#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nuf n MET 3 N 0.00 1.26 0.15 1.64 0.00 -1.26 -4.53 117.12 114.39 2nuf n MET 3 Ca 0.00 -0.01 0.13 0.00 -0.00 0.00 0.00 57.70 57.82 2nuf n MET 3 Cb 0.00 -1.04 0.44 0.00 0.00 0.00 0.00 33.22 32.63 2nuf n MET 3 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 175.97 177.34 2nuf h LEU 4 N 0.00 0.00 -0.88 -0.89 8.10 -1.99 -1.07 115.31 118.58 2nuf h LEU 4 Ca -0.01 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.92 2nuf h LEU 4 Cb 0.40 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.62 2nuf h LEU 4 CO 0.00 0.00 -0.26 1.05 -4.11 0.00 0.00 178.44 175.12 2nuf h GLU 5 N 0.00 0.00 -0.11 0.17 4.11 -1.99 -1.14 114.58 115.62 2nuf h GLU 5 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.24 2nuf h GLU 5 Cb 0.61 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2nuf h GLU 5 CO 0.00 0.26 -0.73 0.37 0.07 0.00 0.00 179.01 178.99 2nuf h GLN 6 N 0.00 0.54 -0.19 1.06 4.15 -1.44 -2.49 115.11 116.74 2nuf h GLN 6 Ca -0.00 -0.43 -0.22 0.00 0.77 0.00 0.00 58.65 58.77 2nuf h GLN 6 Cb 0.86 0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.65 2nuf h GLN 6 CO 0.03 1.05 -0.73 1.25 -1.93 0.00 0.00 178.83 178.51 2nuf h LEU 7 N 0.37 0.96 -1.94 -2.39 5.85 -1.31 -2.99 115.31 113.87 2nuf h LEU 7 Ca -0.03 -0.60 -0.02 0.00 0.84 0.00 0.00 57.88 58.07 2nuf h LEU 7 Cb 1.31 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 2nuf h LEU 7 CO 0.13 1.41 -0.07 -0.33 -0.34 0.00 0.00 178.44 179.24 2nuf h GLU 8 N 0.58 0.00 -0.15 1.25 5.08 -1.19 -0.80 114.58 119.35 2nuf h GLU 8 Ca -0.04 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.14 2nuf h GLU 8 Cb 1.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 2nuf h GLU 8 CO 0.15 0.07 -0.64 -0.22 -1.00 0.00 0.00 179.01 177.37 2nuf h LYS 9 N 0.00 0.56 -0.08 2.33 3.64 -1.31 0.20 116.57 121.91 2nuf h LYS 9 Ca -0.00 -0.40 -0.01 0.00 -1.27 0.00 0.00 60.65 58.97 2nuf h LYS 9 Cb 0.14 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2nuf h LYS 9 CO 0.01 1.02 0.01 0.87 -2.27 0.00 0.00 179.45 179.09 2nuf h LYS 10 N 0.41 0.13 -0.27 1.90 1.57 -1.06 -2.95 116.57 116.30 2nuf h LYS 10 Ca -0.01 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 2nuf h LYS 10 Cb 1.21 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 2nuf h LYS 10 CO 0.12 0.37 -0.17 -0.07 -0.57 0.00 0.00 179.45 179.13 2nuf h LEU 11 N -0.13 0.46 -0.86 2.94 3.38 -1.24 -3.47 115.31 116.39 2nuf h LEU 11 Ca 0.02 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2nuf h LEU 11 Cb 0.31 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2nuf h LEU 11 CO 0.00 0.65 0.00 0.61 0.09 0.00 0.00 178.44 179.79 2nuf n GLY 12 N -0.56 0.96 3.59 0.83 0.00 0.00 -5.00 105.19 105.01 2nuf n GLY 12 Ca 0.00 -0.60 -0.14 0.00 0.00 0.00 0.00 46.02 45.28 2nuf n GLY 12 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2nuf s TYR 13 N -2.86 -0.74 -0.11 1.61 5.04 -0.87 -5.05 117.35 114.36 2nuf s TYR 13 Ca 0.00 1.77 0.00 0.00 -2.44 0.00 0.00 57.07 56.40 2nuf s TYR 13 Cb 0.00 0.27 -0.02 0.00 0.35 0.00 0.00 41.96 42.56 2nuf s TYR 13 CO 0.00 -0.38 -0.11 0.99 -1.34 0.00 0.00 175.55 174.71 2nuf s THR 14 N 0.22 3.27 0.56 4.34 2.01 -1.26 -4.56 115.64 120.22 2nuf s THR 14 Ca -0.01 -0.60 -0.14 0.00 0.31 0.00 0.00 61.69 61.25 2nuf s THR 14 Cb -0.04 -2.36 -0.06 0.00 0.01 0.00 0.00 72.50 70.04 2nuf s THR 14 CO 0.02 0.54 1.00 -0.36 -0.69 0.00 0.00 174.62 175.13 2nuf s PHE 15 N 0.03 3.54 -0.20 4.92 0.40 -1.26 -4.95 117.98 120.47 2nuf s PHE 15 Ca -0.03 1.37 0.16 0.00 -0.60 0.00 0.00 56.93 57.82 2nuf s PHE 15 Cb -0.14 -2.75 -0.24 0.00 0.51 0.00 0.00 43.02 40.40 2nuf s PHE 15 CO 0.04 -0.52 0.07 1.17 0.70 0.00 0.00 175.22 176.68 2nuf n LYS 16 N -2.16 0.68 -3.85 0.44 4.81 -1.26 -4.66 118.16 112.16 2nuf n LYS 16 Ca 0.06 0.03 -0.32 0.00 -0.87 0.00 0.00 58.31 57.21 2nuf n LYS 16 Cb 0.54 -1.54 -0.12 0.00 0.02 0.00 0.00 35.03 33.94 2nuf n LYS 16 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2nuf s ASP 17 N -5.66 4.83 0.47 3.14 -1.08 -1.26 -4.96 116.67 112.15 2nuf s ASP 17 Ca -0.13 -3.22 0.17 0.00 -0.52 0.00 0.00 52.55 48.86 2nuf s ASP 17 Cb 0.06 -1.72 1.17 0.00 -1.46 0.00 0.00 42.92 40.97 2nuf s ASP 17 CO 0.80 -0.23 2.01 0.11 0.52 0.00 0.00 175.17 178.38 2nuf h LYS 18 N 6.36 0.23 0.00 4.34 1.79 -2.00 -1.24 116.57 126.05 2nuf h LYS 18 Ca 0.01 -0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 2nuf h LYS 18 Cb 0.87 -0.05 -0.00 0.00 -1.58 0.00 0.00 32.23 31.47 2nuf h LYS 18 CO 0.72 0.15 -0.06 0.66 -1.08 0.00 0.00 179.45 179.83 2nuf h SER 19 N 0.23 0.00 -0.10 0.86 4.64 -1.99 -0.80 113.55 116.40 2nuf h SER 19 Ca 0.22 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.33 2nuf h SER 19 Cb 0.57 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.68 2nuf h SER 19 CO -0.04 0.06 -0.76 0.25 -0.87 0.00 0.00 176.83 175.47 2nuf h LEU 20 N 0.00 0.84 -0.93 5.97 5.85 -1.65 -1.61 115.31 123.78 2nuf h LEU 20 Ca -0.00 -0.66 -0.04 0.00 0.84 0.00 0.00 57.88 58.01 2nuf h LEU 20 Cb 0.35 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2nuf h LEU 20 CO 0.01 1.38 0.27 0.25 -0.34 0.00 0.00 178.44 180.00 2nuf h LEU 21 N 0.38 0.96 -1.15 2.25 5.85 -1.30 -1.51 115.31 120.79 2nuf h LEU 21 Ca -0.07 -0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.43 2nuf h LEU 21 Cb 1.40 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 2nuf h LEU 21 CO 0.15 0.86 -0.27 -0.33 -0.34 0.00 0.00 178.44 178.52 2nuf h GLU 22 N 1.02 0.26 -0.21 1.25 5.08 -1.07 -2.82 114.58 118.08 2nuf h GLU 22 Ca 0.23 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 2nuf h GLU 22 Cb 0.21 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2nuf h GLU 22 CO -0.02 0.51 0.10 -0.22 -1.00 0.00 0.00 179.01 178.39 2nuf h LYS 23 N 0.23 0.31 -0.01 2.33 3.64 -0.27 -2.00 116.57 120.80 2nuf h LYS 23 Ca 0.04 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2nuf h LYS 23 Cb 0.61 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2nuf h LYS 23 CO 0.04 0.33 0.01 0.00 -2.27 0.00 0.00 179.45 177.56 2nuf h ALA 24 N 0.96 1.60 -0.00 5.00 0.00 -1.18 -2.05 119.26 123.60 2nuf h ALA 24 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2nuf h ALA 24 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2nuf h ALA 24 CO -0.01 -0.02 -0.66 1.28 0.00 0.00 0.00 179.25 179.84 2nuf n LEU 25 N -3.93 0.73 -4.66 0.00 4.77 -0.95 -4.65 117.00 108.32 2nuf n LEU 25 Ca -0.03 -0.20 -0.38 0.00 -0.03 0.00 0.00 56.01 55.37 2nuf n LEU 25 Cb 0.10 -0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 40.95 2nuf n LEU 25 CO 0.28 0.18 0.03 -0.89 -1.33 0.00 0.00 177.39 175.66 2nuf s THR 26 N -2.96 5.23 0.47 -5.08 2.01 -0.78 -1.42 115.64 113.10 2nuf s THR 26 Ca 0.11 0.57 -0.12 0.00 0.31 0.00 0.00 61.69 62.56 2nuf s THR 26 Cb 0.17 -3.67 -0.06 0.00 0.01 0.00 0.00 72.50 68.94 2nuf s THR 26 CO 0.75 0.25 0.86 -2.28 -0.69 0.00 0.00 174.62 173.51 2nuf s HIS 27 N 1.40 3.49 0.23 4.92 2.46 -0.91 -1.13 115.29 125.75 2nuf s HIS 27 Ca 0.16 1.16 -0.07 0.00 0.47 0.00 0.00 55.06 56.78 2nuf s HIS 27 Cb -0.15 -2.55 0.37 0.00 -0.13 0.00 0.00 32.58 30.12 2nuf s HIS 27 CO 0.08 -0.26 1.71 -0.24 -2.47 0.00 0.00 174.74 173.55 2nuf h VAL 28 N 0.79 0.62 -0.60 0.89 3.04 -1.90 -2.18 116.25 116.91 2nuf h VAL 28 Ca -0.47 -0.11 0.04 0.00 -1.01 0.00 0.00 66.70 65.15 2nuf h VAL 28 Cb 1.19 0.28 -0.03 0.00 -2.01 0.00 0.00 31.29 30.71 2nuf h VAL 28 CO 0.63 0.06 0.40 0.77 -1.01 0.00 0.00 177.57 178.41 2nuf h SER 29 N 0.31 0.60 0.72 3.17 4.64 -1.93 -2.13 113.55 118.93 2nuf h SER 29 Ca 0.36 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.55 2nuf h SER 29 Cb 0.56 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 2nuf h SER 29 CO -0.42 0.41 -0.60 0.22 -0.87 0.00 0.00 176.83 175.56 2nuf h TYR 30 N 0.69 0.00 -1.96 4.77 