#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kyz h GLU 6 N 0.00 0.14 -6.41 1.61 4.39 -2.02 -3.41 114.58 108.88 1kyz h GLU 6 Ca 0.00 -0.14 -0.57 0.00 0.34 0.00 0.00 59.36 58.99 1kyz h GLU 6 Cb 0.00 0.04 -0.05 0.00 -0.10 0.00 0.00 28.75 28.64 1kyz h GLU 6 CO 0.00 0.86 1.03 0.99 -1.16 0.00 0.00 179.01 180.73 1kyz s THR 7 N -3.23 4.00 0.08 1.13 2.01 -1.26 -4.99 115.64 113.39 1kyz s THR 7 Ca -0.16 1.10 -0.01 0.00 0.31 0.00 0.00 61.69 62.92 1kyz s THR 7 Cb 0.01 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1kyz s THR 7 CO 0.73 -0.55 0.01 -1.10 -0.69 0.00 0.00 174.62 173.02 1kyz s GLN 8 N 4.51 0.74 0.49 4.92 -0.21 -1.26 -5.02 119.66 123.83 1kyz s GLN 8 Ca 0.60 -1.29 0.28 0.00 0.02 0.00 0.00 55.36 54.97 1kyz s GLN 8 Cb -0.17 0.23 1.14 0.00 1.00 0.00 0.00 33.01 35.22 1kyz s GLN 8 CO 0.27 -0.18 1.91 -0.84 -2.12 0.00 0.00 175.29 174.34 1kyz h ILE 9 N 3.02 0.34 -3.90 1.08 3.07 -1.94 -3.45 117.51 115.75 1kyz h ILE 9 Ca -0.34 -0.83 -0.21 0.00 1.55 0.00 0.00 64.86 65.02 1kyz h ILE 9 Cb 1.16 1.63 -0.16 0.00 -0.27 0.00 0.00 36.82 39.19 1kyz h ILE 9 CO 0.63 0.13 -0.70 0.42 -1.05 0.00 0.00 178.15 177.58 1kyz s THR 10 N -3.71 0.60 0.18 0.16 -4.23 -1.26 -5.09 115.64 102.29 1kyz s THR 10 Ca 0.00 -1.80 -0.31 0.00 -1.18 0.00 0.00 61.69 58.40 1kyz s THR 10 Cb 0.10 -1.52 -0.09 0.00 1.34 0.00 0.00 72.50 72.33 1kyz s THR 10 CO 0.60 -0.83 1.41 -2.16 -0.54 0.00 0.00 174.62 173.09 1kyz s PRO 11 N -3.55 4.31 0.32 3.99 0.04 -1.26 -4.90 135.00 133.94 1kyz s PRO 11 Ca 0.08 2.17 0.03 0.00 0.04 0.00 0.00 61.00 63.32 1kyz s PRO 11 Cb 0.04 -3.18 0.53 0.00 0.04 0.00 0.00 34.50 31.92 1kyz s PRO 11 CO -0.05 -0.41 1.85 1.79 0.04 0.00 0.00 177.00 180.22 1kyz h THR 12 N 3.90 1.21 -3.94 1.26 1.35 -1.94 -3.44 112.91 111.31 1kyz h THR 12 Ca -0.44 -0.82 -0.21 0.00 -0.55 0.00 0.00 66.41 64.40 1kyz h THR 12 Cb 1.21 0.89 -0.16 0.00 -1.73 0.00 0.00 68.15 68.35 1kyz h THR 12 CO 0.83 0.29 -0.70 -1.38 -0.25 0.00 0.00 175.52 174.30 1kyz s HIS 13 N -5.01 0.73 -0.01 4.73 -3.43 -1.26 -4.98 115.29 106.05 1kyz s HIS 13 Ca -0.08 -0.84 -0.10 0.00 -0.80 0.00 0.00 55.06 53.23 1kyz s HIS 13 Cb 0.15 -0.45 0.01 0.00 -1.43 0.00 0.00 32.58 30.87 1kyz s HIS 13 CO 0.78 -0.19 0.21 0.42 -2.00 0.00 0.00 174.74 173.96 1kyz s ILE 14 N -3.10 0.07 0.28 -5.38 1.01 -1.26 -5.15 121.20 107.66 1kyz s ILE 14 Ca 0.05 -0.57 -0.08 0.00 0.00 0.00 0.00 60.65 60.05 1kyz s ILE 14 Cb 0.02 -0.50 -0.06 0.00 0.01 0.00 0.00 42.46 41.93 1kyz s ILE 14 CO -0.05 -0.31 0.59 -0.44 0.00 0.00 0.00 174.94 174.73 1kyz s SER 15 N -1.27 6.54 0.42 3.58 0.01 -1.26 -5.00 113.70 116.71 1kyz s SER 15 Ca -0.13 0.88 0.14 0.00 1.31 0.00 0.00 55.95 58.14 1kyz s SER 15 Cb -0.06 -2.21 1.00 0.00 0.21 0.00 0.00 66.02 64.96 1kyz s SER 15 CO 0.03 -0.17 1.92 0.44 0.41 0.00 0.00 173.24 175.87 1kyz h ASP 16 N 2.02 0.43 0.19 2.44 3.45 -2.02 -1.55 116.42 121.38 1kyz h ASP 16 Ca -0.47 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.01 1kyz h ASP 16 Cb 1.18 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.88 1kyz h ASP 16 CO 0.67 0.23 0.00 -1.84 -1.57 0.00 0.00 179.24 176.73 1kyz n GLU 17 N -4.49 0.49 -0.48 3.56 -0.00 -1.26 -2.00 120.64 116.46 1kyz n GLU 17 Ca 0.14 0.04 0.09 0.00 -0.00 0.00 0.00 57.16 57.43 1kyz n GLU 17 Cb 0.48 -1.50 0.27 0.00 -0.00 0.00 0.00 31.44 30.70 1kyz n GLU 17 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1kyz n GLU 18 N -1.14 3.09 -0.18 3.44 0.28 -0.58 -4.59 120.64 120.95 1kyz n GLU 18 Ca 0.13 -2.87 -0.09 0.00 -0.16 0.00 0.00 57.16 54.16 1kyz n GLU 18 Cb 0.12 -1.88 0.01 0.00 1.43 0.00 0.00 31.44 31.11 1kyz n GLU 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1kyz h ALA 19 N 1.99 0.69 -0.23 -1.84 0.00 -1.50 -1.49 119.26 116.87 1kyz h ALA 19 Ca 0.00 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1kyz h ALA 19 Cb 1.49 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1kyz h ALA 19 CO 0.25 0.45 0.06 -0.97 0.00 0.00 0.00 179.25 179.04 1kyz h ASN 20 N 0.75 0.34 -0.95 0.00 -1.24 -1.82 0.22 115.58 112.88 1kyz h ASN 20 Ca 0.15 -0.22 0.04 0.00 0.71 0.00 0.00 56.30 56.97 1kyz h ASN 20 Cb 0.45 -0.09 -0.06 0.00 0.73 0.00 0.00 38.32 39.35 1kyz h ASN 20 CO 0.02 0.48 0.62 -0.07 -1.29 0.00 0.00 177.43 177.18 1kyz h LEU 21 N 0.19 1.03 -0.31 0.34 3.38 -1.85 0.10 115.31 118.20 1kyz h LEU 21 Ca 0.07 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.87 1kyz h LEU 21 Cb 0.27 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1kyz h LEU 21 CO 0.00 0.70 -0.43 0.15 0.09 0.00 0.00 178.44 178.95 1kyz h PHE 22 N 1.20 1.03 -0.61 1.13 -0.00 -1.05 -2.05 116.94 116.58 1kyz h PHE 22 Ca 0.38 -0.34 -0.01 0.00 -0.00 0.00 0.00 57.97 58.00 1kyz h PHE 22 Cb 0.01 -0.20 -0.03 0.00 -0.00 0.00 0.00 35.95 35.72 1kyz h PHE 22 CO -0.01 1.15 0.35 0.00 -0.00 0.00 0.00 178.31 179.80 1kyz h ALA 23 N 0.70 0.79 -0.76 2.41 0.00 0.01 -1.92 119.26 120.49 1kyz h ALA 23 Ca 0.03 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1kyz h ALA 23 Cb 1.03 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1kyz h ALA 23 CO 0.10 0.29 0.30 0.52 0.00 0.00 0.00 179.25 180.46 1kyz h MET 24 N 0.83 1.12 -0.49 0.00 2.86 -0.71 -0.18 114.93 118.37 1kyz h MET 24 Ca 0.22 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1kyz h MET 24 Cb 0.02 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.47 1kyz h MET 24 CO -0.04 0.91 0.18 0.37 1.06 0.00 0.00 176.91 179.39 1kyz h GLN 25 N 1.10 0.75 -0.05 1.72 4.15 -1.03 -2.48 115.11 119.27 1kyz h GLN 25 Ca 0.25 -0.14 -0.08 0.00 0.77 0.00 0.00 58.65 59.45 1kyz h GLN 25 Cb 0.20 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.76 1kyz h GLN 25 CO -0.02 0.68 -0.34 -0.07 -1.93 0.00 0.00 178.83 177.14 1kyz h LEU 26 N 0.66 0.09 -2.58 -2.39 3.38 -1.09 -1.09 115.31 112.28 1kyz h LEU 26 Ca 0.16 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1kyz h LEU 26 Cb 0.22 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 1kyz h LEU 26 CO -0.01 0.43 -0.02 0.00 0.09 0.00 0.00 178.44 178.93 1kyz h ALA 27 N 1.58 1.18 -0.09 1.53 0.00 -0.54 -2.94 119.26 119.97 1kyz h ALA 27 Ca 0.01 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1kyz h ALA 27 Cb 0.64 -0.00 -0.39 0.00 0.00 0.00 0.00 17.79 18.04 1kyz h ALA 27 CO 0.05 0.02 -1.05 -1.13 0.00 0.00 0.00 179.25 177.14 1kyz n SER 28 N -3.36 1.08 0.24 0.00 3.41 -1.06 -4.91 113.62 109.02 1kyz n SER 28 Ca -0.03 -2.00 0.16 0.00 -0.26 0.00 0.00 58.87 56.74 1kyz n SER 28 Cb 0.11 -0.33 0.79 0.00 -0.26 0.00 0.00 64.21 64.53 1kyz n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kyz h ALA 29 N 1.31 1.00 0.00 7.33 0.00 -1.02 -2.10 119.26 125.78 1kyz h ALA 29 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1kyz h ALA 29 Cb 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1kyz h ALA 29 CO 0.11 0.00 0.00 0.66 0.00 0.00 0.00 179.25 180.02 1kyz h SER 30 N 0.00 0.00 -0.77 0.00 4.64 -1.87 -3.10 113.55 112.46 1kyz h SER 30 Ca 0.00 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1kyz h SER 30 Cb 0.20 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.25 1kyz h SER 30 CO 0.00 0.00 0.49 0.58 -0.87 0.00 0.00 176.83 177.03 1kyz h VAL 31 N 0.00 1.13 0.67 0.95 2.07 -1.77 -2.44 116.25 116.86 1kyz h VAL 31 Ca 0.00 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1kyz h VAL 31 Cb 0.25 0.08 0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1kyz h VAL 31 CO 0.00 0.18 -0.32 0.25 0.02 0.00 0.00 177.57 177.69 1kyz h LEU 32 N 0.96 -0.76 -1.62 2.57 5.85 -1.79 0.15 115.31 120.67 1kyz h LEU 32 Ca 0.30 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.01 1kyz h LEU 32 Cb -0.01 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1kyz h LEU 32 CO -0.10 -0.50 0.07 1.55 -0.34 0.00 0.00 178.44 179.12 1kyz h PRO 33 N -0.98 0.32 0.07 5.25 0.13 -1.74 -0.75 132.00 134.31 1kyz h PRO 33 Ca -0.09 -0.04 -0.28 0.00 -0.87 0.00 0.00 66.00 64.72 1kyz h PRO 33 Cb 0.71 -0.06 0.03 0.00 0.13 0.00 0.00 31.00 31.81 1kyz h PRO 33 CO 0.15 0.28 -1.15 0.52 -0.23 0.00 0.00 178.00 177.57 1kyz h MET 34 N 0.32 0.65 -0.47 0.86 2.86 -1.37 -1.67 114.93 116.11 1kyz h MET 34 Ca 0.08 -0.80 -0.10 0.00 -2.06 0.00 0.00 59.70 56.82 1kyz h MET 34 Cb 0.10 0.25 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 1kyz h MET 34 CO -0.01 1.36 -0.11 0.82 1.06 0.00 0.00 176.91 180.03 1kyz h ILE 35 N 0.30 1.26 -0.50 -1.22 1.08 -0.80 -0.88 117.51 116.76 1kyz h ILE 35 Ca -0.17 -1.21 -0.03 0.00 -0.39 0.00 0.00 64.86 63.07 1kyz h ILE 35 Cb 1.82 1.02 -0.02 0.00 -3.07 0.00 0.00 36.82 36.56 1kyz h ILE 35 CO 0.22 0.42 0.21 0.25 -0.69 0.00 0.00 178.15 178.56 1kyz h LEU 36 N 0.78 0.68 0.10 1.44 5.85 -1.15 0.12 115.31 123.13 1kyz h LEU 36 Ca 0.13 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.70 1kyz h LEU 36 Cb 0.62 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1kyz h LEU 36 CO 0.04 0.66 -0.20 0.50 -0.34 0.00 0.00 178.44 179.10 1kyz h LYS 37 N 0.67 -0.37 -0.68 1.25 3.64 -0.87 0.55 116.57 120.76 1kyz h LYS 37 Ca 0.17 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.60 1kyz h LYS 37 Cb 0.18 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 1kyz h LYS 37 CO -0.02 -0.24 0.45 0.77 -2.27 0.00 0.00 179.45 178.14 1kyz h SER 38 N -0.38 0.72 -0.65 4.20 0.02 -0.96 0.11 113.55 116.61 1kyz h SER 38 Ca 0.03 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1kyz h SER 38 Cb 0.40 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1kyz h SER 38 CO -0.12 0.50 0.35 0.00 -1.14 0.00 0.00 176.83 176.43 1kyz h ALA 39 N 1.60 0.83 -0.54 3.77 0.00 -0.18 -0.35 119.26 124.39 1kyz h ALA 39 Ca 0.26 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 1kyz h ALA 39 Cb 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1kyz h ALA 39 CO -0.07 0.34 -0.13 -0.07 0.00 0.00 0.00 179.25 179.33 1kyz h LEU 40 N 0.88 1.04 -1.20 0.00 3.38 0.52 -0.13 115.31 119.80 1kyz h LEU 40 Ca 0.23 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1kyz h LEU 40 Cb 0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1kyz h LEU 40 CO -0.04 1.16 0.11 -0.33 0.09 0.00 0.00 178.44 179.43 1kyz h GLU 41 N 0.91 0.67 -0.00 1.13 5.08 -0.46 -0.62 114.58 121.28 1kyz h GLU 41 Ca 0.14 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1kyz h GLU 41 Cb 0.70 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1kyz h GLU 41 CO 0.05 0.61 -0.03 1.28 -1.00 0.00 0.00 179.01 179.92 1kyz n LEU 42 N -4.31 0.36 -1.84 1.33 4.77 -0.18 -4.91 117.00 112.21 1kyz n LEU 42 Ca 0.03 -0.02 -0.17 0.00 -0.03 0.00 0.00 56.01 55.82 1kyz n LEU 42 Cb 0.20 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1kyz n LEU 42 CO 0.39 0.06 -0.21 -0.67 -1.33 0.00 0.00 177.39 175.63 1kyz n ASP 43 N -0.87 -5.11 -0.38 -1.43 4.64 -0.24 -4.92 116.55 108.24 1kyz n ASP 43 Ca 0.19 0.08 -0.02 0.00 -1.38 0.00 0.00 54.79 53.66 1kyz n ASP 43 Cb 0.22 -4.18 0.11 0.00 -1.04 0.00 0.00 41.12 36.23 1kyz n ASP 43 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1kyz h LEU 44 N 0.00 1.14 -0.50 -2.67 3.38 -1.32 -2.10 115.31 113.24 1kyz h LEU 44 Ca -0.40 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.40 1kyz h LEU 44 Cb 1.27 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1kyz h LEU 44 CO 0.50 0.82 -0.36 -0.07 0.09 0.00 0.00 178.44 179.41 1kyz h LEU 45 N 1.35 0.87 -0.81 1.67 3.38 -1.92 -2.08 115.31 117.77 1kyz h LEU 45 Ca 0.37 -0.39 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1kyz h LEU 45 Cb -0.13 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.35 1kyz h LEU 45 CO -0.09 1.14 0.11 -0.33 0.09 0.00 0.00 178.44 179.37 1kyz h GLU 46 N 0.68 1.01 -0.41 1.13 4.39 -1.87 0.07 114.58 119.58 1kyz h GLU 46 Ca 0.06 -0.25 -0.01 0.00 0.34 0.00 0.00 59.36 59.50 1kyz h GLU 46 Cb 0.93 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.43 1kyz h GLU 46 CO 0.09 0.92 0.22 0.82 -1.16 0.00 0.00 179.01 179.89 1kyz h ILE 47 N 0.95 1.16 -0.60 3.13 2.04 -1.19 -0.56 117.51 122.44 1kyz h ILE 47 Ca 0.19 -0.41 -0.08 0.00 1.00 0.00 0.00 64.86 65.56 1kyz h ILE 47 Cb 0.39 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1kyz h ILE 47 CO 0.01 0.16 0.06 0.40 0.00 0.00 0.00 178.15 178.79 1kyz h ILE 48 N 0.52 1.26 -0.41 -0.67 2.04 -1.07 -2.80 117.51 116.37 1kyz h ILE 48 Ca 0.14 -1.03 -0.03 0.00 1.00 0.00 0.00 64.86 64.94 1kyz h ILE 48 Cb 0.07 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 1kyz h ILE 48 CO -0.02 0.38 0.13 0.00 0.00 0.00 0.00 178.15 178.64 1kyz h ALA 49 N 1.14 1.46 0.00 1.87 0.00 -0.48 -2.30 119.26 120.95 1kyz h ALA 