -0.11 0.00 -2.04 0.00 0.00 64.05 61.58 3b3d n THR 3 Cb 0.35 -0.26 -0.02 0.00 -1.82 0.00 0.00 70.33 68.57 3b3d n THR 3 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 3b3d s HIS 4 N -3.10 -0.40 0.58 -1.42 0.00 -1.26 -4.85 115.29 104.85 3b3d s HIS 4 Ca -0.08 0.11 0.28 0.00 -3.00 0.00 0.00 55.06 52.38 3b3d s HIS 4 Cb 0.10 0.56 1.55 0.00 -4.00 0.00 0.00 32.58 30.80 3b3d s HIS 4 CO 0.86 -0.94 2.00 1.25 -1.00 0.00 0.00 174.74 176.91 3b3d h LEU 5 N 2.04 0.00 -3.11 5.38 6.46 -1.92 -0.67 115.31 123.49 3b3d h LEU 5 Ca -0.30 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.46 3b3d h LEU 5 Cb 1.29 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.22 3b3d h LEU 5 CO 0.35 0.00 0.00 0.00 -0.62 0.00 0.00 178.44 178.17 3b3d n GLN 6 N -3.81 2.81 -2.32 1.25 6.02 -1.26 -4.51 117.38 115.56 3b3d n GLN 6 Ca 0.05 -2.50 -0.40 0.00 -0.01 0.00 0.00 57.00 54.14 3b3d n GLN 6 Cb 0.50 -1.60 -0.03 0.00 1.02 0.00 0.00 30.24 30.13 3b3d n GLN 6 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3b3d s ALA 7 N -2.15 3.38 0.01 -1.58 0.00 -0.26 -4.96 121.76 116.20 3b3d s ALA 7 Ca 0.33 1.03 0.08 0.00 0.00 0.00 0.00 51.96 53.41 3b3d s ALA 7 Cb 0.25 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.96 3b3d s ALA 7 CO 0.10 -0.40 -0.25 0.15 0.00 0.00 0.00 175.76 175.36 3b3d s LYS 8 N -1.76 1.98 0.33 0.00 -0.14 -1.26 -1.14 119.74 117.75 3b3d s LYS 8 Ca 0.49 -1.01 -0.19 0.00 -1.36 0.00 0.00 55.97 53.91 3b3d s LYS 8 Cb -0.34 -2.03 -0.09 0.00 -1.68 0.00 0.00 37.83 33.68 3b3d s LYS 8 CO 0.44 0.54 0.81 0.00 -0.76 0.00 0.00 175.35 176.38 3b3d s ALA 9 N -0.72 3.25 -0.31 5.17 0.00 0.15 -4.79 121.76 124.50 3b3d s ALA 9 Ca 0.11 0.21 -0.14 0.00 0.00 0.00 0.00 51.96 52.14 3b3d s ALA 9 Cb -0.10 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 20.07 3b3d s ALA 9 CO 0.01 0.26 0.31 0.99 0.00 0.00 0.00 175.76 177.33 3b3d s THR 10 N -1.91 5.21 0.93 0.00 2.01 -1.26 -0.42 115.64 120.21 3b3d s THR 10 Ca 0.54 0.15 -0.12 0.00 0.31 0.00 0.00 61.69 62.57 3b3d s THR 10 Cb -0.12 -3.72 0.15 0.00 0.01 0.00 0.00 72.50 68.82 3b3d s THR 10 CO 0.18 0.05 1.10 -0.76 -0.69 0.00 0.00 174.62 174.49 3b3d s LEU 11 N 1.94 2.00 0.41 4.42 1.43 0.10 -4.90 118.68 124.08 3b3d s LEU 11 Ca 0.11 1.31 0.29 0.00 -1.03 0.00 0.00 54.13 54.81 3b3d s LEU 11 Cb -0.16 -3.64 1.31 0.00 0.03 0.00 0.00 46.19 43.73 3b3d s LEU 11 CO 0.11 -2.78 1.87 1.12 0.23 0.00 0.00 176.35 176.90 3b3d h HIS 12 N -1.65 0.00 -0.66 0.29 2.07 -1.86 -0.23 115.15 113.11 3b3d h HIS 12 Ca -0.51 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.01 3b3d h HIS 12 Cb 1.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.28 3b3d h HIS 12 CO 0.36 0.00 0.00 0.27 -3.07 0.00 0.00 177.93 175.49 3b3d n ASN 13 N -2.62 3.64 0.00 3.10 6.94 -1.26 -4.94 115.26 120.13 3b3d n ASN 13 Ca 0.00 -2.04 0.00 0.00 -0.02 0.00 0.00 54.58 52.53 3b3d n ASN 13 Cb 0.21 -0.46 0.00 0.00 -2.36 0.00 0.00 39.78 37.17 3b3d n ASN 13 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3b3d n GLY 14 N 1.52 0.69 3.69 4.83 0.00 -0.10 -5.04 105.19 110.78 3b3d n GLY 14 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3b3d n GLY 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b3d s VAL 15 N -2.68 4.72 -0.19 1.61 1.01 -1.25 -4.78 120.40 118.83 3b3d s VAL 15 Ca 0.00 1.98 -0.28 0.00 0.00 0.00 0.00 61.98 63.69 3b3d s VAL 15 Cb 0.00 -4.27 -0.00 0.00 0.00 0.00 0.00 36.38 32.10 3b3d s VAL 15 CO 0.00 0.03 0.95 -1.61 0.00 0.00 0.00 175.10 174.47 3b3d s GLU 16 N 1.89 4.29 -0.11 2.72 0.41 -1.26 -0.72 118.70 125.93 3b3d s GLU 16 Ca 0.50 1.22 0.03 0.00 -0.41 0.00 0.00 54.97 56.32 3b3d s GLU 16 Cb -0.20 -3.60 0.00 0.00 -1.78 0.00 0.00 34.13 28.55 3b3d s GLU 16 CO 0.20 -0.48 -0.23 1.41 -0.49 0.00 0.00 175.26 175.67 3b3d s MET 17 N 2.65 3.07 0.14 1.61 -2.45 0.45 -4.93 119.30 119.83 3b3d s MET 17 Ca 0.42 -0.86 -0.35 0.00 -1.25 0.00 0.00 55.69 53.65 3b3d s MET 17 Cb -0.16 -2.35 -0.15 0.00 1.25 0.00 0.00 34.83 33.42 3b3d s MET 17 CO 0.10 0.16 1.39 -2.30 1.05 0.00 0.00 175.02 175.42 3b3d n PRO 18 N 3.60 1.54 0.27 4.11 -0.02 -1.26 0.29 135.00 143.53 3b3d n PRO 18 Ca -0.19 0.55 0.11 0.00 -2.02 0.00 0.00 63.50 61.95 3b3d n PRO 18 Cb 0.53 -2.21 0.74 0.00 -0.02 0.00 0.00 33.50 32.54 3b3d n PRO 18 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 3b3d h TRP 19 N 4.72 0.00 -3.34 6.00 4.06 -1.43 -3.42 115.95 122.54 3b3d h TRP 19 Ca -0.46 0.00 -0.55 0.00 2.06 0.00 0.00 58.89 59.94 3b3d h TRP 19 Cb 1.31 0.00 -0.34 0.00 -1.00 0.00 0.00 29.16 29.13 3b3d h TRP 19 CO 0.59 0.03 -0.83 0.12 -3.56 0.00 0.00 178.44 174.80 3b3d s PHE 20 N -4.79 1.72 0.33 0.49 5.36 -1.26 -1.29 117.98 118.54 3b3d s PHE 20 Ca -0.05 -0.72 0.01 0.00 -0.96 0.00 0.00 56.93 55.21 3b3d s PHE 20 Cb 0.16 -1.25 -0.01 0.00 -0.34 0.00 0.00 43.02 41.57 3b3d s PHE 20 CO 0.62 -0.37 0.38 0.20 -1.46 0.00 0.00 175.22 174.59 3b3d s GLY 21 N 0.83 1.80 -0.26 13.12 0.00 -0.13 -4.40 107.32 118.28 3b3d s GLY 21 Ca -0.11 -1.74 -0.09 0.00 0.00 0.00 0.00 44.72 42.78 3b3d s GLY 21 CO 0.02 -1.20 0.13 -2.27 0.00 0.00 0.00 173.10 169.78 3b3d s LEU 22 N -3.28 3.76 -0.06 0.66 2.96 -0.25 -3.21 118.68 119.27 3b3d s LEU 22 Ca 0.35 -0.09 -0.30 0.00 -0.22 0.00 0.00 54.13 53.87 3b3d s LEU 22 Cb 0.01 -2.03 -0.03 0.00 0.50 0.00 0.00 46.19 44.64 3b3d s LEU 22 CO 0.23 -0.03 1.14 -0.83 -1.32 0.00 0.00 176.35 175.54 3b3d s GLY 23 N 1.63 2.21 0.24 7.98 0.00 -0.92 -0.68 107.32 117.78 3b3d s GLY 23 Ca 0.07 0.57 -0.02 0.00 0.00 0.00 0.00 44.72 45.34 3b3d s GLY 23 CO 0.07 2.11 0.44 0.14 0.00 0.00 0.00 173.10 175.87 3b3d s VAL 24 N 2.05 5.15 0.18 1.40 1.01 -0.10 -3.79 120.40 126.30 3b3d s VAL 24 Ca 0.54 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 62.18 3b3d s VAL 24 Cb -0.23 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 3b3d s VAL 24 CO 0.22 -0.24 0.25 0.12 0.00 0.00 0.00 175.10 175.44 3b3d s PHE 25 N -1.96 0.62 -0.51 5.22 2.19 -1.26 -4.78 117.98 117.50 3b3d s PHE 25 Ca 0.40 -0.96 -0.23 0.00 0.33 0.00 0.00 56.93 56.47 3b3d s PHE 25 Cb -0.11 -0.19 -0.24 0.00 -1.31 0.00 0.00 43.02 41.17 3b3d s PHE 25 CO 0.30 -0.72 1.69 0.94 1.83 0.00 0.00 175.22 179.26 3b3d n GLN 26 N -0.24 0.04 -4.10 10.12 0.00 -1.26 -4.85 117.38 117.10 3b3d n GLN 26 Ca -0.04 -1.15 -0.34 0.00 -0.00 0.00 0.00 57.00 55.47 3b3d n GLN 26 Cb 0.63 -2.90 -0.14 0.00 0.00 0.00 0.00 30.24 27.83 3b3d n GLN 26 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3b3d s VAL 27 N 10.89 3.14 0.00 1.69 1.01 -1.26 -5.04 120.40 130.84 3b3d s VAL 27 Ca 0.62 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.02 3b3d s VAL 27 Cb 0.03 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 34.01 3b3d s VAL 27 CO 0.21 0.46 0.00 -1.84 0.00 0.00 0.00 175.10 173.93 3b3d n GLU 28 N 4.52 0.00 0.00 2.72 -0.00 -1.26 -4.82 120.64 121.80 3b3d n GLU 28 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.97 3b3d n GLU 28 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.95 3b3d n GLU 28 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 3b3d n GLU 29 N 0.00 0.00 0.00 3.44 2.13 -1.26 -5.05 120.64 119.90 3b3d n GLU 29 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3b3d n GLU 29 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 3b3d n GLU 29 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3b3d n GLY 30 N 1.70 0.38 0.11 8.31 0.00 -1.26 -4.64 105.19 109.80 3b3d n GLY 30 Ca 0.00 -0.80 -0.03 0.00 0.00 0.00 0.00 46.02 45.19 3b3d n GLY 30 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3b3d n SER 31 N 5.97 -0.27 -0.02 1.61 2.88 -1.26 0.30 113.62 122.82 3b3d n SER 31 Ca 0.00 0.78 -0.12 0.00 -1.33 0.00 0.00 58.87 58.21 3b3d n SER 31 Cb 0.00 -0.22 -0.10 0.00 -0.75 0.00 0.00 64.21 63.14 3b3d n SER 31 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3b3d h GLU 32 N 0.00 -0.06 -0.97 -1.46 4.81 -1.98 -2.58 114.58 112.34 3b3d h GLU 32 Ca 0.04 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.38 3b3d h GLU 32 Cb 0.11 0.01 -0.12 0.00 0.63 0.00 0.00 28.75 29.38 3b3d h GLU 32 CO -0.24 0.58 -0.53 -0.11 -0.73 0.00 0.00 179.01 177.97 3b3d n LEU 33 N -4.77 -0.94 -0.24 1.64 -0.00 -1.05 -1.18 117.00 110.46 3b3d n LEU 33 Ca -0.08 1.71 -0.05 0.00 -0.00 0.00 0.00 56.01 57.60 3b3d n LEU 33 Cb 0.33 -0.26 0.06 0.00 -0.00 0.00 0.00 43.42 43.55 3b3d n LEU 33 CO 0.28 -1.42 1.15 0.58 -0.00 0.00 0.00 177.39 177.98 3b3d h VAL 34 N 0.00 1.14 -0.51 1.96 2.07 -0.10 -1.94 116.25 118.87 3b3d h VAL 34 Ca 0.19 -0.30 -0.09 0.00 0.82 0.00 0.00 66.70 67.32 3b3d h VAL 34 Cb 0.43 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3b3d h VAL 34 CO -0.92 0.16 -0.05 -1.13 0.02 0.00 0.00 177.57 175.65 3b3d h ASN 35 N 0.88 0.88 -0.21 0.57 -0.73 -1.28 -1.98 115.58 113.71 3b3d h ASN 35 Ca 0.26 -0.25 0.00 0.00 1.87 0.00 0.00 56.30 58.18 3b3d h ASN 35 Cb -0.05 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.29 3b3d h ASN 35 CO -0.08 0.97 0.14 0.00 -0.37 0.00 0.00 177.43 178.09 3b3d h ALA 36 N 1.12 0.27 -0.38 1.57 0.00 -0.42 0.16 119.26 121.58 3b3d h ALA 36 Ca 0.14 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3b3d h ALA 36 Cb 0.56 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3b3d h ALA 36 CO 0.03 -0.25 0.09 0.28 0.00 0.00 0.00 179.25 179.40 3b3d h VAL 37 N 0.28 1.23 0.21 0.00 2.07 -1.26 -1.68 116.25 117.09 3b3d h VAL 37 Ca 0.08 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 3b3d h VAL 37 Cb -0.02 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3b3d h VAL 37 CO -0.02 0.27 -0.10 0.50 0.02 0.00 0.00 177.57 178.24 3b3d h LYS 38 N 0.47 -0.27 -0.45 1.57 3.64 -1.24 -2.44 116.57 117.85 3b3d h LYS 38 Ca 0.12 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.60 3b3d h LYS 38 Cb 0.32 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.13 3b3d