5.03 -1.66 -3.43 116.97 120.40 2nuf h TYR 30 Ca 0.24 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.56 2nuf h TYR 30 Cb 0.11 0.00 -0.23 0.00 1.55 0.00 0.00 36.73 38.15 2nuf h TYR 30 CO -0.00 0.60 -0.26 0.45 -1.32 0.00 0.00 178.16 177.64 2nuf s SER 31 N -6.75 -0.80 0.43 -2.11 0.15 -0.81 -4.94 113.70 98.88 2nuf s SER 31 Ca -0.01 1.16 0.23 0.00 0.70 0.00 0.00 55.95 58.03 2nuf s SER 31 Cb 0.12 1.89 0.78 0.00 -1.71 0.00 0.00 66.02 67.10 2nuf s SER 31 CO 0.75 -0.24 1.76 0.07 1.20 0.00 0.00 173.24 176.79 2nuf h LYS 32 N 8.07 0.00 0.00 5.44 2.10 -1.84 -3.37 116.57 126.98 2nuf h LYS 32 Ca -0.18 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.23 2nuf h LYS 32 Cb 1.12 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.41 2nuf h LYS 32 CO 0.15 0.23 -1.31 1.63 -2.00 0.00 0.00 179.45 178.14 2nuf n LYS 33 N -3.31 0.57 -3.91 0.07 4.76 -1.26 -4.80 118.16 110.28 2nuf n LYS 33 Ca 0.01 0.56 -0.31 0.00 -2.87 0.00 0.00 58.31 55.70 2nuf n LYS 33 Cb 0.47 -1.74 -0.13 0.00 -1.84 0.00 0.00 35.03 31.79 2nuf n LYS 33 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2nuf s GLU 34 N -2.37 2.13 0.41 1.97 0.41 -1.26 -5.07 118.70 114.92 2nuf s GLU 34 Ca -0.29 -2.70 0.04 0.00 -0.41 0.00 0.00 54.97 51.61 2nuf s GLU 34 Cb 0.06 -3.40 -0.02 0.00 -1.78 0.00 0.00 34.13 28.99 2nuf s GLU 34 CO 0.59 -1.14 0.13 -3.38 -0.49 0.00 0.00 175.26 170.97 2nuf s HIS 35 N -0.41 1.79 -2.13 1.61 -3.43 -1.26 -4.78 115.29 106.69 2nuf s HIS 35 Ca 0.18 -1.29 0.31 0.00 -0.80 0.00 0.00 55.06 53.46 2nuf s HIS 35 Cb -0.23 -1.16 1.69 0.00 -1.43 0.00 0.00 32.58 31.45 2nuf s HIS 35 CO -0.02 -0.30 2.11 2.48 -2.00 0.00 0.00 174.74 177.01 2nuf n TYR 36 N -0.93 0.00 -0.11 0.38 0.18 -0.28 -4.47 117.16 111.93 2nuf n TYR 36 Ca -0.06 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.65 2nuf n TYR 36 Cb 0.65 -0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.61 2nuf n TYR 36 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 2nuf h GLU 37 N 0.60 -0.17 -0.40 -3.48 4.81 -1.91 -1.35 114.58 112.68 2nuf h GLU 37 Ca 0.00 0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 2nuf h GLU 37 Cb 0.13 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2nuf h GLU 37 CO 0.00 -0.12 -0.15 1.15 -0.73 0.00 0.00 179.01 179.16 2nuf h THR 38 N -0.18 1.26 -0.69 0.32 2.02 -2.01 -2.83 112.91 110.79 2nuf h THR 38 Ca 0.18 -1.21 -0.07 0.00 0.77 0.00 0.00 66.41 66.08 2nuf h THR 38 Cb 0.47 1.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.97 2nuf h THR 38 CO -0.49 0.41 0.15 -0.07 0.37 0.00 0.00 175.52 175.89 2nuf h LEU 39 N 0.66 1.07 -1.56 2.58 3.38 -1.76 -2.21 115.31 117.46 2nuf h LEU 39 Ca 0.11 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2nuf h LEU 39 Cb 0.63 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2nuf h LEU 39 CO 0.04 1.04 0.07 -0.08 0.09 0.00 0.00 178.44 179.60 2nuf h GLU 40 N 1.05 0.36 0.41 1.13 4.22 -1.08 0.82 114.58 121.49 2nuf h GLU 40 Ca 0.21 -0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.59 2nuf h GLU 40 Cb 0.40 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2nuf h GLU 40 CO 0.01 0.33 -0.20 0.35 -2.18 0.00 0.00 179.01 177.31 2nuf h PHE 41 N 0.36 -0.51 -0.54 0.92 3.57 -1.17 -0.66 116.94 118.90 2nuf h PHE 41 Ca 0.09 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.49 2nuf h PHE 41 Cb 0.13 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 2nuf h PHE 41 CO 0.00 -0.31 -0.01 1.25 -2.23 0.00 0.00 178.31 177.01 2nuf h LEU 42 N -0.57 0.94 -1.59 0.59 5.85 -1.05 -2.95 115.31 116.53 2nuf h LEU 42 Ca -0.06 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.35 2nuf h LEU 42 Cb 0.43 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 2nuf h LEU 42 CO 0.09 1.03 0.27 1.23 -0.34 0.00 0.00 178.44 180.72 2nuf h GLY 43 N 0.83 0.58 0.62 3.75 0.00 0.77 -2.23 103.07 107.40 2nuf h GLY 43 Ca 0.15 -0.22 0.06 0.00 0.00 0.00 0.00 47.33 47.32 2nuf h GLY 43 CO 0.03 0.21 0.27 -1.80 0.00 0.00 0.00 176.54 175.26 2nuf h ASP 44 N 0.56 0.36 -0.06 0.19 1.82 -0.93 -1.45 116.42 116.91 2nuf h ASP 44 Ca 0.15 0.04 -0.03 0.00 -0.39 0.00 0.00 57.03 56.81 2nuf h ASP 44 Cb -0.06 -0.02 -0.00 0.00 0.68 0.00 0.00 39.33 39.93 2nuf h ASP 44 CO -0.03 0.24 -0.06 0.00 -1.61 0.00 0.00 179.24 177.78 2nuf h ALA 45 N 1.33 0.09 -0.08 -0.78 0.00 -1.48 -1.81 119.26 116.52 2nuf h ALA 45 Ca 0.26 -0.28 0.04 0.00 0.00 0.00 0.00 54.91 54.94 2nuf h ALA 45 Cb 0.22 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.93 2nuf h ALA 45 CO -0.21 -0.11 -0.30 1.25 0.00 0.00 0.00 179.25 179.88 2nuf h LEU 46 N -0.29 -0.93 -0.59 0.00 5.85 -1.21 -0.98 115.31 117.15 2nuf h LEU 46 Ca 0.01 0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.78 2nuf h LEU 46 Cb 0.57 0.39 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 2nuf h LEU 46 CO 0.02 -0.35 0.05 0.58 -0.34 0.00 0.00 178.44 178.39 2nuf h VAL 47 N -0.41 1.26 -0.45 1.05 2.07 -1.34 -1.62 116.25 116.81 2nuf h VAL 47 Ca 0.08 -1.07 0.09 0.00 0.82 0.00 0.00 66.70 66.62 2nuf h VAL 47 Cb 0.53 0.79 -0.08 0.00 -1.52 0.00 0.00 31.29 31.02 2nuf h VAL 47 CO -0.31 0.39 -0.01 -1.13 0.02 0.00 0.00 177.57 176.53 2nuf h ASN 48 N 0.91 -0.21 -0.86 0.57 -1.24 -1.01 0.56 115.58 114.30 2nuf h ASN 48 Ca 0.17 0.11 0.02 0.00 0.71 0.00 0.00 56.30 57.31 2nuf h ASN 48 Cb 0.49 0.20 -0.05 0.00 0.73 0.00 0.00 38.32 39.69 2nuf h ASN 48 CO 0.02 -0.07 0.57 0.15 -1.29 0.00 0.00 177.43 176.81 2nuf h PHE 49 N 0.10 1.06 -0.35 0.67 3.57 -0.74 -0.15 116.94 121.11 2nuf h PHE 49 Ca 0.23 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.69 2nuf h PHE 49 Cb 0.33 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 2nuf h PHE 49 CO -0.30 0.65 -0.02 0.74 -2.23 0.00 0.00 178.31 177.14 2nuf h PHE 50 N 1.13 0.69 -0.16 0.41 0.04 -0.02 -1.79 116.94 117.23 2nuf h PHE 50 Ca 0.33 -0.13 -0.03 0.00 2.80 0.00 0.00 57.97 60.94 2nuf h PHE 50 Cb -0.06 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 37.91 2nuf h PHE 50 CO -0.00 0.75 -0.00 0.82 -0.60 0.00 0.00 178.31 179.28 2nuf h ILE 51 N 0.43 1.26 -0.38 -0.55 1.08 -0.75 -2.98 117.51 115.61 2nuf h ILE 51 Ca 0.09 -0.86 0.04 0.00 -0.39 0.00 0.00 64.86 63.74 2nuf h ILE 51 Cb 0.49 1.50 -0.04 0.00 -3.07 0.00 0.00 36.82 35.71 2nuf h ILE 51 CO 0.02 0.26 0.17 0.58 -0.69 0.00 0.00 178.15 178.48 2nuf h VAL 52 N 0.03 0.94 -0.73 1.67 2.07 -1.01 0.47 116.25 119.69 2nuf h VAL 52 Ca 0.05 -0.12 0.12 0.00 0.82 0.00 0.00 66.70 67.56 2nuf h VAL 52 Cb 0.39 0.56 -0.08 0.00 -1.52 0.00 0.00 31.29 30.63 2nuf h VAL 52 CO 0.01 0.06 0.33 -0.78 0.02 0.00 0.00 177.57 177.21 2nuf h ASP 53 N 0.35 0.38 -0.11 0.57 1.82 -1.27 -1.25 116.42 116.89 2nuf h ASP 53 Ca 0.17 0.08 -0.04 0.00 -0.39 0.00 0.00 57.03 56.86 2nuf h ASP 53 Cb 0.11 0.03 -0.00 0.00 0.68 0.00 0.00 39.33 40.15 2nuf h ASP 53 CO -0.14 0.19 -0.08 -0.07 -1.61 0.00 0.00 179.24 177.53 2nuf h LEU 54 N 0.53 0.26 -0.68 2.28 3.38 -1.25 -3.13 115.31 116.71 2nuf h LEU 54 Ca 0.38 -0.44 0.14 0.00 0.09 0.00 0.00 57.88 58.05 2nuf h LEU 54 Cb 0.49 -0.07 -0.10 0.00 0.09 0.00 0.00 40.66 41.07 2nuf h LEU 54 CO -0.33 0.65 0.11 0.25 0.09 0.00 0.00 178.44 179.21 2nuf h LEU 55 N -0.12 -0.08 -1.25 1.67 6.46 -0.21 -0.07 115.31 121.71 2nuf h LEU 55 Ca 0.02 0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 57.91 2nuf h LEU 55 Cb 0.56 0.21 -0.00 0.00 -0.73 0.00 0.00 40.66 40.70 2nuf h LEU 55 CO 0.02 -0.05 -0.07 -0.37 -0.62 0.00 0.00 178.44 177.35 2nuf h VAL 56 N 0.22 0.17 0.13 1.05 -1.51 -1.28 0.14 116.25 115.17 2nuf h VAL 56 Ca 0.37 -0.73 -0.35 0.00 -1.23 0.00 0.00 66.70 64.76 2nuf h VAL 56 Cb 0.61 1.62 -0.01 0.00 -2.13 0.00 0.00 31.29 31.38 2nuf h VAL 56 CO -0.50 0.07 -1.84 1.56 -1.23 0.00 0.00 177.57 175.63 2nuf h GLN 57 N 0.00 0.27 0.00 5.19 4.20 -1.03 -3.41 115.11 120.33 2nuf h GLN 57 Ca -0.00 -0.46 0.00 0.00 0.06 