49 Ca 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1kyz h ALA 49 Cb 0.45 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1kyz h ALA 49 CO 0.02 0.40 0.00 0.87 0.00 0.00 0.00 179.25 180.54 1kyz h LYS 50 N 0.59 0.00 0.00 0.00 1.57 -0.83 -2.45 116.57 115.45 1kyz h LYS 50 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1kyz h LYS 50 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1kyz h LYS 50 CO -0.01 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.87 1kyz h ALA 51 N 2.17 1.00 0.00 3.86 0.00 -1.43 -3.49 119.26 121.36 1kyz h ALA 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1kyz h ALA 51 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1kyz h ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1kyz n GLY 52 N 0.35 2.65 3.74 0.00 0.00 -0.92 -4.77 105.19 106.24 1kyz n GLY 52 Ca 0.03 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.65 1kyz n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1kyz n PRO 53 N 0.24 2.77 -0.60 1.61 -0.04 -1.26 -1.91 135.00 135.80 1kyz n PRO 53 Ca 0.00 0.99 0.00 0.00 -0.04 0.00 0.00 63.50 64.45 1kyz n PRO 53 Cb 0.00 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 30.66 1kyz n PRO 53 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1kyz n GLY 54 N 2.90 1.01 3.75 0.55 0.00 -1.26 -4.99 105.19 107.15 1kyz n GLY 54 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1kyz n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kyz s ALA 55 N -2.78 2.38 -0.05 4.61 0.00 -0.81 -5.00 121.76 120.12 1kyz s ALA 55 Ca 0.00 0.74 -0.02 0.00 0.00 0.00 0.00 51.96 52.68 1kyz s ALA 55 Cb 0.00 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.76 1kyz s ALA 55 CO 0.00 -1.42 0.04 -0.65 0.00 0.00 0.00 175.76 173.74 1kyz s GLN 56 N -3.86 0.12 0.17 0.00 -0.21 -1.26 -4.18 119.66 110.44 1kyz s GLN 56 Ca 0.71 0.30 0.09 0.00 0.02 0.00 0.00 55.36 56.48 1kyz s GLN 56 Cb -0.25 -0.65 -0.04 0.00 1.00 0.00 0.00 33.01 33.07 1kyz s GLN 56 CO 0.40 -0.32 -0.19 0.96 -2.12 0.00 0.00 175.29 174.02 1kyz s ILE 57 N 2.11 1.90 0.75 1.08 -4.36 0.64 -4.64 121.20 118.68 1kyz s ILE 57 Ca 0.05 -1.91 -0.11 0.00 -0.26 0.00 0.00 60.65 58.41 1kyz s ILE 57 Cb -0.12 -1.87 0.04 0.00 1.25 0.00 0.00 42.46 41.75 1kyz s ILE 57 CO -0.04 -0.27 1.09 -0.94 0.24 0.00 0.00 174.94 175.02 1kyz s SER 58 N -2.62 4.99 0.38 4.36 1.04 -1.26 0.21 113.70 120.79 1kyz s SER 58 Ca 0.16 1.34 0.06 0.00 0.48 0.00 0.00 55.95 57.98 1kyz s SER 58 Cb -0.06 -2.13 0.75 0.00 0.10 0.00 0.00 66.02 64.68 1kyz s SER 58 CO 0.07 -1.66 2.00 -0.65 0.98 0.00 0.00 173.24 173.98 1kyz h PRO 59 N -0.87 0.57 -0.38 4.02 0.11 -1.88 -1.69 132.00 131.88 1kyz h PRO 59 Ca -0.46 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.55 1kyz h PRO 59 Cb 1.25 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1kyz h PRO 59 CO 0.60 0.44 0.07 0.82 -0.21 0.00 0.00 178.00 179.72 1kyz h ILE 60 N 0.58 1.23 -0.52 4.15 2.04 -1.93 0.17 117.51 123.24 1kyz h ILE 60 Ca 0.15 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.17 1kyz h ILE 60 Cb 0.05 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1kyz h ILE 60 CO -0.02 0.28 0.24 -0.33 0.00 0.00 0.00 178.15 178.32 1kyz h GLU 61 N 0.46 0.76 -0.52 2.37 5.08 -1.82 -0.53 114.58 120.38 1kyz h GLU 61 Ca 0.12 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1kyz h GLU 61 Cb 0.34 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1kyz h GLU 61 CO 0.00 0.64 0.24 0.82 -1.00 0.00 0.00 179.01 179.71 1kyz h ILE 62 N 0.70 1.20 -0.15 3.13 2.04 -1.13 -2.49 117.51 120.81 1kyz h ILE 62 Ca 0.18 -0.58 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 1kyz h ILE 62 Cb 0.14 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1kyz h ILE 62 CO -0.02 0.23 -0.08 0.00 0.00 0.00 0.00 178.15 178.28 1kyz h ALA 63 N 1.08 1.60 0.00 1.87 0.00 -0.36 -1.66 119.26 121.79 1kyz h ALA 63 Ca 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1kyz h ALA 63 Cb 0.14 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1kyz h ALA 63 CO -0.02 0.29 0.00 0.66 0.00 0.00 0.00 179.25 180.18 1kyz h SER 64 N 0.21 0.00 -0.01 0.00 4.64 -0.62 -1.23 113.55 116.54 1kyz h SER 64 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1kyz h SER 64 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1kyz h SER 64 CO 0.01 0.00 -0.13 0.00 -0.87 0.00 0.00 176.83 175.84 1kyz n GLN 65 N -2.44 1.92 -2.94 4.77 1.13 -0.63 -4.95 117.38 114.24 1kyz n GLN 65 Ca -0.00 -1.54 -0.30 0.00 -1.94 0.00 0.00 57.00 53.22 1kyz n GLN 65 Cb 0.14 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 28.99 1kyz n GLN 65 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1kyz s LEU 66 N -2.14 3.87 -1.50 1.08 1.43 -0.47 -4.97 118.68 115.97 1kyz s LEU 66 Ca 0.26 1.06 -0.10 0.00 -1.03 0.00 0.00 54.13 54.32 1kyz s LEU 66 Cb 0.20 -3.93 0.00 0.00 0.03 0.00 0.00 46.19 42.49 1kyz s LEU 66 CO 0.38 -0.36 2.60 -0.81 0.23 0.00 0.00 176.35 178.39 1kyz n PRO 67 N -1.23 3.70 -3.68 1.29 -0.04 -1.26 -4.87 135.00 128.91 1kyz n PRO 67 Ca 0.02 -2.65 -0.10 0.00 -0.04 0.00 0.00 63.50 60.72 1kyz n PRO 67 Cb 0.54 -2.88 -0.04 0.00 -0.04 0.00 0.00 33.50 31.08 1kyz n PRO 67 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1kyz s THR 68 N 1.56 0.05 -0.80 0.52 -1.32 -1.26 -5.03 115.64 109.35 1kyz s THR 68 Ca 0.59 -0.66 0.07 0.00 -1.21 0.00 0.00 61.69 60.49 1kyz s THR 68 Cb 0.17 -1.36 0.03 0.00 -1.51 0.00 0.00 72.50 69.82 1kyz s THR 68 CO -0.07 -0.21 0.63 0.35 -2.21 0.00 0.00 174.62 173.11 1kyz n THR 69 N -0.29 0.00 -1.42 5.08 -2.24 -1.26 -5.00 114.28 109.15 1kyz n THR 69 Ca -0.13 -0.46 -0.51 0.00 -2.27 0.00 0.00 64.05 60.68 1kyz n THR 69 Cb 0.63 1.12 -0.08 0.00 -2.10 0.00 0.00 70.33 69.90 1kyz n THR 69 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1kyz n ASN 70 N 0.03 1.85 0.04 3.42 5.15 -1.26 -4.84 115.26 119.65 1kyz n ASN 70 Ca 0.04 0.40 0.20 0.00 -0.60 0.00 0.00 54.58 54.61 1kyz n ASN 70 Cb 0.17 -1.21 0.72 0.00 -0.53 0.00 0.00 39.78 38.93 1kyz n ASN 70 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1kyz h PRO 71 N 12.21 0.00 -0.01 1.20 0.11 -2.04 -1.03 132.00 142.45 1kyz h PRO 71 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1kyz h PRO 71 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1kyz h PRO 71 CO 1.05 0.00 -0.14 -0.25 -0.21 0.00 0.00 178.00 178.45 1kyz n ASP 72 N -4.17 0.83 -0.04 -2.05 8.00 -1.26 -4.39 116.55 113.48 1kyz n ASP 72 Ca 0.08 -0.87 -0.08 0.00 0.71 0.00 0.00 54.79 54.63 1kyz n ASP 72 Cb 0.58 0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.68 1kyz n ASP 72 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1kyz h ALA 73 N 3.78 -0.06 -0.34 2.24 0.00 -1.56 -2.41 119.26 120.91 1kyz h ALA 73 Ca 0.00 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.05 1kyz h ALA 73 Cb 0.42 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 18.54 1kyz h ALA 73 CO 0.00 -0.62 -0.40 -1.35 0.00 0.00 0.00 179.25 176.88 1kyz h PRO 74 N -0.20 -0.34 -0.84 0.00 0.11 -1.81 0.18 132.00 129.11 1kyz h PRO 74 Ca 0.13 0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.30 1kyz h PRO 74 Cb 0.40 0.08 -0.05 0.00 0.11 0.00 0.00 31.00 31.53 1kyz h PRO 74 CO -0.34 -0.22 0.53 0.28 -0.21 0.00 0.00 178.00 178.04 1kyz h VAL 75 N -0.35 1.10 -0.37 3.15 2.07 -1.84 0.11 116.25 120.12 1kyz h VAL 75 Ca 0.13 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 1kyz h VAL 75 Cb 0.58 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1kyz h VAL 75 CO -0.53 0.18 0.22 0.24 0.02 0.00 0.00 177.57 177.71 1kyz h MET 76 N 1.01 0.50 -0.32 1.57 2.86 -0.72 -2.27 114.93 117.56 1kyz h MET 76 Ca 0.35 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.93 1kyz h MET 76 Cb 0.06 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 1kyz h MET 76 CO -0.13 0.39 0.19 -0.07 1.06 0.00 0.00 176.91 178.35 1kyz h LEU 77 N 0.48 0.39 -0.71 1.22 3.38 -0.00 -2.57 115.31 117.49 1kyz h LEU 77 Ca 0.13 -0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.19 1kyz h LEU 77 Cb 0.02 -0.10 -0.10 0.00 0.09 0.00 0.00 40.66 40.57 1kyz h LEU 77 CO -0.02 0.33 0.20 -0.78 0.09 0.00 0.00 178.44 178.25 1kyz h ASP 78 N 0.41 0.07 -0.19 -0.43 3.58 -0.48 0.42 116.42 119.81 1kyz h ASP 78 Ca 0.12 0.13 -0.08 0.00 0.42 0.00 0.00 57.03 57.62 1kyz h ASP 78 Cb 0.02 0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.21 1kyz h ASP 78 CO -0.02 0.00 -0.13 0.03 -2.88 0.00 0.00 179.24 176.25 1kyz h ARG 79 N 0.31 0.58 -0.05 0.28 3.08 -1.17 0.17 114.38 117.57 1kyz h ARG 79 Ca 0.40 -0.18 -0.08 0.00 0.07 0.00 0.00 59.98 60.19 1kyz h ARG 79 Cb 0.64 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.64 1kyz h ARG 79 CO -0.46 0.69 -0.27 0.52 -1.07 0.00 0.00 179.97 179.37 1kyz h MET 80 N 0.53 0.28 -0.76 0.04 2.86 -0.71 -3.19 114.93 113.97 1kyz h MET 80 Ca 0.09 -0.23 -0.01 0.00 -2.06 0.00 0.00 59.70 57.49 1kyz h MET 80 Cb 0.53 0.05 -0.04 0.00 0.06 0.00 0.00 31.60 32.21 1kyz h MET 80 CO 0.03 0.88 0.41 -0.07 1.06 0.00 0.00 176.91 179.23 1kyz h LEU 81 N -0.26 0.93 -1.32 1.22 -0.00 -0.07 -2.02 115.31 113.80 1kyz h LEU 81 Ca -0.02 -0.07 0.05 0.00 -0.00 0.00 0.00 57.88 57.84 1kyz h LEU 81 Cb 0.94 -0.24 -0.05 0.00 -0.00 0.00 0.00 40.66 41.31 1kyz h LEU 81 CO 0.06 0.75 0.50 -0.09 -0.00 0.00 0.00 178.44 179.65 1kyz h ARG 82 N 1.05 0.83 -0.30 1.13 2.43 -1.00 0.36 114.38 118.89 1kyz h ARG 82 Ca 0.27 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.32 1kyz h ARG 82 Cb 0.02 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1kyz h ARG 82 CO -0.04 0.55 -0.09 1.25 -1.51 0.00 0.00 179.97 180.13 1kyz h LEU 83 N 0.86 0.60 -1.47 3.80 5.85 -1.36 -1.76 115.31 121.82 1kyz h LEU 83 Ca 0.31 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 1kyz h LEU 83 Cb 0.16 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1kyz h LEU 83 CO -0.10 0.83 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.49 1kyz h LEU 84 N 0.35 0.00 -0.44 2.25 3.38 -1.05 -2.17 115.31 117.63 1kyz h LEU 84 Ca 0.07 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.87 1kyz h LEU 84 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1kyz h LEU 84 CO 0.03 0.27 -0.58 0.00 0.09 0.00 0.00 178.44 178.26 1kyz h ALA 85 N 1.73 0.62 0.00 1.53 0.00 -0.75 -0.77 119.26 121.62 1kyz h ALA 85 Ca -0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.34 1kyz h ALA 85 Cb 0.50 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1kyz h ALA 85 CO 0.04 0.69 -0.21 0.00 0.00 0.00 0.00 179.25 179.77 1kyz n TYR 87 N -4.28 1.69 -2.33 0.00 4.02 -0.98 -4.92 117.16 110.36 1kyz n TYR 87 Ca -0.02 -0.64 -0.18 0.00 -0.01 0.00 0.00 57.90 57.05 1kyz n TYR 87 Cb 0.27 -0.45 -0.02 0.00 -0.02 0.00 0.00 39.34 39.12 1kyz n TYR 87 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 1kyz n ILE 88 N 0.39 -0.75 0.03 -0.72 2.08 -0.66 -4.84 119.36 114.88 1kyz n ILE 88 Ca 0.24 0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.37 1kyz n ILE 88 Cb 1.02 -2.42 -0.14 0.00 -0.75 0.00 0.00 39.64 37.35 1kyz n ILE 88 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 1kyz h ILE 89 N 0.00 0.88 -2.36 1.39 2.04 -1.35 -3.45 117.51 114.66 1kyz h ILE 89 Ca -0.41 -2.58 -0.61 0.00 1.00 0.00 0.00 64.86 62.25 1kyz h ILE 89 Cb 1.29 2.60 -0.14 0.00 -0.74 0.00 0.00 36.82 39.83 1kyz h ILE 89 CO 0.50 0.79 -0.76 -0.76 0.00 0.00 0.00 178.15 177.91 1kyz s LEU 90 N -6.85 2.61 0.28 1.44 1.43 -1.15 -1.81 118.68 114.63 1kyz s LEU 90 Ca -0.14 -0.98 0.06 0.00 -1.03 0.00 0.00 54.13 52.05 1kyz s LEU 90 Cb 0.07 -1.16 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 1kyz s LEU 90 CO 0.82 0.05 0.35 0.42 0.23 0.00 0.00 176.35 178.21 1kyz s THR 91 N -2.37 4.49 -0.20 5.49 -4.23 0.11 -4.42 115.64 114.51 1kyz s THR 91 Ca 0.29 -1.13 -0.18 0.00 -1.18 0.00 0.00 61.69 59.48 1kyz s THR 91 Cb -0.06 -3.53 0.05 0.00 1.34 0.00 0.00 72.50 70.30 1kyz s THR 91 CO 0.15 -0.26 0.53 0.00 -0.54 0.00 0.00 174.62 174.50 1kyz s SER 93 N 0.30 1.34 -0.01 0.00 1.04 -0.90 -4.97 113.70 110.50 1kyz s SER 93 Ca -0.00 -0.21 -0.09 0.00 0.48 0.00 0.00 55.95 56.12 1kyz s SER 93 Cb -0.04 -0.51 -0.05 0.00 0.10 0.00 0.00 66.02 65.53 1kyz s SER 93 CO 0.01 0.03 0.31 -0.69 0.98 0.00 0.00 173.24 173.87 1kyz s VAL 94 N 0.49 5.23 -0.11 5.02 1.01 -1.26 -1.47 120.40 129.30 1kyz s VAL 94 Ca -0.09 0.41 -0.13 0.00 0.00 0.00 0.00 61.98 62.18 1kyz s VAL 94 Cb -0.12 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.70 1kyz s VAL 94 CO 0.01 0.46 0.35 0.00 0.00 0.00 0.00 175.10 175.92 1kyz s ARG 95 N -1.46 0.46 -0.13 2.72 1.70 -0.34 -4.99 