h LYS 38 CO 0.00 -0.18 -0.02 1.15 -2.27 0.00 0.00 179.45 178.13 3b3d h THR 39 N -0.28 0.63 -0.49 1.00 2.02 -0.61 -1.18 112.91 114.01 3b3d h THR 39 Ca -0.03 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.12 3b3d h THR 39 Cb 0.22 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 3b3d h THR 39 CO 0.05 0.02 0.31 0.00 0.37 0.00 0.00 175.52 176.27 3b3d h ALA 40 N 1.41 0.62 -0.07 6.16 0.00 -1.25 -1.50 119.26 124.63 3b3d h ALA 40 Ca 0.22 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3b3d h ALA 40 Cb 0.33 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 3b3d h ALA 40 CO -0.39 0.08 0.03 0.82 0.00 0.00 0.00 179.25 179.79 3b3d h ILE 41 N 0.66 1.12 -0.86 0.00 2.04 -0.91 -0.24 117.51 119.33 3b3d h ILE 41 Ca 0.18 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.68 3b3d h ILE 41 Cb -0.06 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.22 3b3d h ILE 41 CO -0.04 0.10 0.56 0.58 0.00 0.00 0.00 178.15 179.36 3b3d h VAL 42 N -0.02 1.22 -0.20 1.67 2.07 -1.16 -1.31 116.25 118.52 3b3d h VAL 42 Ca 0.02 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 3b3d h VAL 42 Cb 0.14 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.86 3b3d h VAL 42 CO -0.00 0.22 -0.09 -0.74 0.02 0.00 0.00 177.57 176.97 3b3d h HIS 43 N 1.17 0.32 0.00 1.57 -0.00 -1.08 -3.47 115.15 113.66 3b3d h HIS 43 Ca 0.31 -0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.65 3b3d h HIS 43 Cb -0.12 -0.09 0.00 0.00 -0.00 0.00 0.00 27.41 27.19 3b3d h HIS 43 CO 0.00 0.41 0.00 0.41 -0.00 0.00 0.00 177.93 178.75 3b3d n GLY 44 N -0.89 -0.56 3.77 5.26 0.00 -0.50 -5.10 105.19 107.17 3b3d n GLY 44 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3b3d n GLY 44 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3b3d s TYR 45 N -0.40 3.05 -0.02 1.61 4.12 -0.17 -4.65 117.35 120.90 3b3d s TYR 45 Ca 0.00 1.53 0.03 0.00 0.02 0.00 0.00 57.07 58.65 3b3d s TYR 45 Cb 0.00 -3.46 0.05 0.00 -1.52 0.00 0.00 41.96 37.03 3b3d s TYR 45 CO 0.00 -1.45 0.86 0.54 0.02 0.00 0.00 175.55 175.51 3b3d n ARG 46 N 0.19 0.72 -4.04 -0.62 5.12 -1.26 -4.28 116.66 112.49 3b3d n ARG 46 Ca 0.04 -1.18 -0.19 0.00 -1.93 0.00 0.00 57.85 54.59 3b3d n ARG 46 Cb 0.46 -0.75 -0.16 0.00 -1.16 0.00 0.00 32.46 30.84 3b3d n ARG 46 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3b3d s SER 47 N -0.98 0.70 -0.09 0.55 0.15 -1.26 -0.35 113.70 112.43 3b3d s SER 47 Ca 0.05 -0.08 0.01 0.00 0.70 0.00 0.00 55.95 56.64 3b3d s SER 47 Cb 0.05 -0.34 0.02 0.00 -1.71 0.00 0.00 66.02 64.04 3b3d s SER 47 CO 0.00 -0.08 -0.11 -0.63 1.20 0.00 0.00 173.24 173.63 3b3d s ILE 48 N 0.98 1.14 -0.17 6.45 -1.09 -0.18 -1.09 121.20 127.25 3b3d s ILE 48 Ca -0.10 -0.44 0.00 0.00 -2.23 0.00 0.00 60.65 57.88 3b3d s ILE 48 Cb -0.14 -1.08 0.01 0.00 -1.58 0.00 0.00 42.46 39.67 3b3d s ILE 48 CO -0.01 0.37 -0.17 -0.62 -1.23 0.00 0.00 174.94 173.28 3b3d s ASP 49 N 1.03 3.45 0.21 3.58 2.15 0.14 -1.41 116.67 125.82 3b3d s ASP 49 Ca -0.07 -0.55 0.03 0.00 0.43 0.00 0.00 52.55 52.38 3b3d s ASP 49 Cb -0.15 -1.54 -0.01 0.00 -0.30 0.00 0.00 42.92 40.93 3b3d s ASP 49 CO -0.01 0.03 0.09 1.07 -0.17 0.00 0.00 175.17 176.19 3b3d n THR 50 N 4.39 0.00 -3.65 1.71 5.66 -0.02 -0.92 114.28 121.45 3b3d n THR 50 Ca -0.20 -1.28 -0.15 0.00 -3.05 0.00 0.00 64.05 59.37 3b3d n THR 50 Cb 0.51 0.49 -0.08 0.00 -1.55 0.00 0.00 70.33 69.70 3b3d n THR 50 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3b3d s ALA 51 N -2.62 -1.28 0.32 1.79 0.00 -1.26 -3.77 121.76 114.95 3b3d s ALA 51 Ca 0.13 0.97 0.18 0.00 0.00 0.00 0.00 51.96 53.24 3b3d s ALA 51 Cb 0.01 -0.17 0.90 0.00 0.00 0.00 0.00 23.12 23.85 3b3d s ALA 51 CO 0.09 -0.30 1.86 0.00 0.00 0.00 0.00 175.76 177.42 3b3d h ALA 52 N 3.87 1.25 0.00 0.00 0.00 -1.92 -3.06 119.26 119.41 3b3d h ALA 52 Ca -0.28 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 3b3d h ALA 52 Cb 1.16 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3b3d h ALA 52 CO 0.34 0.38 -0.21 0.97 0.00 0.00 0.00 179.25 180.74 3b3d h ILE 53 N 0.00 0.73 -0.44 0.00 -0.00 -1.96 -1.73 117.51 114.11 3b3d h ILE 53 Ca -0.00 -0.85 0.04 0.00 -0.00 0.00 0.00 64.86 64.04 3b3d h ILE 53 Cb 0.64 1.53 -0.05 0.00 -0.00 0.00 0.00 36.82 38.93 3b3d h ILE 53 CO 0.04 0.20 -0.26 -1.22 -0.00 0.00 0.00 178.15 176.91 3b3d n TYR 54 N -3.69 -0.19 -1.15 2.19 4.02 -1.16 -4.91 117.16 112.27 3b3d n TYR 54 Ca -0.01 0.55 0.00 0.00 -0.01 0.00 0.00 57.90 58.43 3b3d n TYR 54 Cb 0.32 -0.49 0.00 0.00 -0.02 0.00 0.00 39.34 39.16 3b3d n TYR 54 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3b3d n GLY 55 N -1.11 0.66 1.93 2.72 0.00 -0.65 -4.89 105.19 103.85 3b3d n GLY 55 Ca 0.01 -0.75 -0.04 0.00 0.00 0.00 0.00 46.02 45.24 3b3d n GLY 55 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3b3d n ASN 56 N 1.51 2.34 0.13 1.61 0.23 -1.26 -4.84 115.26 114.97 3b3d n ASN 56 Ca 0.00 -2.79 -0.02 0.00 -0.53 0.00 0.00 54.58 51.24 3b3d n ASN 56 Cb 0.20 -0.41 0.18 0.00 -2.08 0.00 0.00 39.78 37.66 3b3d n ASN 56 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 3b3d h GLU 57 N 1.85 0.07 -0.39 -3.83 5.08 -1.90 -2.22 114.58 113.25 3b3d h GLU 57 Ca -0.00 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3b3d h GLU 57 Cb 1.44 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.67 3b3d h GLU 57 CO 0.28 0.63 0.18 0.00 -1.00 0.00 0.00 179.01 179.11 3b3d h ALA 58 N 1.36 0.50 -0.11 3.43 0.00 -1.88 0.16 119.26 122.72 3b3d h ALA 58 Ca -0.01 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.81 3b3d h ALA 58 Cb 1.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 3b3d h ALA 58 CO 0.08 0.06 0.00 0.78 0.00 0.00 0.00 179.25 180.18 3b3d h GLY 59 N 0.49 0.10 0.47 0.00 0.00 -1.85 -2.17 103.07 100.10 3b3d h GLY 59 Ca 0.13 0.01 0.09 0.00 0.00 0.00 0.00 47.33 47.56 3b3d h GLY 59 CO -0.02 -0.02 0.32 -2.08 0.00 0.00 0.00 176.54 174.75 3b3d h VAL 60 N 0.04 0.84 -0.41 4.60 2.07 -1.22 -1.57 116.25 120.60 3b3d h VAL 60 Ca 0.05 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.41 3b3d h VAL 60 Cb 0.06 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.03 3b3d h VAL 60 CO -0.08 0.10 0.20 1.23 0.02 0.00 0.00 177.57 179.04 3b3d h GLY 61 N 0.55 0.55 0.89 2.17 0.00 -0.43 0.64 103.07 107.45 3b3d h GLY 61 Ca 0.33 -0.14 -0.06 0.00 0.00 0.00 0.00 47.33 47.46 3b3d h GLY 61 CO -0.27 0.10 -0.06 -2.09 0.00 0.00 0.00 176.54 174.22 3b3d h GLU 62 N 0.41 0.58 -0.88 4.80 4.57 -1.29 -1.77 114.58 121.00 3b3d h GLU 62 Ca 0.17 -0.22 0.08 0.00 -1.18 0.00 0.00 59.36 58.22 3b3d h GLU 62 Cb 0.08 -0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.57 3b3d h GLU 62 CO -0.12 0.76 0.54 0.78 -1.18 0.00 0.00 179.01 179.79 3b3d h GLY 63 N 0.35 1.37 0.99 1.92 0.00 -1.09 0.27 103.07 106.89 3b3d h GLY 63 Ca 0.08 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 3b3d h GLY 63 CO 0.03 0.21 0.31 -2.22 0.00 0.00 0.00 176.54 174.87 3b3d h ILE 64 N 0.93 1.15 0.28 2.60 2.04 -0.77 0.12 117.51 123.87 3b3d h ILE 64 Ca 0.41 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.92 3b3d h ILE 64 Cb 0.29 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3b3d h ILE 64 CO -0.21 0.15 -0.13 0.03 0.00 0.00 0.00 178.15 177.99 3b3d h ARG 65 N 0.68 -0.36 -0.00 2.37 3.08 -0.27 0.15 114.38 120.03 3b3d h ARG 65 Ca 0.18 0.02 -0.16 0.00 0.07 0.00 0.00 59.98 60.09 3b3d h ARG 65 Cb -0.02 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 3b3d h ARG 65 CO -0.03 -0.23 -0.77 1.05 -1.07 0.00 0.00 179.97 178.92 3b3d h GLU 66 N -0.39 0.02 0.25 0.04 4.11 -1.02 -2.59 114.58 115.00 3b3d h GLU 66 Ca -0.04 -0.02 0.01 0.00 0.07 0.00 0.00 59.36 59.38 3b3d h GLU 66 Cb 0.30 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 3b3d h GLU 66 CO 0.06 0.78 -0.45 0.78 0.07 0.00 0.00 179.01 180.25 3b3d h GLY 67 N 2.22 -1.00 -0.32 1.06 0.00 -0.74 -1.59 103.07 102.69 3b3d h GLY 67 Ca -0.01 0.54 0.10 0.00 0.00 0.00 0.00 47.33 47.95 3b3d h GLY 67 CO 0.10 -0.30 -0.33 -2.22 0.00 0.00 0.00 176.54 173.80 3b3d h ILE 68 N -0.77 0.20 -0.58 2.60 2.04 -0.66 -0.94 117.51 119.40 3b3d h ILE 68 Ca -0.01 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.75 3b3d h ILE 68 Cb 0.74 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3b3d h ILE 68 CO -0.18 0.00 -0.04 1.05 0.00 0.00 0.00 178.15 178.98 3b3d h GLU 69 N -0.19 1.05 0.00 2.37 4.11 -1.36 -1.34 114.58 119.23 3b3d h GLU 69 Ca 0.21 -0.35 -0.17 0.00 0.07 0.00 0.00 59.36 59.12 3b3d h GLU 69 Cb 0.54 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3b3d h GLU 69 CO -0.63 1.05 -0.83 1.49 0.07 0.00 0.00 179.01 180.17 3b3d h GLU 70 N 0.95 0.00 0.00 1.06 4.81 -1.04 -3.06 114.58 117.29 3b3d h GLU 70 Ca 0.16 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 3b3d h GLU 70 Cb 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3b3d h GLU 70 CO 0.04 0.83 -0.04 0.00 -0.73 0.00 0.00 179.01 179.11 3b3d h ALA 71 N 1.17 0.98 -2.05 2.92 0.00 -1.16 -3.48 119.26 117.64 3b3d h ALA 71 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 3b3d h ALA 71 Cb 1.49 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.31 3b3d h ALA 71 CO 0.11 0.00 -0.25 0.41 0.00 0.00 0.00 179.25 179.52 3b3d n GLY 72 N 1.12 0.17 0.17 0.00 0.00 -0.55 -5.05 105.19 101.05 3b3d n GLY 72 Ca 0.04 -0.42 -0.01 0.00 0.00 0.00 0.00 46.02 45.63 3b3d n GLY 72 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3b3d n ILE 73 N -3.78 0.00 -4.31 -0.61 -5.35 -0.93 -5.06 119.36 99.32 3b3d n ILE 73 Ca -0.05 -0.09 -0.25 0.00 -0.27 0.00 0.00 62.75 62.09 3b3d n ILE 73 Cb 0.55 -0.60 -0.08 0.00 -1.74 0.00 0.00 39.64 37.77 3b3d n ILE 73 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 3b3d s SER 74 N -1.15 4.31 0.42 7.28 0.01 -1.26 -4.72 113.70 118.58 3b3d s SER 74 Ca 0.02 -0.65 0.21 0.00 1.31 0.00 0.00 55.95 56.84 3b3d