0.00 0.00 58.65 58.25 2nuf h GLN 57 Cb 0.62 0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.57 2nuf h GLN 57 CO 0.01 1.15 -0.86 0.66 -0.67 0.00 0.00 178.83 179.11 2nuf n TYR 58 N -3.46 0.00 -1.70 2.96 4.02 -0.21 -4.99 117.16 113.78 2nuf n TYR 58 Ca -0.26 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.19 2nuf n TYR 58 Cb 1.06 -0.06 -0.03 0.00 -0.02 0.00 0.00 39.34 40.28 2nuf n TYR 58 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2nuf n SER 59 N -1.46 3.55 -0.26 7.72 2.88 0.49 -4.86 113.62 121.67 2nuf n SER 59 Ca 0.02 1.09 -0.07 0.00 -1.33 0.00 0.00 58.87 58.58 2nuf n SER 59 Cb 0.25 -1.51 0.05 0.00 -0.75 0.00 0.00 64.21 62.25 2nuf n SER 59 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2nuf h PRO 60 N 5.89 1.12 -5.75 -1.46 0.13 -1.89 -3.41 132.00 126.63 2nuf h PRO 60 Ca -0.45 -0.24 -0.67 0.00 -0.87 0.00 0.00 66.00 63.78 2nuf h PRO 60 Cb 1.23 -0.16 -0.22 0.00 0.13 0.00 0.00 31.00 31.97 2nuf h PRO 60 CO 0.89 0.95 -0.72 1.21 -0.23 0.00 0.00 178.00 180.10 2nuf s ASN 61 N -6.36 4.43 -0.25 1.44 3.84 -1.26 -5.03 114.94 111.75 2nuf s ASN 61 Ca -0.12 -0.15 0.11 0.00 0.21 0.00 0.00 52.86 52.91 2nuf s ASN 61 Cb 0.15 -1.39 0.49 0.00 -0.55 0.00 0.00 41.25 39.95 2nuf s ASN 61 CO 0.84 0.26 1.41 0.29 -2.79 0.00 0.00 177.10 177.11 2nuf n LYS 62 N 2.89 2.00 -2.83 0.43 5.02 -1.26 -4.70 118.16 119.72 2nuf n LYS 62 Ca -0.18 -3.08 -0.39 0.00 -2.02 0.00 0.00 58.31 52.65 2nuf n LYS 62 Cb 0.53 -1.78 -0.06 0.00 -0.02 0.00 0.00 35.03 33.69 2nuf n LYS 62 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2nuf s ARG 63 N -3.13 4.67 0.41 1.97 0.52 -1.26 -4.91 118.95 117.22 2nuf s ARG 63 Ca 0.43 1.33 0.09 0.00 -0.52 0.00 0.00 55.73 57.06 2nuf s ARG 63 Cb 0.38 -3.08 0.89 0.00 0.52 0.00 0.00 34.95 33.66 2nuf s ARG 63 CO 0.01 0.44 2.01 1.05 0.02 0.00 0.00 175.30 178.83 2nuf h GLU 64 N 3.78 0.54 0.00 3.54 4.11 -1.98 0.04 114.58 124.62 2nuf h GLU 64 Ca -0.46 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2nuf h GLU 64 Cb 1.20 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2nuf h GLU 64 CO 0.66 0.36 0.00 0.78 0.07 0.00 0.00 179.01 180.88 2nuf h GLY 65 N 0.56 0.00 0.15 1.06 0.00 -2.01 -1.94 103.07 100.89 2nuf h GLY 65 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 47.18 2nuf h GLY 65 CO -0.07 0.00 -2.32 0.33 0.00 0.00 0.00 176.54 174.49 2nuf n PHE 66 N -3.07 0.35 0.10 5.60 -0.00 -0.36 -4.25 117.46 115.83 2nuf n PHE 66 Ca -0.00 0.09 -0.01 0.00 -0.00 0.00 0.00 57.45 57.52 2nuf n PHE 66 Cb 0.25 -1.04 0.27 0.00 -0.00 0.00 0.00 39.48 38.95 2nuf n PHE 66 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 2nuf h LEU 67 N -0.15 0.24 0.14 -2.13 3.38 -1.01 -2.67 115.31 113.11 2nuf h LEU 67 Ca -0.55 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.33 2nuf h LEU 67 Cb 1.87 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.56 2nuf h LEU 67 CO -0.09 0.57 -0.07 0.28 0.09 0.00 0.00 178.44 179.22 2nuf h SER 68 N 0.21 -0.16 -0.09 -0.43 0.02 -1.57 0.21 113.55 111.74 2nuf h SER 68 Ca 0.03 -0.32 0.03 0.00 -0.84 0.00 0.00 61.79 60.69 2nuf h SER 68 Cb 0.70 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 63.25 2nuf h SER 68 CO 0.05 0.26 -0.09 -0.65 -1.14 0.00 0.00 176.83 175.26 2nuf h PRO 69 N -0.61 -0.11 -0.47 3.45 0.11 -1.73 0.36 132.00 132.99 2nuf h PRO 69 Ca -0.02 0.01 0.03 0.00 0.11 0.00 0.00 66.00 66.13 2nuf h PRO 69 Cb 0.47 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.57 2nuf h PRO 69 CO 0.03 -0.08 0.27 1.25 -0.21 0.00 0.00 178.00 179.26 2nuf h LEU 70 N -0.12 0.42 -1.46 2.35 5.85 -1.52 -0.39 115.31 120.44 2nuf h LEU 70 Ca 0.07 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2nuf h LEU 70 Cb 0.22 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2nuf h LEU 70 CO -0.16 0.30 0.18 0.50 -0.34 0.00 0.00 178.44 178.91 2nuf h LYS 71 N 0.53 0.54 -0.81 1.25 3.64 -0.57 -0.52 116.57 120.63 2nuf h LYS 71 Ca 0.20 -0.06 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 2nuf h LYS 71 Cb 0.05 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.71 2nuf h LYS 71 CO -0.11 0.43 0.51 0.00 -2.27 0.00 0.00 179.45 178.01 2nuf h ALA 72 N 1.66 1.07 0.05 5.00 0.00 0.73 -2.79 119.26 124.99 2nuf h ALA 72 Ca 0.14 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2nuf h ALA 72 Cb 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2nuf h ALA 72 CO -0.02 0.32 -0.02 -0.92 0.00 0.00 0.00 179.25 178.60 2nuf h TYR 73 N 0.99 -0.06 0.00 0.00 3.20 -0.45 -3.14 116.97 117.51 2nuf h TYR 73 Ca 0.33 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.20 2nuf h TYR 73 Cb 0.04 0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.33 2nuf h TYR 73 CO -0.03 0.53 0.10 -0.07 -1.64 0.00 0.00 178.16 177.05 2nuf h LEU 74 N -0.73 0.00 -2.95 2.82 3.38 -1.04 -0.44 115.31 116.36 2nuf h LEU 74 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2nuf h LEU 74 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2nuf h LEU 74 CO 0.01 0.00 0.00 2.30 0.09 0.00 0.00 178.44 180.84 2nuf n ILE 75 N -2.64 1.08 -2.54 1.22 -5.35 -1.06 -4.83 119.36 105.24 2nuf n ILE 75 Ca -0.02 -1.08 -0.31 0.00 -0.27 0.00 0.00 62.75 61.07 2nuf n ILE 75 Cb 0.15 0.44 -0.03 0.00 -1.74 0.00 0.00 39.64 38.46 2nuf n ILE 75 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2nuf s SER 76 N -1.10 6.53 0.21 7.28 1.04 -0.17 -4.89 113.70 122.59 2nuf s SER 76 Ca 0.15 1.35 -0.14 0.00 0.48 0.00 0.00 55.95 57.79 2nuf s SER 76 Cb 0.09 -2.42 0.25 0.00 0.10 0.00 0.00 66.02 64.04 2nuf s SER 76 CO 0.09 -0.54 1.62 -0.08 0.98 0.00 0.00 173.24 175.30 2nuf h GLU 77 N 0.90 -0.02 -0.80 4.02 4.81 -1.92 0.12 114.58 121.70 2nuf h GLU 77 Ca -0.47 0.00 0.19 0.00 -0.13 0.00 0.00 59.36 58.96 2nuf h GLU 77 Cb 1.19 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 30.44 2nuf h GLU 77 CO 0.62 -0.01 0.17 1.49 -0.73 0.00 0.00 179.01 180.55 2nuf h GLU 78 N -0.02 0.21 0.00 1.92 4.81 -1.91 -0.54 114.58 119.05 2nuf h GLU 78 Ca 0.31 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.35 2nuf h GLU 78 Cb 0.50 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 2nuf h GLU 78 CO -0.69 0.14 -0.83 0.35 -0.73 0.00 0.00 179.01 177.25 2nuf h PHE 79 N 0.22 0.05 -0.01 0.92 3.57 -1.03 -3.14 116.94 117.51 2nuf h PHE 79 Ca 0.47 -0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.80 2nuf h PHE 79 Cb 0.88 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.59 2nuf h PHE 79 CO -0.29 0.85 -0.65 0.74 -2.23 0.00 0.00 178.31 176.72 2nuf h PHE 80 N 0.02 0.06 -0.44 0.41 0.04 0.00 -2.13 116.94 114.90 2nuf h PHE 80 Ca -0.01 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.64 2nuf h PHE 80 Cb 1.46 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.58 2nuf h PHE 80 CO 0.00 0.68 -0.09 -0.91 -0.60 0.00 0.00 178.31 177.40 2nuf h ASN 81 N 0.03 0.75 -0.29 2.17 2.35 -1.18 0.36 115.58 119.77 2nuf h ASN 81 Ca -0.01 -0.21 -0.10 0.00 -0.55 0.00 0.00 56.30 55.43 2nuf h ASN 81 Cb 1.16 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.32 2nuf h ASN 81 CO 0.09 0.87 -0.19 -0.07 -1.65 0.00 0.00 177.43 176.48 2nuf h LEU 82 N 0.70 0.68 -0.84 1.61 3.38 -1.46 -2.66 115.31 116.73 2nuf h LEU 82 Ca 0.12 -0.43 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 2nuf h LEU 82 Cb 0.55 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2nuf h LEU 82 CO 0.03 0.96 -0.37 -0.07 0.09 0.00 0.00 178.44 179.08 2nuf h LEU 83 N 0.40 0.43 -0.74 1.67 3.38 -1.16 -3.04 115.31 116.25 2nuf h LEU 83 Ca 0.06 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2nuf h LEU 83 Cb 0.73 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2nuf h LEU 83 CO 0.05 0.77 0.00 0.00 0.09 0.00 0.00 178.44 179.35 2nuf h ALA 84 N 1.25 1.00 -0.83 1.53 0.00 -0.19 -3.22 119.26 118.81 2nuf h ALA 84 Ca 0.04 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2nuf