118.95 116.91 1kyz s ARG 95 Ca 0.25 0.39 -0.23 0.00 -0.47 0.00 0.00 55.73 55.67 1kyz s ARG 95 Cb -0.14 0.22 -0.03 0.00 -0.57 0.00 0.00 34.95 34.43 1kyz s ARG 95 CO 0.13 -0.07 0.70 0.99 -1.08 0.00 0.00 175.30 175.97 1kyz s THR 96 N -0.05 5.00 0.43 4.99 2.01 -1.26 0.19 115.64 126.95 1kyz s THR 96 Ca -0.02 1.39 -0.07 0.00 0.31 0.00 0.00 61.69 63.30 1kyz s THR 96 Cb -0.03 -4.03 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 1kyz s THR 96 CO 0.01 0.16 0.75 -1.58 -0.69 0.00 0.00 174.62 173.27 1kyz s GLN 97 N 1.45 3.64 0.27 4.92 2.00 0.83 -4.91 119.66 127.86 1kyz s GLN 97 Ca 0.35 0.27 0.07 0.00 -2.00 0.00 0.00 55.36 54.05 1kyz s GLN 97 Cb -0.17 -2.42 0.40 0.00 0.80 0.00 0.00 33.01 31.63 1kyz s GLN 97 CO 0.14 -0.09 1.05 1.04 -0.50 0.00 0.00 175.29 176.93 1kyz n GLN 98 N -1.74 0.05 -0.11 1.67 6.02 -1.26 0.16 117.38 122.18 1kyz n GLN 98 Ca 0.01 0.48 0.10 0.00 -0.01 0.00 0.00 57.00 57.58 1kyz n GLN 98 Cb 0.55 -2.09 0.32 0.00 1.02 0.00 0.00 30.24 30.04 1kyz n GLN 98 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1kyz n ASP 99 N -1.82 1.89 -0.11 1.08 5.75 -1.26 -4.90 116.55 117.18 1kyz n ASP 99 Ca -0.00 -1.78 -0.01 0.00 -0.01 0.00 0.00 54.79 52.98 1kyz n ASP 99 Cb 0.43 -0.14 -0.01 0.00 -1.03 0.00 0.00 41.12 40.37 1kyz n ASP 99 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kyz n GLY 100 N 1.16 0.51 3.66 6.12 0.00 0.43 -5.03 105.19 112.04 1kyz n GLY 100 Ca 0.16 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1kyz n GLY 100 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kyz s LYS 101 N -1.12 2.73 0.26 1.61 -0.14 -1.22 -4.85 119.74 117.02 1kyz s LYS 101 Ca 0.00 -0.63 -0.29 0.00 -1.36 0.00 0.00 55.97 53.69 1kyz s LYS 101 Cb 0.00 -2.63 -0.09 0.00 -1.68 0.00 0.00 37.83 33.43 1kyz s LYS 101 CO 0.00 0.62 0.98 0.14 -0.76 0.00 0.00 175.35 176.33 1kyz s VAL 102 N -1.05 3.94 -0.02 3.17 -7.23 -1.26 -0.12 120.40 117.83 1kyz s VAL 102 Ca 0.18 1.90 0.03 0.00 -1.81 0.00 0.00 61.98 62.28 1kyz s VAL 102 Cb -0.11 -4.19 0.00 0.00 0.56 0.00 0.00 36.38 32.64 1kyz s VAL 102 CO 0.09 0.41 -0.10 -1.58 -0.31 0.00 0.00 175.10 173.62 1kyz s GLN 103 N -1.37 0.95 -0.12 4.82 0.74 0.13 -4.89 119.66 119.91 1kyz s GLN 103 Ca 0.43 -0.33 -0.06 0.00 0.05 0.00 0.00 55.36 55.45 1kyz s GLN 103 Cb -0.26 -0.89 -0.04 0.00 1.10 0.00 0.00 33.01 32.92 1kyz s GLN 103 CO 0.33 0.14 0.12 1.03 -0.55 0.00 0.00 175.29 176.36 1kyz s ARG 104 N 0.08 3.40 -0.09 1.67 0.52 -1.26 -1.20 118.95 122.06 1kyz s ARG 104 Ca -0.01 -0.17 0.01 0.00 -0.52 0.00 0.00 55.73 55.04 1kyz s ARG 104 Cb -0.07 -3.14 -0.02 0.00 0.52 0.00 0.00 34.95 32.24 1kyz s ARG 104 CO 0.00 0.75 -0.13 -0.51 0.02 0.00 0.00 175.30 175.43 1kyz s LEU 105 N -0.96 2.74 -0.01 2.53 1.43 -0.54 -4.11 118.68 119.76 1kyz s LEU 105 Ca 0.14 -0.26 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1kyz s LEU 105 Cb -0.12 -1.59 -0.03 0.00 0.03 0.00 0.00 46.19 44.48 1kyz s LEU 105 CO 0.04 0.25 -0.18 -0.31 0.23 0.00 0.00 176.35 176.37 1kyz s TYR 106 N -0.14 2.57 0.28 0.29 1.51 0.13 -2.11 117.35 119.88 1kyz s TYR 106 Ca -0.01 -0.26 0.02 0.00 -1.01 0.00 0.00 57.07 55.82 1kyz s TYR 106 Cb -0.14 -1.54 -0.04 0.00 -0.11 0.00 0.00 41.96 40.14 1kyz s TYR 106 CO 0.03 0.17 0.14 0.20 -1.11 0.00 0.00 175.55 174.98 1kyz s GLY 107 N -0.99 1.88 -0.03 0.71 0.00 -0.78 -0.26 107.32 107.85 1kyz s GLY 107 Ca 0.12 -1.79 -0.18 0.00 0.00 0.00 0.00 44.72 42.88 1kyz s GLY 107 CO 0.02 -1.55 0.50 1.08 0.00 0.00 0.00 173.10 173.16 1kyz s LEU 108 N -3.32 4.40 0.48 0.66 1.43 -1.26 0.09 118.68 121.16 1kyz s LEU 108 Ca 0.37 1.00 -0.19 0.00 -1.03 0.00 0.00 54.13 54.29 1kyz s LEU 108 Cb 0.06 -2.75 -0.09 0.00 0.03 0.00 0.00 46.19 43.43 1kyz s LEU 108 CO 0.16 0.15 0.98 0.00 0.23 0.00 0.00 176.35 177.86 1kyz s ALA 109 N -0.25 3.03 0.22 4.21 0.00 -0.75 -4.66 121.76 123.56 1kyz s ALA 109 Ca 0.27 0.31 -0.09 0.00 0.00 0.00 0.00 51.96 52.46 1kyz s ALA 109 Cb -0.17 -3.15 0.19 0.00 0.00 0.00 0.00 23.12 19.99 1kyz s ALA 109 CO 0.14 -0.12 1.87 1.79 0.00 0.00 0.00 175.76 179.45 1kyz h THR 110 N 1.35 1.23 0.00 0.00 1.35 -1.91 -1.33 112.91 113.59 1kyz h THR 110 Ca -0.48 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 64.90 1kyz h THR 110 Cb 1.19 0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 1kyz h THR 110 CO 0.61 0.24 0.00 0.55 -0.25 0.00 0.00 175.52 176.66 1kyz n VAL 111 N -4.45 1.52 0.33 6.82 3.14 -1.26 -1.74 118.33 122.68 1kyz n VAL 111 Ca 0.09 0.38 0.05 0.00 -2.96 0.00 0.00 64.34 61.90 1kyz n VAL 111 Cb 0.05 -1.30 0.21 0.00 -1.06 0.00 0.00 33.84 31.73 1kyz n VAL 111 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1kyz n ALA 112 N -1.45 2.83 -0.22 1.55 0.00 -0.50 -4.58 120.51 118.13 1kyz n ALA 112 Ca 0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 53.44 52.51 1kyz n ALA 112 Cb 0.05 -1.02 0.01 0.00 0.00 0.00 0.00 19.45 18.50 1kyz n ALA 112 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1kyz h LYS 113 N 2.37 -0.13 -0.11 0.00 3.64 -1.49 -1.47 116.57 119.37 1kyz h LYS 113 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1kyz h LYS 113 Cb 0.92 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1kyz h LYS 113 CO 0.13 -0.09 0.00 0.66 -2.27 0.00 0.00 179.45 177.88 1kyz n TYR 114 N -5.44 0.00 0.87 1.91 4.02 -1.26 -2.76 117.16 114.49 1kyz n TYR 114 Ca 0.05 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 58.03 1kyz n TYR 114 Cb 0.36 -0.01 -0.12 0.00 -0.02 0.00 0.00 39.34 39.55 1kyz n TYR 114 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1kyz n LEU 115 N -0.44 0.87 -4.72 7.72 4.77 -0.55 -0.55 117.00 124.10 1kyz n LEU 115 Ca 0.00 -0.46 -0.35 0.00 -0.03 0.00 0.00 56.01 55.17 1kyz n LEU 115 Cb 0.03 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.03 1kyz n LEU 115 CO 0.00 0.22 -0.27 -0.69 -1.33 0.00 0.00 177.39 175.32 1kyz s VAL 116 N -2.95 4.65 1.23 4.08 1.01 -1.11 -4.60 120.40 122.71 1kyz s VAL 116 Ca 0.06 -0.11 -0.19 0.00 0.00 0.00 0.00 61.98 61.74 1kyz s VAL 116 Cb 0.15 -3.00 0.30 0.00 0.00 0.00 0.00 36.38 33.83 1kyz s VAL 116 CO 0.83 0.59 1.06 -0.54 0.00 0.00 0.00 175.10 177.04 1kyz s LYS 117 N -0.72 -1.46 0.00 2.72 1.02 -1.26 -4.65 119.74 115.39 1kyz s LYS 117 Ca 0.12 0.09 0.00 0.00 0.02 0.00 0.00 55.97 56.20 1kyz s LYS 117 Cb -0.12 -1.55 0.00 0.00 -0.52 0.00 0.00 37.83 35.64 1kyz s LYS 117 CO 0.02 -3.90 0.00 0.09 -0.92 0.00 0.00 175.35 170.65 1kyz n ASN 118 N -4.92 -0.62 0.00 2.83 4.13 -0.88 -4.79 115.26 111.01 1kyz n ASN 118 Ca 0.11 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.37 1kyz n ASN 118 Cb 0.59 0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.84 1kyz n ASN 118 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1kyz n GLU 119 N 2.00 0.00 0.00 3.52 2.13 -1.26 -4.48 120.64 122.54 1kyz n GLU 119 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1kyz n GLU 119 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1kyz n GLU 119 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1kyz n ASP 120 N 0.00 0.00 0.00 4.31 8.00 -1.26 -4.71 116.55 122.89 1kyz n ASP 120 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1kyz n ASP 120 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1kyz n ASP 120 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1kyz n GLY 121 N 0.00 1.03 3.69 0.44 0.00 -1.26 -5.09 105.19 104.00 1kyz n GLY 121 Ca 0.00 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 1kyz n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kyz s VAL 122 N -2.00 4.10 0.18 1.61 1.01 -1.26 -4.38 120.40 119.66 1kyz s VAL 122 Ca 0.00 -0.82 -0.23 0.00 0.00 0.00 0.00 61.98 60.92 1kyz s VAL 122 Cb 0.00 -2.91 0.06 0.00 0.00 0.00 0.00 36.38 33.54 1kyz s VAL 122 CO 0.00 0.22 0.96 -0.94 0.00 0.00 0.00 175.10 175.34 1kyz s SER 123 N -2.02 -0.12 0.13 3.32 1.04 -1.26 -2.08 113.70 112.72 1kyz s SER 123 Ca 0.24 -0.54 0.26 0.00 0.48 0.00 0.00 55.95 56.39 1kyz s SER 123 Cb -0.12 0.53 0.78 0.00 0.10 0.00 0.00 66.02 67.31 1kyz s SER 123 CO 0.15 -1.00 1.68 -0.38 0.98 0.00 0.00 173.24 174.67 1kyz n ILE 124 N -0.53 0.37 -0.12 -1.02 2.08 0.29 -3.89 119.36 116.54 1kyz n ILE 124 Ca -0.05 -0.20 0.11 0.00 0.56 0.00 0.00 62.75 63.17 1kyz n ILE 124 Cb 0.60 -0.40 0.47 0.00 -0.75 0.00 0.00 39.64 39.56 1kyz n ILE 124 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1kyz h SER 125 N 0.00 0.44 -0.05 4.38 0.02 -1.81 -0.58 113.55 115.95 1kyz h SER 125 Ca 0.00 0.01 0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1kyz h SER 125 Cb 0.67 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 1kyz h SER 125 CO 0.00 0.26 0.05 0.00 -1.14 0.00 0.00 176.83 176.00 1kyz h ALA 126 N 1.67 1.75 -0.06 3.77 0.00 -1.91 0.78 119.26 125.25 1kyz h ALA 126 Ca 0.30 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.08 1kyz h ALA 126 Cb 0.54 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1kyz h ALA 126 CO -0.09 -0.08 -0.55 -0.07 0.00 0.00 0.00 179.25 178.46 1kyz h LEU 127 N 0.00 0.21 -0.22 0.00 4.07 -1.34 -1.49 115.31 116.54 1kyz h LEU 127 Ca 0.03 -0.11 -0.17 0.00 0.08 0.00 0.00 57.88 57.71 1kyz h LEU 127 Cb 0.13 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.81 1kyz h LEU 127 CO -0.00 0.71 -0.51 -1.13 -1.08 0.00 0.00 178.44 176.43 1kyz h ASN 128 N 0.15 0.84 0.19 -0.43 -0.73 -0.92 0.64 115.58 115.31 1kyz h ASN 128 Ca 0.00 -0.56 -0.03 0.00 1.87 0.00 0.00 56.30 57.58 1kyz h ASN 128 Cb 1.01 -0.24 -0.00 0.00 0.27 0.00 0.00 38.32 39.35 1kyz h ASN 128 CO 0.08 1.24 -0.13 -0.07 -0.37 0.00 0.00 177.43 178.19 1kyz h LEU 129 N 0.47 0.00 0.00 0.34 3.38 -1.14 -2.37 115.31 115.99 1kyz h LEU 129 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1kyz h LEU 129 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1kyz h LEU 129 CO 0.11 0.13 -0.04 -0.03 0.09 0.00 0.00 178.44 178.71 1kyz h MET 130 N 0.00 0.00 -0.04 1.13 4.05 -0.99 -3.18 114.93 115.90 1kyz h MET 130 Ca -0.00 0.00 0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1kyz h MET 130 Cb 0.26 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.06 1kyz h MET 130 CO 0.02 0.00 0.04 -0.91 0.23 0.00 0.00 176.91 176.28 1kyz h ASN 131 N -0.93 0.00 -0.66 1.39 -0.26 -0.92 -1.55 115.58 112.65 1kyz h ASN 131 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1kyz h ASN 131 Cb 0.04 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.30 1kyz h ASN 131 CO 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.37 1kyz n GLN 132 N -4.29 3.69 -2.29 0.81 3.00 -0.89 -4.40 117.38 113.00 1kyz n GLN 132 Ca -0.02 -2.89 -0.39 0.00 -0.01 0.00 0.00 57.00 53.69 1kyz n GLN 132 Cb 0.13 -1.88 -0.02 0.00 0.00 0.00 0.00 30.24 28.47 1kyz n GLN 132 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1kyz s ASP 133 N -0.92 6.71 0.48 1.08 -1.08 -0.59 -4.83 116.67 117.51 1kyz s ASP 133 Ca 0.51 2.40 0.28 0.00 -0.52 0.00 0.00 52.55 55.22 1kyz s ASP 133 Cb 0.33 -2.62 1.34 0.00 -1.46 0.00 0.00 42.92 40.50 1kyz s ASP 133 CO 0.25 -0.55 1.81 0.07 0.52 0.00 0.00 175.17 177.28 1kyz h LYS 134 N 2.99 0.17 -0.09 4.34 2.10 -1.91 -1.30 116.57 122.87 1kyz h LYS 134 Ca -0.48 -0.01 -0.00 0.00 -2.00 0.00 0.00 60.65 58.15 1kyz h LYS 134 Cb 1.23 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1kyz h LYS 134 CO 0.64 0.11 0.05 0.28 -2.00 0.00 0.00 179.45 178.53 1kyz h VAL 135 N 0.17 1.11 0.00 0.07 2.07 -1.93 -2.82 116.25 114.93 1kyz h VAL 135 Ca 0.54 -0.33 -0.12 0.00 0.82 0.00 0.00 66.70 67.61 1kyz h VAL 135 Cb 1.81 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.72 1kyz h VAL 135 CO -0.13 0.10 -0.59 -0.07 0.02 0.00 0.00 177.57 176.90 1kyz h LEU 136 N 0.03 0.00 -1.43 2.57 3.38 -1.56 -3.24 115.31 115.06 1kyz h LEU 136 Ca 0.03 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1kyz h LEU 136 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1kyz h LEU 136 CO -0.00 0.59 -0.24 0.24 0.09 0.00 0.00 178.44 179.11 1kyz h MET 137 N 0.00 0.00 -0.02 1.13 2.86 -1.26 -3.09 114.93 114.55 1kyz h MET 137 Ca -0.01 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 1kyz h MET 137 Cb 1.36 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.02 1kyz h MET 137 CO 0.08 0.24 -0.10 1.49 1.06 0.00 0.00 176.91 179.68 1kyz h GLU 138 N 0.00 0.03 -0.40 1.72 4.57 -1.52 -2.78 114.58 116.20 1kyz h GLU 138 Ca -0.00 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1kyz h GLU 138 Cb 0.59 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.16 1kyz h GLU 138 CO 0.03 0.13 0.25 0.77 -1.18 0.00 0.00 179.01 179.01 1kyz h SER 139 N 0.03 0.46 -0.66 1.04 0.02 -1.74 -2.85 