s SER 74 Cb -0.00 -0.73 1.18 0.00 0.21 0.00 0.00 66.02 66.68 3b3d s SER 74 CO 0.01 0.05 1.76 -0.09 0.41 0.00 0.00 173.24 175.38 3b3d h ARG 75 N 2.42 0.31 0.00 12.44 1.12 -1.96 -1.43 114.38 127.28 3b3d h ARG 75 Ca -0.45 -0.02 -0.02 0.00 -1.11 0.00 0.00 59.98 58.38 3b3d h ARG 75 Cb 1.23 -0.07 -0.00 0.00 -0.01 0.00 0.00 29.97 31.12 3b3d h ARG 75 CO 0.57 0.20 -0.11 1.05 -3.11 0.00 0.00 179.97 178.58 3b3d h GLU 76 N 0.32 0.00 0.00 0.20 9.09 -2.04 -1.89 114.58 120.26 3b3d h GLU 76 Ca 0.62 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.03 3b3d h GLU 76 Cb 1.70 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.80 3b3d h GLU 76 CO -0.28 0.11 0.00 -0.25 0.05 0.00 0.00 179.01 178.64 3b3d n ASP 77 N -3.29 0.50 -4.91 3.06 8.00 -0.54 -4.80 116.55 114.58 3b3d n ASP 77 Ca -0.00 0.61 -0.27 0.00 0.71 0.00 0.00 54.79 55.83 3b3d n ASP 77 Cb 0.34 -0.72 -0.04 0.00 -0.02 0.00 0.00 41.12 40.68 3b3d n ASP 77 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3b3d s LEU 78 N -4.07 4.26 -0.27 0.64 1.43 -0.71 -4.89 118.68 115.06 3b3d s LEU 78 Ca 0.06 0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 53.30 3b3d s LEU 78 Cb 0.10 -2.85 0.04 0.00 0.03 0.00 0.00 46.19 43.52 3b3d s LEU 78 CO 0.40 0.09 -0.04 0.12 0.23 0.00 0.00 176.35 177.14 3b3d s PHE 79 N -1.67 3.18 -0.11 0.29 5.36 0.52 -4.96 117.98 120.59 3b3d s PHE 79 Ca 0.34 -1.79 -0.02 0.00 -0.96 0.00 0.00 56.93 54.51 3b3d s PHE 79 Cb -0.11 -2.07 -0.03 0.00 -0.34 0.00 0.00 43.02 40.47 3b3d s PHE 79 CO 0.27 -0.78 -0.05 0.42 -1.46 0.00 0.00 175.22 173.62 3b3d s ILE 80 N 1.27 3.80 -0.08 3.12 -1.09 -1.26 -1.01 121.20 125.95 3b3d s ILE 80 Ca -0.03 -0.41 0.04 0.00 -2.23 0.00 0.00 60.65 58.01 3b3d s ILE 80 Cb -0.18 -2.61 0.00 0.00 -1.58 0.00 0.00 42.46 38.08 3b3d s ILE 80 CO -0.03 0.55 -0.21 -0.89 -1.23 0.00 0.00 174.94 173.13 3b3d s THR 81 N -0.19 1.81 0.45 2.92 2.01 -0.50 -1.85 115.64 120.29 3b3d s THR 81 Ca 0.03 -0.89 0.03 0.00 0.31 0.00 0.00 61.69 61.17 3b3d s THR 81 Cb -0.13 -1.57 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 3b3d s THR 81 CO 0.03 0.51 0.06 -0.55 -0.69 0.00 0.00 174.62 173.97 3b3d s SER 82 N 0.28 3.42 -0.00 3.53 0.15 -1.03 -0.84 113.70 119.21 3b3d s SER 82 Ca -0.14 -1.64 -0.01 0.00 0.70 0.00 0.00 55.95 54.87 3b3d s SER 82 Cb -0.16 0.44 -0.00 0.00 -1.71 0.00 0.00 66.02 64.58 3b3d s SER 82 CO 0.06 -0.86 0.01 -0.54 1.20 0.00 0.00 173.24 173.12 3b3d s LYS 83 N -3.79 0.11 0.08 5.44 1.02 -1.25 -1.24 119.74 120.11 3b3d s LYS 83 Ca 0.17 -0.14 -0.30 0.00 0.02 0.00 0.00 55.97 55.72 3b3d s LYS 83 Cb 0.03 0.04 -0.05 0.00 -0.52 0.00 0.00 37.83 37.33 3b3d s LYS 83 CO 0.10 -0.02 1.01 0.08 -0.92 0.00 0.00 175.35 175.60 3b3d s VAL 84 N -0.40 4.47 0.42 3.17 1.01 -0.20 -2.92 120.40 125.95 3b3d s VAL 84 Ca -0.04 1.94 -0.20 0.00 0.00 0.00 0.00 61.98 63.68 3b3d s VAL 84 Cb -0.03 -4.24 -0.11 0.00 0.00 0.00 0.00 36.38 32.00 3b3d s VAL 84 CO -0.00 0.25 0.93 0.86 0.00 0.00 0.00 175.10 177.13 3b3d s TRP 85 N 0.35 3.33 0.32 5.22 -0.00 -1.26 -1.68 118.94 125.21 3b3d s TRP 85 Ca 0.50 1.55 0.07 0.00 -0.00 0.00 0.00 56.10 58.22 3b3d s TRP 85 Cb -0.24 -2.81 0.90 0.00 -0.00 0.00 0.00 33.47 31.32 3b3d s TRP 85 CO 0.30 -0.10 1.59 -0.91 -0.00 0.00 0.00 176.95 177.83 3b3d h ASN 86 N 1.90 -0.19 0.33 5.86 4.21 -1.91 0.69 115.58 126.47 3b3d h ASN 86 Ca -0.49 0.26 0.00 0.00 1.21 0.00 0.00 56.30 57.28 3b3d h ASN 86 Cb 1.18 0.39 0.00 0.00 -1.12 0.00 0.00 38.32 38.77 3b3d h ASN 86 CO 0.62 -0.34 0.00 0.00 -1.29 0.00 0.00 177.43 176.41 3b3d h ALA 87 N 1.95 1.00 -0.15 -0.83 0.00 -1.94 -2.77 119.26 116.52 3b3d h ALA 87 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.57 3b3d h ALA 87 Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3b3d h ALA 87 CO -0.84 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.16 3b3d n ASP 88 N -2.45 2.57 -4.76 0.00 8.00 0.23 -5.01 116.55 115.14 3b3d n ASP 88 Ca -0.00 -2.22 -0.40 0.00 0.71 0.00 0.00 54.79 52.88 3b3d n ASP 88 Cb 0.13 -0.19 -0.06 0.00 -0.02 0.00 0.00 41.12 40.98 3b3d n ASP 88 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3b3d s LEU 89 N -1.39 4.63 0.00 0.64 1.43 -1.05 -2.32 118.68 120.62 3b3d s LEU 89 Ca 0.16 1.86 0.00 0.00 -1.03 0.00 0.00 54.13 55.12 3b3d s LEU 89 Cb 0.11 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.81 3b3d s LEU 89 CO 0.07 0.16 0.00 0.61 0.23 0.00 0.00 176.35 177.42 3b3d n GLY 90 N 1.56 3.32 0.22 -3.19 0.00 -1.25 -4.82 105.19 101.04 3b3d n GLY 90 Ca -0.03 -1.73 -0.08 0.00 0.00 0.00 0.00 46.02 44.18 3b3d n GLY 90 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3b3d h TYR 91 N 0.00 -0.47 -0.41 1.61 3.20 -1.91 -1.09 116.97 117.90 3b3d h TYR 91 Ca 0.00 -0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.71 3b3d h TYR 91 Cb 0.00 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 3b3d h TYR 91 CO 0.00 -0.29 -0.31 1.49 -1.64 0.00 0.00 178.16 177.40 3b3d h GLU 92 N -0.82 0.94 -0.84 1.82 4.57 -1.95 -2.45 114.58 115.84 3b3d h GLU 92 Ca -0.05 -0.46 0.02 0.00 -1.18 0.00 0.00 59.36 57.69 3b3d h GLU 92 Cb 0.39 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.93 3b3d h GLU 92 CO 0.09 1.12 0.55 0.93 -1.18 0.00 0.00 179.01 180.51 3b3d h GLU 93 N 0.76 1.06 -0.11 1.92 3.07 -1.82 0.21 114.58 119.68 3b3d h GLU 93 Ca 0.08 -0.06 -0.18 0.00 -0.50 0.00 0.00 59.36 58.69 3b3d h GLU 93 Cb 0.90 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 28.57 3b3d h GLU 93 CO 0.08 0.70 -0.69 1.15 -1.40 0.00 0.00 179.01 178.86 3b3d h THR 94 N 1.10 1.36 -0.29 1.13 2.02 -0.78 -1.03 112.91 116.42 3b3d h THR 94 Ca 0.32 -2.03 -0.01 0.00 0.77 0.00 0.00 66.41 65.46 3b3d h THR 94 Cb -0.06 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 68.35 3b3d h THR 94 CO -0.09 0.62 0.16 -0.07 0.37 0.00 0.00 175.52 176.50 3b3d h LEU 95 N 0.33 0.36 -0.52 2.58 3.38 -0.97 -2.10 115.31 118.36 3b3d h LEU 95 Ca -0.02 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3b3d h LEU 95 Cb 1.25 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 3b3d h LEU 95 CO 0.12 0.35 0.25 0.00 0.09 0.00 0.00 178.44 179.25 3b3d h ALA 96 N 1.03 0.67 -0.63 1.53 0.00 -0.83 -2.85 119.26 118.18 3b3d h ALA 96 Ca 0.10 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3b3d h ALA 96 Cb 0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3b3d h ALA 96 CO -0.02 0.23 0.13 0.00 0.00 0.00 0.00 179.25 179.60 3b3d h ALA 97 N 1.09 1.04 -0.46 0.00 0.00 -1.06 -1.53 119.26 118.34 3b3d h ALA 97 Ca 0.18 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.89 3b3d h ALA 97 Cb 0.11 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 3b3d h ALA 97 CO -0.02 0.62 0.20 0.35 0.00 0.00 0.00 179.25 180.40 3b3d h PHE 98 N 0.95 0.36 -0.70 0.00 3.57 -1.37 -0.96 116.94 118.79 3b3d h PHE 98 Ca 0.20 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 3b3d h PHE 98 Cb 0.37 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.99 3b3d h PHE 98 CO 0.03 0.16 0.31 0.93 -2.23 0.00 0.00 178.31 177.51 3b3d h GLU 99 N 0.40 1.03 -0.44 1.11 4.39 -1.20 -1.23 114.58 118.64 3b3d h GLU 99 Ca 0.21 -0.17 0.02 0.00 0.34 0.00 0.00 59.36 59.76 3b3d h GLU 99 Cb 0.16 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 3b3d h GLU 99 CO -0.18 0.83 0.25 1.15 -1.16 0.00 0.00 179.01 179.90 3b3d h THR 100 N 0.99 1.03 -0.54 1.13 2.02 -1.08 -2.04 112.91 114.40 3b3d h THR 100 Ca 0.24 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.25 3b3d h THR 100 Cb 0.16 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 67.03 3b3d h THR 100 CO -0.02 0.09 0.34 0.28 0.37 0.00 0.00 175.52 176.58 3b3d h SER 101 N 0.50 0.64 -0.62 4.18 0.02 -0.91 -2.49 113.55 114.88 3b3d h SER 101 Ca 0.18 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 3b3d h SER 101 Cb 0.03 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 3b3d h SER 101 CO -0.09 0.50 0.36 -0.07 -1.14 0.00 0.00 176.83 176.39 3b3d h LEU 102 N 0.73 0.75 0.22 5.07 3.38 -1.03 -1.56 115.31 122.89 3b3d h LEU 102 Ca 0.20 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.10 3b3d h LEU 102 Cb -0.04 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3b3d h LEU 102 CO -0.04 0.60 -0.25 0.28 0.09 0.00 0.00 178.44 179.12 3b3d h SER 103 N 0.84 -0.68 -0.57 -0.43 0.02 -1.23 -1.34 113.55 110.17 3b3d h SER 103 Ca 0.22 0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 61.20 3b3d h SER 103 Cb -0.01 0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 3b3d h SER 103 CO -0.04 -0.36 0.22 0.11 -1.14 0.00 0.00 176.83 175.62 3b3d h LYS 104 N -0.52 0.85 0.00 3.45 1.57 -1.37 -2.42 116.57 118.14 3b3d h LYS 104 Ca 0.00 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 3b3d h LYS 104 Cb 0.49 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3b3d h LYS 104 CO -0.07 0.74 0.00 -0.07 -0.57 0.00 0.00 179.45 179.48 3b3d h LEU 105 N 0.78 0.00 -0.48 2.94 3.38 -1.30 -3.27 115.31 117.36 3b3d h LEU 105 Ca 0.19 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.95 3b3d h LEU 105 Cb 0.22 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.02 3b3d h LEU 105 CO -0.01 0.00 -0.34 0.61 0.09 0.00 0.00 178.44 178.78 3b3d n GLY 106 N 0.05 0.13 3.47 0.83 0.00 -0.77 -4.21 105.19 104.68 3b3d n GLY 106 Ca 0.02 -0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 3b3d n GLY 106 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3b3d s LEU 107 N -4.10 2.59 -0.01 0.99 1.43 -0.58 -5.04 118.68 113.96 3b3d s LEU 107 Ca 0.25 -0.96 0.21 0.00 -1.03 0.00 0.00 54.13 52.61 3b3d s LEU 107 Cb -0.11 -1.16 -0.24 0.00 0.03 0.00 0.00 46.19 44.72 3b3d s LEU 107 CO 0.31 0.06 0.78 0.47 0.23 0.00 0.00 176.35 178.21 3b3d n ASP 108 N -0.40 0.65 -3.60 2.29 8.00 -1.26 -4.55 116.55 117.68 3b3d n ASP 108 Ca -0.07 -0.62 -0.12 0.00 0.71 0.00 0.00 54.79 54.68 3b3d n ASP 108 Cb 