h ALA 84 Cb 0.82 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 2nuf h ALA 84 CO 0.07 0.00 0.51 1.96 0.00 0.00 0.00 179.25 181.79 2nuf h GLN 85 N 0.00 0.90 -0.09 0.00 4.20 -1.35 -1.04 115.11 117.73 2nuf h GLN 85 Ca 0.00 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.68 2nuf h GLN 85 Cb 0.47 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 2nuf h GLN 85 CO 0.00 0.59 0.21 -0.22 -0.67 0.00 0.00 178.83 178.74 2nuf h LYS 86 N 0.93 0.00 0.00 1.46 3.64 -1.77 -2.23 116.57 118.60 2nuf h LYS 86 Ca 0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 2nuf h LYS 86 Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2nuf h LYS 86 CO -0.18 0.00 -0.92 1.28 -2.27 0.00 0.00 179.45 177.36 2nuf n LEU 87 N -3.31 0.79 -3.81 5.20 4.77 -0.40 -5.01 117.00 115.23 2nuf n LEU 87 Ca -0.00 -0.31 -0.26 0.00 -0.03 0.00 0.00 56.01 55.41 2nuf n LEU 87 Cb 0.29 -0.07 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 2nuf n LEU 87 CO 0.21 0.19 -0.15 -0.62 -1.33 0.00 0.00 177.39 175.69 2nuf n GLU 88 N -1.58 -3.19 0.25 3.23 1.02 -0.84 -4.88 120.64 114.65 2nuf n GLU 88 Ca 0.04 0.48 0.09 0.00 -0.02 0.00 0.00 57.16 57.75 2nuf n GLU 88 Cb 0.35 -4.61 0.63 0.00 -0.02 0.00 0.00 31.44 27.79 2nuf n GLU 88 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2nuf h LEU 89 N -1.85 0.00 -1.98 -4.62 3.38 -1.86 -2.95 115.31 105.43 2nuf h LEU 89 Ca -0.63 0.00 0.20 0.00 0.09 0.00 0.00 57.88 57.54 2nuf h LEU 89 Cb 1.37 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.09 2nuf h LEU 89 CO 0.57 0.15 0.54 1.12 0.09 0.00 0.00 178.44 180.91 2nuf h HIS 90 N 0.00 0.00 -0.30 1.13 2.07 -1.94 0.79 115.15 116.90 2nuf h HIS 90 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2nuf h HIS 90 Cb 0.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.29 2nuf h HIS 90 CO 0.00 0.00 0.00 0.36 -3.07 0.00 0.00 177.93 175.22 2nuf n LYS 91 N -4.14 1.97 0.00 5.12 2.85 -1.11 -4.11 118.16 118.73 2nuf n LYS 91 Ca 0.14 -1.48 0.00 0.00 -1.05 0.00 0.00 58.31 55.92 2nuf n LYS 91 Cb 0.80 -1.40 0.00 0.00 -0.65 0.00 0.00 35.03 33.78 2nuf n LYS 91 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2nuf n PHE 92 N 0.69 0.00 -2.06 5.58 3.72 0.18 -5.05 117.46 120.52 2nuf n PHE 92 Ca 0.16 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.15 2nuf n PHE 92 Cb 0.39 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.91 2nuf n PHE 92 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2nuf s ILE 93 N -1.84 2.70 -0.35 4.37 1.01 -0.63 -4.93 121.20 121.52 2nuf s ILE 93 Ca 0.00 0.64 -0.10 0.00 0.00 0.00 0.00 60.65 61.19 2nuf s ILE 93 Cb 0.00 -3.41 0.02 0.00 0.01 0.00 0.00 42.46 39.08 2nuf s ILE 93 CO 0.00 0.13 0.18 -0.13 0.00 0.00 0.00 174.94 175.12 2nuf s ARG 94 N -1.10 2.96 -0.00 2.79 0.52 -0.51 -5.02 118.95 118.59 2nuf s ARG 94 Ca 0.54 -0.98 0.02 0.00 -0.52 0.00 0.00 55.73 54.79 2nuf s ARG 94 Cb -0.41 -3.66 -0.01 0.00 0.52 0.00 0.00 34.95 31.39 2nuf s ARG 94 CO 0.48 -0.61 -0.07 -1.50 0.02 0.00 0.00 175.30 173.62 2nuf s ILE 95 N 1.56 0.54 -0.29 1.52 1.10 -1.26 -2.14 121.20 122.23 2nuf s ILE 95 Ca 0.03 -0.34 -0.08 0.00 -0.51 0.00 0.00 60.65 59.74 2nuf s ILE 95 Cb -0.19 -0.47 -0.01 0.00 0.15 0.00 0.00 42.46 41.95 2nuf s ILE 95 CO 0.06 0.12 0.12 -0.75 -2.11 0.00 0.00 174.94 172.38 2nuf s LYS 96 N -0.25 3.35 -0.62 3.50 2.47 -1.26 -4.55 119.74 122.38 2nuf s LYS 96 Ca 0.02 -0.70 0.00 0.00 -1.56 0.00 0.00 55.97 53.73 2nuf s LYS 96 Cb -0.03 -3.47 0.00 0.00 -1.46 0.00 0.00 37.83 32.87 2nuf s LYS 96 CO -0.00 -0.37 0.00 0.54 0.16 0.00 0.00 175.35 175.68 2nuf n ARG 97 N 4.94 -1.47 -2.72 4.03 1.74 -1.26 -4.71 116.66 117.20 2nuf n ARG 97 Ca -0.14 0.42 -0.22 0.00 -0.77 0.00 0.00 57.85 57.13 2nuf n ARG 97 Cb 0.49 -4.30 0.08 0.00 -1.02 0.00 0.00 32.46 27.71 2nuf n ARG 97 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2nuf s GLY 98 N -1.44 1.78 -0.21 -0.13 0.00 -1.26 -5.09 107.32 100.96 2nuf s GLY 98 Ca 0.00 -1.76 0.02 0.00 0.00 0.00 0.00 44.72 42.98 2nuf s GLY 98 CO 0.00 -1.28 -0.17 1.25 0.00 0.00 0.00 173.10 172.90 2nuf s LYS 99 N -4.92 2.74 -0.93 2.90 2.20 -1.26 -5.02 119.74 115.44 2nuf s LYS 99 Ca 0.63 -1.00 -0.27 0.00 -0.36 0.00 0.00 55.97 54.97 2nuf s LYS 99 Cb -0.07 -2.67 -0.26 0.00 -1.51 0.00 0.00 37.83 33.33 2nuf s LYS 99 CO 0.41 -0.33 2.03 -0.89 -0.36 0.00 0.00 175.35 176.22 2nuf n ILE 100 N 4.56 0.00 -1.61 5.43 5.41 -1.26 -4.90 119.36 127.00 2nuf n ILE 100 Ca -0.19 -0.01 -0.30 0.00 1.00 0.00 0.00 62.75 63.26 2nuf n ILE 100 Cb 0.47 -1.98 0.19 0.00 -0.71 0.00 0.00 39.64 37.62 2nuf n ILE 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2nuf s ASN 101 N 8.27 2.56 0.56 4.38 2.20 -1.26 -4.83 114.94 126.82 2nuf s ASN 101 Ca 0.79 0.51 0.37 0.00 -0.94 0.00 0.00 52.86 53.59 2nuf s ASN 101 Cb -0.02 -0.71 1.83 0.00 -2.00 0.00 0.00 41.25 40.34 2nuf s ASN 101 CO 0.21 -3.10 2.12 -0.33 -2.94 0.00 0.00 177.10 173.06 2nuf h GLU 102 N -1.89 0.00 0.21 3.55 4.39 -2.00 -2.34 114.58 116.50 2nuf h GLU 102 Ca -0.46 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 58.90 2nuf h GLU 102 Cb 1.27 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.94 2nuf h GLU 102 CO 0.42 0.00 -1.65 1.15 -1.16 0.00 0.00 179.01 177.76 2nuf h THR 103 N 0.00 1.04 0.45 1.13 2.02 -1.96 -2.90 112.91 112.69 2nuf h THR 103 Ca 0.00 -2.56 -0.02 0.00 0.77 0.00 0.00 66.41 64.60 2nuf h THR 103 Cb 0.21 2.85 0.00 0.00 -1.74 0.00 0.00 68.15 69.48 2nuf h THR 103 CO 0.00 0.84 -0.22 0.40 0.37 0.00 0.00 175.52 176.91 2nuf h ILE 104 N 0.10 0.55 -0.64 3.11 1.08 -1.85 -1.91 117.51 117.94 2nuf h ILE 104 Ca -0.32 -0.16 0.13 0.00 -0.39 0.00 0.00 64.86 64.13 2nuf h ILE 104 Cb 2.10 0.62 -0.10 0.00 -3.07 0.00 0.00 36.82 36.37 2nuf h ILE 104 CO 0.20 0.03 0.06 0.40 -0.69 0.00 0.00 178.15 178.16 2nuf h ILE 105 N -0.70 0.52 -0.70 -0.67 2.04 -1.57 -0.21 117.51 116.22 2nuf h ILE 105 Ca -0.06 -0.06 0.10 0.00 1.00 0.00 0.00 64.86 65.83 2nuf h ILE 105 Cb 0.52 0.33 -0.07 0.00 -0.74 0.00 0.00 36.82 36.85 2nuf h ILE 105 CO 0.10 0.03 0.34 1.23 0.00 0.00 0.00 178.15 179.85 2nuf h GLY 106 N 0.17 1.05 1.39 5.37 0.00 -1.28 0.62 103.07 110.40 2nuf h GLY 106 Ca 0.34 -0.20 -0.19 0.00 0.00 0.00 0.00 47.33 47.28 2nuf h GLY 106 CO -0.50 0.04 -0.66 -0.55 0.00 0.00 0.00 176.54 174.86 2nuf h ASP 107 N 0.57 0.71 -0.25 0.19 3.32 -0.30 -2.75 116.42 117.91 2nuf h ASP 107 Ca 0.35 -0.43 -0.10 0.00 0.02 0.00 0.00 57.03 56.88 2nuf h ASP 107 Cb 0.39 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2nuf h ASP 107 CO -0.28 1.18 -0.17 0.58 -1.72 0.00 0.00 179.24 178.84 2nuf h VAL 108 N 0.45 1.26 0.17 -1.35 2.07 -0.62 0.17 116.25 118.39 2nuf h VAL 108 Ca -0.02 -1.21 0.01 0.00 0.82 0.00 0.00 66.70 66.30 2nuf h VAL 108 Cb 1.25 1.16 -0.03 0.00 -1.52 0.00 0.00 31.29 32.14 2nuf h VAL 108 CO 0.13 0.40 -0.28 0.15 0.02 0.00 0.00 177.57 177.99 2nuf h PHE 109 N 0.61 -0.75 -0.09 1.57 3.57 -0.75 0.58 116.94 121.68 2nuf h PHE 109 Ca 0.10 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.62 2nuf h PHE 109 Cb 0.63 0.31 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2nuf h PHE 109 CO 0.03 -0.39 0.01 0.93 -2.23 0.00 0.00 178.31 176.66 2nuf h GLU 110 N -0.52 0.04 -0.41 1.11 5.08 -1.23 -2.43 114.58 116.22 2nuf h GLU 110 Ca 0.02 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2nuf h GLU 110 Cb 0.53 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 2nuf h GLU 110 CO -0.13 0.03 0.27 0.00 -1.00 0.00 0.00 179.01 178.18 2nuf h ALA 111 N 1.07 1.73 -0.92 3.43 0.00 -0.21 -2.41 119.26 121.95 2nuf h ALA 111 Ca 0.04 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2nuf h ALA 111 Cb 0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2nuf h ALA 111 CO -0.06 0.24 0.56 -0.07 0.00 0.00 0.00 179.25 179.91 2nuf h LEU 112 N 0.53 1.10 -0.42 0.00 3.38 