113.55 109.85 1kyz h SER 139 Ca 0.01 -0.02 0.08 0.00 -0.84 0.00 0.00 61.79 61.02 1kyz h SER 139 Cb 0.20 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 1kyz h SER 139 CO 0.01 0.35 0.44 -0.50 -1.14 0.00 0.00 176.83 175.99 1kyz h TRP 140 N 0.54 0.61 0.00 3.45 -0.00 -1.70 -1.08 115.95 117.78 1kyz h TRP 140 Ca 0.14 0.02 0.00 0.00 -0.00 0.00 0.00 58.89 59.05 1kyz h TRP 140 Cb -0.03 -0.20 0.00 0.00 -0.00 0.00 0.00 29.16 28.93 1kyz h TRP 140 CO 0.00 0.31 0.00 0.66 -0.00 0.00 0.00 178.44 179.41 1kyz n TYR 141 N -4.48 0.00 0.04 0.49 4.02 -1.08 -2.61 117.16 113.54 1kyz n TYR 141 Ca 0.10 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 58.03 1kyz n TYR 141 Cb 0.29 -0.44 0.09 0.00 -0.02 0.00 0.00 39.34 39.26 1kyz n TYR 141 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1kyz n HIS 142 N -1.44 0.22 -0.12 -0.72 8.25 -0.42 -4.65 115.22 116.35 1kyz n HIS 142 Ca 0.06 -0.32 -0.11 0.00 -0.26 0.00 0.00 57.72 57.08 1kyz n HIS 142 Cb 0.19 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.25 1kyz n HIS 142 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1kyz h LEU 143 N 1.55 0.65 -0.74 2.41 5.85 -1.41 -1.35 115.31 122.27 1kyz h LEU 143 Ca 0.00 -0.34 0.04 0.00 0.84 0.00 0.00 57.88 58.42 1kyz h LEU 143 Cb 0.56 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 1kyz h LEU 143 CO 0.00 0.83 0.45 0.50 -0.34 0.00 0.00 178.44 179.89 1kyz h LYS 144 N 0.45 0.83 -0.07 1.25 3.11 -1.82 -1.72 116.57 118.60 1kyz h LYS 144 Ca 0.09 -0.05 -0.09 0.00 -2.81 0.00 0.00 60.65 57.79 1kyz h LYS 144 Cb 0.53 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.56 1kyz h LYS 144 CO 0.03 0.55 -0.39 -0.44 -2.81 0.00 0.00 179.45 176.39 1kyz h ASP 145 N 0.86 0.16 -0.03 4.20 3.32 -1.82 -2.14 116.42 120.96 1kyz h ASP 145 Ca 0.31 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.20 1kyz h ASP 145 Cb 0.09 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1kyz h ASP 145 CO -0.14 0.53 -0.27 0.00 -1.72 0.00 0.00 179.24 177.65 1kyz h ALA 146 N 1.48 1.11 -0.08 3.45 0.00 -0.38 0.16 119.26 124.99 1kyz h ALA 146 Ca 0.01 -0.35 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 1kyz h ALA 146 Cb 0.75 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1kyz h ALA 146 CO 0.06 0.56 -0.28 0.28 0.00 0.00 0.00 179.25 179.86 1kyz h VAL 147 N 0.40 1.42 -0.07 0.00 2.07 -1.15 0.12 116.25 119.04 1kyz h VAL 147 Ca 0.06 -1.66 -0.21 0.00 0.82 0.00 0.00 66.70 65.71 1kyz h VAL 147 Cb 0.68 2.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 1kyz h VAL 147 CO 0.05 0.48 -0.82 -0.07 0.02 0.00 0.00 177.57 177.23 1kyz h LEU 148 N -0.15 0.65 -0.67 2.57 3.38 -1.27 -3.34 115.31 116.47 1kyz h LEU 148 Ca -0.01 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1kyz h LEU 148 Cb 0.91 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1kyz h LEU 148 CO 0.06 1.23 -0.32 0.47 0.09 0.00 0.00 178.44 179.97 1kyz n ASP 149 N -3.84 1.26 0.00 -0.43 8.00 0.55 -5.10 116.55 117.00 1kyz n ASP 149 Ca -0.06 -1.13 0.00 0.00 0.71 0.00 0.00 54.79 54.31 1kyz n ASP 149 Cb 0.76 0.56 0.00 0.00 -0.02 0.00 0.00 41.12 42.43 1kyz n ASP 149 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1kyz n GLY 150 N 1.06 -1.75 0.00 0.44 0.00 0.43 -5.00 105.19 100.37 1kyz n GLY 150 Ca 0.05 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.53 1kyz n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kyz n GLY 151 N -1.58 -1.92 3.40 -0.02 0.00 -1.25 -4.58 105.19 99.25 1kyz n GLY 151 Ca 0.00 -2.20 -0.34 0.00 0.00 0.00 0.00 46.02 43.49 1kyz n GLY 151 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1kyz s ILE 152 N -0.78 3.41 0.19 -0.61 1.09 -1.26 -4.80 121.20 118.44 1kyz s ILE 152 Ca 0.00 -0.52 -0.20 0.00 -1.10 0.00 0.00 60.65 58.83 1kyz s ILE 152 Cb 0.00 -2.48 0.14 0.00 -1.06 0.00 0.00 42.46 39.06 1kyz s ILE 152 CO 0.00 0.49 1.58 -0.65 -0.10 0.00 0.00 174.94 176.26 1kyz h PRO 153 N 7.00 -0.13 -0.31 2.79 0.11 -1.81 -0.18 132.00 139.47 1kyz h PRO 153 Ca -0.31 0.01 0.02 0.00 0.11 0.00 0.00 66.00 65.83 1kyz h PRO 153 Cb 1.19 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1kyz h PRO 153 CO 0.59 -0.09 0.16 0.35 -0.21 0.00 0.00 178.00 178.80 1kyz h PHE 154 N -0.14 0.29 -1.00 0.65 3.57 -1.61 -1.52 116.94 117.19 1kyz h PHE 154 Ca 0.25 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.81 1kyz h PHE 154 Cb 0.56 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.15 1kyz h PHE 154 CO -0.67 0.16 0.65 -0.91 -2.23 0.00 0.00 178.31 175.31 1kyz h ASN 155 N 0.33 1.06 0.11 0.41 -0.26 -1.42 -0.66 115.58 115.15 1kyz h ASN 155 Ca 0.13 -0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.77 1kyz h ASN 155 Cb 0.04 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.05 1kyz h ASN 155 CO -0.08 0.70 -0.32 0.11 -1.06 0.00 0.00 177.43 176.78 1kyz h LYS 156 N 1.22 0.32 0.08 0.81 1.57 -0.64 0.29 116.57 120.21 1kyz h LYS 156 Ca 0.41 -0.13 -0.28 0.00 -1.87 0.00 0.00 60.65 58.79 1kyz h LYS 156 Cb 0.08 -0.01 0.02 0.00 0.08 0.00 0.00 32.23 32.40 1kyz h LYS 156 CO -0.15 0.61 -1.16 0.00 -0.57 0.00 0.00 179.45 178.18 1kyz h ALA 157 N 1.39 0.11 -0.01 3.86 0.00 -0.44 -3.38 119.26 120.80 1kyz h ALA 157 Ca 0.04 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1kyz h ALA 157 Cb 0.71 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1kyz h ALA 157 CO 0.05 0.75 -0.26 0.66 0.00 0.00 0.00 179.25 180.46 1kyz n TYR 158 N -3.75 0.00 -1.89 0.00 4.02 -0.34 -5.00 117.16 110.20 1kyz n TYR 158 Ca -0.11 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.63 1kyz n TYR 158 Cb 0.95 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 40.23 1kyz n TYR 158 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1kyz n GLY 159 N 0.98 0.54 3.65 2.72 0.00 0.10 -4.96 105.19 108.23 1kyz n GLY 159 Ca 0.05 -0.31 -0.05 0.00 0.00 0.00 0.00 46.02 45.71 1kyz n GLY 159 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1kyz s MET 160 N -4.04 1.01 0.87 1.61 0.23 -1.23 -5.07 119.30 112.68 1kyz s MET 160 Ca 0.00 -0.50 -0.12 0.00 -1.03 0.00 0.00 55.69 54.04 1kyz s MET 160 Cb 0.00 0.38 0.11 0.00 -1.53 0.00 0.00 34.83 33.79 1kyz s MET 160 CO 0.00 -0.46 1.11 0.95 -2.03 0.00 0.00 175.02 174.59 1kyz s THR 161 N -3.18 2.60 0.09 3.16 -4.23 -1.26 -4.05 115.64 108.77 1kyz s THR 161 Ca 0.10 0.19 -0.16 0.00 -1.18 0.00 0.00 61.69 60.64 1kyz s THR 161 Cb -0.01 -2.86 -0.08 0.00 1.34 0.00 0.00 72.50 70.88 1kyz s THR 161 CO -0.02 -0.25 1.44 0.00 -0.54 0.00 0.00 174.62 175.24 1kyz h ALA 162 N -1.37 0.41 0.00 3.99 0.00 -1.94 -1.93 119.26 118.41 1kyz h ALA 162 Ca -0.49 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.05 1kyz h ALA 162 Cb 1.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1kyz h ALA 162 CO 0.59 0.36 -0.05 0.27 0.00 0.00 0.00 179.25 180.41 1kyz h PHE 163 N 0.39 0.00 0.17 0.00 -5.15 -1.93 -2.44 116.94 107.97 1kyz h PHE 163 Ca 0.06 0.00 -0.33 0.00 -0.20 0.00 0.00 57.97 57.49 1kyz h PHE 163 Cb 0.75 0.00 0.01 0.00 0.22 0.00 0.00 35.95 36.93 1kyz h PHE 163 CO 0.07 0.05 -1.63 0.93 -2.00 0.00 0.00 178.31 175.73 1kyz h GLU 164 N 0.00 0.36 -0.77 6.09 5.08 -1.89 -3.35 114.58 120.09 1kyz h GLU 164 Ca -0.00 -0.61 0.09 0.00 -1.00 0.00 0.00 59.36 57.84 1kyz h GLU 164 Cb 0.20 0.23 -0.05 0.00 0.50 0.00 0.00 28.75 29.62 1kyz h GLU 164 CO 0.01 1.25 0.51 -0.92 -1.00 0.00 0.00 179.01 178.86 1kyz h TYR 165 N 0.10 0.77 -0.47 4.33 3.20 -0.85 -2.99 116.97 121.05 1kyz h TYR 165 Ca -0.29 0.02 0.08 0.00 3.14 0.00 0.00 58.73 61.68 1kyz h TYR 165 Cb 2.08 -0.25 -0.10 0.00 1.54 0.00 0.00 36.73 40.00 1kyz h TYR 165 CO 0.09 0.37 -0.40 0.45 -1.64 0.00 0.00 178.16 177.03 1kyz h HIS 166 N 0.73 -1.15 -0.13 -3.82 3.86 -1.68 0.32 115.15 113.28 1kyz h HIS 166 Ca 0.35 0.07 0.04 0.00 -1.16 0.00 0.00 60.37 59.67 1kyz h HIS 166 Cb 0.41 0.57 -0.01 0.00 1.06 0.00 0.00 27.41 29.44 1kyz h HIS 166 CO -0.00 -0.42 0.23 0.78 0.86 0.00 0.00 177.93 179.38 1kyz h GLY 167 N -0.27 0.00 1.07 2.45 0.00 -1.75 -0.38 103.07 104.19 1kyz h GLY 167 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1kyz h GLY 167 CO -0.61 0.00 -0.56 -1.30 0.00 0.00 0.00 176.54 174.07 1kyz n THR 168 N -3.43 0.14 -3.54 4.70 -2.24 0.07 -4.64 114.28 105.34 1kyz n THR 168 Ca 0.00 -0.12 -0.29 0.00 -2.27 0.00 0.00 64.05 61.38 1kyz n THR 168 Cb 0.33 0.08 -0.12 0.00 -2.10 0.00 0.00 70.33 68.52 1kyz n THR 168 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1kyz s ASP 169 N -3.52 2.90 0.41 3.42 -1.08 -0.15 -5.00 116.67 113.66 1kyz s ASP 169 Ca 0.09 -2.61 0.09 0.00 -0.52 0.00 0.00 52.55 49.61 1kyz s ASP 169 Cb 0.16 -0.65 0.86 0.00 -1.46 0.00 0.00 42.92 41.82 1kyz s ASP 169 CO 0.71 -0.25 1.99 1.55 0.52 0.00 0.00 175.17 179.68 1kyz h PRO 170 N 6.53 0.32 -0.16 4.34 0.13 -1.83 -1.67 132.00 139.65 1kyz h PRO 170 Ca 0.09 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1kyz h PRO 170 Cb 0.93 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 1kyz h PRO 170 CO 0.37 0.33 0.10 -0.09 -0.23 0.00 0.00 178.00 178.49 1kyz h ARG 171 N 0.31 0.21 -0.37 0.86 2.43 -1.94 -1.87 114.38 114.02 1kyz h ARG 171 Ca 0.07 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1kyz h ARG 171 Cb 0.19 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1kyz h ARG 171 CO 0.00 0.16 0.15 0.35 -1.51 0.00 0.00 179.97 179.12 1kyz h PHE 172 N 0.20 0.57 -0.99 2.20 3.57 -1.84 -2.47 116.94 118.18 1kyz h PHE 172 Ca 0.06 -0.04 0.16 0.00 3.53 0.00 0.00 57.97 61.68 1kyz h PHE 172 Cb -0.00 -0.17 -0.09 0.00 2.79 0.00 0.00 35.95 38.47 1kyz h PHE 172 CO -0.06 0.52 0.62 -0.97 -2.23 0.00 0.00 178.31 176.18 1kyz h ASN 173 N 0.45 0.79 -0.36 0.41 -1.24 -1.12 0.26 115.58 114.78 1kyz h ASN 173 Ca 0.12 0.07 -0.10 0.00 0.71 0.00 0.00 56.30 57.10 1kyz h ASN 173 Cb 0.19 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.15 1kyz h ASN 173 CO -0.01 0.35 -0.16 0.50 -1.29 0.00 0.00 177.43 176.82 1kyz h LYS 174 N 0.81 0.75 -0.43 6.67 3.64 -1.05 -0.38 116.57 126.57 1kyz h LYS 174 Ca 0.53 -0.32 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1kyz h LYS 174 Cb 0.76 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 1kyz h LYS 174 CO -0.31 0.93 0.15 0.28 -2.27 0.00 0.00 179.45 178.23 1kyz h VAL 175 N 0.53 1.21 0.05 2.00 2.07 -0.68 -1.83 116.25 119.60 1kyz h VAL 175 Ca 0.08 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1kyz h VAL 175 Cb 0.70 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1kyz h VAL 175 CO 0.05 0.25 -0.02 0.15 0.02 0.00 0.00 177.57 178.02 1kyz h PHE 176 N 0.56 -0.06 -0.55 1.57 3.57 -0.45 -2.27 116.94 119.31 1kyz h PHE 176 Ca 0.14 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.65 1kyz h PHE 176 Cb 0.24 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 1kyz h PHE 176 CO 0.01 -0.02 0.35 -0.91 -2.23 0.00 0.00 178.31 175.51 1kyz h ASN 177 N -0.08 0.59 -0.86 0.41 2.35 -0.97 -1.73 115.58 115.29 1kyz h ASN 177 Ca -0.01 -0.01 0.02 0.00 -0.55 0.00 0.00 56.30 55.76 1kyz h ASN 177 Cb 0.07 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.26 1kyz h ASN 177 CO 0.01 0.42 0.56 0.50 -1.65 0.00 0.00 177.43 177.27 1kyz h LYS 178 N 0.70 1.09 -0.03 0.81 1.63 -1.22 0.26 116.57 119.81 1kyz h LYS 178 Ca 0.21 -0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.94 1kyz h LYS 178 Cb -0.04 -0.25 -0.00 0.00 -0.60 0.00 0.00 32.23 31.35 1kyz h LYS 178 CO -0.07 0.72 -0.01 0.78 -3.45 0.00 0.00 179.45 177.42 1kyz h GLY 179 N 1.12 0.07 1.46 5.01 0.00 -1.08 -1.26 103.07 108.40 1kyz h GLY 179 Ca 0.33 -0.06 -0.10 0.00 0.00 0.00 0.00 47.33 47.50 1kyz h GLY 179 CO -0.09 0.05 -0.21 -0.33 0.00 0.00 0.00 176.54 175.96 1kyz h MET 180 N -0.30 0.63 -0.01 4.80 2.86 -1.20 -2.28 114.93 119.43 1kyz h MET 180 Ca 0.01 -0.23 -0.00 0.00 -2.06 0.00 0.00 59.70 57.41 1kyz h MET 180 Cb 0.40 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 1kyz h MET 180 CO 0.00 0.80 0.00 1.03 1.06 0.00 0.00 176.91 179.80 1kyz h SER 181 N 0.55 0.02 -0.62 1.22 0.87 -0.46 -1.32 113.55 113.81 1kyz h SER 181 Ca 0.08 -0.23 -0.03 0.00 -1.23 0.00 0.00 61.79 60.38 1kyz h SER 181 Cb 0.67 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.60 1kyz h SER 181 CO 0.05 0.25 0.27 0.44 -0.53 0.00 0.00 176.83 177.31 1kyz h ASP 182 N -0.21 0.83 -0.31 6.23 5.19 -1.21 -2.11 116.42 124.83 1kyz h ASP 182 Ca 0.00 -0.15 -0.00 0.00 -0.62 0.00 0.00 57.03 56.26 1kyz h ASP 182 Cb 0.24 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 1kyz h ASP 182 CO 0.00 0.75 0.19 -0.74 -3.12 0.00 0.00 179.24 176.32 1kyz h HIS 183 N 0.85 0.41 -0.59 4.55 2.76 -1.38 -2.61 115.15 119.14 1kyz h HIS 183 Ca 0.21 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.39 1kyz h HIS 183 Cb 0.16 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 28.96 1kyz h HIS 183 CO 0.01 0.30 0.38 1.03 -1.30 0.00 0.00 177.93 178.35 1kyz h SER 184 N 0.40 0.65 -0.07 3.26 0.87 -1.04 -1.52 113.55 116.09 1kyz h SER 184 Ca 0.11 -0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.68 1kyz h SER 184 Cb 0.01 -0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 1kyz h SER 184 CO -0.02 0.46 -0.04 0.74 -0.53 0.00 0.00 176.83 177.45 1kyz h THR 185 N 0.77 0.88 -0.57 2.23 2.02 -1.24 0.22 112.91 117.22 1kyz h THR 185 Ca 0.22 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.37 1kyz h THR 185 Cb -0.05 0.88 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 1kyz h THR 185 CO -0.06 0.00 0.24 0.40 0.37 0.00 0.00 175.52 176.47 1kyz h ILE 186 N -0.03 1.22 -0.12 3.11 2.04 -1.29 -2.27 117.51 120.16 1kyz h ILE 186 Ca 0.04 -0.68 -0.17 0.00 1.00 0.00 0.00 64.86 65.06 1kyz h ILE 186 Cb 0.09 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1kyz h ILE 186 CO -0.09 0.26 -0.63 0.74 0.00 0.00 0.00 178.15 178.43 1kyz h THR 187 N 0.79 1.35 -0.45 -0.27 2.02 -1.10 -2.93 112.91 112.33 1kyz h THR 187 Ca 0.19 -1.96 -0.13 0.00 0.77 0.00 0.00 66.41 65.28 1kyz h THR 187 Cb 0.18 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 1kyz h THR 187 CO -0.02 0.60 -0.25 -0.03 0.37 0.00 0.00 175.52 176.19 1kyz h MET 188 N 0.33 0.94 -0.18 6.66 -1.53 -0.43 -0.41 114.93 120.31 1kyz h MET 188 Ca -0.01 -0.41 -0.01 0.00 -3.44 0.00 0.00 59.70 55.83 1kyz h MET 188 Cb 1.18 -0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 32.20 1kyz h MET 188 CO 0.11 1.07 0.09 -0.22 0.14 0.00 0.00 176.91 178.10 1kyz h LYS 189 N 0.80 0.25 -0.76 0.39 3.64 -1.43 -1.53 116.57 117.93 1kyz h LYS 189 Ca 0.10 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1kyz h LYS 189 Cb 0.82 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.55 1kyz h LYS 189 CO 0.07 0.27 0.45 -0.22 -2.27 0.00 0.00 179.45 177.75 1kyz h LYS 190 N 0.17 1.03 -0.22 1.90 1.63 -1.36 -2.53 116.57 117.19 1kyz h LYS 190 Ca 0.06 -0.09 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 1kyz h LYS 190 Cb 0.10 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 1kyz h LYS 190 CO -0.01 0.73 0.10 0.82 -3.45 0.00 0.00 179.45 177.64 1kyz h ILE 191 N 1.05 1.15 0.00 2.00 2.04 -0.62 -2.68 117.51 120.44 1kyz h ILE 191 Ca 0.27 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1kyz h ILE 191 Cb -0.04 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1kyz h ILE 191 CO -0.05 0.15 0.00 -0.07 0.00 0.00 0.00 178.15 178.17 1kyz h LEU 192 N 0.23 0.00 -0.01 1.44 4.07 -0.97 0.14 115.31 120.21 1kyz h LEU 192 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.04 1kyz h LEU 192 Cb 0.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.88 1kyz h LEU 192 CO -0.01 0.00 -0.09 -0.62 -1.08 0.00 0.00 178.44 176.64 1kyz n GLU 193 N -3.00 0.05 0.00 1.13 1.02 -0.98 -4.47 120.64 114.39 1kyz n GLU 193 Ca -0.01 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1kyz n GLU 193 Cb 0.16 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.08 1kyz n GLU 193 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1kyz n THR 194 N -1.47 0.00 -2.48 2.62 -2.24 -0.64 -5.06 114.28 105.01 1kyz n THR 194 Ca 0.07 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.44 1kyz n THR 194 Cb 0.33 -0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1kyz n THR 194 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1kyz s TYR 195 N -1.69 3.52 -0.35 4.78 5.04 0.38 -4.93 117.35 124.10 1kyz s TYR 195 Ca 0.00 1.46 0.10 0.00 -2.44 0.00 0.00 57.07 56.19 1kyz s TYR 195 Cb 0.00 -3.34 0.25 0.00 0.35 0.00 0.00 41.96 39.22 1kyz s TYR 195 CO 0.00 -0.90 1.19 0.25 -1.34 0.00 0.00 175.55 174.74 1kyz n THR 196 N 3.20 1.41 0.69 4.34 -2.24 -1.26 -4.71 114.28 115.70 1kyz n THR 196 Ca 0.06 -1.40 0.09 0.00 -2.27 0.00 0.00 64.05 60.53 1kyz n THR 196 Cb 0.47 0.22 0.41 0.00 -2.10 0.00 0.00 70.33 69.33 1kyz n THR 196 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1kyz n GLY 197 N -0.36 -1.12 0.14 3.38 0.00 -1.26 -2.39 105.19 103.59 1kyz n GLY 197 Ca 0.11 -0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1kyz n GLY 197 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1kyz h PHE 198 N 0.00 0.00 -3.24 1.61 0.05 -2.01 -3.45 116.94 109.90 1kyz h PHE 198 Ca 0.00 0.00 -0.54 0.00 3.82 0.00 0.00 57.97 61.25 1kyz h PHE 198 Cb 0.30 0.00 0.09 0.00 2.00 0.00 0.00 35.95 38.34 1kyz h PHE 198 CO 0.00 0.21 0.85 -1.91 -0.18 0.00 0.00 178.31 177.28 1kyz n GLU 199 N -2.93 2.63 0.00 1.51 2.13 -1.01 -1.91 120.64 121.06 1kyz n GLU 199 Ca -0.00 0.94 0.00 0.00 0.66 0.00 0.00 57.16 58.75 1kyz n GLU 199 Cb 0.64 -2.70 0.00 0.00 0.27 0.00 0.00 31.44 29.64 1kyz n GLU 199 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1kyz n GLY 200 N 2.10 2.22 3.80 8.31 0.00 -1.26 -5.04 105.19 115.32 1kyz n GLY 200 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1kyz n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1kyz s LEU 201 N 0.00 3.72 0.00 0.99 1.43 -0.80 -4.95 118.68 119.07 1kyz s LEU 201 Ca 0.00 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 1kyz s LEU 201 Cb 0.00 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.67 1kyz s LEU 201 CO 0.00 -0.92 0.10 2.29 0.23 0.00 0.00 176.35 178.05 1kyz n LYS 202 N -1.34 4.82 -3.69 1.70 2.85 -1.26 -4.23 118.16 117.00 1kyz n LYS 202 Ca 0.09 -0.10 -0.13 0.00 -1.05 0.00 0.00 58.31 57.12 1kyz n LYS 202 Cb 0.53 -0.57 -0.09 0.00 -0.65 0.00 0.00 35.03 34.25 1kyz n LYS 202 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1kyz s SER 203 N -0.72 -0.56 -0.19 -5.58 0.15 -1.26 -1.33 113.70 104.21 1kyz s SER 203 Ca 0.00 1.05 -0.11 0.00 0.70 0.00 0.00 55.95 57.59 1kyz s SER 203 Cb 0.00 1.05 0.06 0.00 -1.71 0.00 0.00 66.02 65.42 1kyz s SER 203 CO 0.00 -0.18 0.47 -0.22 1.20 0.00 0.00 173.24 174.51 1kyz s LEU 204 N 0.43 -0.28 -0.18 3.45 2.96 -1.13 -3.34 118.68 120.58 1kyz s LEU 204 Ca -0.01 1.03 -0.02 0.00 -0.22 0.00 0.00 54.13 54.91 1kyz s LEU 204 Cb -0.04 1.59 -0.01 0.00 0.50 0.00 0.00 46.19 48.23 1kyz s LEU 204 CO -0.01 -0.20 -0.09 0.54 -1.32 0.00 0.00 176.35 175.27 1kyz s VAL 205 N 1.44 3.17 -0.50 1.68 0.11 -0.92 -0.65 120.40 124.73 1kyz s VAL 205 Ca -0.10 -0.58 -0.19 0.00 -2.93 0.00 0.00 61.98 58.18 1kyz s VAL 205 Cb -0.08 -2.39 0.05 0.00 -1.53 0.00 0.00 36.38 32.44 1kyz s VAL 205 CO -0.14 0.47 0.62 -0.62 -3.33 0.00 0.00 175.10 172.10 1kyz s ASP 206 N 0.98 6.23 -0.21 3.54 2.15 0.21 -1.13 116.67 128.44 1kyz s ASP 206 Ca -0.01 -0.87 -0.29 0.00 0.43 0.00 0.00 52.55 51.81 1kyz s ASP 206 Cb -0.15 -2.29 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 1kyz s ASP 206 CO -0.01 -0.87 1.12 -0.69 -0.17 0.00 0.00 175.17 174.55 1kyz s VAL 207 N 2.62 4.53 -0.01 1.11 1.01 -0.24 -1.37 120.40 128.05 1kyz s VAL 207 Ca 0.15 1.85 0.00 0.00 0.00 0.00 0.00 61.98 63.98 1kyz s VAL 207 Cb -0.19 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 31.99 1kyz s VAL 207 CO 0.12 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.67 1kyz n GLY 208 N 3.44 0.37 0.00 4.51 0.00 0.16 -4.63 105.19 109.03 1kyz n GLY 208 Ca 0.13 -0.93 0.05 0.00 0.00 0.00 0.00 46.02 45.26 1kyz n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kyz n GLY 209 N -1.48 -0.73 7.00 -0.02 0.00 -0.78 -4.94 105.19 104.23 1kyz n GLY 209 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1kyz n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kyz n GLY 210 N -0.45 4.40 0.15 -0.02 0.00 -1.26 -1.58 105.19 106.43 1kyz n GLY 210 Ca 0.04 0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.34 1kyz n GLY 210 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1kyz h THR 211 N 0.00 0.00 0.00 2.61 2.02 -1.92 -3.43 112.91 112.19 1kyz h THR 211 Ca 0.00 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1kyz h THR 211 Cb 0.00 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1kyz h THR 211 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 1kyz n GLY 212 N -0.00 0.73 0.27 2.16 0.00 -0.61 -4.37 105.19 103.36 1kyz n GLY 212 Ca 0.02 -0.08 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 1kyz n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kyz h ALA 213 N 0.00 0.91 0.31 4.61 0.00 -1.90 -1.52 119.26 121.67 1kyz h ALA 213 Ca 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1kyz h ALA 213 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1kyz h ALA 213 CO 0.00 0.13 -0.15 0.28 0.00 0.00 0.00 179.25 179.51 1kyz h VAL 214 N 0.77 0.71 -0.69 0.00 2.07 -1.93 -2.03 116.25 115.16 1kyz h VAL 214 Ca 0.29 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1kyz h VAL 214 Cb 0.11 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1kyz h VAL 214 CO -0.15 0.09 0.40 -0.29 0.02 0.00 0.00 177.57 177.64 1kyz h ILE 215 N -0.65 1.20 -0.41 4.57 6.09 -1.90 -0.90 117.51 125.51 1kyz h ILE 215 Ca -0.04 -0.46 0.03 0.00 -1.37 0.00 0.00 64.86 63.02 1kyz h ILE 215 Cb 0.46 0.24 -0.04 0.00 0.47 0.00 0.00 36.82 37.96 1kyz h ILE 215 CO 0.07 0.21 0.20 -1.13 -3.07 0.00 0.00 178.15 174.43 1kyz h ASN 216 N 0.95 0.28 -0.54 2.19 -0.00 -1.22 0.31 115.58 117.56 1kyz h ASN 216 Ca 0.25 0.02 -0.00 0.00 -0.00 0.00 0.00 56.30 56.57 1kyz h ASN 216 Cb -0.01 -0.03 -0.03 0.00 -0.00 0.00 0.00 38.32 38.25 1kyz h ASN 216 CO -0.04 0.20 0.33 0.74 -0.00 0.00 0.00 177.43 178.65 1kyz h THR 217 N 0.40 1.16 0.17 -3.57 2.02 -0.54 -0.45 112.91 112.09 1kyz h THR 217 Ca 0.18 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 1kyz h THR 217 Cb 0.09 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1kyz h THR 217 CO -0.13 0.16 -0.08 0.40 0.37 0.00 0.00 175.52 176.24 1kyz h ILE 218 N 0.72 0.89 -0.97 3.11 2.04 -0.69 -2.82 117.51 119.79 1kyz h ILE 218 Ca 0.19 -0.23 0.02 0.00 1.00 0.00 0.00 64.86 65.84 1kyz h ILE 218 Cb -0.02 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 1kyz h ILE 218 CO -0.04 0.05 0.64 0.58 0.00 0.00 0.00 178.15 179.39 1kyz h VAL 219 N -0.34 1.22 -0.57 1.67 2.07 -0.83 -0.36 116.25 119.11 1kyz h VAL 219 Ca -0.02 -0.44 0.05 0.00 0.82 0.00 0.00 66.70 67.11 1kyz h VAL 219 Cb 0.26 -0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 29.83 1kyz h VAL 219 CO 0.04 0.23 0.38 0.28 0.02 0.00 0.00 177.57 178.52 1kyz h SER 220 N 1.28 0.50 0.63 0.57 0.02 -0.95 -0.68 113.55 114.91 1kyz h SER 220 Ca 0.37 -0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 61.04 1kyz h SER 220 Cb -0.10 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.34 1kyz h SER 220 CO -0.09 0.33 -1.28 0.50 -1.14 0.00 0.00 176.83 175.15 1kyz h LYS 221 N 0.57 0.24 -2.83 3.45 3.64 -1.07 -3.40 116.57 117.17 1kyz h LYS 221 Ca 0.24 -0.41 -0.61 0.00 -1.27 0.00 0.00 60.65 58.60 1kyz h LYS 221 Cb 0.24 0.15 -0.41 0.00 -0.41 0.00 0.00 32.23 31.81 1kyz h LYS 221 CO -0.07 1.17 -0.70 0.66 -2.27 0.00 0.00 179.45 178.25 1kyz n TYR 222 N -3.49 2.03 0.32 1.91 4.02 -0.23 -4.95 117.16 116.77 1kyz n TYR 222 Ca -0.09 -4.01 0.16 0.00 -0.01 0.00 0.00 57.90 53.94 1kyz n TYR 222 Cb 1.02 -0.37 0.82 0.00 -0.02 0.00 0.00 39.34 40.79 1kyz n TYR 222 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1kyz h PRO 223 N 5.39 0.00 0.00 -0.72 0.11 -1.39 0.06 132.00 135.45 1kyz h PRO 223 Ca 0.18 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.28 1kyz h PRO 223 Cb 0.79 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 1kyz h PRO 223 CO 0.62 0.00 -0.06 1.15 -0.21 0.00 0.00 178.00 179.50 1kyz h THR 224 N 0.00 0.32 -3.39 -1.15 2.02 -1.90 -3.43 112.91 105.37 1kyz h THR 224 Ca 0.01 -0.37 -0.55 0.00 0.77 0.00 0.00 66.41 66.27 1kyz h THR 224 Cb 0.69 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 1kyz h THR 224 CO -0.00 0.06 0.19 -0.63 0.37 0.00 0.00 175.52 175.51 1kyz s ILE 225 N -4.11 4.92 -1.02 3.11 1.01 0.01 -4.58 121.20 120.54 1kyz s ILE 225 Ca -0.03 1.67 -0.19 0.00 0.00 0.00 0.00 60.65 62.10 1kyz s ILE 225 Cb 0.12 -4.14 0.11 0.00 0.01 0.00 0.00 42.46 38.57 1kyz s ILE 225 CO 0.53 0.25 1.30 -0.54 0.00 0.00 0.00 174.94 176.48 1kyz s LYS 226 N 0.66 3.70 0.29 2.79 -0.14 -0.44 -4.90 119.74 121.71 1kyz s LYS 226 Ca 0.42 -1.75 -0.29 0.00 -1.36 0.00 0.00 55.97 52.99 1kyz s LYS 226 Cb -0.19 -5.10 -0.10 0.00 -1.68 0.00 0.00 37.83 30.76 1kyz s LYS 226 CO 0.22 -1.92 1.18 0.20 -0.76 0.00 0.00 175.35 174.27 1kyz s GLY 227 N 3.88 3.01 -0.09 -3.33 0.00 -1.05 -2.85 107.32 106.89 1kyz s GLY 227 Ca 