0.59 1.29 -0.05 0.00 -0.02 0.00 0.00 41.12 42.93 3b3d n ASP 108 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3b3d s TYR 109 N -3.18 -0.33 0.12 1.24 -0.85 -1.26 -5.02 117.35 108.07 3b3d s TYR 109 Ca 0.03 0.23 0.05 0.00 -0.52 0.00 0.00 57.07 56.85 3b3d s TYR 109 Cb 0.15 0.31 -0.04 0.00 0.38 0.00 0.00 41.96 42.76 3b3d s TYR 109 CO 0.88 -0.67 0.07 -0.51 -1.52 0.00 0.00 175.55 173.80 3b3d s LEU 110 N -2.31 3.68 0.06 -3.49 2.01 -1.10 -5.02 118.68 112.51 3b3d s LEU 110 Ca -0.02 -0.13 -0.12 0.00 0.01 0.00 0.00 54.13 53.87 3b3d s LEU 110 Cb 0.00 -2.35 -0.27 0.00 0.01 0.00 0.00 46.19 43.58 3b3d s LEU 110 CO -0.06 0.13 1.12 0.44 1.01 0.00 0.00 176.35 178.99 3b3d h ASP 111 N 2.96 0.77 -3.79 2.29 3.32 -1.75 -1.92 116.42 118.29 3b3d h ASP 111 Ca -0.47 -0.72 -0.18 0.00 0.02 0.00 0.00 57.03 55.67 3b3d h ASP 111 Cb 1.18 -0.24 -0.26 0.00 0.22 0.00 0.00 39.33 40.23 3b3d h ASP 111 CO 0.63 1.54 -0.49 -0.22 -1.72 0.00 0.00 179.24 178.98 3b3d s LEU 112 N -7.70 1.25 -0.04 1.55 2.96 -0.77 -0.09 118.68 115.83 3b3d s LEU 112 Ca -0.08 0.39 0.01 0.00 -0.22 0.00 0.00 54.13 54.23 3b3d s LEU 112 Cb 0.06 0.66 0.02 0.00 0.50 0.00 0.00 46.19 47.43 3b3d s LEU 112 CO 0.92 -0.07 -0.05 -0.47 -1.32 0.00 0.00 176.35 175.36 3b3d s TYR 113 N 0.12 0.79 0.11 5.38 5.04 -1.10 -2.47 117.35 125.23 3b3d s TYR 113 Ca -0.00 -0.23 0.10 0.00 -2.44 0.00 0.00 57.07 54.50 3b3d s TYR 113 Cb -0.02 -0.68 -0.04 0.00 0.35 0.00 0.00 41.96 41.57 3b3d s TYR 113 CO 0.00 -0.19 -0.24 -0.51 -1.34 0.00 0.00 175.55 173.28 3b3d s LEU 114 N 0.85 2.44 -0.00 6.97 1.43 -0.37 -2.33 118.68 127.68 3b3d s LEU 114 Ca -0.12 -0.65 -0.30 0.00 -1.03 0.00 0.00 54.13 52.03 3b3d s LEU 114 Cb -0.14 -1.35 -0.05 0.00 0.03 0.00 0.00 46.19 44.68 3b3d s LEU 114 CO 0.01 0.19 1.28 -0.63 0.23 0.00 0.00 176.35 177.43 3b3d s ILE 115 N -1.05 3.96 0.08 -0.59 1.01 -0.86 -1.03 121.20 122.72 3b3d s ILE 115 Ca 0.15 1.34 -0.16 0.00 0.00 0.00 0.00 60.65 61.98 3b3d s ILE 115 Cb -0.10 -3.86 -0.11 0.00 0.01 0.00 0.00 42.46 38.39 3b3d s ILE 115 CO 0.07 0.03 1.37 -0.74 0.00 0.00 0.00 174.94 175.67 3b3d h HIS 116 N 7.41 0.76 -3.91 3.97 2.76 -1.61 -0.96 115.15 123.58 3b3d h HIS 116 Ca -0.37 -0.25 -0.17 0.00 -2.20 0.00 0.00 60.37 57.38 3b3d h HIS 116 Cb 1.18 -0.15 -0.21 0.00 1.55 0.00 0.00 27.41 29.78 3b3d h HIS 116 CO 0.72 0.98 -0.67 -1.58 -1.30 0.00 0.00 177.93 176.09 3b3d s TRP 117 N -4.22 0.22 -1.21 5.26 0.52 -1.26 -4.38 118.94 113.88 3b3d s TRP 117 Ca -0.13 -0.47 -0.17 0.00 0.02 0.00 0.00 56.10 55.35 3b3d s TRP 117 Cb 0.08 -0.17 -0.03 0.00 -1.15 0.00 0.00 33.47 32.20 3b3d s TRP 117 CO 0.82 -0.20 2.06 -0.35 0.02 0.00 0.00 176.95 179.30 3b3d n PRO 118 N 1.58 2.38 -2.34 4.98 -0.04 -1.26 -4.85 135.00 135.45 3b3d n PRO 118 Ca -0.24 -2.42 -0.43 0.00 -0.04 0.00 0.00 63.50 60.37 3b3d n PRO 118 Cb 0.55 -3.22 -0.02 0.00 -0.04 0.00 0.00 33.50 30.77 3b3d n PRO 118 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3b3d s VAL 119 N 4.34 4.00 0.16 0.52 1.01 -1.26 -4.91 120.40 124.27 3b3d s VAL 119 Ca 0.52 1.11 -0.33 0.00 0.00 0.00 0.00 61.98 63.29 3b3d s VAL 119 Cb 0.12 -4.07 -0.13 0.00 0.00 0.00 0.00 36.38 32.31 3b3d s VAL 119 CO 0.01 -0.49 1.67 1.21 0.00 0.00 0.00 175.10 177.50 3b3d n GLU 120 N 7.53 2.46 -0.15 2.72 4.07 -1.26 -1.26 120.64 134.75 3b3d n GLU 120 Ca 0.16 0.89 0.00 0.00 -0.06 0.00 0.00 57.16 58.15 3b3d n GLU 120 Cb 0.47 -2.70 0.00 0.00 -0.06 0.00 0.00 31.44 29.14 3b3d n GLU 120 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3b3d n GLY 121 N 3.76 1.47 0.00 8.31 0.00 -1.26 -4.83 105.19 112.64 3b3d n GLY 121 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3b3d n GLY 121 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3b3d n LYS 122 N -2.00 1.78 0.16 1.61 5.02 -0.39 -4.87 118.16 119.47 3b3d n LYS 122 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 3b3d n LYS 122 Cb 0.00 -0.93 0.21 0.00 -0.02 0.00 0.00 35.03 34.29 3b3d n LYS 122 CO 0.00 0.00 0.00 0.10 -0.52 0.00 0.00 177.40 176.98 3b3d h TYR 123 N 0.00 0.00 -0.33 2.13 -0.00 -1.78 -2.55 116.97 114.44 3b3d h TYR 123 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.73 58.67 3b3d h TYR 123 Cb 0.32 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.04 3b3d h TYR 123 CO 0.00 0.49 -0.03 0.87 -0.00 0.00 0.00 178.16 179.49 3b3d h LYS 124 N 0.00 0.61 -0.53 0.10 1.57 -1.89 0.12 116.57 116.54 3b3d h LYS 124 Ca -0.00 -0.21 -0.07 0.00 -1.87 0.00 0.00 60.65 58.49 3b3d h LYS 124 Cb 1.09 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 3b3d h LYS 124 CO 0.06 0.75 0.03 0.93 -0.57 0.00 0.00 179.45 180.66 3b3d h GLU 125 N 0.40 0.88 -0.30 3.15 4.39 -1.90 -2.56 114.58 118.63 3b3d h GLU 125 Ca 0.09 -0.23 0.03 0.00 0.34 0.00 0.00 59.36 59.59 3b3d h GLU 125 Cb 0.50 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 3b3d h GLU 125 CO 0.02 0.85 0.10 0.00 -1.16 0.00 0.00 179.01 178.83 3b3d h ALA 126 N 1.21 0.34 -0.94 3.43 0.00 -1.26 -2.75 119.26 119.29 3b3d h ALA 126 Ca 0.16 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.18 3b3d h ALA 126 Cb 0.45 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 3b3d h ALA 126 CO 0.02 -0.30 0.59 2.35 0.00 0.00 0.00 179.25 181.90 3b3d h TRP 127 N 0.23 1.09 -0.82 0.00 2.91 -0.64 -1.65 115.95 117.06 3b3d h TRP 127 Ca 0.13 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.22 3b3d h TRP 127 Cb 0.11 -0.35 -0.05 0.00 -0.51 0.00 0.00 29.16 28.36 3b3d h TRP 127 CO -0.14 0.52 0.52 0.00 -1.03 0.00 0.00 178.44 178.32 3b3d h ARG 128 N 1.04 0.99 -0.24 2.65 3.08 -1.28 0.44 114.38 121.06 3b3d h ARG 128 Ca 0.42 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.41 3b3d h ARG 128 Cb 0.25 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 3b3d h ARG 128 CO -0.20 0.65 0.13 0.00 -1.07 0.00 0.00 179.97 179.49 3b3d h ALA 129 N 1.35 0.30 -0.61 0.04 0.00 -1.18 -0.77 119.26 118.40 3b3d h ALA 129 Ca 0.33 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.27 3b3d h ALA 129 Cb 0.02 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.65 3b3d h ALA 129 CO -0.12 -0.17 0.24 -0.07 0.00 0.00 0.00 179.25 179.13 3b3d h LEU 130 N 0.27 0.27 -0.73 0.00 3.38 -0.91 -1.87 115.31 115.72 3b3d h LEU 130 Ca 0.08 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3b3d h LEU 130 Cb 0.06 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.81 3b3d h LEU 130 CO -0.01 0.16 0.38 -0.33 0.09 0.00 0.00 178.44 178.73 3b3d h GLU 131 N 0.44 1.03 0.23 1.13 5.08 -0.77 0.11 114.58 121.83 3b3d h GLU 131 Ca 0.30 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3b3d h GLU 131 Cb 0.35 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3b3d h GLU 131 CO -0.28 0.78 -0.27 1.15 -1.00 0.00 0.00 179.01 179.39 3b3d h THR 132 N 1.01 0.42 -0.91 1.13 2.02 -0.98 0.20 112.91 115.80 3b3d h THR 132 Ca 0.25 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.46 3b3d h THR 132 Cb 0.06 0.42 -0.05 0.00 -1.74 0.00 0.00 68.15 66.85 3b3d h THR 132 CO -0.04 0.00 0.60 -0.07 0.37 0.00 0.00 175.52 176.38 3b3d h LEU 133 N -0.55 1.01 0.13 2.58 3.38 -1.22 0.61 115.31 121.26 3b3d h LEU 133 Ca 0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3b3d h LEU 133 Cb 0.52 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3b3d h LEU 133 CO -0.08 0.71 -0.06 0.22 0.09 0.00 0.00 178.44 179.31 3b3d h TYR 134 N 1.18 -0.17 -0.15 1.13 3.20 -0.62 -0.63 116.97 120.90 3b3d h TYR 134 Ca 0.35 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.26 3b3d h TYR 134 Cb -0.04 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 3b3d h TYR 134 CO -0.00 -0.05 0.12 0.87 -1.64 0.00 0.00 178.16 177.47 3b3d h LYS 135 N -0.24 0.00 -0.00 1.82 1.57 0.29 -1.15 116.57 118.85 3b3d h LYS 135 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3b3d h LYS 135 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3b3d h LYS 135 CO 0.03 0.00 -0.14 0.39 -0.57 0.00 0.00 179.45 179.16 3b3d n GLU 136 N -4.27 0.66 -0.88 3.15 1.02 0.12 -4.92 120.64 115.52 3b3d n GLU 136 Ca 0.01 -0.25 0.00 0.00 -0.02 0.00 0.00 57.16 56.90 3b3d n GLU 136 Cb 0.25 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 3b3d n GLU 136 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3b3d n GLY 137 N 1.30 0.47 0.09 0.62 0.00 -0.43 -4.95 105.19 102.28 3b3d n GLY 137 Ca 0.14 -0.86 -0.04 0.00 0.00 0.00 0.00 46.02 45.26 3b3d n GLY 137 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3b3d h ARG 138 N 0.16 0.00 -5.45 1.61 2.47 -1.30 -3.45 114.38 108.41 3b3d h ARG 138 Ca 0.00 0.00 -0.60 0.00 -1.26 0.00 0.00 59.98 58.12 3b3d h ARG 138 Cb 0.00 0.00 -0.32 0.00 -1.65 0.00 0.00 29.97 28.00 3b3d h ARG 138 CO 0.00 0.59 -0.85 0.42 0.56 0.00 0.00 179.97 180.69 3b3d s ILE 139 N -2.77 1.61 0.15 2.04 1.01 -1.23 -2.72 121.20 119.30 3b3d s ILE 139 Ca -0.01 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 3b3d s ILE 139 Cb 0.09 -1.38 0.03 0.00 0.01 0.00 0.00 42.46 41.21 3b3d s ILE 139 CO 0.81 0.46 1.65 0.11 0.00 0.00 0.00 174.94 177.96 3b3d h LYS 140 N 6.27 0.85 -3.91 2.79 1.57 -1.26 -3.43 116.57 119.45 3b3d h LYS 140 Ca -0.31 -0.22 -0.10 0.00 -1.87 0.00 0.00 60.65 58.15 3b3d h LYS 140 Cb 1.18 -0.10 -0.14 0.00 0.08 0.00 0.00 32.23 33.25 3b3d h LYS 140 CO 0.48 0.83 -0.42 0.00 -0.57 0.00 0.00 179.45 179.77 3b3d s ALA 141 N -5.23 -0.03 -0.05 3.86 0.00 0.87 -4.94 121.76 116.25 3b3d s ALA 141 Ca -0.13 -0.79 -0.03 0.00 0.00 0.00 0.00 51.96 51.01 3b3d s ALA 141 Cb 0.12 0.55 0.02 0.00 0.00 0.00 0.00 23.12 23.81 3b3d s ALA 141 CO 0.81 -0.52 0.12 0.96 0.00 0.00 0.00 175.76 177.13 3b3d s ILE 142 N -3.90 -0.02 0.00 0.00 -4.36 -1.26 -2.69 121.20 108.97 3b3d s ILE 142 Ca 0.08 0.06 0.00 0.00 -0.26 0.00 0.00 60.65 60.54 3b3d s ILE 142 Cb 0.05 -0.19 0.00 0.00 1.25 0.00 0.00 42.46 43.57 3b3d s ILE 142 CO -0.08 0.03 0.00 