0.65 -1.29 115.31 119.26 2nuf h LEU 112 Ca 0.16 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 2nuf h LEU 112 Cb -0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 2nuf h LEU 112 CO -0.03 0.84 -0.30 -0.50 0.09 0.00 0.00 178.44 178.54 2nuf h TRP 113 N 1.27 0.00 -0.13 1.13 4.06 -1.29 -2.09 115.95 118.89 2nuf h TRP 113 Ca 0.33 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 61.10 2nuf h TRP 113 Cb -0.06 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.11 2nuf h TRP 113 CO 0.01 0.30 -0.61 0.00 -3.56 0.00 0.00 178.44 174.58 2nuf h ALA 114 N 1.70 0.25 -0.20 1.49 0.00 -1.21 -2.58 119.26 118.71 2nuf h ALA 114 Ca -0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 2nuf h ALA 114 Cb 1.07 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2nuf h ALA 114 CO 0.04 0.51 -0.00 0.00 0.00 0.00 0.00 179.25 179.80 2nuf h ALA 115 N 0.51 1.64 -0.11 0.00 0.00 -1.06 -0.81 119.26 119.44 2nuf h ALA 115 Ca -0.04 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2nuf h ALA 115 Cb 1.25 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 2nuf h ALA 115 CO 0.13 0.27 -0.17 0.28 0.00 0.00 0.00 179.25 179.76 2nuf h VAL 116 N 0.28 1.38 0.06 0.00 2.07 -1.35 -2.26 116.25 116.42 2nuf h VAL 116 Ca 0.07 -1.41 0.02 0.00 0.82 0.00 0.00 66.70 66.19 2nuf h VAL 116 Cb 0.20 2.04 -0.05 0.00 -1.52 0.00 0.00 31.29 31.96 2nuf h VAL 116 CO 0.00 0.41 -0.53 0.22 0.02 0.00 0.00 177.57 177.69 2nuf h TYR 117 N -0.12 -1.54 0.22 1.57 3.20 -0.99 0.13 116.97 119.45 2nuf h TYR 117 Ca 0.01 0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.94 2nuf h TYR 117 Cb 0.73 0.66 -0.03 0.00 1.54 0.00 0.00 36.73 39.64 2nuf h TYR 117 CO 0.10 -0.58 -0.35 0.82 -1.64 0.00 0.00 178.16 176.51 2nuf h ILE 118 N -0.71 0.28 0.00 1.81 2.04 -1.24 0.10 117.51 119.79 2nuf h ILE 118 Ca 0.01 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.87 2nuf h ILE 118 Cb 0.74 0.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 2nuf h ILE 118 CO -0.33 0.00 -0.00 -0.78 0.00 0.00 0.00 178.15 177.04 2nuf h ASP 119 N -0.64 0.00 0.00 1.72 3.58 -1.25 0.58 116.42 120.41 2nuf h ASP 119 Ca 0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2nuf h ASP 119 Cb 0.63 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.68 2nuf h ASP 119 CO -0.14 0.00 0.00 -0.24 -2.88 0.00 0.00 179.24 175.98 2nuf n SER 120 N -3.48 0.00 0.00 2.28 2.88 0.44 -4.79 113.62 110.95 2nuf n SER 120 Ca -0.03 -1.33 0.00 0.00 -1.33 0.00 0.00 58.87 56.18 2nuf n SER 120 Cb 0.08 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 2nuf n SER 120 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2nuf n GLY 121 N 0.81 0.52 2.23 0.46 0.00 0.19 -3.73 105.19 105.66 2nuf n GLY 121 Ca 0.16 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 2nuf n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nuf n ARG 122 N -2.85 -2.49 -2.86 1.61 1.74 0.28 -5.00 116.66 107.09 2nuf n ARG 122 Ca 0.00 0.30 -0.43 0.00 -0.77 0.00 0.00 57.85 56.95 2nuf n ARG 122 Cb 0.00 -3.79 -0.04 0.00 -1.02 0.00 0.00 32.46 27.61 2nuf n ARG 122 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2nuf s ASP 123 N -3.04 6.30 0.44 0.55 -1.08 -1.23 -4.91 116.67 113.69 2nuf s ASP 123 Ca 0.18 -0.51 0.25 0.00 -0.52 0.00 0.00 52.55 51.95 2nuf s ASP 123 Cb -0.08 -2.42 0.53 0.00 -1.46 0.00 0.00 42.92 39.48 2nuf s ASP 123 CO 0.22 -1.25 1.68 0.00 0.52 0.00 0.00 175.17 176.34 2nuf h ALA 124 N 9.34 1.00 0.01 3.66 0.00 -1.94 -2.94 119.26 128.40 2nuf h ALA 124 Ca -0.27 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2nuf h ALA 124 Cb 1.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2nuf h ALA 124 CO 1.10 0.00 -0.01 -0.91 0.00 0.00 0.00 179.25 179.43 2nuf h ASN 125 N 0.00 -0.01 -0.31 0.00 2.35 -1.98 -1.71 115.58 113.92 2nuf h ASN 125 Ca 0.00 -0.77 0.04 0.00 -0.55 0.00 0.00 56.30 55.02 2nuf h ASN 125 Cb 0.91 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.24 2nuf h ASN 125 CO 0.00 0.79 0.10 0.15 -1.65 0.00 0.00 177.43 176.82 2nuf h PHE 126 N -0.85 0.18 -0.62 1.19 3.57 -2.00 0.27 116.94 118.68 2nuf h PHE 126 Ca -0.00 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 2nuf h PHE 126 Cb 0.78 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 2nuf h PHE 126 CO 0.20 0.07 0.23 1.15 -2.23 0.00 0.00 178.31 177.73 2nuf h THR 127 N 0.23 1.22 -0.12 4.41 2.02 -1.61 -0.32 112.91 118.75 2nuf h THR 127 Ca 0.14 -0.73 -0.07 0.00 0.77 0.00 0.00 66.41 66.52 2nuf h THR 127 Cb 0.12 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 2nuf h THR 127 CO -0.15 0.29 -0.26 -0.09 0.37 0.00 0.00 175.52 175.68 2nuf h ARG 128 N 0.89 0.21 -0.02 6.66 2.43 -0.66 -2.10 114.38 121.79 2nuf h ARG 128 Ca 0.21 -0.07 -0.24 0.00 -0.81 0.00 0.00 59.98 59.07 2nuf h ARG 128 Cb 0.21 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2nuf h ARG 128 CO -0.02 0.46 -0.96 0.93 -1.51 0.00 0.00 179.97 178.88 2nuf h GLU 129 N 0.19 0.56 -0.17 0.20 4.39 0.44 -1.91 114.58 118.29 2nuf h GLU 129 Ca 0.03 -0.58 0.00 0.00 0.34 0.00 0.00 59.36 59.15 2nuf h GLU 129 Cb 0.56 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 2nuf h GLU 129 CO 0.04 1.20 0.11 -0.07 -1.16 0.00 0.00 179.01 179.13 2nuf h LEU 130 N 0.33 0.20 -0.38 1.33 3.38 -0.97 0.13 115.31 119.32 2nuf h LEU 130 Ca -0.09 -0.02 0.07 0.00 0.09 0.00 0.00 57.88 57.93 2nuf h LEU 130 Cb 1.60 -0.05 -0.06 0.00 0.09 0.00 0.00 40.66 42.24 2nuf h LEU 130 CO 0.18 0.16 -0.01 0.15 0.09 0.00 0.00 178.44 179.01 2nuf h PHE 131 N 0.22 -0.03 -0.30 1.13 3.57 -1.36 -2.38 116.94 117.78 2nuf h PHE 131 Ca 0.06 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.54 2nuf h PHE 131 Cb -0.01 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 2nuf h PHE 131 CO -0.06 -0.08 0.01 1.88 -2.23 0.00 0.00 178.31 177.83 2nuf h TYR 132 N 0.10 0.56 -0.90 0.41 0.05 -0.93 0.21 116.97 116.47 2nuf h TYR 132 Ca 0.19 -0.09 0.26 0.00 0.05 0.00 0.00 58.73 59.13 2nuf h TYR 132 Cb 0.26 -0.15 -0.04 0.00 1.01 0.00 0.00 36.73 37.81 2nuf h TYR 132 CO -0.26 0.65 0.64 0.87 -1.05 0.00 0.00 178.16 179.00 2nuf h LYS 133 N 0.31 0.04 0.02 4.88 1.57 -0.37 -0.27 116.57 122.77 2nuf h LYS 133 Ca 0.09 -0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.52 2nuf h LYS 133 Cb 0.42 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.66 2nuf h LYS 133 CO 0.01 0.03 -2.10 1.28 -0.57 0.00 0.00 179.45 178.10 2nuf n LEU 134 N -4.30 1.31 0.00 2.94 4.77 -0.93 -4.78 117.00 116.01 2nuf n LEU 134 Ca 0.19 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 2nuf n LEU 134 Cb 0.94 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 2nuf n LEU 134 CO 0.38 0.61 0.14 0.49 -1.33 0.00 0.00 177.39 177.68 2nuf n PHE 135 N -3.08 0.00 -0.17 -1.77 3.72 0.71 -4.82 117.46 112.06 2nuf n PHE 135 Ca -0.30 -0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.08 2nuf n PHE 135 Cb 1.07 -0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.68 2nuf n PHE 135 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2nuf h LYS 136 N 0.00 0.33 -0.33 -1.08 3.64 -1.23 -1.27 116.57 116.62 2nuf h LYS 136 Ca 0.00 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.40 2nuf h LYS 136 Cb 0.22 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 2nuf h LYS 136 CO 0.00 0.22 0.11 1.49 -2.27 0.00 0.00 179.45 179.00 2nuf h GLU 137 N 0.34 0.24 -0.31 1.90 4.81 -1.88 0.45 114.58 120.14 2nuf h GLU 137 Ca 0.25 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 2nuf h GLU 137 Cb 0.29 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2nuf h GLU 137 CO -0.27 0.16 0.20 -0.44 -0.73 0.00 0.00 179.01 177.93 2nuf h ASP 138 N 0.25 0.34 -0.34 1.04 3.32 -1.79 -1.57 116.42 117.68 2nuf h ASP 138 Ca 0.15 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 2nuf h ASP 138 Cb 0.13 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2nuf