0.39 1.02 0.00 0.00 0.00 0.00 0.00 44.72 46.13 1kyz s GLY 227 CO -0.07 1.66 -0.08 -0.42 0.00 0.00 0.00 173.10 174.20 1kyz s ILE 228 N -1.07 0.96 -0.25 0.90 1.01 0.17 -0.55 121.20 122.36 1kyz s ILE 228 Ca 0.47 -0.28 -0.13 0.00 0.00 0.00 0.00 60.65 60.71 1kyz s ILE 228 Cb -0.35 -0.96 -0.04 0.00 0.01 0.00 0.00 42.46 41.12 1kyz s ILE 228 CO 0.45 0.35 0.28 0.21 0.00 0.00 0.00 174.94 176.22 1kyz s ASN 229 N 1.46 6.20 -0.14 3.58 3.04 0.94 -0.62 114.94 129.40 1kyz s ASN 229 Ca -0.00 0.21 0.03 0.00 0.04 0.00 0.00 52.86 53.14 1kyz s ASN 229 Cb -0.13 -2.17 0.01 0.00 -1.54 0.00 0.00 41.25 37.42 1kyz s ASN 229 CO -0.05 -0.07 -0.22 0.12 -3.04 0.00 0.00 177.10 173.84 1kyz s PHE 230 N 1.61 2.66 0.38 0.43 5.36 -0.47 -0.75 117.98 127.19 1kyz s PHE 230 Ca 0.12 -1.33 -0.16 0.00 -0.96 0.00 0.00 56.93 54.60 1kyz s PHE 230 Cb -0.15 -1.81 0.06 0.00 -0.34 0.00 0.00 43.02 40.78 1kyz s PHE 230 CO 0.08 -0.60 0.82 0.34 -1.46 0.00 0.00 175.22 174.40 1kyz s ASP 231 N 0.79 0.03 0.76 6.13 -1.08 -1.09 0.36 116.67 122.57 1kyz s ASP 231 Ca -0.08 -1.16 -0.14 0.00 -0.52 0.00 0.00 52.55 50.65 1kyz s ASP 231 Cb -0.16 0.84 0.06 0.00 -1.46 0.00 0.00 42.92 42.20 1kyz s ASP 231 CO -0.01 -1.67 1.20 -0.76 0.52 0.00 0.00 175.17 174.45 1kyz s LEU 232 N -3.12 3.23 0.13 -1.34 1.43 -1.25 -0.97 118.68 116.80 1kyz s LEU 232 Ca 0.16 2.34 -0.21 0.00 -1.03 0.00 0.00 54.13 55.40 1kyz s LEU 232 Cb -0.05 -4.59 -0.02 0.00 0.03 0.00 0.00 46.19 41.56 1kyz s LEU 232 CO 0.11 -2.43 1.69 -0.65 0.23 0.00 0.00 176.35 175.31 1kyz h PRO 233 N -0.59 -0.07 0.00 1.29 0.11 -1.87 -1.55 132.00 129.33 1kyz h PRO 233 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1kyz h PRO 233 Cb 1.29 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1kyz h PRO 233 CO 0.48 -0.04 0.00 1.12 -0.21 0.00 0.00 178.00 179.35 1kyz h HIS 234 N -0.07 0.00 0.08 0.65 2.07 -1.97 0.40 115.15 116.32 1kyz h HIS 234 Ca 0.10 0.00 -0.22 0.00 -2.85 0.00 0.00 60.37 57.40 1kyz h HIS 234 Cb 0.21 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.19 1kyz h HIS 234 CO -0.24 0.00 -1.09 0.28 -3.07 0.00 0.00 177.93 173.81 1kyz h VAL 235 N 0.00 1.20 -0.37 6.12 2.07 -1.78 -3.35 116.25 120.14 1kyz h VAL 235 Ca 0.00 -2.38 -0.10 0.00 0.82 0.00 0.00 66.70 65.04 1kyz h VAL 235 Cb 0.17 2.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.73 1kyz h VAL 235 CO 0.00 0.63 -0.18 0.40 0.02 0.00 0.00 177.57 178.44 1kyz h ILE 236 N -0.52 1.26 -0.96 4.57 1.08 -0.91 -3.28 117.51 118.75 1kyz h ILE 236 Ca -0.24 -1.24 0.35 0.00 -0.39 0.00 0.00 64.86 63.33 1kyz h ILE 236 Cb 1.56 1.18 -0.11 0.00 -3.07 0.00 0.00 36.82 36.38 1kyz h ILE 236 CO 0.02 0.41 0.59 1.21 -0.69 0.00 0.00 178.15 179.70 1kyz n GLU 237 N -4.14 -0.03 0.00 2.37 2.13 0.14 -0.45 120.64 120.66 1kyz n GLU 237 Ca 0.00 0.96 0.00 0.00 0.66 0.00 0.00 57.16 58.79 1kyz n GLU 237 Cb 0.40 -1.85 0.00 0.00 0.27 0.00 0.00 31.44 30.25 1kyz n GLU 237 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1kyz n ASP 238 N -4.32 1.34 -4.61 4.31 3.85 -1.24 -5.07 116.55 110.81 1kyz n ASP 238 Ca 0.30 -1.49 -0.36 0.00 -0.71 0.00 0.00 54.79 52.53 1kyz n ASP 238 Cb 1.12 0.00 0.07 0.00 -1.35 0.00 0.00 41.12 40.96 1kyz n ASP 238 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1kyz n ALA 239 N -0.24 -0.12 -1.84 2.12 0.00 0.41 -4.97 120.51 115.86 1kyz n ALA 239 Ca 0.00 -0.12 -0.33 0.00 0.00 0.00 0.00 53.44 52.99 1kyz n ALA 239 Cb 0.18 -2.10 -0.06 0.00 0.00 0.00 0.00 19.45 17.46 1kyz n ALA 239 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1kyz s PRO 240 N -3.10 4.17 0.29 0.00 0.04 -1.26 -5.05 135.00 130.08 1kyz s PRO 240 Ca 0.74 1.07 -0.17 0.00 0.04 0.00 0.00 61.00 62.69 1kyz s PRO 240 Cb -0.37 -2.18 -0.09 0.00 0.04 0.00 0.00 34.50 31.90 1kyz s PRO 240 CO 0.49 -0.07 0.74 -1.12 0.04 0.00 0.00 177.00 177.08 1kyz s SER 241 N -2.35 6.89 0.01 6.66 0.01 -1.26 -4.96 113.70 118.70 1kyz s SER 241 Ca 0.61 1.34 -0.00 0.00 1.31 0.00 0.00 55.95 59.21 1kyz s SER 241 Cb -0.09 -2.39 -0.01 0.00 0.21 0.00 0.00 66.02 63.73 1kyz s SER 241 CO 0.16 -0.12 -0.01 -0.31 0.41 0.00 0.00 173.24 173.38 1kyz s TYR 242 N -1.82 0.14 0.33 2.43 1.51 -1.26 -5.11 117.35 113.58 1kyz s TYR 242 Ca 0.50 -0.29 -0.29 0.00 -1.01 0.00 0.00 57.07 55.98 1kyz s TYR 242 Cb -0.13 -0.11 -0.10 0.00 -0.11 0.00 0.00 41.96 41.51 1kyz s TYR 242 CO 0.19 -0.12 1.36 -1.25 -1.11 0.00 0.00 175.55 174.62 1kyz s PRO 243 N -0.87 4.29 -0.24 -1.71 0.04 -1.26 -2.12 135.00 133.14 1kyz s PRO 243 Ca -0.10 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.25 1kyz s PRO 243 Cb -0.06 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.43 1kyz s PRO 243 CO -0.01 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.15 1kyz n GLY 244 N 0.88 0.48 3.06 0.56 0.00 -1.26 -4.95 105.19 103.96 1kyz n GLY 244 Ca 0.01 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 1kyz n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kyz s VAL 245 N -1.77 1.52 -0.21 1.61 1.01 -0.90 -2.54 120.40 119.13 1kyz s VAL 245 Ca 0.00 -0.65 -0.07 0.00 0.00 0.00 0.00 61.98 61.26 1kyz s VAL 245 Cb 0.00 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 1kyz s VAL 245 CO 0.00 0.45 0.05 -0.70 0.00 0.00 0.00 175.10 174.89 1kyz s GLU 246 N 1.03 3.78 -0.19 2.72 2.12 0.28 -4.55 118.70 123.89 1kyz s GLU 246 Ca -0.05 -0.44 -0.14 0.00 0.36 0.00 0.00 54.97 54.70 1kyz s GLU 246 Cb -0.15 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.00 1kyz s GLU 246 CO -0.02 0.07 0.32 -1.01 -0.54 0.00 0.00 175.26 174.08 1kyz s HIS 247 N 0.90 3.40 -0.14 5.30 3.76 -1.26 -0.04 115.29 127.20 1kyz s HIS 247 Ca 0.03 0.54 -0.00 0.00 -0.15 0.00 0.00 55.06 55.48 1kyz s HIS 247 Cb -0.14 -2.41 0.02 0.00 1.11 0.00 0.00 32.58 31.16 1kyz s HIS 247 CO 0.02 0.09 -0.11 0.08 -0.85 0.00 0.00 174.74 173.98 1kyz s VAL 248 N 0.96 1.33 -0.22 -0.90 1.01 0.07 -4.96 120.40 117.69 1kyz s VAL 248 Ca 0.16 -0.50 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 1kyz s VAL 248 Cb -0.14 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 1kyz s VAL 248 CO 0.06 0.40 0.49 -0.83 0.00 0.00 0.00 175.10 175.22 1kyz s GLY 249 N 1.58 2.02 0.00 4.51 0.00 -1.26 -2.67 107.32 111.50 1kyz s GLY 249 Ca 0.05 -0.48 0.00 0.00 0.00 0.00 0.00 44.72 44.29 1kyz s GLY 249 CO -0.09 1.07 0.00 0.61 0.00 0.00 0.00 173.10 174.68 1kyz n GLY 250 N 4.02 3.50 2.64 0.20 0.00 -0.14 -4.78 105.19 110.63 1kyz n GLY 250 Ca -0.05 -0.71 -0.24 0.00 0.00 0.00 0.00 46.02 45.01 1kyz n GLY 250 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1kyz s ASP 251 N 1.86 2.12 0.46 1.61 -1.08 -1.26 -3.76 116.67 116.62 1kyz s ASP 251 Ca 0.00 -0.51 0.28 0.00 -0.52 0.00 0.00 52.55 51.81 1kyz s ASP 251 Cb 0.00 -0.14 1.54 0.00 -1.46 0.00 0.00 42.92 42.86 1kyz s ASP 251 CO 0.00 -0.34 1.86 0.00 0.52 0.00 0.00 175.17 177.21 1kyz h MET 252 N 8.41 0.00 0.00 4.34 -0.00 -1.95 0.11 114.93 125.83 1kyz h MET 252 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.55 1kyz h MET 252 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.75 1kyz h MET 252 CO 0.28 0.00 -0.19 1.19 -0.00 0.00 0.00 176.91 178.19 1kyz n PHE 253 N -2.55 0.22 -0.08 -0.10 3.01 -1.26 -4.23 117.46 112.47 1kyz n PHE 253 Ca -0.02 0.06 -0.08 0.00 1.01 0.00 0.00 57.45 58.42 1kyz n PHE 253 Cb 0.12 -0.53 -0.03 0.00 -0.01 0.00 0.00 39.48 39.03 1kyz n PHE 253 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1kyz n VAL 254 N -1.69 1.40 -3.43 -4.37 0.31 0.34 -4.87 118.33 106.01 1kyz n VAL 254 Ca 0.06 0.17 -0.13 0.00 -0.01 0.00 0.00 64.34 64.43 1kyz n VAL 254 Cb 0.36 -2.30 -0.02 0.00 -0.91 0.00 0.00 33.84 30.97 1kyz n VAL 254 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1kyz s SER 255 N -5.77 -0.58 -0.06 4.52 1.04 -1.01 -4.98 113.70 106.86 1kyz s SER 255 Ca -0.26 0.08 0.05 0.00 0.48 0.00 0.00 55.95 56.29 1kyz s SER 255 Cb 0.04 0.59 -0.00 0.00 0.10 0.00 0.00 66.02 66.74 1kyz s SER 255 CO 0.39 -0.92 -0.20 -0.63 0.98 0.00 0.00 173.24 172.86 1kyz s ILE 256 N -3.45 1.67 0.40 -1.02 1.09 -1.26 -4.29 121.20 114.34 1kyz s ILE 256 Ca -0.00 -0.84 -0.23 0.00 -1.10 0.00 0.00 60.65 58.48 1kyz s ILE 256 Cb -0.01 -1.44 -0.13 0.00 -1.06 0.00 0.00 42.46 39.82 1kyz s ILE 256 CO -0.10 0.47 0.55 -2.65 -0.10 0.00 0.00 174.94 173.11 1kyz n PRO 257 N 3.20 0.56 -2.35 2.79 -0.02 -1.26 -4.62 135.00 133.31 1kyz n PRO 257 Ca -0.18 0.20 -0.38 0.00 -2.02 0.00 0.00 63.50 61.12 1kyz n PRO 257 Cb 0.53 -1.47 -0.03 0.00 -0.02 0.00 0.00 33.50 32.51 1kyz n PRO 257 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1kyz s LYS 258 N -1.51 4.14 -0.08 -0.52 -0.14 -1.26 -4.86 119.74 115.50 1kyz s LYS 258 Ca 0.63 1.79 -0.32 0.00 -1.36 0.00 0.00 55.97 56.70 1kyz s LYS 258 Cb -0.63 -2.71 0.12 0.00 -1.68 0.00 0.00 37.83 32.93 1kyz s LYS 258 CO 0.58 -0.23 1.21 0.00 -0.76 0.00 0.00 175.35 176.15 1kyz s ALA 259 N -1.42 -2.10 -0.74 5.17 0.00 -1.19 -4.92 121.76 116.56 1kyz s ALA 259 Ca 0.56 1.09 0.26 0.00 0.00 0.00 0.00 51.96 53.87 1kyz s ALA 259 Cb -0.30 0.17 0.86 0.00 0.00 0.00 0.00 23.12 23.85 1kyz s ALA 259 CO 0.37 -0.82 1.78 -0.25 0.00 0.00 0.00 175.76 176.84 1kyz n ASP 260 N -0.29 0.72 -3.50 0.00 8.00 -1.22 -4.23 116.55 116.02 1kyz n ASP 260 Ca -0.04 0.58 -0.14 0.00 0.71 0.00 0.00 54.79 55.89 1kyz n ASP 260 Cb 0.61 -0.77 -0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1kyz n ASP 260 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1kyz s ALA 261 N -3.11 -1.54 -0.06 2.24 0.00 -1.21 -3.62 121.76 114.47 1kyz s ALA 261 Ca 0.10 0.73 0.05 0.00 0.00 0.00 0.00 51.96 52.84 1kyz s ALA 261 Cb 0.13 0.49 -0.00 0.00 0.00 0.00 0.00 23.12 23.73 1kyz s ALA 261 CO 0.57 -0.58 -0.20 0.08 0.00 0.00 0.00 175.76 175.63 1kyz s VAL 262 N -2.65 1.70 -0.05 0.00 1.01 -0.37 -2.16 120.40 117.87 1kyz s VAL 262 Ca -0.04 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.10 1kyz s VAL 262 Cb -0.01 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1kyz s VAL 262 CO -0.03 0.48 -0.07 0.12 0.00 0.00 0.00 175.10 175.60 1kyz s PHE 263 N 0.07 2.93 0.00 5.22 5.36 -0.28 0.14 117.98 131.41 1kyz s PHE 263 Ca -0.07 0.01 0.00 0.00 -0.96 0.00 0.00 56.93 55.91 1kyz s PHE 263 Cb -0.14 -1.68 0.00 0.00 -0.34 0.00 0.00 43.02 40.86 1kyz s PHE 263 CO 0.04 0.35 0.00 -0.12 -1.46 0.00 0.00 175.22 174.02 1kyz n MET 264 N 2.03 0.00 -1.78 10.12 1.56 -0.52 -1.08 117.12 127.45 1kyz n MET 264 Ca -0.17 0.00 -0.01 0.00 -0.27 0.00 0.00 57.70 57.25 1kyz n MET 264 Cb 0.53 0.00 -0.01 0.00 2.15 0.00 0.00 33.22 35.89 1kyz n MET 264 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 175.97 176.41 1kyz n LYS 265 N -0.70 -2.12 -3.75 2.12 4.81 -1.25 -4.64 118.16 112.62 1kyz n LYS 265 Ca 0.00 1.85 -0.27 0.00 -0.87 0.00 0.00 58.31 59.02 1kyz n LYS 265 Cb 0.00 -2.55 0.05 0.00 0.02 0.00 0.00 35.03 32.55 1kyz n LYS 265 CO 0.00 0.00 0.00 0.91 1.17 0.00 0.00 177.40 179.48 1kyz n TRP 266 N 0.76 -2.56 -0.03 5.64 8.01 -0.50 -4.90 117.44 123.85 1kyz n TRP 266 Ca -0.10 0.96 -0.05 0.00 -1.31 0.00 0.00 57.50 57.00 1kyz n TRP 266 Cb 0.15 -4.51 -0.02 0.00 -2.01 0.00 0.00 31.31 24.93 1kyz n TRP 266 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.69 175.79 1kyz n ILE 267 N -4.81 1.38 -0.30 -0.99 2.08 -1.26 -4.67 119.36 110.78 1kyz n ILE 267 Ca 0.01 0.25 0.11 0.00 0.56 0.00 0.00 62.75 63.68 1kyz n ILE 267 Cb 0.55 -2.02 0.28 0.00 -0.75 0.00 0.00 39.64 37.69 1kyz n ILE 267 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1kyz n HIS 269 N -5.00 0.17 1.29 0.00 1.44 -1.26 -1.55 115.22 110.32 1kyz n HIS 269 Ca 0.20 0.08 0.13 0.00 -2.01 0.00 0.00 57.72 56.12 1kyz n HIS 269 Cb 0.58 -0.62 0.36 0.00 0.12 0.00 0.00 29.99 30.43 1kyz n HIS 269 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1kyz n ASP 270 N -1.67 1.59 -4.20 4.39 8.00 -0.19 -0.60 116.55 123.87 1kyz n ASP 270 Ca 0.02 -1.35 -0.16 0.00 0.71 0.00 0.00 54.79 54.01 1kyz n ASP 270 Cb 0.12 0.10 -0.11 0.00 -0.02 0.00 0.00 41.12 41.21 1kyz n ASP 270 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1kyz s TRP 271 N -2.23 1.21 1.03 1.24 0.51 -0.59 -3.82 118.94 116.29 1kyz s TRP 271 Ca 0.30 -0.60 -0.12 0.00 -2.12 0.00 0.00 56.10 53.56 1kyz s TRP 271 Cb 0.20 -0.65 0.21 0.00 -0.81 0.00 0.00 33.47 32.42 1kyz s TRP 271 CO 0.42 0.06 1.07 -1.54 -0.51 0.00 0.00 176.95 176.46 1kyz s SER 272 N -2.40 2.24 0.17 2.95 1.04 -1.06 -4.47 113.70 112.16 1kyz s SER 272 Ca 0.06 1.37 -0.15 0.00 0.48 0.00 0.00 55.95 57.72 1kyz s SER 272 Cb -0.04 -2.07 0.05 0.00 0.10 0.00 0.00 66.02 64.06 1kyz s SER 272 CO 0.01 -3.40 1.83 0.44 0.98 0.00 