0.61 0.24 0.00 0.00 174.94 175.73 3b3d n GLY 143 N 3.43 2.88 3.26 6.27 0.00 -0.98 -0.96 105.19 119.09 3b3d n GLY 143 Ca -0.17 -0.48 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 3b3d n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3b3d s VAL 144 N -1.34 0.11 -0.01 1.61 0.11 -0.63 -2.03 120.40 118.22 3b3d s VAL 144 Ca 0.00 -0.94 -0.01 0.00 -2.93 0.00 0.00 61.98 58.10 3b3d s VAL 144 Cb 0.00 -1.29 0.01 0.00 -1.53 0.00 0.00 36.38 33.57 3b3d s VAL 144 CO 0.00 -0.50 0.03 -0.44 -3.33 0.00 0.00 175.10 170.86 3b3d s SER 145 N -2.84 -0.01 -1.26 3.54 0.01 -0.36 -0.84 113.70 111.94 3b3d s SER 145 Ca 0.05 0.06 -0.01 0.00 1.31 0.00 0.00 55.95 57.36 3b3d s SER 145 Cb 0.04 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.30 3b3d s SER 145 CO -0.11 -0.04 0.10 0.59 0.41 0.00 0.00 173.24 174.19 3b3d n ASN 146 N 3.35 -4.63 -4.77 2.44 3.02 -0.28 -4.13 115.26 110.27 3b3d n ASN 146 Ca -0.16 -0.06 -0.37 0.00 -0.03 0.00 0.00 54.58 53.96 3b3d n ASN 146 Cb 0.57 -3.71 -0.07 0.00 -0.61 0.00 0.00 39.78 35.97 3b3d n ASN 146 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3b3d s PHE 147 N -2.81 3.53 0.72 3.10 2.99 -1.26 -4.51 117.98 119.73 3b3d s PHE 147 Ca 0.05 0.65 -0.07 0.00 0.00 0.00 0.00 56.93 57.55 3b3d s PHE 147 Cb -0.02 -2.27 0.07 0.00 0.00 0.00 0.00 43.02 40.80 3b3d s PHE 147 CO 0.06 0.38 1.03 -0.65 -0.00 0.00 0.00 175.22 176.05 3b3d s GLN 148 N -0.02 2.14 0.21 0.44 -1.52 -1.26 -4.89 119.66 114.76 3b3d s GLN 148 Ca 0.17 -0.24 -0.13 0.00 -1.95 0.00 0.00 55.36 53.21 3b3d s GLN 148 Cb -0.13 -2.15 0.25 0.00 -0.22 0.00 0.00 33.01 30.76 3b3d s GLN 148 CO 0.05 -1.30 1.64 0.82 -0.25 0.00 0.00 175.29 176.25 3b3d h ILE 149 N -0.66 0.41 0.00 1.08 2.04 -1.97 -1.42 117.51 116.99 3b3d h ILE 149 Ca -0.44 -0.01 -0.09 0.00 1.00 0.00 0.00 64.86 65.32 3b3d h ILE 149 Cb 1.32 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3b3d h ILE 149 CO 0.60 0.01 -0.42 1.12 0.00 0.00 0.00 178.15 179.46 3b3d h HIS 150 N 0.03 0.00 -0.61 1.37 2.07 -1.98 0.65 115.15 116.67 3b3d h HIS 150 Ca 0.31 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.75 3b3d h HIS 150 Cb 0.48 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.44 3b3d h HIS 150 CO -0.47 0.42 0.09 0.45 -3.07 0.00 0.00 177.93 175.35 3b3d h HIS 151 N 0.00 1.09 -0.16 6.12 3.86 -1.81 -0.46 115.15 123.79 3b3d h HIS 151 Ca -0.00 -0.16 -0.08 0.00 -1.16 0.00 0.00 60.37 58.97 3b3d h HIS 151 Cb 0.74 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.91 3b3d h HIS 151 CO 0.00 0.94 -0.21 -0.07 0.86 0.00 0.00 177.93 179.45 3b3d h LEU 152 N 0.93 0.46 -0.43 2.43 3.38 -0.16 -0.91 115.31 121.02 3b3d h LEU 152 Ca 0.18 -0.51 0.09 0.00 0.09 0.00 0.00 57.88 57.73 3b3d h LEU 152 Cb 0.44 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 3b3d h LEU 152 CO 0.01 0.88 -0.14 -0.33 0.09 0.00 0.00 178.44 178.95 3b3d h GLU 153 N 0.06 -0.05 -0.70 1.13 5.08 -0.94 -2.05 114.58 117.11 3b3d h GLU 153 Ca 0.02 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 3b3d h GLU 153 Cb 0.77 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 3b3d h GLU 153 CO 0.05 -0.03 0.20 0.22 -1.00 0.00 0.00 179.01 178.45 3b3d h ASP 154 N -0.05 1.03 -0.55 1.42 -0.00 -1.02 -2.73 116.42 114.53 3b3d h ASP 154 Ca 0.21 -0.20 0.02 0.00 -0.00 0.00 0.00 57.03 57.05 3b3d h ASP 154 Cb 0.37 -0.27 -0.03 0.00 -0.00 0.00 0.00 39.33 39.40 3b3d h ASP 154 CO -0.47 0.97 0.37 0.25 -0.00 0.00 0.00 179.24 180.37 3b3d h LEU 155 N 1.05 0.60 -1.67 2.28 5.85 -0.77 -3.09 115.31 119.56 3b3d h LEU 155 Ca 0.23 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.93 3b3d h LEU 155 Cb 0.32 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3b3d h LEU 155 CO -0.00 0.42 0.00 0.23 -0.34 0.00 0.00 178.44 178.75 3b3d n MET 156 N -4.46 2.09 0.10 1.25 2.81 -0.81 -1.93 117.12 116.18 3b3d n MET 156 Ca 0.06 -1.65 -0.03 0.00 -1.81 0.00 0.00 57.70 54.27 3b3d n MET 156 Cb 0.09 -1.44 0.02 0.00 -0.71 0.00 0.00 33.22 31.17 3b3d n MET 156 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 3b3d h THR 157 N 3.24 1.48 0.00 2.03 1.35 -1.48 -3.37 112.91 116.16 3b3d h THR 157 Ca 0.00 -2.76 0.00 0.00 -0.55 0.00 0.00 66.41 63.10 3b3d h THR 157 Cb 0.71 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 69.66 3b3d h THR 157 CO 0.00 0.77 0.00 0.00 -0.25 0.00 0.00 175.52 176.04 3b3d n ALA 158 N -2.35 2.40 -1.87 6.62 0.00 -1.15 -5.06 120.51 119.10 3b3d n ALA 158 Ca -0.00 -0.44 -0.38 0.00 0.00 0.00 0.00 53.44 52.62 3b3d n ALA 158 Cb 0.79 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.18 3b3d n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3b3d s ALA 159 N -0.11 3.34 -0.10 0.00 0.00 -0.81 -4.95 121.76 119.13 3b3d s ALA 159 Ca 0.00 0.46 0.16 0.00 0.00 0.00 0.00 51.96 52.58 3b3d s ALA 159 Cb 0.00 -3.08 -0.16 0.00 0.00 0.00 0.00 23.12 19.88 3b3d s ALA 159 CO 0.00 0.24 0.80 1.49 0.00 0.00 0.00 175.76 178.29 3b3d h GLU 160 N 3.83 0.00 -5.83 0.00 4.81 -1.95 -3.46 114.58 111.98 3b3d h GLU 160 Ca -0.46 0.00 -0.63 0.00 -0.13 0.00 0.00 59.36 58.14 3b3d h GLU 160 Cb 1.20 0.00 -0.31 0.00 0.63 0.00 0.00 28.75 30.27 3b3d h GLU 160 CO 0.66 0.35 -0.86 0.42 -0.73 0.00 0.00 179.01 178.85 3b3d s ILE 161 N -2.84 1.75 0.14 2.32 1.01 -1.26 -5.12 121.20 117.19 3b3d s ILE 161 Ca -0.03 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.50 3b3d s ILE 161 Cb 0.08 -1.48 -0.07 0.00 0.01 0.00 0.00 42.46 41.00 3b3d s ILE 161 CO 0.81 0.49 0.66 -0.75 0.00 0.00 0.00 174.94 176.16 3b3d s LYS 162 N -0.20 4.29 0.37 2.79 2.20 -1.26 -5.03 119.74 122.90 3b3d s LYS 162 Ca -0.00 0.86 -0.26 0.00 -0.36 0.00 0.00 55.97 56.21 3b3d s LYS 162 Cb -0.11 -3.13 -0.12 0.00 -1.51 0.00 0.00 37.83 32.95 3b3d s LYS 162 CO 0.02 0.55 1.01 -2.30 -0.36 0.00 0.00 175.35 174.27 3b3d n PRO 163 N 1.37 1.38 -0.01 4.03 -0.02 -1.26 -4.94 135.00 135.55 3b3d n PRO 163 Ca -0.07 0.49 0.09 0.00 -2.02 0.00 0.00 63.50 61.99 3b3d n PRO 163 Cb 0.50 -1.97 -0.13 0.00 -0.02 0.00 0.00 33.50 31.89 3b3d n PRO 163 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3b3d n MET 164 N 0.41 0.68 -4.17 -0.52 2.81 -0.13 -4.62 117.12 111.59 3b3d n MET 164 Ca 0.09 -0.13 -0.16 0.00 -1.81 0.00 0.00 57.70 55.69 3b3d n MET 164 Cb 0.36 -1.40 -0.14 0.00 -0.71 0.00 0.00 33.22 31.33 3b3d n MET 164 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3b3d s ILE 165 N -3.12 0.44 -0.31 2.02 -1.09 -1.26 -1.57 121.20 116.31 3b3d s ILE 165 Ca -0.04 -0.28 0.01 0.00 -2.23 0.00 0.00 60.65 58.12 3b3d s ILE 165 Cb 0.12 -0.38 0.10 0.00 -1.58 0.00 0.00 42.46 40.71 3b3d s ILE 165 CO 0.74 0.10 0.06 0.21 -1.23 0.00 0.00 174.94 174.82 3b3d s ASN 166 N -0.20 4.29 -0.27 3.58 3.04 0.49 -1.61 114.94 124.27 3b3d s ASN 166 Ca 0.02 -1.79 -0.19 0.00 0.04 0.00 0.00 52.86 50.94 3b3d s ASN 166 Cb -0.02 -1.20 -0.02 0.00 -1.54 0.00 0.00 41.25 38.47 3b3d s ASN 166 CO -0.00 -0.38 0.57 -1.58 -3.04 0.00 0.00 177.10 172.66 3b3d s GLN 167 N 1.31 4.04 0.04 0.43 0.74 -0.02 -2.46 119.66 123.74 3b3d s GLN 167 Ca 0.09 0.37 -0.00 0.00 0.05 0.00 0.00 55.36 55.87 3b3d s GLN 167 Cb -0.18 -3.67 -0.03 0.00 1.10 0.00 0.00 33.01 30.23 3b3d s GLN 167 CO -0.16 -0.41 -0.04 0.08 -0.55 0.00 0.00 175.29 174.21 3b3d s VAL 168 N 2.42 0.25 0.28 1.34 1.01 -0.08 -1.12 120.40 124.49 3b3d s VAL 168 Ca 0.23 -1.40 -0.30 0.00 0.00 0.00 0.00 61.98 60.51 3b3d s VAL 168 Cb -0.15 -0.96 -0.11 0.00 0.00 0.00 0.00 36.38 35.16 3b3d s VAL 168 CO 0.09 -0.74 1.58 -0.70 0.00 0.00 0.00 175.10 175.34 3b3d s GLU 169 N -2.74 4.14 -0.30 2.72 2.12 -1.26 -0.38 118.70 123.00 3b3d s GLU 169 Ca -0.03 2.54 -0.15 0.00 0.36 0.00 0.00 54.97 57.69 3b3d s GLU 169 Cb -0.01 -3.04 0.16 0.00 0.26 0.00 0.00 34.13 31.50 3b3d s GLU 169 CO -0.05 -0.62 0.98 0.12 -0.54 0.00 0.00 175.26 175.16 3b3d s PHE 170 N 0.10 -0.68 0.13 5.30 2.19 -1.26 -4.92 117.98 118.84 3b3d s PHE 170 Ca 0.64 1.19 -0.25 0.00 0.33 0.00 0.00 56.93 58.83 3b3d s PHE 170 Cb -0.47 0.41 0.07 0.00 -1.31 0.00 0.00 43.02 41.72 3b3d s PHE 170 CO 0.46 -0.34 1.03 -3.38 1.83 0.00 0.00 175.22 174.82 3b3d s HIS 171 N 2.37 -0.08 0.58 10.12 -3.43 -0.98 -4.63 115.29 119.24 3b3d s HIS 171 Ca -0.03 -0.21 0.28 0.00 -0.80 0.00 0.00 55.06 54.29 3b3d s HIS 171 Cb -0.06 0.64 1.59 0.00 -1.43 0.00 0.00 32.58 33.32 3b3d s HIS 171 CO -0.17 -0.76 2.06 -1.35 -2.00 0.00 0.00 174.74 172.51 3b3d h PRO 172 N 2.00 0.00 -0.02 -0.38 0.11 -1.90 -1.24 132.00 130.57 3b3d h PRO 172 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3b3d h PRO 172 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3b3d h PRO 172 CO 0.28 0.00 -0.06 0.54 -0.21 0.00 0.00 178.00 178.54 3b3d n ARG 173 N -3.86 1.69 -3.22 1.05 1.74 -1.26 -1.08 116.66 111.72 3b3d n ARG 173 Ca 0.03 -1.15 -0.20 0.00 -0.77 0.00 0.00 57.85 55.76 3b3d n ARG 173 Cb 0.40 -1.48 -0.07 0.00 -1.02 0.00 0.00 32.46 30.29 3b3d n ARG 173 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3b3d s LEU 174 N -2.10 0.55 0.00 0.55 0.20 -0.47 -0.59 118.68 116.81 3b3d s LEU 174 Ca 0.32 -2.61 0.26 0.00 0.69 0.00 0.00 54.13 52.79 3b3d s LEU 174 Cb 0.20 0.24 0.66 0.00 -0.43 0.00 0.00 46.19 46.87 3b3d s LEU 174 CO 0.37 -0.15 1.51 0.35 -0.29 0.00 0.00 176.35 178.14 3b3d n THR 175 N 2.97 0.00 -2.78 3.68 -2.24 -1.18 -2.32 114.28 112.41 3b3d n THR 175 Ca 0.25 -0.07 -0.21 0.00 -2.27 0.00 0.00 64.05 61.75 3b3d n THR 175 Cb 0.50 0.33 0.01 0.00 -2.10 0.00 0.00 70.33 69.07 3b3d n THR 175 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3b3d n GLN 176 N -1.00 -3.45 -0.13 -0.78 1.13 -1.26 -4.89 117.38 106.99 3b3d n GLN 176 Ca 0.09 0.89 -0.04 0.00 -1.94 0.00 0.00 57.00 56.01 3b3d n GLN 176 Cb 0.34 -5.66 0.04 0.00 0.11 0.00 0.00 30.24 25.07 3b3d n GLN 176 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 3b3d h LYS 177 N -0.76 0.10 -0.44 -1.09 1.79 -1.99 -0.29 116.57 113.88 3b3d h LYS 177 Ca -0.49 -0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 57.92 3b3d h LYS 177 Cb 1.35 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.96 3b3d h LYS 177 CO 0.56 0.06 0.10 0.93 -1.08 0.00 0.00 179.45 180.02 3b3d h GLU 178 N 0.10 0.71 -0.51 3.15 5.08 -2.00 -2.29 114.58 118.83 3b3d h GLU 178 Ca 0.21 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 3b3d h GLU 178 Cb 0.31 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3b3d h GLU 178 CO -0.36 0.72 -0.06 1.25 -1.00 0.00 0.00 179.01 179.55 3b3d h LEU 179 N 0.58 0.94 -0.31 1.33 5.85 -1.88 -1.57 115.31 120.26 3b3d h LEU 179 Ca 0.14 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 3b3d h LEU 179 Cb 0.34 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3b3d h LEU 179 CO 0.00 1.06 0.14 0.40 -0.34 0.00 0.00 178.44 179.69 3b3d h ILE 180 N 0.81 1.17 -0.11 4.05 2.04 -1.02 -1.27 117.51 123.18 3b3d h ILE 180 Ca 0.14 -0.50 0.04 0.00 1.00 0.00 0.00 64.86 65.53 3b3d h ILE 180 Cb 0.61 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 3b3d h ILE 180 CO 0.04 0.18 -0.14 -0.09 0.00 0.00 0.00 178.15 178.13 3b3d h ARG 181 N 0.36 -0.18 -0.37 2.37 2.43 -1.40 0.30 114.38 117.89 3b3d h ARG 181 Ca 0.10 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 3b3d h ARG 181 Cb 0.15 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.70 3b3d h ARG 181 CO -0.01 -0.12 0.13 -0.92 -1.51 0.00 0.00 179.97 177.54 3b3d h TYR 182 N -0.19 0.23 -0.52 2.20 3.20 -1.12 -1.39 116.97 119.38 3b3d h TYR 182 Ca 0.09 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.89 3b3d h TYR 182 Cb 0.31 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.51 3b3d h TYR 182 CO -0.25 0.09 0.01 0.00 -1.64 0.00 0.00 178.16 176.36 3b3d h GLN 184 N 0.78 1.16 0.00 0.00 4.20 -0.73 0.18 115.11 120.70 3b3d h GLN 184 Ca 0.15 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 3b3d h GLN 184 Cb 0.52 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 3b3d h GLN 184 CO 0.03 0.84 -0.32 -0.91 -0.67 0.00 0.00 178.83 177.80 3b3d h ASN 185 N 1.17 0.00 0.40 1.46 4.21 -0.94 -2.18 115.58 119.70 3b3d h ASN 185 Ca 0.30 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.81 3b3d h ASN 185 Cb 0.01 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.21 3b3d h ASN 185 CO -0.05 0.32 -0.23 0.00 -1.29 0.00 0.00 177.43 176.18 3b3d n GLN 186 N -3.92 0.54 -2.08 0.81 1.13 -0.70 -4.94 117.38 108.23 3b3d n GLN 186 Ca -0.02 -0.26 -0.09 0.00 -1.94 0.00 0.00 57.00 54.70 3b3d n GLN 186 Cb 0.39 -1.49 -0.01 0.00 0.11 0.00 0.00 30.24 29.23 3b3d n GLN 186 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3b3d n GLY 187 N 1.36 0.11 3.54 1.08 0.00 -0.74 -5.03 105.19 105.51 3b3d n GLY 187 Ca 0.11 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 3b3d n GLY 187 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3b3d s ILE 188 N -2.42 4.56 -0.11 -0.61 1.01 0.57 -4.49 121.20 119.71 3b3d s ILE 188 Ca 0.00 -0.10 -0.24 0.00 0.00 0.00 0.00 60.65 60.31 3b3d s ILE 188 Cb 0.00 -3.09 -0.03 0.00 0.01 0.00 0.00 42.46 39.35 3b3d s ILE 188 CO 0.00 0.40 0.74 -1.58 0.00 0.00 0.00 174.94 174.49 3b3d s GLN 189 N 0.99 4.37 0.28 2.79 2.00 -0.60 -3.96 119.66 125.52 3b3d s GLN 189 Ca 0.04 0.90 -0.27 0.00 -2.00 0.00 0.00 55.36 54.03 3b3d s GLN 189 Cb -0.14 -3.50 -0.09 0.00 0.80 0.00 0.00 33.01 30.07 3b3d s GLN 189 CO 0.03 -0.10 0.93 -1.64 -0.50 0.00 0.00 175.29 174.01 3b3d s MET 190 N 1.36 4.68 0.01 1.67 -1.94 -1.26 -0.38 119.30 123.45 3b3d s MET 190 Ca 0.37 1.37 0.01 0.00 -1.71 0.00 0.00 55.69 55.73 3b3d s MET 190 Cb -0.17 -3.02 -0.01 0.00 2.01 0.00 0.00 34.83 33.64 3b3d s MET 190 CO 0.16 0.40 -0.05 -2.00 -0.01 0.00 0.00 175.02 173.51 3b3d s GLU 191 N -1.65 0.37 -0.25 2.03 2.12 -1.03 -1.77 118.70 118.51 3b3d s GLU 191 Ca 0.46 -0.29 -0.09 0.00 0.36 0.00 0.00 54.97 55.40 3b3d s GLU 191 Cb -0.22 -0.29 -0.04 0.00 0.26 0.00 0.00 34.13 33.85 3b3d s GLU 191 CO 0.27 0.07 0.11 0.00 -0.54 0.00 0.00 175.26 175.18 3b3d s ALA 192 N -0.43 3.32 0.20 6.30 0.00 0.21 -0.90 121.76 130.47 3b3d s ALA 192 Ca -0.02 -1.08 -0.28 0.00 0.00 0.00 0.00 51.96 50.59 3b3d s ALA 192 Cb -0.04 -2.22 -0.08 0.00 0.00 0.00 0.00 23.12 20.78 3b3d s ALA 192 CO -0.00 -0.45 0.85 -0.46 0.00 0.00 0.00 175.76 175.70 3b3d s TRP 193 N 1.55 3.95 -1.28 0.00 -0.00 0.48 -3.30 118.94 120.35 3b3d s TRP 193 Ca 0.06 1.77 -0.10 0.00 -0.00 0.00 0.00 56.10 57.84 3b3d s TRP 193 Cb -0.15 -2.87 -0.00 0.00 -0.00 0.00 0.00 33.47 30.45 3b3d s TRP 193 CO 0.06 0.49 0.62 0.43 -0.00 0.00 0.00 176.95 178.54 3b3d n SER 194 N 1.55 -2.61 0.11 5.86 7.64 -1.26 -4.34 113.62 120.57 3b3d n SER 194 Ca -0.04 -1.00 0.16 0.00 1.01 0.00 0.00 58.87 59.01 3b3d n SER 194 Cb 0.48 -3.28 0.71 0.00 -1.01 0.00 0.00 64.21 61.11 3b3d n SER 194 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3b3d h PRO 195 N -1.88 0.00 -0.01 1.43 0.13 -1.82 -1.82 132.00 128.02 3b3d h PRO 195 Ca -0.65 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 3b3d h PRO 195 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 3b3d h PRO 195 CO 0.55 0.00 -0.53 1.28 -0.23 0.00 0.00 178.00 179.08 3b3d n LEU 196 N -4.27 1.43 -4.08 1.56 4.77 -1.26 -4.74 117.00 110.40 3b3d n LEU 196 Ca 0.05 -0.51 -0.44 0.00 -0.03 0.00 0.00 56.01 55.08 3b3d n LEU 196 Cb 0.41 -0.06 0.01 0.00 -2.33 0.00 0.00 43.42 41.46 3b3d n LEU 196 CO 0.34 0.28 -0.19 0.80 -1.33 0.00 0.00 177.39 177.29 3b3d n MET 197 N -0.62 -0.41 -3.30 3.23 0.00 -0.69 -0.85 117.12 114.49 3b3d n MET 197 Ca 0.09 0.10 -0.24 0.00 -0.00 0.00 0.00 57.70 57.65 3b3d n MET 197 Cb 0.40 -2.75 0.02 0.00 0.00 0.00 0.00 33.22 30.89 3b3d n MET 197 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 175.97 176.91 3b3d n GLN 198 N -4.96 -4.43 -1.40 2.12 7.27 -1.26 -2.26 117.38 112.46 3b3d n GLN 198 Ca -0.13 0.68 -0.12 0.00 0.07 0.00 0.00 57.00 57.50 3b3d n GLN 198 Cb 0.58 -5.48 -0.05 0.00 2.41 0.00 0.00 30.24 27.70 3b3d n GLN 198 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3b3d n GLY 199 N -1.41 1.20 0.20 1.69 0.00 -0.03 -4.91 105.19 101.93 3b3d n GLY 199 Ca -0.05 -0.48 0.15 0.00 0.00 0.00 0.00 46.02 45.64 3b3d n GLY 199 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3b3d h GLN 200 N 0.00 0.00 -0.01 1.61 4.15 -1.44 -2.60 115.11 116.82 3b3d h GLN 200 Ca -0.24 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.18 3b3d h GLN 200 Cb 0.80 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.49 3b3d h GLN 200 CO 0.35 0.00 -0.20 1.28 -1.93 0.00 0.00 178.83 178.33 3b3d n LEU 201 N -2.57 1.38 0.00 -2.39 4.77 -1.26 -4.76 117.00 112.17 3b3d n LEU 201 Ca 0.00 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.19 3b3d n LEU 201 Cb 0.18 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3b3d n LEU 201 CO 0.19 0.27 0.49 0.18 -1.33 0.00 0.00 177.39 177.20 3b3d n LEU 202 N -0.11 0.00 -0.96 2.23 4.77 -0.98 0.13 117.00 122.08 3b3d n LEU 202 Ca 0.05 0.47 0.10 0.00 -0.03 0.00 0.00 56.01 56.59 3b3d n LEU 202 Cb 0.24 -0.47 0.18 0.00 -2.33 0.00 0.00 43.42 41.05 3b3d n LEU 202 CO 0.13 -0.47 0.65 0.47 -1.33 0.00 0.00 177.39 176.84 3b3d n ASP 203 N -1.47 3.16 -4.72 -1.43 9.92 -1.26 -4.84 116.55 115.91 3b3d n ASP 203 Ca 0.00 -1.91 -0.42 0.00 -0.53 0.00 0.00 54.79 51.93 3b3d n ASP 203 Cb 0.02 -0.22 -0.03 0.00 -0.64 0.00 0.00 41.12 40.25 3b3d n ASP 203 CO 0.00 0.00 0.00 -2.28 0.13 0.00 0.00 177.20 175.05 3b3d s HIS 204 N -1.29 3.31 0.22 1.24 2.46 0.35 -4.85 115.29 116.74 3b3d s HIS 204 Ca 0.32 1.13 -0.05 0.00 0.47 0.00 0.00 55.06 56.93 3b3d s HIS 204 Cb 0.19 -3.58 0.20 0.00 -0.13 0.00 0.00 32.58 29.26 3b3d s HIS 204 CO 0.26 -1.90 1.69 -1.00 -2.47 0.00 0.00 174.74 171.32 3b3d h PRO 205 N 6.40 0.91 -0.09 2.88 0.13 -1.96 0.70 132.00 140.98 3b3d h PRO 205 Ca -0.43 -0.28 0.00 0.00 -0.87 0.00 0.00 66.00 64.43 3b3d h PRO 205 Cb 1.21 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 3b3d h PRO 205 CO 0.82 0.93 0.05 0.28 -0.23 0.00 0.00 178.00 179.84 3b3d h VAL 206 N 0.84 1.00 -0.21 1.56 2.07 -1.98 -0.44 116.25 119.10 3b3d h VAL 206 Ca 0.15 -0.03 -0.16 0.00 0.82 0.00 0.00 66.70 67.48 3b3d h VAL 206 Cb 0.54 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3b3d h VAL 206 CO 0.03 0.02 -0.52 -0.07 0.02 0.00 0.00 177.57 177.04 3b3d h LEU 207 N 0.10 0.68 -0.84 2.57 3.38 -1.77 -1.68 115.31 117.75 3b3d h LEU 207 Ca 0.03 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 3b3d h LEU 207 Cb 0.00 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3b3d h LEU 207 CO -0.02 1.07 0.06 0.00 0.09 0.00 0.00 178.44 179.64 3b3d h ALA 208 N 0.94 1.04 0.26 1.53 0.00 0.47 0.12 119.26 123.62 3b3d h ALA 208 Ca 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3b3d h ALA 208 Cb 1.