h ASP 138 CO -0.16 0.25 0.12 0.40 -1.72 0.00 0.00 179.24 178.13 2nuf h ILE 139 N 0.41 1.20 -0.42 0.35 2.04 -0.76 -1.37 117.51 118.95 2nuf h ILE 139 Ca 0.11 -0.62 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 2nuf h ILE 139 Cb -0.04 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2nuf h ILE 139 CO -0.03 0.22 0.22 -0.07 0.00 0.00 0.00 178.15 178.48 2nuf h LEU 140 N 0.40 0.51 0.07 1.44 4.07 0.02 -1.33 115.31 120.49 2nuf h LEU 140 Ca 0.11 -0.04 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 2nuf h LEU 140 Cb 0.22 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 41.83 2nuf h LEU 140 CO -0.01 0.43 -0.03 -1.28 -1.08 0.00 0.00 178.44 176.47 2nuf h SER 141 N 0.58 -0.08 -0.57 -0.43 0.87 -0.96 -1.00 113.55 111.96 2nuf h SER 141 Ca 0.15 -0.39 0.02 0.00 -1.23 0.00 0.00 61.79 60.34 2nuf h SER 141 Cb 0.04 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 61.99 2nuf h SER 141 CO -0.02 0.36 0.38 0.00 -0.53 0.00 0.00 176.83 177.02 2nuf h ALA 142 N 0.33 1.63 -0.34 6.23 0.00 -1.04 -1.40 119.26 124.68 2nuf h ALA 142 Ca -0.01 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2nuf h ALA 142 Cb 0.47 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2nuf h ALA 142 CO 0.02 0.33 -0.24 0.82 0.00 0.00 0.00 179.25 180.17 2nuf h ILE 143 N 0.74 1.29 -0.97 0.00 2.04 -1.20 -1.20 117.51 118.21 2nuf h ILE 143 Ca 0.22 -1.39 0.05 0.00 1.00 0.00 0.00 64.86 64.74 2nuf h ILE 143 Cb -0.02 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 2nuf h ILE 143 CO -0.05 0.45 0.63 0.50 0.00 0.00 0.00 178.15 179.68 2nuf h LYS 144 N 0.53 1.14 -0.62 2.37 3.64 -0.15 -2.02 116.57 121.45 2nuf h LYS 144 Ca 0.07 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2nuf h LYS 144 Cb 0.80 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 2nuf h LYS 144 CO 0.06 0.75 0.00 -0.85 -2.27 0.00 0.00 179.45 177.15 2nuf n GLU 145 N -4.47 3.71 -1.74 1.90 0.28 -0.68 -5.01 120.64 114.62 2nuf n GLU 145 Ca 0.14 -2.87 -0.38 0.00 -0.16 0.00 0.00 57.16 53.89 2nuf n GLU 145 Cb 0.14 -1.88 0.05 0.00 1.43 0.00 0.00 31.44 31.19 2nuf n GLU 145 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2nuf n GLY 146 N 1.00 0.73 3.58 -1.84 0.00 -0.46 -5.03 105.19 103.17 2nuf n GLY 146 Ca 0.25 -0.04 -0.07 0.00 0.00 0.00 0.00 46.02 46.17 2nuf n GLY 146 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2nuf s ARG 147 N -3.06 0.64 -0.04 1.61 3.52 -1.26 -5.06 118.95 115.29 2nuf s ARG 147 Ca 0.75 1.20 -0.30 0.00 -0.13 0.00 0.00 55.73 57.26 2nuf s ARG 147 Cb -0.40 0.22 -0.05 0.00 -1.56 0.00 0.00 34.95 33.16 2nuf s ARG 147 CO 0.46 -0.16 1.55 0.08 -0.81 0.00 0.00 175.30 176.42 2nuf s VAL 148 N 1.80 3.63 -0.75 7.11 1.01 -1.26 -4.95 120.40 126.99 2nuf s VAL 148 Ca -0.09 0.86 -0.02 0.00 0.00 0.00 0.00 61.98 62.73 2nuf s VAL 148 Cb -0.07 -3.56 0.19 0.00 0.00 0.00 0.00 36.38 32.95 2nuf s VAL 148 CO -0.19 -0.05 0.59 -0.54 0.00 0.00 0.00 175.10 174.91 2nuf s LYS 149 N 3.48 2.88 0.38 2.72 1.02 -1.26 -5.08 119.74 123.88 2nuf s LYS 149 Ca 0.69 -2.89 -0.27 0.00 0.02 0.00 0.00 55.97 53.52 2nuf s LYS 149 Cb -0.32 -3.82 -0.10 0.00 -0.52 0.00 0.00 37.83 33.07 2nuf s LYS 149 CO 0.27 -1.22 1.40 0.15 -0.92 0.00 0.00 175.35 175.04 2nuf s LYS 150 N -0.68 4.07 0.55 1.68 1.02 -1.26 -5.01 119.74 120.11 2nuf s LYS 150 Ca 0.22 2.39 -0.07 0.00 0.02 0.00 0.00 55.97 58.52 2nuf s LYS 150 Cb -0.14 -2.90 -0.03 0.00 -0.52 0.00 0.00 37.83 34.24 2nuf s LYS 150 CO -0.08 -0.50 0.89 0.16 -0.92 0.00 0.00 175.35 174.91 2nuf s ASP 151 N -0.39 6.13 0.17 2.83 -4.77 -1.26 -4.86 116.67 114.52 2nuf s ASP 151 Ca 0.54 1.07 -0.17 0.00 -3.30 0.00 0.00 52.55 50.69 2nuf s ASP 151 Cb -0.43 -2.24 0.11 0.00 -1.09 0.00 0.00 42.92 39.28 2nuf s ASP 151 CO 0.57 -0.77 1.66 1.88 0.70 0.00 0.00 175.17 179.21 2nuf h TYR 152 N -0.04 -0.25 -0.73 2.11 0.05 -1.95 -0.75 116.97 115.40 2nuf h TYR 152 Ca -0.46 0.04 0.10 0.00 0.05 0.00 0.00 58.73 58.47 2nuf h TYR 152 Cb 1.21 0.18 -0.08 0.00 1.01 0.00 0.00 36.73 39.05 2nuf h TYR 152 CO 0.59 -0.20 0.35 0.87 -1.05 0.00 0.00 178.16 178.73 2nuf h LYS 153 N -0.01 0.57 -0.05 4.88 1.57 -1.89 0.12 116.57 121.75 2nuf h LYS 153 Ca 0.21 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2nuf h LYS 153 Cb 0.33 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 2nuf h LYS 153 CO -0.45 0.37 0.00 1.15 -0.57 0.00 0.00 179.45 179.96 2nuf h THR 154 N 0.58 1.23 -0.09 -0.16 2.02 -1.74 -0.74 112.91 114.01 2nuf h THR 154 Ca 0.37 -0.71 0.03 0.00 0.77 0.00 0.00 66.41 66.86 2nuf h THR 154 Cb 0.42 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 2nuf h THR 154 CO -0.29 0.19 -0.08 0.40 0.37 0.00 0.00 175.52 176.12 2nuf h ILE 155 N -0.19 0.78 0.11 3.11 2.04 -0.71 -0.91 117.51 121.73 2nuf h ILE 155 Ca 0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.88 2nuf h ILE 155 Cb 0.31 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.15 2nuf h ILE 155 CO 0.00 0.00 -0.13 0.25 0.00 0.00 0.00 178.15 178.28 2nuf h LEU 156 N -0.09 -0.34 -1.78 1.44 5.85 -0.78 -1.43 115.31 118.18 2nuf h LEU 156 Ca 0.06 0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.90 2nuf h LEU 156 Cb 0.18 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 2nuf h LEU 156 CO -0.15 -0.19 0.30 -0.61 -0.34 0.00 0.00 178.44 177.45 2nuf h GLN 157 N -0.27 0.25 0.00 1.25 4.15 -0.91 0.49 115.11 120.07 2nuf h GLN 157 Ca 0.01 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2nuf h GLN 157 Cb 0.27 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.90 2nuf h GLN 157 CO -0.05 0.16 0.00 0.93 -1.93 0.00 0.00 178.83 177.95 2nuf h GLU 158 N 0.26 0.00 0.15 1.69 5.08 -0.51 -2.55 114.58 118.70 2nuf h GLU 158 Ca 0.20 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.30 2nuf h GLU 158 Cb 0.47 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.73 2nuf h GLU 158 CO -0.04 0.00 -1.25 0.82 -1.00 0.00 0.00 179.01 177.54 2nuf h ILE 159 N 0.00 1.21 -0.13 3.13 2.04 0.10 -3.14 117.51 120.72 2nuf h ILE 159 Ca 0.00 -2.49 -0.12 0.00 1.00 0.00 0.00 64.86 63.25 2nuf h ILE 159 Cb 0.86 2.92 -0.01 0.00 -0.74 0.00 0.00 36.82 39.84 2nuf h ILE 159 CO 0.00 0.73 -0.46 0.71 0.00 0.00 0.00 178.15 179.13 2nuf h THR 160 N -0.24 1.33 -0.08 -0.27 1.35 -1.31 -1.80 112.91 111.88 2nuf h THR 160 Ca -0.25 -1.65 -0.17 0.00 -0.55 0.00 0.00 66.41 63.79 2nuf h THR 160 Cb 1.79 1.73 -0.01 0.00 -1.73 0.00 0.00 68.15 69.94 2nuf h THR 160 CO 0.12 0.50 -0.69 1.56 -0.25 0.00 0.00 175.52 176.77 2nuf h GLN 161 N 0.27 0.36 -0.03 4.72 4.20 -1.35 0.14 115.11 123.42 2nuf h GLN 161 Ca 0.02 -0.28 -0.03 0.00 0.06 0.00 0.00 58.65 58.42 2nuf h GLN 161 Cb 0.92 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.75 2nuf h GLN 161 CO 0.08 0.92 -0.08 -0.22 -0.67 0.00 0.00 178.83 178.85 2nuf h LYS 162 N 0.26 0.11 0.00 1.46 3.64 -1.48 -0.24 116.57 120.33 2nuf h LYS 162 Ca -0.02 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.18 2nuf h LYS 162 Cb 1.24 0.01 0.01 0.00 -0.41 0.00 0.00 32.23 33.08 2nuf h LYS 162 CO 0.12 0.68 -0.40 -0.09 -2.27 0.00 0.00 179.45 177.48 2nuf h ARG 163 N -0.43 0.27 -0.00 1.90 2.43 -1.38 -3.40 114.38 113.76 2nuf h ARG 163 Ca -0.00 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 2nuf h ARG 163 Cb 0.68 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 2nuf h ARG 163 CO 0.02 1.00 -0.07 0.91 -1.51 0.00 0.00 179.97 180.32 2nuf n TRP 164 N -4.38 0.00 -2.17 2.20 8.01 0.24 -5.00 117.44 116.33 2nuf n TRP 164 Ca -0.10 0.00 -0.13 0.00 -1.31 0.00 0.00 57.50 55.96 2nuf n TRP 164 Cb 0.58 0.00 -0.01 0.00 -2.01 0.00 0.00 31.31 29.87 2nuf n TRP 164 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 2nuf n LYS 165 N -0.93 -1.02 -4.10 -0.99 5.02 0.16 -4.94 118.16 111.36 2nuf n LYS 165 Ca 0.00 0.66 -0.14 0.00 -2.02 0.00 0.00 58.31 56.81 2nuf n LYS 165 Cb 0.03 -4.87 -0.11 0.00 -0.02 0.00 0.00 35.03 30.06 2nuf n LYS 165 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2nuf s GLU 166 N -4.51 0.62 0.04 1.97 2.02 -1.06 -4.87 118.70 112.92 2nuf s GLU 166 Ca 0.00 -0.85 0.00 0.00 0.02 0.00 0.00 54.97 54.14 2nuf s GLU 166 Cb 0.00 -0.41 -0.04 0.00 0.10 0.00 0.00 34.13 33.78 2nuf s GLU 166 CO 0.00 0.08 0.17 1.03 0.02 0.00 0.00 175.26 176.55 2nuf s ARG 167 N -1.78 3.29 0.77 1.61 0.52 -1.26 -2.98 118.95 119.12 2nuf s ARG 167 Ca -0.07 -0.47 -0.11 0.00 -0.52 0.00 0.00 55.73 54.57 2nuf s ARG 167 Cb -0.09 -2.97 0.05 0.00 0.52 0.00 0.00 34.95 32.46 2nuf s ARG 167 CO 0.01 0.62 1.08 -1.25 0.02 0.00 0.00 175.30 175.77 2nuf s PRO 168 N -2.30 2.33 0.07 3.54 0.04 -1.26 -4.92 135.00 132.50 2nuf s PRO 168 Ca 0.31 0.96 0.10 0.00 0.04 0.00 0.00 61.00 62.41 2nuf s PRO 168 Cb -0.13 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.46 2nuf s PRO 168 CO 0.24 -1.53 -0.25 -1.21 0.04 0.00 0.00 177.00 174.28 2nuf s GLU 169 N -5.00 1.71 0.00 4.56 2.02 -0.08 -4.93 118.70 116.99 2nuf s GLU 169 Ca 0.60 -1.17 0.07 0.00 0.02 0.00 0.00 54.97 54.50 2nuf s GLU 169 Cb -0.16 -1.98 -0.03 0.00 0.10 0.00 0.00 34.13 32.07 2nuf s GLU 169 CO 0.56 0.50 -0.22 0.71 0.02 0.00 0.00 175.26 176.82 2nuf s TYR 170 N -0.90 2.44 -0.02 1.61 2.02 -1.26 -1.45 117.35 119.81 2nuf s TYR 170 Ca 0.13 -0.34 -0.02 0.00 -0.37 0.00 0.00 57.07 56.47 2nuf s TYR 170 Cb -0.10 -1.49 0.00 0.00 -0.40 0.00 0.00 41.96 39.97 2nuf s TYR 170 CO 0.04 0.10 0.05 -0.98 -1.57 0.00 0.00 175.55 173.19 2nuf s ARG 171 N -0.95 0.11 -0.02 -0.62 1.70 -0.26 -4.95 118.95 113.96 2nuf s ARG 171 Ca 0.12 -0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 55.06 2nuf s ARG 171 Cb -0.10 0.05 -0.04 0.00 -0.57 0.00 0.00 34.95 34.29 2nuf s ARG 171 CO 0.01 -0.02 1.20 -1.17 -1.08 0.00 0.00 175.30 174.25 2nuf s LEU 172 N -0.20 4.31 -0.19 -1.89 2.96 -1.26 -0.62 118.68 121.79 2nuf s LEU 172 Ca -0.02 1.88 0.04 0.00 -0.22 0.00 0.00 54.13 55.80 2nuf s LEU 172 Cb -0.02 -3.56 -0.21 0.00 0.50 0.00 0.00 46.19 42.89 2nuf s LEU 172 CO 0.00 -0.55 0.07 -0.38 -1.32 0.00 0.00 176.35 174.17 2nuf n ILE 173 N 4.41 1.56 -3.57 6.68 2.08 -0.02 -4.93 119.36 125.56 2nuf n ILE 173 Ca 0.10 -0.67 -0.06 0.00 0.56 0.00 0.00 62.75 62.69 2nuf n ILE 173 Cb 0.46 -1.28 -0.02 0.00 -0.75 0.00 0.00 39.64 38.05 2nuf n ILE 173 CO 0.00 0.00 0.00 -0.94 0.56 0.00 0.00 176.55 176.17 2nuf s SER 174 N -6.42 -0.25 -0.04 4.38 1.04 -1.15 -5.02 113.70 106.24 2nuf s SER 174 Ca -0.24 -0.07 0.02 0.00 0.48 0.00 0.00 55.95 56.14 2nuf s SER 174 Cb 0.08 0.31 0.02 0.00 0.10 0.00 0.00 66.02 66.53 2nuf s SER 174 CO 0.71 -0.52 -0.07 -0.69 0.98 0.00 0.00 173.24 173.65 2nuf s VAL 175 N -2.89 0.69 0.15 5.02 1.01 -1.26 -2.11 120.40 121.02 2nuf s VAL 175 Ca 0.08 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 61.90 2nuf s VAL 175 Cb -0.01 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 2nuf s VAL 175 CO -0.06 0.25 -0.17 -1.61 0.00 0.00 0.00 175.10 173.51 2nuf s GLU 176 N 0.72 1.20 0.15 2.72 2.02 0.42 -4.96 118.70 120.96 2nuf s GLU 176 Ca -0.11 -1.36 0.00 0.00 0.02 0.00 0.00 54.97 53.52 2nuf s GLU 176 Cb -0.14 -1.19 0.00 0.00 0.10 0.00 0.00 34.13 32.90 2nuf s GLU 176 CO 0.01 0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.94 2nuf n GLY 177 N 0.36 -2.89 3.80 -1.39 0.00 -1.26 0.01 105.19 103.81 2nuf n GLY 177 Ca -0.14 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.78 2nuf n GLY 177 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2nuf s PRO 178 N -0.73 2.98 0.40 1.61 0.02 -0.92 -4.80 135.00 133.57 2nuf s PRO 178 Ca 0.00 1.15 0.07 0.00 0.02 0.00 0.00 61.00 62.24 2nuf s PRO 178 Cb 0.00 -1.99 0.84 0.00 0.02 0.00 0.00 34.50 33.37 2nuf s PRO 178 CO 0.00 -1.07 2.04 0.45 -0.33 0.00 0.00 177.00 178.09 2nuf h HIS 179 N -0.19 0.56 -0.01 6.54 3.86 -2.00 0.38 115.15 124.29 2nuf h HIS 179 Ca -0.45 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.77 2nuf h HIS 179 Cb 1.22 -0.19 0.00 0.00 1.06 0.00 0.00 27.41 29.50 2nuf h HIS 179 CO 0.59 0.34 -0.04 -2.39 0.86 0.00 0.00 177.93 177.29 2nuf n HIS 180 N -4.47 0.00 -3.14 2.45 -0.00 -1.26 -4.29 115.22 104.52 2nuf n HIS 180 Ca 0.05 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.58 2nuf n HIS 180 Cb 0.10 -0.05 -0.05 0.00 -0.00 0.00 0.00 29.99 29.99 2nuf n HIS 180 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2nuf n LYS 181 N -0.53 0.41 -3.89 -1.40 5.02 0.09 -5.14 118.16 112.71 2nuf n LYS 181 Ca 0.19 -2.75 -0.32 0.00 -2.02 0.00 0.00 58.31 53.41 2nuf n LYS 181 Cb 0.25 -1.53 -0.04 0.00 -0.02 0.00 0.00 35.03 33.70 2nuf n LYS 181 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2nuf s LYS 182 N 0.13 3.45 -0.13 1.97 1.02 -0.98 -2.17 119.74 123.02 2nuf s LYS 182 Ca 0.32 -0.36 0.02 0.00 0.02 0.00 0.00 55.97 55.98 2nuf s LYS 182 Cb 0.07 -3.06 0.01 0.00 -0.52 0.00 0.00 37.83 34.33 2nuf s LYS 182 CO -0.15 0.63 -0.19 0.21 -0.92 0.00 0.00 175.35 174.93 2nuf s LYS 183 N -2.23 2.74 0.07 1.68 2.20 0.10 -4.42 119.74 119.88 2nuf s LYS 183 Ca 0.32 -0.75 0.05 0.00 -0.36 0.00 0.00 55.97 55.23 2nuf s LYS 183 Cb -0.13 -2.26 -0.04 0.00 -1.51 0.00 0.00 37.83 33.89 2nuf s LYS 183 CO 0.23 -0.05 -0.05 -0.06 -0.36 0.00 0.00 175.35 175.06 2nuf s PHE 184 N 0.92 2.87 -0.14 4.03 0.40 -0.04 -0.44 117.98 125.58 2nuf s PHE 184 Ca -0.06 -0.08 -0.00 0.00 -0.60 0.00 0.00 56.93 56.20 2nuf s PHE 184 Cb -0.15 -1.52 0.03 0.00 0.51 0.00 0.00 43.02 41.89 2nuf s PHE 184 CO -0.03 0.43 -0.08 0.42 0.70 0.00 0.00 175.22 176.66 2nuf s ILE 185 N -1.19 1.19 0.16 0.64 1.01 -0.90 -2.06 121.20 120.06 2nuf s ILE 185 Ca 0.22 -0.52 0.09 0.00 0.00 0.00 0.00 60.65 60.44 2nuf s ILE 185 Cb -0.11 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.06 2nuf s ILE 185 CO 0.14 0.28 -0.16 -0.69 0.00 0.00 0.00 174.94 174.51 2nuf s VAL 186 N 1.62 2.87 -0.10 2.92 1.01 0.16 -0.84 120.40 128.04 2nuf s VAL 186 Ca 0.03 -1.68 0.02 0.00 0.00 0.00 0.00 61.98 60.35 2nuf s VAL 186 Cb -0.14 -2.37 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 2nuf s VAL 186 CO -0.08 -0.03 -0.18 -0.70 0.00 0.00 0.00 175.10 174.10 2nuf s GLU 187 N -2.53 3.08 -0.06 2.72 2.12 0.21 -0.92 118.70 123.32 2nuf s GLU 187 Ca 0.21 -0.77 0.01 0.00 0.36 0.00 0.00 54.97 54.78 2nuf s GLU 187 Cb -0.09 -2.45 -0.03 0.00 0.26 0.00 0.00 34.13 31.82 2nuf s GLU 187 CO 0.12 0.27 -0.06 0.00 -0.54 0.00 0.00 175.26 175.05 2nuf s ALA 188 N 0.16 3.04 -0.05 6.30 0.00 -0.17 -1.10 121.76 129.94 2nuf s ALA 188 Ca -0.10 -0.90 -0.14 0.00 0.00 0.00 0.00 51.96 50.81 2nuf s ALA 188 Cb -0.16 -1.25 0.03 0.00 0.00 0.00 0.00 23.12 21.74 2nuf s ALA 188 CO 0.06 0.59 0.33 -1.59 0.00 0.00 0.00 175.76 175.14 2nuf s LYS 189 N -0.95 0.60 -0.24 0.00 0.00 -0.53 -1.56 119.74 117.06 2nuf s LYS 189 Ca 0.14 0.02 -0.06 0.00 0.00 0.00 0.00 55.97 56.07 2nuf s LYS 189 Cb -0.11 0.27 0.12 0.00 0.00 0.00 0.00 37.83 38.11 2nuf s LYS 189 CO 0.03 -0.15 0.48 -1.50 0.00 0.00 0.00 175.35 174.22 2nuf s ILE 190 N -0.87 -0.76 0.00 3.79 1.10 -0.64 -0.90 121.20 122.92 2nuf s ILE 190 Ca -0.09 0.07 0.00 0.00 -0.51 0.00 0.00 60.65 60.11 2nuf s ILE 190 Cb -0.04 -0.81 0.00 0.00 0.15 0.00 0.00 42.46 41.76 2nuf s ILE 190 CO 0.03 0.01 0.00 0.29 -2.11 0.00 0.00 174.94 173.16 2nuf n LYS 191 N 5.40 0.00 -0.35 3.50 4.76 -1.26 -1.86 118.16 128.35 2nuf n LYS 191 Ca -0.07 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.45 2nuf n LYS 191 Cb 0.50 0.00 0.25 0.00 -1.84 0.00 0.00 35.03 33.93 2nuf n LYS 191 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2nuf n GLU 192 N 13.05 3.06 -3.48 1.97 4.71 -1.26 -4.94 120.64 133.74 2nuf n GLU 192 Ca 0.00 -2.47 -0.37 0.00 -0.01 0.00 0.00 57.16 54.31 2nuf n GLU 192 Cb 0.00 -1.55 -0.07 0.00 -1.01 0.00 0.00 31.44 28.81 2nuf n GLU 192 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 