0.00 173.24 173.11 1kyz h ASP 273 N -2.07 0.55 -0.45 7.02 3.32 -1.94 -0.31 116.42 122.54 1kyz h ASP 273 Ca -0.56 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.43 1kyz h ASP 273 Cb 1.32 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 1kyz h ASP 273 CO 0.54 0.40 0.09 1.05 -1.72 0.00 0.00 179.24 179.60 1kyz h GLU 274 N 0.65 0.80 -0.37 3.56 4.11 -1.99 -0.46 114.58 120.88 1kyz h GLU 274 Ca 0.18 -0.17 -0.15 0.00 0.07 0.00 0.00 59.36 59.28 1kyz h GLU 274 Cb -0.07 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 1kyz h GLU 274 CO -0.04 0.74 -0.37 0.45 0.07 0.00 0.00 179.01 179.86 1kyz h HIS 275 N 0.76 1.03 -0.34 2.06 3.86 -1.82 -2.64 115.15 118.07 1kyz h HIS 275 Ca 0.16 -0.30 0.00 0.00 -1.16 0.00 0.00 60.37 59.08 1kyz h HIS 275 Cb 0.33 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 1kyz h HIS 275 CO 0.02 1.10 0.22 0.00 0.86 0.00 0.00 177.93 180.13 1kyz h LEU 277 N 0.46 0.76 0.43 0.00 3.38 -1.05 -0.05 115.31 119.24 1kyz h LEU 277 Ca 0.12 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 1kyz h LEU 277 Cb -0.03 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1kyz h LEU 277 CO -0.03 0.51 -0.21 0.50 0.09 0.00 0.00 178.44 179.31 1kyz h LYS 278 N 0.87 -0.55 0.00 1.13 3.64 -1.00 -0.87 116.57 119.79 1kyz h LYS 278 Ca 0.31 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1kyz h LYS 278 Cb 0.13 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1kyz h LYS 278 CO -0.10 -0.31 -0.02 0.27 -2.27 0.00 0.00 179.45 177.03 1kyz h PHE 279 N -0.70 0.00 -0.06 1.91 -5.15 -1.37 -2.92 116.94 108.66 1kyz h PHE 279 Ca -0.06 0.00 -0.14 0.00 -0.20 0.00 0.00 57.97 57.57 1kyz h PHE 279 Cb 0.51 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.66 1kyz h PHE 279 CO -0.02 0.02 -0.61 1.25 -2.00 0.00 0.00 178.31 176.95 1kyz h LEU 280 N 0.00 0.22 -0.39 2.10 5.85 -0.89 -1.42 115.31 120.78 1kyz h LEU 280 Ca -0.00 -0.13 -0.18 0.00 0.84 0.00 0.00 57.88 58.41 1kyz h LEU 280 Cb 0.82 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 1kyz h LEU 280 CO 0.00 0.78 -0.65 0.11 -0.34 0.00 0.00 178.44 178.34 1kyz h LYS 281 N 0.15 0.58 -0.27 1.25 1.57 -0.97 -2.09 116.57 116.79 1kyz h LYS 281 Ca -0.01 -0.42 -0.07 0.00 -1.87 0.00 0.00 60.65 58.28 1kyz h LYS 281 Cb 1.11 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 1kyz h LYS 281 CO 0.09 1.04 -0.14 -0.91 -0.57 0.00 0.00 179.45 178.96 1kyz h ASN 282 N 0.42 0.44 -0.58 0.86 2.35 -1.33 -1.45 115.58 116.30 1kyz h ASN 282 Ca -0.02 -0.11 -0.08 0.00 -0.55 0.00 0.00 56.30 55.54 1kyz h ASN 282 Cb 1.23 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 39.46 1kyz h ASN 282 CO 0.12 0.61 0.08 0.00 -1.65 0.00 0.00 177.43 176.59 1kyz h TYR 284 N 0.93 -0.10 -0.42 0.00 3.20 -0.59 -2.67 116.97 117.33 1kyz h TYR 284 Ca 0.19 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.03 1kyz h TYR 284 Cb 0.43 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.74 1kyz h TYR 284 CO 0.03 -0.07 0.10 0.93 -1.64 0.00 0.00 178.16 177.51 1kyz h GLU 285 N -0.03 0.62 0.00 1.82 5.08 -1.04 -2.53 114.58 118.50 1kyz h GLU 285 Ca 0.05 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1kyz h GLU 285 Cb 0.11 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1kyz h GLU 285 CO -0.11 0.57 0.00 0.00 -1.00 0.00 0.00 179.01 178.47 1kyz n ALA 286 N -2.47 1.85 -2.53 3.43 0.00 -0.58 -4.83 120.51 115.39 1kyz n ALA 286 Ca 0.03 0.03 -0.29 0.00 0.00 0.00 0.00 53.44 53.20 1kyz n ALA 286 Cb 0.20 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 1kyz n ALA 286 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1kyz s LEU 287 N -4.16 4.08 0.00 0.00 1.43 -0.95 -3.17 118.68 115.91 1kyz s LEU 287 Ca 0.07 0.71 0.00 0.00 -1.03 0.00 0.00 54.13 53.88 1kyz s LEU 287 Cb 0.11 -3.52 0.00 0.00 0.03 0.00 0.00 46.19 42.81 1kyz s LEU 287 CO 0.43 -0.17 0.00 -0.81 0.23 0.00 0.00 176.35 176.02 1kyz n PRO 288 N -0.84 1.96 0.07 1.29 -0.04 -1.26 -4.89 135.00 131.29 1kyz n PRO 288 Ca -0.02 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.39 1kyz n PRO 288 Cb 0.54 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.90 1kyz n PRO 288 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1kyz h ASP 289 N 0.00 0.00 -0.78 3.54 5.19 -1.93 -3.35 116.42 119.09 1kyz h ASP 289 Ca 0.00 0.00 -0.50 0.00 -0.62 0.00 0.00 57.03 55.91 1kyz h ASP 289 Cb 0.00 0.00 -0.42 0.00 0.18 0.00 0.00 39.33 39.09 1kyz h ASP 289 CO 0.00 0.90 -0.87 0.59 -3.12 0.00 0.00 179.24 176.75 1kyz n ASN 290 N -3.30 4.29 -3.87 6.45 4.13 -1.25 -3.64 115.26 118.07 1kyz n ASN 290 Ca -0.01 -3.45 -0.21 0.00 1.68 0.00 0.00 54.58 52.59 1kyz n ASN 290 Cb 0.91 -0.38 0.13 0.00 -1.54 0.00 0.00 39.78 38.90 1kyz n ASN 290 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1kyz n GLY 291 N -0.66 -0.18 3.49 7.41 0.00 -1.24 -4.88 105.19 109.14 1kyz n GLY 291 Ca 0.37 -1.89 -0.17 0.00 0.00 0.00 0.00 46.02 44.32 1kyz n GLY 291 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kyz s LYS 292 N -4.92 1.04 -0.23 1.61 -2.85 -1.24 -2.69 119.74 110.46 1kyz s LYS 292 Ca 0.57 0.19 -0.08 0.00 -1.00 0.00 0.00 55.97 55.65 1kyz s LYS 292 Cb -0.02 0.49 -0.04 0.00 -2.06 0.00 0.00 37.83 36.19 1kyz s LYS 292 CO 0.39 -0.33 0.09 0.08 0.10 0.00 0.00 175.35 175.68 1kyz s VAL 293 N -1.32 4.74 -0.46 1.79 1.01 -0.56 -1.24 120.40 124.36 1kyz s VAL 293 Ca -0.11 -0.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.67 1kyz s VAL 293 Cb -0.00 -3.19 0.05 0.00 0.00 0.00 0.00 36.38 33.23 1kyz s VAL 293 CO 0.08 0.37 0.44 -0.63 0.00 0.00 0.00 175.10 175.37 1kyz s ILE 294 N 1.10 5.12 -0.23 2.22 1.01 0.36 -0.87 121.20 129.91 1kyz s ILE 294 Ca 0.05 -0.71 -0.10 0.00 0.00 0.00 0.00 60.65 59.89 1kyz s ILE 294 Cb -0.14 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.16 1kyz s ILE 294 CO 0.04 -0.56 0.14 -0.69 0.00 0.00 0.00 174.94 173.87 1kyz s VAL 295 N 1.99 5.21 -0.35 2.92 1.01 -0.39 -1.44 120.40 129.35 1kyz s VAL 295 Ca 0.09 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 62.15 1kyz s VAL 295 Cb -0.21 -3.42 0.06 0.00 0.00 0.00 0.00 36.38 32.82 1kyz s VAL 295 CO 0.10 0.37 0.11 0.00 0.00 0.00 0.00 175.10 175.67 1kyz s ALA 296 N 0.96 3.02 0.12 5.51 0.00 -1.26 -0.50 121.76 129.61 1kyz s ALA 296 Ca 0.07 -1.97 -0.15 0.00 0.00 0.00 0.00 51.96 49.91 1kyz s ALA 296 Cb -0.13 -2.23 0.03 0.00 0.00 0.00 0.00 23.12 20.79 1kyz s ALA 296 CO 0.03 -1.45 0.37 -1.21 0.00 0.00 0.00 175.76 173.50 1kyz s GLU 297 N 1.29 1.04 0.82 0.00 0.41 -0.77 -1.41 118.70 120.08 1kyz s GLU 297 Ca -0.00 -0.75 -0.11 0.00 -0.41 0.00 0.00 54.97 53.70 1kyz s GLU 297 Cb -0.21 0.45 0.08 0.00 -1.78 0.00 0.00 34.13 32.68 1kyz s GLU 297 CO -0.00 -0.40 1.09 0.00 -0.49 0.00 0.00 175.26 175.46 1kyz s ILE 299 N -2.98 1.27 0.05 0.00 1.01 -1.26 -4.63 121.20 114.66 1kyz s ILE 299 Ca 0.62 -0.53 -0.26 0.00 0.00 0.00 0.00 60.65 60.48 1kyz s ILE 299 Cb -0.17 -1.17 -0.05 0.00 0.01 0.00 0.00 42.46 41.08 1kyz s ILE 299 CO 0.56 0.39 0.80 -0.22 0.00 0.00 0.00 174.94 176.47 1kyz s LEU 300 N 0.89 4.45 0.54 2.97 2.96 0.72 -4.98 118.68 126.22 1kyz s LEU 300 Ca -0.10 1.50 -0.11 0.00 -0.22 0.00 0.00 54.13 55.21 1kyz s LEU 300 Cb -0.15 -3.30 -0.05 0.00 0.50 0.00 0.00 46.19 43.19 1kyz s LEU 300 CO 0.01 -0.01 0.93 -2.16 -1.32 0.00 0.00 176.35 173.79 1kyz s PRO 301 N 0.03 3.68 0.15 0.98 0.04 -1.26 -4.18 135.00 134.44 1kyz s PRO 301 Ca 0.40 0.62 -0.10 0.00 0.04 0.00 0.00 61.00 61.96 1kyz s PRO 301 Cb -0.21 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 1kyz s PRO 301 CO 0.24 -0.36 1.53 0.28 0.04 0.00 0.00 177.00 178.73 1kyz h VAL 302 N 0.23 1.27 -2.98 -0.36 2.07 -1.99 -3.44 116.25 111.05 1kyz h VAL 302 Ca -0.46 -1.44 -0.64 0.00 0.82 0.00 0.00 66.70 64.99 1kyz h VAL 302 Cb 1.19 1.19 -0.06 0.00 -1.52 0.00 0.00 31.29 32.09 1kyz h VAL 302 CO 0.62 0.49 -0.54 0.00 0.02 0.00 0.00 177.57 178.17 1kyz s ALA 303 N -4.59 3.82 0.42 1.67 0.00 -1.26 -5.10 121.76 116.72 1kyz s ALA 303 Ca -0.11 -0.87 -0.22 0.00 0.00 0.00 0.00 51.96 50.76 1kyz s ALA 303 Cb 0.12 -1.71 -0.10 0.00 0.00 0.00 0.00 23.12 21.44 1kyz s ALA 303 CO 0.88 0.77 1.00 -2.14 0.00 0.00 0.00 175.76 176.26 1kyz s PRO 304 N -2.20 4.16 0.19 0.00 0.02 -1.26 -5.06 135.00 130.84 1kyz s PRO 304 Ca 0.30 1.31 -0.09 0.00 0.02 0.00 0.00 61.00 62.54 1kyz s PRO 304 Cb -0.13 -2.34 -0.01 0.00 0.02 0.00 0.00 34.50 32.04 1kyz s PRO 304 CO 0.22 -0.11 0.31 0.16 -0.33 0.00 0.00 177.00 177.25 1kyz s ASP 305 N -1.89 0.02 0.00 2.53 -4.77 -1.26 -5.06 116.67 106.24 1kyz s ASP 305 Ca 0.61 -0.97 0.17 0.00 -3.30 0.00 0.00 52.55 49.06 1kyz s ASP 305 Cb -0.16 0.47 0.65 0.00 -1.09 0.00 0.00 42.92 42.79 1kyz s ASP 305 CO 0.20 -0.95 1.47 -1.54 0.70 0.00 0.00 175.17 175.05 1kyz n SER 306 N -0.27 1.47 -4.77 2.11 3.41 -1.26 -4.60 113.62 109.71 1kyz n SER 306 Ca -0.04 -1.76 -0.32 0.00 -0.26 0.00 0.00 58.87 56.49 1kyz n SER 306 Cb 0.63 -0.12 0.06 0.00 -0.26 0.00 0.00 64.21 64.52 1kyz n SER 306 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1kyz s SER 307 N -1.41 4.90 0.29 4.04 1.04 -1.26 -4.78 113.70 116.52 1kyz s SER 307 Ca 0.28 1.90 0.03 0.00 0.48 0.00 0.00 55.95 58.64 1kyz s SER 307 Cb 0.15 -2.54 0.45 0.00 0.10 0.00 0.00 66.02 64.18 1kyz s SER 307 CO 0.22 -1.77 1.76 -0.07 0.98 0.00 0.00 173.24 174.36 1kyz h LEU 308 N -0.46 0.50 0.00 2.42 3.38 -1.93 -1.30 115.31 117.92 1kyz h LEU 308 Ca -0.45 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.37 1kyz h LEU 308 Cb 1.24 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1kyz h LEU 308 CO 0.53 0.70 -0.00 0.00 0.09 0.00 0.00 178.44 179.76 1kyz h ALA 309 N 1.35 -0.00 -0.36 1.53 0.00 -1.97 0.17 119.26 119.98 1kyz h ALA 309 Ca 0.08 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1kyz h ALA 309 Cb 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1kyz h ALA 309 CO 0.04 -0.45 -0.08 1.15 0.00 0.00 0.00 179.25 179.90 1kyz h THR 310 N -0.11 1.28 -0.76 0.00 2.02 -1.87 -2.66 112.91 110.81 1kyz h THR 310 Ca -0.00 -1.15 0.01 0.00 0.77 0.00 0.00 66.41 66.04 1kyz h THR 310 Cb 0.10 1.27 -0.04 0.00 -1.74 0.00 0.00 68.15 67.75 1kyz h THR 310 CO 0.00 0.38 0.50 0.11 0.37 0.00 0.00 175.52 176.88 1kyz h LYS 311 N 0.50 1.00 -0.62 6.66 1.57 -1.15 -0.52 116.57 124.01 1kyz h LYS 311 Ca 0.09 -0.06 0.07 0.00 -1.87 0.00 0.00 60.65 58.88 1kyz h LYS 311 Cb 0.59 -0.22 -0.06 0.00 0.08 0.00 0.00 32.23 32.61 1kyz h LYS 311 CO 0.03 0.67 0.30 0.78 -0.57 0.00 0.00 179.45 180.66 1kyz h GLY 312 N 1.03 0.90 1.40 3.86 0.00 -0.31 0.43 103.07 110.38 1kyz h GLY 312 Ca 0.28 -0.19 -0.26 0.00 0.00 0.00 0.00 47.33 47.16 1kyz h GLY 312 CO -0.06 0.07 -1.05 -0.24 0.00 0.00 0.00 176.54 175.26 1kyz h VAL 313 N 0.54 1.35 -0.36 4.60 3.04 -1.15 -3.19 116.25 121.08 1kyz h VAL 313 Ca 0.29 -2.44 -0.08 0.00 -1.01 0.00 0.00 66.70 63.47 1kyz h VAL 313 Cb 0.27 2.50 -0.02 0.00 -2.01 0.00 0.00 31.29 32.04 1kyz h VAL 313 CO -0.23 0.74 -0.10 0.58 -1.01 0.00 0.00 177.57 177.55 1kyz h VAL 314 N 0.27 1.24 -0.32 1.51 2.07 -0.82 -1.88 116.25 118.32 1kyz h VAL 314 Ca -0.12 -1.06 0.05 0.00 0.82 0.00 0.00 66.70 66.39 1kyz h VAL 314 Cb 1.71 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 1kyz h VAL 314 CO 0.19 0.35 0.07 0.45 0.02 0.00 0.00 177.57 178.65 1kyz h HIS 315 N 0.58 0.11 -0.42 1.57 3.86 -0.94 -1.58 115.15 118.33 1kyz h HIS 315 Ca 0.11 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.23 1kyz h HIS 315 Cb 0.51 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 1kyz h HIS 315 CO 0.02 0.02 -0.15 0.82 0.86 0.00 0.00 177.93 179.50 1kyz h ILE 316 N 0.18 1.26 -0.88 2.45 1.08 -1.48 -1.54 117.51 118.58 1kyz h ILE 316 Ca 0.15 -1.23 0.01 0.00 -0.39 0.00 0.00 64.86 63.40 1kyz h ILE 316 Cb 0.16 1.10 -0.04 0.00 -3.07 0.00 0.00 36.82 34.97 1kyz h ILE 316 CO -0.20 0.42 0.58 -0.78 -0.69 0.00 0.00 178.15 177.48 1kyz h ASP 317 N 0.69 1.01 0.16 1.72 3.58 -0.78 0.86 116.42 123.67 1kyz h ASP 317 Ca 0.11 -0.03 -0.16 0.00 0.42 0.00 0.00 57.03 57.37 1kyz h ASP 317 Cb 0.64 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.43 1kyz h ASP 317 CO 0.05 0.73 -0.59 0.58 -2.88 0.00 0.00 179.24 177.13 1kyz h VAL 318 N 1.20 1.35 -0.40 2.25 2.07 -1.11 -1.42 116.25 120.18 1kyz h VAL 318 Ca 0.32 -1.89 -0.06 0.00 0.82 0.00 0.00 66.70 65.89 1kyz h VAL 318 Cb -0.14 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1kyz h VAL 318 CO -0.07 0.58 -0.02 0.40 0.02 0.00 0.00 177.57 178.48 1kyz h ILE 319 N 0.33 1.22 -0.45 4.57 2.04 -0.69 -1.14 117.51 123.39 1kyz h ILE 319 Ca -0.00 -0.92 -0.13 0.00 1.00 0.00 0.00 64.86 64.80 