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3b3d h ALA 208 CO 0.10 0.61 -0.13 0.22 0.00 0.00 0.00 179.25 180.05 3b3d h ASP 209 N 0.86 -0.30 -0.85 0.00 3.58 -0.89 -1.63 116.42 117.20 3b3d h ASP 209 Ca 0.17 -0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.63 3b3d h ASP 209 Cb 0.43 0.08 -0.05 0.00 1.72 0.00 0.00 39.33 41.51 3b3d h ASP 209 CO 0.01 -0.19 0.55 0.40 -2.88 0.00 0.00 179.24 177.14 3b3d h ILE 210 N -0.38 1.17 -0.62 2.25 2.04 -1.20 -1.49 117.51 119.28 3b3d h ILE 210 Ca -0.04 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.42 3b3d h ILE 210 Cb 0.29 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.32 3b3d h ILE 210 CO 0.06 0.20 0.27 0.00 0.00 0.00 0.00 178.15 178.68 3b3d h ALA 211 N 1.33 0.80 -0.49 1.87 0.00 -0.91 -2.82 119.26 119.05 3b3d h ALA 211 Ca 0.33 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 3b3d h ALA 211 Cb -0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3b3d h ALA 211 CO -0.09 0.40 -0.14 -0.56 0.00 0.00 0.00 179.25 178.85 3b3d h GLN 212 N 0.86 0.96 0.00 0.00 -0.00 -0.83 0.12 115.11 116.22 3b3d h GLN 212 Ca 0.21 -0.38 -0.02 0.00 -0.00 0.00 0.00 58.65 58.47 3b3d h GLN 212 Cb 0.17 -0.05 -0.00 0.00 -0.00 0.00 0.00 27.48 27.60 3b3d h GLN 212 CO -0.02 1.04 -0.08 0.00 -0.00 0.00 0.00 178.83 179.77 3b3d h THR 213 N 0.81 0.50 -0.02 1.86 1.03 -1.04 -1.84 112.91 114.21 3b3d h THR 213 Ca 0.12 -0.37 0.00 0.00 -0.01 0.00 0.00 66.41 66.15 3b3d h THR 213 Cb 0.70 1.24 0.00 0.00 -1.07 0.00 0.00 68.15 69.03 3b3d h THR 213 CO 0.05 0.08 -0.25 -1.22 -0.01 0.00 0.00 175.52 174.17 3b3d n TYR 214 N -3.64 0.00 -3.67 0.00 4.01 -1.04 -4.97 117.16 107.84 3b3d n TYR 214 Ca -0.02 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.50 3b3d n TYR 214 Cb 0.19 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.27 3b3d n TYR 214 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3b3d n ASN 215 N 0.62 -2.44 -4.47 7.72 5.15 -0.58 -5.02 115.26 116.24 3b3d n ASN 215 Ca 0.12 -0.75 -0.23 0.00 -0.60 0.00 0.00 54.58 53.12 3b3d n ASN 215 Cb 0.53 -4.34 -0.10 0.00 -0.53 0.00 0.00 39.78 35.33 3b3d n ASN 215 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3b3d s LYS 216 N -5.99 1.65 0.58 1.20 -0.14 0.31 -5.03 119.74 112.33 3b3d s LYS 216 Ca 0.17 -1.84 -0.14 0.00 -1.36 0.00 0.00 55.97 52.80 3b3d s LYS 216 Cb -0.08 -1.35 -0.05 0.00 -1.68 0.00 0.00 37.83 34.67 3b3d s LYS 216 CO 0.79 0.07 1.02 -1.54 -0.76 0.00 0.00 175.35 174.93 3b3d s SER 217 N -3.50 6.27 0.18 2.83 1.04 -1.26 -4.35 113.70 114.92 3b3d s SER 217 Ca 0.31 1.53 -0.16 0.00 0.48 0.00 0.00 55.95 58.11 3b3d s SER 217 Cb 0.03 -2.49 0.15 0.00 0.10 0.00 0.00 66.02 63.81 3b3d s SER 217 CO 0.14 -0.83 1.64 0.58 0.98 0.00 0.00 173.24 175.74 3b3d h VAL 218 N 0.21 0.45 -0.83 5.02 2.07 -1.88 -1.62 116.25 119.67 3b3d h VAL 218 Ca -0.45 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.26 3b3d h VAL 218 Cb 1.19 0.45 -0.12 0.00 -1.52 0.00 0.00 31.29 31.28 3b3d h VAL 218 CO 0.61 0.00 0.25 0.00 0.02 0.00 0.00 177.57 178.45 3b3d h ALA 219 N 1.40 1.18 -0.48 1.67 0.00 -1.94 -0.10 119.26 120.99 3b3d h ALA 219 Ca 0.24 0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 3b3d h ALA 219 Cb 0.40 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 3b3d h ALA 219 CO -0.53 -0.37 0.18 1.96 0.00 0.00 0.00 179.25 180.49 3b3d h GLN 220 N 0.29 0.73 -0.30 0.00 4.20 -1.66 -1.84 115.11 116.53 3b3d h GLN 220 Ca 0.50 -0.14 -0.17 0.00 0.06 0.00 0.00 58.65 58.89 3b3d h GLN 220 Cb 0.92 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.58 3b3d h GLN 220 CO -0.56 0.66 -0.50 -0.84 -0.67 0.00 0.00 178.83 176.92 3b3d h ILE 221 N 0.64 1.28 -0.49 2.54 -0.00 -0.75 -1.58 117.51 119.16 3b3d h ILE 221 Ca 0.16 -1.69 0.09 0.00 -0.00 0.00 0.00 64.86 63.42 3b3d h ILE 221 Cb 0.21 1.58 -0.07 0.00 -0.00 0.00 0.00 36.82 38.54 3b3d h ILE 221 CO -0.01 0.55 0.08 0.40 -0.00 0.00 0.00 178.15 179.16 3b3d h ILE 222 N 0.65 0.70 -0.54 0.16 2.04 -0.96 -0.68 117.51 118.89 3b3d h ILE 222 Ca 0.03 -0.07 -0.08 0.00 1.00 0.00 0.00 64.86 65.74 3b3d h ILE 222 Cb 1.09 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 3b3d h ILE 222 CO 0.11 0.04 0.03 -0.07 0.00 0.00 0.00 178.15 178.25 3b3d h LEU 223 N 0.20 0.91 -1.01 1.44 4.07 -1.26 0.45 115.31 120.12 3b3d h LEU 223 Ca 0.25 -0.29 0.03 0.00 0.08 0.00 0.00 57.88 57.94 3b3d h LEU 223 Cb 0.34 -0.24 -0.05 0.00 1.08 0.00 0.00 40.66 41.78 3b3d h LEU 223 CO -0.34 0.98 0.66 -0.09 -1.08 0.00 0.00 178.44 178.57 3b3d h ARG 224 N 0.82 1.28 -0.32 1.13 9.65 -1.12 -2.43 114.38 123.38 3b3d h ARG 224 Ca 0.16 -0.08 -0.03 0.00 -1.10 0.00 0.00 59.98 58.93 3b3d h ARG 224 Cb 0.50 -0.29 -0.01 0.00 -1.39 0.00 0.00 29.97 28.78 3b3d h ARG 224 CO 0.02 0.84 0.10 2.35 2.80 0.00 0.00 179.97 186.08 3b3d h TRP 225 N 1.31 0.52 -0.59 2.20 7.01 -0.45 0.12 115.95 126.07 3b3d h TRP 225 Ca 0.39 -0.05 0.10 0.00 2.11 0.00 0.00 58.89 61.43 3b3d h TRP 225 Cb -0.07 -0.15 -0.11 0.00 -2.10 0.00 0.00 29.16 26.73 3b3d h TRP 225 CO -0.00 0.53 -0.36 -0.44 -2.79 0.00 0.00 178.44 175.38 3b3d h ASP 226 N 0.36 -1.24 -0.39 2.65 3.32 -0.83 -0.83 116.42 119.45 3b3d h ASP 226 Ca 0.10 0.23 0.01 0.00 0.02 0.00 0.00 57.03 57.39 3b3d h ASP 226 Cb 0.25 0.60 -0.02 0.00 0.22 0.00 0.00 39.33 40.38 3b3d h ASP 226 CO -0.00 -0.31 0.26 -0.07 -1.72 0.00 0.00 179.24 177.39 3b3d h LEU 227 N -0.18 0.44 -0.63 1.55 3.38 -1.11 -1.52 115.31 117.24 3b3d h LEU 227 Ca 0.22 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3b3d h LEU 227 Cb 0.56 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3b3d h LEU 227 CO -0.68 0.32 0.00 1.56 0.09 0.00 0.00 178.44 179.72 3b3d h GLN 228 N 0.52 0.00 0.00 1.13 4.20 -0.47 -1.13 115.11 119.36 3b3d h GLN 228 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3b3d h GLN 228 Cb -0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.73 3b3d h GLN 228 CO -0.04 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.84 3b3d n HIS 229 N -2.55 0.00 -2.60 2.96 8.25 -0.34 -4.93 115.22 116.01 3b3d n HIS 229 Ca 0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.39 3b3d n HIS 229 Cb 0.33 -0.23 0.02 0.00 1.12 0.00 0.00 29.99 31.22 3b3d n HIS 229 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3b3d n GLY 230 N 0.84 0.18 3.32 -1.41 0.00 -0.43 -5.04 105.19 102.65 3b3d n GLY 230 Ca 0.14 -0.39 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 3b3d n GLY 230 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3b3d s ILE 231 N -2.82 2.70 0.30 -0.61 1.01 -0.61 -4.64 121.20 116.53 3b3d s ILE 231 Ca 0.14 -0.79 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 3b3d s ILE 231 Cb -0.06 -2.10 -0.10 0.00 0.01 0.00 0.00 42.46 40.21 3b3d s ILE 231 CO 0.17 0.54 1.26 -0.63 0.00 0.00 0.00 174.94 176.27 3b3d s ILE 232 N 0.35 2.96 -0.02 2.92 1.01 -0.73 -3.86 121.20 123.83 3b3d s ILE 232 Ca -0.14 0.95 0.03 0.00 0.00 0.00 0.00 60.65 61.49 3b3d s ILE 232 Cb -0.17 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.70 3b3d s ILE 232 CO 0.07 0.22 -0.10 0.28 0.00 0.00 0.00 174.94 175.41 3b3d s THR 233 N -1.01 0.83 -0.48 2.92 -1.32 -0.41 0.68 115.64 116.85 3b3d s THR 233 Ca 0.49 -0.40 0.08 0.00 -1.21 0.00 0.00 61.69 60.65 3b3d s THR 233 Cb -0.37 -0.73 0.30 0.00 -1.51 0.00 0.00 72.50 70.19 3b3d s THR 233 CO 0.48 0.25 0.73 2.30 -2.21 0.00 0.00 174.62 176.17 3b3d n ILE 234 N 3.20 0.97 -1.93 5.08 -5.35 -1.21 -0.95 119.36 119.16 3b3d n ILE 234 Ca -0.17 -4.80 -0.41 0.00 -0.27 0.00 0.00 62.75 57.10 3b3d n ILE 234 Cb 0.55 -1.36 -0.02 0.00 -1.74 0.00 0.00 39.64 37.07 3b3d n ILE 234 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 3b3d s PRO 235 N -2.35 4.22 0.19 6.28 0.04 -1.20 -2.60 135.00 139.58 3b3d s PRO 235 Ca 0.41 2.41 -0.30 0.00 0.04 0.00 0.00 61.00 63.55 3b3d s PRO 235 Cb 0.24 -3.05 -0.08 0.00 0.04 0.00 0.00 34.50 31.66 3b3d s PRO 235 CO -0.09 -0.44 0.99 0.15 0.04 0.00 0.00 177.00 177.65 3b3d s LYS 236 N -1.12 4.74 -0.17 4.56 3.01 -1.26 -2.15 119.74 127.34 3b3d s LYS 236 Ca 0.56 1.55 -0.35 0.00 -1.01 0.00 0.00 55.97 56.72 3b3d s LYS 236 Cb -0.44 -3.30 0.14 0.00 -1.01 0.00 0.00 37.83 33.22 3b3d s LYS 236 CO 0.51 0.32 1.27 0.45 0.51 0.00 0.00 175.35 178.40 3b3d s SER 237 N -0.59 -0.09 0.00 2.83 0.15 -1.25 -4.98 113.70 109.77 3b3d s SER 237 Ca 0.45 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 57.07 3b3d s SER 237 Cb -0.26 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 3b3d s SER 237 CO 0.33 -0.19 0.00 0.41 1.20 0.00 0.00 173.24 174.98 3b3d n THR 238 N -0.16 0.00 -3.01 6.45 -1.04 -1.26 -4.90 114.28 110.35 3b3d n THR 238 Ca -0.01 -0.01 -0.41 0.00 -2.04 0.00 0.00 64.05 61.58 3b3d n THR 238 Cb 0.59 0.27 -0.05 0.00 -1.82 0.00 0.00 70.33 69.31 3b3d n THR 238 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3b3d s LYS 239 N -0.11 4.06 0.19 -2.82 1.02 -1.26 -4.63 119.74 116.19 3b3d s LYS 239 Ca 0.00 0.62 -0.21 0.00 0.02 0.00 0.00 55.97 56.40 3b3d s LYS 239 Cb 0.00 -3.68 0.12 0.00 -0.52 0.00 0.00 37.83 33.75 3b3d s LYS 239 CO 0.00 -0.53 1.59 0.93 -0.92 0.00 0.00 175.35 176.42 3b3d h GLU 240 N 7.94 -0.16 -0.42 1.68 5.08 -1.97 0.14 114.58 126.88 3b3d h GLU 240 Ca -0.25 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 3b3d h GLU 240 Cb 1.11 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 3b3d h GLU 240 CO 0.83 -0.10 0.18 1.12 -1.00 0.00 0.00 179.01 180.04 3b3d h HIS 241 N -0.16 0.58 -0.18 4.33 2.07 -1.99 -1.33 115.15 118.46 3b3d h HIS 241 Ca 0.23 -0.01 -0.09 0.00 -2.85 0.00 0.00 60.37 57.64 3b3d h HIS 241 Cb 0.55 -0.18 -0.00 0.00 2.57 0.00 0.00 27.41 30.34 3b3d h HIS 241 CO -0.63 0.44 -0.26 -0.09 -3.07 0.00 0.00 177.93 174.33 3b3d h ARG 242 N 0.59 0.49 -0.51 5.12 2.43 -1.46 0.10 114.38 121.14 3b3d h ARG 242 Ca 0.15 -0.29 0.06 0.00 -0.81 0.00 0.00 59.98 59.08 3b3d h ARG 242 Cb 0.09 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.62 3b3d h ARG 242 CO -0.02 0.88 0.23 0.82 -1.51 0.00 0.00 179.97 180.37 3b3d h ILE 243 N 0.14 0.90 0.32 1.20 2.04 -0.42 0.25 117.51 121.93 3b3d h ILE 243 Ca 0.02 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 3b3d h ILE 243 Cb 0.83 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 3b3d h ILE 243 CO 0.06 0.08 -0.15 0.11 0.00 0.00 0.00 178.15 178.25 3b3d h LYS 244 N 0.44 -0.41 -0.85 2.37 1.57 -1.25 -3.23 116.57 115.21 3b3d h LYS 244 Ca 0.23 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3b3d h LYS 244 Cb 0.19 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 3b3d h LYS 244 CO -0.20 -0.11 0.54 1.49 -0.57 0.00 0.00 179.45 180.60 3b3d h GLU 245 N -0.72 1.13 -0.09 3.15 4.81 -0.87 -2.42 114.58 119.58 3b3d h GLU 245 Ca -0.04 -0.08 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 3b3d h GLU 245 Cb 0.49 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3b3d h GLU 245 