2nuf s TYR 193 N -1.49 3.50 -0.01 -0.32 2.02 -0.78 -5.08 117.35 115.19 2nuf s TYR 193 Ca 0.37 0.70 -0.06 0.00 -0.37 0.00 0.00 57.07 57.72 2nuf s TYR 193 Cb 0.23 -2.38 0.00 0.00 -0.40 0.00 0.00 41.96 39.41 2nuf s TYR 193 CO 0.20 0.27 0.12 1.03 -1.57 0.00 0.00 175.55 175.59 2nuf s ARG 194 N 0.34 0.35 0.11 -0.62 0.52 -1.26 -1.63 118.95 116.77 2nuf s ARG 194 Ca 0.20 -0.21 -0.11 0.00 -0.52 0.00 0.00 55.73 55.08 2nuf s ARG 194 Cb -0.14 0.15 0.01 0.00 0.52 0.00 0.00 34.95 35.49 2nuf s ARG 194 CO 0.06 -0.07 0.27 0.95 0.02 0.00 0.00 175.30 176.53 2nuf s THR 195 N -0.88 0.11 0.37 0.02 -4.23 -0.60 -4.99 115.64 105.45 2nuf s THR 195 Ca -0.10 -1.06 0.08 0.00 -1.18 0.00 0.00 61.69 59.43 2nuf s THR 195 Cb -0.06 -1.40 -0.04 0.00 1.34 0.00 0.00 72.50 72.35 2nuf s THR 195 CO 0.01 -0.49 0.20 -0.76 -0.54 0.00 0.00 174.62 173.04 2nuf s LEU 196 N -2.87 3.26 -0.11 4.79 1.43 -1.26 -1.00 118.68 122.92 2nuf s LEU 196 Ca 0.07 -0.84 -0.29 0.00 -1.03 0.00 0.00 54.13 52.04 2nuf s LEU 196 Cb 0.04 -1.73 0.07 0.00 0.03 0.00 0.00 46.19 44.60 2nuf s LEU 196 CO -0.09 -0.43 0.68 -0.83 0.23 0.00 0.00 176.35 175.91 2nuf s GLY 197 N -3.92 -0.55 0.04 -3.19 0.00 -0.10 -4.03 107.32 95.57 2nuf s GLY 197 Ca 0.41 1.49 0.02 0.00 0.00 0.00 0.00 44.72 46.63 2nuf s GLY 197 CO 0.24 1.16 -0.07 -1.83 0.00 0.00 0.00 173.10 172.59 2nuf s GLU 198 N -0.75 0.53 -0.01 2.90 -1.05 -1.26 0.40 118.70 119.47 2nuf s GLU 198 Ca -0.08 -0.80 -0.28 0.00 -0.15 0.00 0.00 54.97 53.66 2nuf s GLU 198 Cb -0.02 -0.21 0.09 0.00 -0.44 0.00 0.00 34.13 33.55 2nuf s GLU 198 CO 0.07 0.03 1.27 0.20 0.95 0.00 0.00 175.26 177.78 2nuf s GLY 199 N -1.74 -0.11 0.00 -3.83 0.00 -0.88 -4.46 107.32 96.31 2nuf s GLY 199 Ca -0.08 -0.00 0.21 0.00 0.00 0.00 0.00 44.72 44.84 2nuf s GLY 199 CO -0.01 5.60 1.63 0.58 0.00 0.00 0.00 173.10 180.90 2nuf n LYS 200 N -0.90 0.55 -3.80 2.90 2.85 -1.26 -0.86 118.16 117.63 2nuf n LYS 200 Ca 0.04 0.03 -0.09 0.00 -1.05 0.00 0.00 58.31 57.23 2nuf n LYS 200 Cb 0.58 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.42 2nuf n LYS 200 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2nuf s SER 201 N -2.16 -0.21 0.09 -5.58 1.04 -1.26 -4.69 113.70 100.93 2nuf s SER 201 Ca 0.28 -0.59 -0.27 0.00 0.48 0.00 0.00 55.95 55.85 2nuf s SER 201 Cb 0.14 0.58 -0.13 0.00 0.10 0.00 0.00 66.02 66.71 2nuf s SER 201 CO 0.26 -1.08 1.67 0.11 0.98 0.00 0.00 173.24 175.18 2nuf h LYS 202 N 2.22 -0.41 -0.29 4.02 1.57 -1.95 -0.34 116.57 121.39 2nuf h LYS 202 Ca -0.28 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.60 2nuf h LYS 202 Cb 1.26 0.09 -0.08 0.00 0.08 0.00 0.00 32.23 33.58 2nuf h LYS 202 CO 0.37 -0.27 -0.34 -0.22 -0.57 0.00 0.00 179.45 178.42 2nuf h LYS 203 N -0.43 -0.31 -0.52 3.15 3.64 -1.98 1.18 116.57 121.31 2nuf h LYS 203 Ca -0.01 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2nuf h LYS 203 Cb 0.38 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 2nuf h LYS 203 CO -0.01 -0.21 0.34 1.49 -2.27 0.00 0.00 179.45 178.80 2nuf h GLU 204 N -0.32 0.67 -0.46 1.90 4.81 -1.93 -0.59 114.58 118.67 2nuf h GLU 204 Ca 0.14 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.37 2nuf h GLU 204 Cb 0.55 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 2nuf h GLU 204 CO -0.47 0.45 0.22 0.00 -0.73 0.00 0.00 179.01 178.48 2nuf h ALA 205 N 1.20 0.57 -0.44 2.92 0.00 0.48 -1.88 119.26 122.11 2nuf h ALA 205 Ca 0.20 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2nuf h ALA 205 Cb -0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2nuf h ALA 205 CO -0.05 -0.14 0.17 0.93 0.00 0.00 0.00 179.25 180.17 2nuf h GLU 206 N 0.44 0.63 0.22 0.00 5.08 0.19 -1.37 114.58 119.77 2nuf h GLU 206 Ca 0.20 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2nuf h GLU 206 Cb 0.12 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2nuf h GLU 206 CO -0.15 0.52 -0.11 1.96 -1.00 0.00 0.00 179.01 180.24 2nuf h GLN 207 N 0.63 -0.28 -0.63 2.33 1.08 -0.34 0.90 115.11 118.78 2nuf h GLN 207 Ca 0.15 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.41 2nuf h GLN 207 Cb 0.13 0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.58 2nuf h GLN 207 CO -0.01 -0.05 0.38 0.00 -0.95 0.00 0.00 178.83 178.19 2nuf h ARG 208 N -0.48 0.72 -0.64 1.46 -0.00 -1.32 0.29 114.38 114.40 2nuf h ARG 208 Ca -0.03 -0.04 0.06 0.00 -0.50 0.00 0.00 59.98 59.47 2nuf h ARG 208 Cb 0.36 -0.16 -0.06 0.00 0.00 0.00 0.00 29.97 30.12 2nuf h ARG 208 CO 0.05 0.47 0.34 0.00 0.00 0.00 0.00 179.97 180.83 2nuf h ALA 209 N 1.29 0.86 -0.45 0.04 0.00 -1.06 -2.09 119.26 117.84 2nuf h ALA 209 Ca 0.26 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 2nuf h ALA 209 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2nuf h ALA 209 CO -0.12 -0.00 -0.22 0.00 0.00 0.00 0.00 179.25 178.91 2nuf h ALA 210 N 1.35 0.63 -0.41 0.00 0.00 0.36 -2.32 119.26 118.88 2nuf h ALA 210 Ca 0.29 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2nuf h ALA 210 Cb 0.21 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2nuf h ALA 210 CO -0.20 0.62 0.15 1.49 0.00 0.00 0.00 179.25 181.32 2nuf h GLU 211 N 0.78 0.31 -0.01 0.00 4.81 -0.07 -1.08 114.58 119.32 2nuf h GLU 211 Ca 0.10 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.24 2nuf h GLU 211 Cb 0.79 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2nuf h GLU 211 CO 0.07 0.21 -0.32 0.93 -0.73 0.00 0.00 179.01 179.16 2nuf h GLU 212 N 0.32 0.02 -0.32 1.92 4.39 -1.31 -2.39 114.58 117.20 2nuf h GLU 212 Ca 0.19 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.73 2nuf h GLU 212 Cb 0.16 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2nuf h GLU 212 CO -0.18 0.35 -0.40 1.25 -1.16 0.00 0.00 179.01 178.86 2nuf h LEU 213 N 0.02 0.84 -0.10 1.33 5.85 -0.77 0.13 115.31 122.60 2nuf h LEU 213 Ca 0.00 -0.39 0.01 0.00 0.84 0.00 0.00 57.88 58.34 2nuf h LEU 213 Cb 0.59 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 2nuf h LEU 213 CO 0.04 1.14 0.04 0.40 -0.34 0.00 0.00 178.44 179.72 2nuf h ILE 214 N 0.64 0.99 -0.39 4.05 2.04 -0.85 0.81 117.51 124.79 2nuf h ILE 214 Ca 0.05 -0.03 0.03 0.00 1.00 0.00 0.00 64.86 65.91 2nuf h ILE 214 Cb 0.96 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 2nuf h ILE 214 CO 0.09 0.02 0.20 0.50 0.00 0.00 0.00 178.15 178.96 2nuf h LYS 215 N 0.10 0.39 -0.32 2.37 3.64 -1.23 0.11 116.57 121.63 2nuf h LYS 215 Ca 0.04 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.43 2nuf h LYS 215 Cb 0.02 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 2nuf h LYS 215 CO -0.04 0.26 0.13 1.25 -2.27 0.00 0.00 179.45 178.78 2nuf h LEU 216 N 0.40 0.17 0.52 5.20 5.85 -0.35 -1.80 115.31 125.30 2nuf h LEU 216 Ca 0.17 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 2nuf h LEU 216 Cb 0.07 -0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.11 2nuf h LEU 216 CO -0.12 0.14 -0.25 -0.07 -0.34 0.00 0.00 178.44 177.80 2nuf h LEU 217 N 0.29 -0.59 -1.94 2.25 3.38 -0.45 -0.13 115.31 118.13 2nuf h LEU 217 Ca 0.14 0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.24 2nuf h LEU 217 Cb 0.09 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2nuf h LEU 217 CO -0.12 -0.29 0.46 -0.33 0.09 0.00 0.00 178.44 178.25 2nuf h GLU 218 N -0.96 0.00 0.00 1.13 5.08 -0.85 -1.59 114.58 117.39 2nuf h GLU 218 Ca -0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2nuf h GLU 218 Cb 0.54 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2nuf h GLU 218 CO 0.12 0.00 -0.09 1.49 -1.00 0.00 0.00 179.01 179.53 2nuf h GLU 219 N 0.00 0.00 0.00 2.33 4.81 -1.29 -3.51 114.58 116.92 2nuf h GLU 219 Ca 0.19 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2nuf h GLU 219 Cb 1.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2nuf h GLU 219 CO -0.00 0.46 0.00 -1.13 -0.73 0.00 0.00 179.01 177.61