1kyz h ILE 319 Cb 1.12 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 1kyz h ILE 319 CO 0.10 0.32 -0.24 -0.03 0.00 0.00 0.00 178.15 178.31 1kyz h MET 320 N 0.61 0.96 -0.67 2.37 4.05 -0.53 -1.79 114.93 119.94 1kyz h MET 320 Ca 0.12 -0.43 0.00 0.00 -0.28 0.00 0.00 59.70 59.12 1kyz h MET 320 Cb 0.41 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.15 1kyz h MET 320 CO 0.02 1.09 0.43 1.25 0.23 0.00 0.00 176.91 179.93 1kyz h LEU 321 N 0.80 0.77 -0.29 3.39 5.85 -0.60 0.13 115.31 125.36 1kyz h LEU 321 Ca 0.10 -0.03 -0.20 0.00 0.84 0.00 0.00 57.88 58.59 1kyz h LEU 321 Cb 0.81 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 1kyz h LEU 321 CO 0.07 0.57 -0.85 0.00 -0.34 0.00 0.00 178.44 177.89 1kyz h ALA 322 N 1.57 0.49 0.00 1.25 0.00 -0.82 -3.41 119.26 118.34 1kyz h ALA 322 Ca 0.24 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 1kyz h ALA 322 Cb -0.09 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1kyz h ALA 322 CO -0.05 0.82 -1.19 0.72 0.00 0.00 0.00 179.25 179.55 1kyz n HIS 323 N -3.76 0.00 -4.73 0.00 8.25 -0.71 -1.78 115.22 112.49 1kyz n HIS 323 Ca -0.05 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.08 1kyz n HIS 323 Cb 0.78 -0.10 -0.12 0.00 1.12 0.00 0.00 29.99 31.67 1kyz n HIS 323 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1kyz s ASN 324 N -2.57 4.37 0.30 0.41 3.84 0.43 -4.53 114.94 117.19 1kyz s ASN 324 Ca -0.01 -0.11 0.06 0.00 0.21 0.00 0.00 52.86 53.00 1kyz s ASN 324 Cb 0.02 -1.11 0.48 0.00 -0.55 0.00 0.00 41.25 40.09 1kyz s ASN 324 CO 0.16 0.33 1.72 1.55 -2.79 0.00 0.00 177.10 178.07 1kyz h PRO 325 N 5.47 0.28 0.00 0.43 0.13 -1.92 -3.38 132.00 133.01 1kyz h PRO 325 Ca -0.45 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1kyz h PRO 325 Cb 1.17 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1kyz h PRO 325 CO 0.52 0.61 0.00 0.41 -0.23 0.00 0.00 178.00 179.31 1kyz n GLY 326 N -0.28 0.15 3.79 1.56 0.00 -1.26 -5.00 105.19 104.14 1kyz n GLY 326 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1kyz n GLY 326 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kyz s GLY 327 N -0.01 2.22 -0.19 -0.02 0.00 -1.25 -2.56 107.32 105.51 1kyz s GLY 327 Ca 0.00 0.51 -0.35 0.00 0.00 0.00 0.00 44.72 44.88 1kyz s GLY 327 CO 0.00 0.85 1.24 -1.59 0.00 0.00 0.00 173.10 173.59 1kyz s LYS 328 N -3.94 0.27 0.39 2.90 -2.85 0.23 -4.56 119.74 112.17 1kyz s LYS 328 Ca 0.66 -0.10 -0.07 0.00 -1.00 0.00 0.00 55.97 55.45 1kyz s LYS 328 Cb -0.19 0.12 -0.05 0.00 -2.06 0.00 0.00 37.83 35.65 1kyz s LYS 328 CO 0.36 -0.12 0.70 -1.21 0.10 0.00 0.00 175.35 175.19 1kyz s GLU 329 N -2.36 3.68 0.18 1.78 0.41 -1.26 -4.45 118.70 116.66 1kyz s GLU 329 Ca 0.10 0.25 0.07 0.00 -0.41 0.00 0.00 54.97 54.98 1kyz s GLU 329 Cb -0.01 -2.47 -0.04 0.00 -1.78 0.00 0.00 34.13 29.83 1kyz s GLU 329 CO -0.04 0.01 -0.14 1.03 -0.49 0.00 0.00 175.26 175.63 1kyz s ARG 330 N -3.97 1.22 0.76 1.61 0.52 -1.26 -4.92 118.95 112.91 1kyz s ARG 330 Ca 0.48 -1.49 -0.09 0.00 -0.52 0.00 0.00 55.73 54.10 1kyz s ARG 330 Cb -0.10 -0.99 0.08 0.00 0.52 0.00 0.00 34.95 34.46 1kyz s ARG 330 CO 0.34 0.16 1.10 0.95 0.02 0.00 0.00 175.30 177.87 1kyz s THR 331 N -2.87 2.15 0.24 0.02 -4.23 -1.26 -0.20 115.64 109.48 1kyz s THR 331 Ca 0.19 -0.16 -0.05 0.00 -1.18 0.00 0.00 61.69 60.49 1kyz s THR 331 Cb -0.01 -2.99 0.14 0.00 1.34 0.00 0.00 72.50 70.98 1kyz s THR 331 CO 0.05 0.00 1.77 -0.61 -0.54 0.00 0.00 174.62 175.29 1kyz h GLN 332 N -0.84 1.01 -0.48 3.99 4.15 -1.94 -2.28 115.11 118.72 1kyz h GLN 332 Ca -0.45 -0.22 -0.08 0.00 0.77 0.00 0.00 58.65 58.67 1kyz h GLN 332 Cb 1.32 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.84 1kyz h GLN 332 CO 0.61 0.89 -0.01 -0.22 -1.93 0.00 0.00 178.83 178.17 1kyz h LYS 333 N 0.96 0.81 -0.52 1.69 3.64 -1.94 -1.49 116.57 119.73 1kyz h LYS 333 Ca 0.21 -0.22 -0.10 0.00 -1.27 0.00 0.00 60.65 59.27 1kyz h LYS 333 Cb 0.33 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 1kyz h LYS 333 CO -0.00 0.82 -0.06 0.93 -2.27 0.00 0.00 179.45 178.87 1kyz h GLU 334 N 0.75 0.92 -0.43 1.90 5.08 -1.84 -0.12 114.58 120.84 1kyz h GLU 334 Ca 0.14 -0.30 -0.11 0.00 -1.00 0.00 0.00 59.36 58.09 1kyz h GLU 334 Cb 0.47 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 1kyz h GLU 334 CO 0.02 0.95 -0.19 0.74 -1.00 0.00 0.00 179.01 179.53 1kyz h PHE 335 N 0.84 0.94 -0.57 4.33 -1.00 -1.15 -1.49 116.94 118.84 1kyz h PHE 335 Ca 0.15 -0.21 -0.10 0.00 2.81 0.00 0.00 57.97 60.62 1kyz h PHE 335 Cb 0.58 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.89 1kyz h PHE 335 CO 0.03 0.95 -0.02 1.49 -1.61 0.00 0.00 178.31 179.16 1kyz h GLU 336 N 0.74 1.01 0.00 1.51 4.81 -0.96 -0.16 114.58 121.53 1kyz h GLU 336 Ca 0.11 -0.32 -0.03 0.00 -0.13 0.00 0.00 59.36 58.98 1kyz h GLU 336 Cb 0.71 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 30.00 1kyz h GLU 336 CO 0.05 1.00 -0.15 -0.44 -0.73 0.00 0.00 179.01 178.75 1kyz h ASP 337 N 0.92 0.00 -0.03 1.04 3.45 -0.77 0.13 116.42 121.16 1kyz h ASP 337 Ca 0.16 0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.53 1kyz h ASP 337 Cb 0.56 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.34 1kyz h ASP 337 CO 0.03 0.15 -0.35 -0.07 -1.57 0.00 0.00 179.24 177.43 1kyz h LEU 338 N 0.00 0.36 -0.11 1.55 3.38 -0.37 -0.32 115.31 119.80 1kyz h LEU 338 Ca -0.00 -0.71 0.02 0.00 0.09 0.00 0.00 57.88 57.27 1kyz h LEU 338 Cb 0.59 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1kyz h LEU 338 CO 0.02 1.02 -0.01 0.00 0.09 0.00 0.00 178.44 179.56 1kyz h ALA 339 N 0.35 0.09 -0.07 1.53 0.00 -0.75 -1.13 119.26 119.27 1kyz h ALA 339 Ca -0.03 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1kyz h ALA 339 Cb 1.05 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1kyz h ALA 339 CO 0.07 -0.46 -0.00 0.87 0.00 0.00 0.00 179.25 179.72 1kyz h LYS 340 N 0.03 0.02 0.00 0.00 1.79 -1.00 -1.83 116.57 115.58 1kyz h LYS 340 Ca 0.05 -0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1kyz h LYS 340 Cb 0.07 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.71 1kyz h LYS 340 CO -0.10 0.02 -0.01 0.78 -1.08 0.00 0.00 179.45 179.06 1kyz h GLY 341 N 0.02 0.00 0.13 3.86 0.00 -0.77 -0.32 103.07 106.00 1kyz h GLY 341 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1kyz h GLY 341 CO -0.06 0.00 -0.07 0.00 0.00 0.00 0.00 176.54 176.42 1kyz n ALA 342 N -2.34 2.72 -0.04 3.60 0.00 -0.45 -4.93 120.51 119.07 1kyz n ALA 342 Ca -0.03 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1kyz n ALA 342 Cb 0.09 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1kyz n ALA 342 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kyz n GLY 343 N 1.20 0.43 3.74 0.00 0.00 -0.13 -4.65 105.19 105.79 1kyz n GLY 343 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1kyz n GLY 343 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1kyz s PHE 344 N -2.10 3.35 0.15 1.61 0.40 -0.74 -4.94 117.98 115.72 1kyz s PHE 344 Ca 0.00 1.40 0.02 0.00 -0.60 0.00 0.00 56.93 57.75 1kyz s PHE 344 Cb 0.00 -3.49 -0.04 0.00 0.51 0.00 0.00 43.02 40.00 1kyz s PHE 344 CO 0.00 -1.39 1.35 1.96 0.70 0.00 0.00 175.22 177.84 1kyz h GLN 345 N 4.90 0.20 -5.63 0.44 7.50 -1.45 -3.38 115.11 117.69 1kyz h GLN 345 Ca -0.45 -0.23 -0.50 0.00 0.50 0.00 0.00 58.65 57.96 1kyz h GLN 345 Cb 1.21 0.07 -0.14 0.00 0.05 0.00 0.00 27.48 28.67 1kyz h GLN 345 CO 0.73 0.98 -0.71 0.20 -1.50 0.00 0.00 178.83 178.54 1kyz s GLY 346 N -4.52 1.71 -0.07 3.46 0.00 -0.48 -5.00 107.32 102.43 1kyz s GLY 346 Ca -0.03 -1.82 -0.06 0.00 0.00 0.00 0.00 44.72 42.81 1kyz s GLY 346 CO 0.83 -1.84 0.17 -0.12 0.00 0.00 0.00 173.10 172.15 1kyz s PHE 347 N -2.92 -0.19 -0.18 1.90 5.36 -1.26 -1.22 117.98 119.47 1kyz s PHE 347 Ca 0.27 0.48 -0.14 0.00 -0.96 0.00 0.00 56.93 56.58 1kyz s PHE 347 Cb 0.01 0.05 0.05 0.00 -0.34 0.00 0.00 43.02 42.80 1kyz s PHE 347 CO 0.11 -0.10 0.47 0.21 -1.46 0.00 0.00 175.22 174.44 1kyz s LYS 348 N 0.22 0.50 -0.23 10.12 2.47 -0.75 -4.98 119.74 127.09 1kyz s LYS 348 Ca -0.01 0.75 -0.08 0.00 -1.56 0.00 0.00 55.97 55.07 1kyz s LYS 348 Cb -0.02 0.15 -0.04 0.00 -1.46 0.00 0.00 37.83 36.46 1kyz s LYS 348 CO -0.01 -0.11 0.08 0.08 0.16 0.00 0.00 175.35 175.56 1kyz s VAL 349 N 0.78 4.63 0.00 4.02 1.01 -1.26 -0.14 120.40 129.44 1kyz s VAL 349 Ca -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1kyz s VAL 349 Cb -0.05 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1kyz s VAL 349 CO -0.06 0.37 0.00 1.41 0.00 0.00 0.00 175.10 176.82 1kyz n HIS 350 N 4.41 0.00 -0.33 5.22 8.25 0.12 -5.00 115.22 127.89 1kyz n HIS 350 Ca -0.16 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.03 1kyz n HIS 350 Cb 0.52 0.00 0.25 0.00 1.12 0.00 0.00 29.99 31.88 1kyz n HIS 350 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1kyz s ASN 352 N -2.72 1.04 -0.34 0.00 4.22 -1.26 -1.97 114.94 113.91 1kyz s ASN 352 Ca 0.59 -0.13 -0.06 0.00 -2.14 0.00 0.00 52.86 51.12 1kyz s ASN 352 Cb -0.12 -0.46 0.04 0.00 1.28 0.00 0.00 41.25 41.99 1kyz s ASN 352 CO 0.51 -0.07 0.10 0.00 -2.04 0.00 0.00 177.10 175.61 1kyz s ALA 353 N 1.02 3.04 -1.23 3.54 0.00 0.12 -4.70 121.76 123.55 1kyz s ALA 353 Ca -0.10 -1.77 -0.13 0.00 0.00 0.00 0.00 51.96 49.97 1kyz s ALA 353 Cb -0.14 -2.26 -0.01 0.00 0.00 0.00 0.00 23.12 20.71 1kyz s ALA 353 CO -0.00 -1.35 0.68 1.19 0.00 0.00 0.00 175.76 176.28 1kyz n PHE 354 N 4.80 -1.85 -0.70 0.00 0.99 -1.26 -1.28 117.46 118.16 1kyz n PHE 354 Ca -0.12 0.58 0.00 0.00 -0.00 0.00 0.00 57.45 57.91 1kyz n PHE 354 Cb 0.44 -3.65 0.00 0.00 -1.00 0.00 0.00 39.48 35.28 1kyz n PHE 354 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 1kyz n ASN 355 N -2.81 0.00 -4.59 4.37 5.15 -1.26 -4.98 115.26 111.13 1kyz n ASN 355 Ca -0.18 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.43 1kyz n ASN 355 Cb 0.63 -0.83 -0.11 0.00 -0.53 0.00 0.00 39.78 38.94 1kyz n ASN 355 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1kyz s THR 356 N -2.85 5.14 0.07 -0.44 2.01 -0.40 -4.33 115.64 114.84 1kyz s THR 356 Ca 0.00 0.11 -0.10 0.00 0.31 0.00 0.00 61.69 62.01 1kyz s THR 356 Cb 0.00 -3.42 -0.06 0.00 0.01 0.00 0.00 72.50 69.03 1kyz s THR 356 CO 0.00 0.30 0.39 -0.31 -0.69 0.00 0.00 174.62 174.31 1kyz s TYR 357 N 1.46 3.58 -0.33 4.92 1.51 0.49 0.12 117.35 129.11 1kyz s TYR 357 Ca 0.07 0.78 -0.10 0.00 -1.01 0.00 0.00 57.07 56.80 1kyz s TYR 357 Cb -0.15 -2.15 0.00 0.00 -0.11 0.00 0.00 41.96 39.55 1kyz s TYR 357 CO 0.07 0.53 0.18 0.42 -1.11 0.00 0.00 175.55 175.64 1kyz s ILE 358 N -1.39 4.69 0.28 2.71 -1.09 -0.83 -1.84 121.20 123.73 1kyz s ILE 358 Ca 0.33 -0.51 0.09 0.00 -2.23 0.00 0.00 60.65 58.33 1kyz s ILE 358 Cb -0.14 -3.45 -0.04 0.00 -1.58 0.00 0.00 42.46 37.25 1kyz s ILE 358 CO 0.18 -0.02 0.02 -0.04 -1.23 0.00 0.00 174.94 173.84 1kyz s MET 359 N 1.61 2.29 -0.10 2.79 -1.94 0.35 0.12 119.30 124.43 1kyz s MET 359 Ca 0.04 -1.46 -0.00 0.00 -1.71 0.00 0.00 55.69 52.56 1kyz s MET 359 Cb -0.18 -2.15 0.02 0.00 2.01 0.00 0.00 34.83 34.54 1kyz s MET 359 CO 0.07 0.32 -0.06 -1.21 -0.01 0.00 0.00 175.02 174.13 1kyz s GLU 360 N -3.70 1.30 -0.47 2.03 2.02 0.80 -1.26 118.70 119.42 1kyz s GLU 360 Ca 0.32 -0.18 -0.17 0.00 0.02 0.00 0.00 54.97 54.96 1kyz s GLU 360 Cb -0.05 -1.39 0.05 0.00 0.10 0.00 0.00 34.13 32.84 1kyz s GLU 360 CO 0.20 -0.24 0.50 -0.06 0.02 0.00 0.00 175.26 175.68 1kyz s PHE 361 N 1.62 3.15 0.03 1.61 0.40 -0.05 -1.81 117.98 122.92 1kyz s PHE 361 Ca 0.02 -0.63 -0.07 0.00 -0.60 0.00 0.00 56.93 55.66 1kyz s PHE 361 Cb -0.13 -3.24 -0.05 0.00 0.51 0.00 0.00 43.02 40.11 1kyz s PHE 361 CO -0.06 -0.87 0.29 -0.51 0.70 0.00 0.00 175.22 174.78 1kyz s LEU 362 N 2.17 4.36 -0.08 -0.37 1.43 -0.35 -1.49 118.68 124.34 1kyz s LEU 362 Ca 0.11 0.58 0.01 0.00 -1.03 0.00 0.00 54.13 53.80 1kyz s LEU 362 Cb -0.20 -2.76 0.02 0.00 0.03 0.00 0.00 46.19 43.27 1kyz s LEU 362 CO 0.11 0.23 -0.09 -1.59 0.23 0.00 0.00 176.35 175.23 1kyz s LYS 363 N -1.86 1.47 0.00 1.70 -2.85 -1.10 -1.14 119.74 115.96 1kyz s LYS 363 Ca 0.29 -0.30 0.00 0.00 -1.00 0.00 0.00 55.97 54.96 1kyz s LYS 363 Cb -0.13 -1.35 0.00 0.00 -2.06 0.00 0.00 37.83 34.29 1kyz s LYS 363 CO 0.17 -0.09 0.00 0.36 0.10 0.00 0.00 175.35 175.90 1kyz n LYS 364 N 4.22 0.18 0.00 1.78 2.85 -1.24 -3.61 118.16 122.34 1kyz n LYS 364 Ca -0.20 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.06 1kyz n LYS 364 Cb 0.51 -0.75 0.00 0.00 -0.65 0.00 0.00 35.03 34.14 1kyz n LYS 364 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63