CO 0.07 0.77 -0.03 -0.91 -0.73 0.00 0.00 179.01 178.18 3b3d h ASN 246 N 1.16 0.12 1.68 1.04 2.35 -0.61 -2.59 115.58 118.73 3b3d h ASN 246 Ca 0.31 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 3b3d h ASN 246 Cb -0.10 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.24 3b3d h ASN 246 CO -0.06 0.17 0.00 0.00 -1.65 0.00 0.00 177.43 175.89 3b3d h ALA 247 N 1.85 1.00 -0.67 -0.83 0.00 -1.45 -3.40 119.26 115.76 3b3d h ALA 247 Ca 0.03 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.28 3b3d h ALA 247 Cb 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 3b3d h ALA 247 CO 0.01 0.00 2.31 -1.13 0.00 0.00 0.00 179.25 180.43 3b3d n SER 248 N -2.90 4.60 -0.12 0.00 3.41 -0.98 -4.43 113.62 113.21 3b3d n SER 248 Ca 0.04 -2.89 0.01 0.00 -0.26 0.00 0.00 58.87 55.77 3b3d n SER 248 Cb 0.46 -1.72 0.01 0.00 -0.26 0.00 0.00 64.21 62.70 3b3d n SER 248 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 3b3d n VAL 249 N 6.25 0.41 0.01 -3.33 3.14 -1.26 -4.83 118.33 118.71 3b3d n VAL 249 Ca 0.49 -0.45 0.00 0.00 -2.96 0.00 0.00 64.34 61.43 3b3d n VAL 249 Cb 0.45 0.66 0.01 0.00 -1.06 0.00 0.00 33.84 33.89 3b3d n VAL 249 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 3b3d n PHE 250 N -0.25 0.02 0.81 1.45 3.01 -1.26 -4.45 117.46 116.78 3b3d n PHE 250 Ca 0.02 -0.27 0.12 0.00 1.01 0.00 0.00 57.45 58.33 3b3d n PHE 250 Cb 0.50 -0.03 0.24 0.00 -0.01 0.00 0.00 39.48 40.19 3b3d n PHE 250 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 3b3d n ASP 251 N -0.20 2.79 -3.68 4.37 3.85 -1.26 -4.92 116.55 117.50 3b3d n ASP 251 Ca 0.01 -1.89 -0.10 0.00 -0.71 0.00 0.00 54.79 52.09 3b3d n ASP 251 Cb 0.15 -0.12 -0.04 0.00 -1.35 0.00 0.00 41.12 39.76 3b3d n ASP 251 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 3b3d s PHE 252 N -1.76 0.45 0.02 2.11 -0.12 -1.26 -5.17 117.98 112.25 3b3d s PHE 252 Ca 0.34 -0.83 0.00 0.00 -0.05 0.00 0.00 56.93 56.40 3b3d s PHE 252 Cb 0.21 0.25 -0.02 0.00 -0.63 0.00 0.00 43.02 42.83 3b3d s PHE 252 CO 0.30 -1.12 -0.03 -2.00 -0.05 0.00 0.00 175.22 172.32 3b3d s GLU 253 N -3.57 0.32 -0.03 1.99 2.12 -1.26 -5.04 118.70 113.22 3b3d s GLU 253 Ca 0.23 -0.57 -0.16 0.00 0.36 0.00 0.00 54.97 54.82 3b3d s GLU 253 Cb -0.02 0.04 -0.05 0.00 0.26 0.00 0.00 34.13 34.36 3b3d s GLU 253 CO 0.12 -0.03 0.42 -0.51 -0.54 0.00 0.00 175.26 174.72 3b3d s LEU 254 N -1.34 4.42 1.09 2.70 2.01 -1.26 -5.09 118.68 121.22 3b3d s LEU 254 Ca -0.14 0.92 -0.14 0.00 0.01 0.00 0.00 54.13 54.78 3b3d s LEU 254 Cb -0.09 -2.61 0.24 0.00 0.01 0.00 0.00 46.19 43.74 3b3d s LEU 254 CO -0.01 0.24 1.07 0.42 1.01 0.00 0.00 176.35 179.08 3b3d s THR 255 N -0.60 1.92 0.34 5.49 -4.23 -1.26 -4.83 115.64 112.48 3b3d s THR 255 Ca 0.24 0.00 0.08 0.00 -1.18 0.00 0.00 61.69 60.83 3b3d s THR 255 Cb -0.16 -2.38 0.11 0.00 1.34 0.00 0.00 72.50 71.41 3b3d s THR 255 CO 0.12 0.00 1.82 -0.61 -0.54 0.00 0.00 174.62 175.41 3b3d h GLN 256 N -2.25 0.25 -0.14 3.99 5.75 -1.99 -2.06 115.11 118.66 3b3d h GLN 256 Ca -0.55 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 57.86 3b3d h GLN 256 Cb 1.33 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.85 3b3d h GLN 256 CO 0.52 0.49 0.05 0.22 -2.65 0.00 0.00 178.83 177.46 3b3d h ASP 257 N 0.23 0.19 -0.56 -0.69 1.82 -1.98 -0.37 116.42 115.05 3b3d h ASP 257 Ca 0.04 -0.17 0.09 0.00 -0.39 0.00 0.00 57.03 56.60 3b3d h ASP 257 Cb 0.56 -0.05 -0.07 0.00 0.68 0.00 0.00 39.33 40.45 3b3d h ASP 257 CO 0.04 0.31 0.18 0.44 -1.61 0.00 0.00 179.24 178.60 3b3d h ASP 258 N 0.07 0.15 -0.63 2.28 3.45 -1.91 0.18 116.42 120.02 3b3d h ASP 258 Ca 0.05 0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.59 3b3d h ASP 258 Cb 0.18 0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 38.99 3b3d h ASP 258 CO -0.00 0.10 0.40 0.24 -1.57 0.00 0.00 179.24 178.41 3b3d h MET 259 N 0.35 0.83 -0.09 3.56 2.86 -1.15 -2.13 114.93 119.17 3b3d h MET 259 Ca 0.28 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.77 3b3d h MET 259 Cb 0.35 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 3b3d h MET 259 CO -0.31 0.57 -0.35 -0.91 1.06 0.00 0.00 176.91 176.97 3b3d h ASN 260 N 0.85 0.17 -0.13 1.22 2.35 -0.73 -1.12 115.58 118.19 3b3d h ASN 260 Ca 0.23 -0.06 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 3b3d h ASN 260 Cb -0.07 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 3b3d h ASN 260 CO -0.05 0.52 -0.15 0.03 -1.65 0.00 0.00 177.43 176.13 3b3d h ARG 261 N 0.15 0.51 0.24 0.81 3.08 -0.27 -1.95 114.38 116.95 3b3d h ARG 261 Ca 0.02 -0.16 -0.33 0.00 0.07 0.00 0.00 59.98 59.57 3b3d h ARG 261 Cb 0.70 -0.05 0.03 0.00 0.08 0.00 0.00 29.97 30.73 3b3d h ARG 261 CO 0.05 0.65 -1.50 0.82 -1.07 0.00 0.00 179.97 178.93 3b3d h ILE 262 N 0.47 1.23 -0.64 2.04 2.04 -1.25 -3.24 117.51 118.16 3b3d h ILE 262 Ca 0.08 -2.66 0.06 0.00 1.00 0.00 0.00 64.86 63.35 3b3d h ILE 262 Cb 0.54 3.01 -0.04 0.00 -0.74 0.00 0.00 36.82 39.59 3b3d h ILE 262 CO 0.03 0.81 0.42 0.44 0.00 0.00 0.00 178.15 179.86 3b3d h ASP 263 N 0.11 0.55 0.25 1.72 3.32 -1.23 -2.04 116.42 119.10 3b3d h ASP 263 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3b3d h ASP 263 Cb 2.14 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 41.57 3b3d h ASP 263 CO 0.25 0.36 0.00 0.00 -1.72 0.00 0.00 179.24 178.13 3b3d h ALA 264 N 1.65 1.00 0.00 3.45 0.00 -1.37 -2.47 119.26 121.53 3b3d h ALA 264 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3b3d h ALA 264 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3b3d h ALA 264 CO -0.08 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.45 3b3d n LEU 265 N -2.43 0.36 -4.50 0.00 4.77 -0.77 -4.90 117.00 109.53 3b3d n LEU 265 Ca -0.01 0.54 -0.58 0.00 -0.03 0.00 0.00 56.01 55.94 3b3d n LEU 265 Cb 0.11 -0.44 -0.08 0.00 -2.33 0.00 0.00 43.42 40.68 3b3d n LEU 265 CO 0.15 -0.14 0.58 -3.20 -1.33 0.00 0.00 177.39 173.45 3b3d n ASN 266 N -1.84 0.10 0.00 -1.43 5.15 -0.24 -4.35 115.26 112.65 3b3d n ASN 266 Ca 0.06 1.15 0.00 0.00 -0.60 0.00 0.00 54.58 55.19 3b3d n ASN 266 Cb 0.35 -0.95 0.00 0.00 -0.53 0.00 0.00 39.78 38.65 3b3d n ASN 266 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3b3d n GLU 267 N 1.58 -0.22 -3.40 1.20 1.02 -0.88 -4.99 120.64 114.94 3b3d n GLU 267 Ca 0.20 -0.33 -0.24 0.00 -0.02 0.00 0.00 57.16 56.76 3b3d n GLU 267 Cb 0.10 -0.74 0.01 0.00 -0.02 0.00 0.00 31.44 30.79 3b3d n GLU 267 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3b3d n ASN 268 N -0.03 -4.30 -4.43 1.62 3.02 -0.94 -4.93 115.26 105.26 3b3d n ASN 268 Ca 0.00 -0.44 -0.44 0.00 -0.03 0.00 0.00 54.58 53.67 3b3d n ASN 268 Cb 0.17 -3.52 -0.07 0.00 -0.61 0.00 0.00 39.78 35.74 3b3d n ASN 268 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3b3d s LEU 269 N -6.66 5.18 -0.23 3.41 0.20 0.24 -4.97 118.68 115.84 3b3d s LEU 269 Ca 0.43 -1.01 -0.26 0.00 0.69 0.00 0.00 54.13 53.99 3b3d s LEU 269 Cb -0.22 -2.34 -0.00 0.00 -0.43 0.00 0.00 46.19 43.20 3b3d s LEU 269 CO 0.53 -0.74 0.87 -0.60 -0.29 0.00 0.00 176.35 176.13 3b3d s ARG 270 N 2.18 4.22 -0.10 1.98 3.52 -1.26 -4.39 118.95 125.09 3b3d s ARG 270 Ca 0.11 1.04 -0.03 0.00 -0.13 0.00 0.00 55.73 56.72 3b3d s ARG 270 Cb -0.21 -3.63 -0.26 0.00 -1.56 0.00 0.00 34.95 29.29 3b3d s ARG 270 CO 0.10 -0.52 0.44 0.28 -0.81 0.00 0.00 175.30 174.80 3b3d n VAL 271 N 5.20 1.75 -1.42 7.11 0.31 -1.26 -4.96 118.33 125.06 3b3d n VAL 271 Ca 0.07 -0.69 -0.11 0.00 -0.01 0.00 0.00 64.34 63.60 3b3d n VAL 271 Cb 0.47 -1.59 0.08 0.00 -0.91 0.00 0.00 33.84 31.88 3b3d n VAL 271 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3b3d n GLY 272 N 1.90 -1.13 3.76 2.92 0.00 -1.26 -5.04 105.19 106.34 3b3d n GLY 272 Ca -0.29 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 3b3d n GLY 272 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3b3d s PRO 273 N -4.05 3.74 -0.12 1.61 0.02 -1.26 -4.98 135.00 129.95 3b3d s PRO 273 Ca 0.28 2.11 -0.29 0.00 0.02 0.00 0.00 61.00 63.12 3b3d s PRO 273 Cb -0.01 -2.58 -0.02 0.00 0.02 0.00 0.00 34.50 31.92 3b3d s PRO 273 CO 0.20 -0.67 1.16 0.34 -0.33 0.00 0.00 177.00 177.71 3b3d s ASP 274 N -0.89 7.06 0.60 2.53 3.68 -1.26 -4.92 116.67 123.46 3b3d s ASP 274 Ca 0.61 1.66 0.35 0.00 2.13 0.00 0.00 52.55 57.30 3b3d s ASP 274 Cb -0.37 -2.55 1.92 0.00 -1.45 0.00 0.00 42.92 40.47 3b3d s ASP 274 CO 0.46 -0.63 2.24 -0.65 0.13 0.00 0.00 175.17 176.72 3b3d h PRO 275 N 7.63 0.00 -0.02 4.34 0.11 -1.94 -1.99 132.00 140.13 3b3d h PRO 275 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3b3d h PRO 275 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3b3d h PRO 275 CO 0.92 0.03 -0.18 -0.25 -0.21 0.00 0.00 178.00 178.31 3b3d n ASP 276 N -3.49 2.31 -2.82 -2.05 8.00 -1.26 -4.73 116.55 112.51 3b3d n ASP 276 Ca -0.02 -1.68 -0.09 0.00 0.71 0.00 0.00 54.79 53.70 3b3d n ASP 276 Cb 0.13 0.16 0.02 0.00 -0.02 0.00 0.00 41.12 41.41 3b3d n ASP 276 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3b3d n ASN 277 N 0.57 -2.65 -4.09 -2.24 2.85 -0.76 -5.14 115.26 103.81 3b3d n ASN 277 Ca 0.13 -3.12 -0.10 0.00 -0.11 0.00 0.00 54.58 51.38 3b3d n ASN 277 Cb 0.50 1.49 -0.11 0.00 1.24 0.00 0.00 39.78 42.90 3b3d n ASN 277 CO 0.00 0.00 0.00 0.72 -2.11 0.00 0.00 177.26 175.87 3b3d s PHE 278 N 0.53 0.63 -0.38 1.20 -0.12 -1.12 -4.09 117.98 114.63 3b3d s PHE 278 Ca 0.32 -0.74 0.03 0.00 -0.05 0.00 0.00 56.93 56.48 3b3d s PHE 278 Cb 0.16 -0.40 0.16 0.00 -0.63 0.00 0.00 43.02 42.31 3b3d s PHE 278 CO -0.19 -0.18 0.34 -0.51 -0.05 0.00 0.00 175.22 174.64 3b3d s ASP 279 N -2.26 1.57 0.00 1.98 1.01 -1.26 -5.11 116.67 112.60 3b3d s ASP 279 Ca -0.01 -2.07 0.00 0.00 0.71 0.00 0.00 52.55 51.18 3b3d s ASP 279 Cb -0.02 0.17 0.00 0.00 1.01 0.00 0.00 42.92 44.08 3b3d s ASP 279 CO -0.03 -0.24 0.00 2.22 0.21 0.00 0.00 175.17 177.32