#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kyz s PRO 11 N 0.00 3.53 0.50 -2.82 0.04 -1.26 -4.94 135.00 130.05 1kyz s PRO 11 Ca 0.00 1.89 0.29 0.00 0.04 0.00 0.00 61.00 63.22 1kyz s PRO 11 Cb 0.00 -2.32 0.98 0.00 0.04 0.00 0.00 34.50 33.19 1kyz s PRO 11 CO 0.00 -0.77 1.84 1.79 0.04 0.00 0.00 177.00 179.90 1kyz h THR 12 N 1.68 0.08 -3.67 1.26 1.35 -2.06 -3.44 112.91 108.11 1kyz h THR 12 Ca -0.50 -0.77 -0.17 0.00 -0.55 0.00 0.00 66.41 64.42 1kyz h THR 12 Cb 1.26 1.71 -0.22 0.00 -1.73 0.00 0.00 68.15 69.17 1kyz h THR 12 CO 0.59 0.04 -0.59 -1.38 -0.25 0.00 0.00 175.52 173.93 1kyz s HIS 13 N -3.51 0.08 -0.05 4.73 -3.43 -1.26 -4.98 115.29 106.87 1kyz s HIS 13 Ca 0.03 -0.17 -0.01 0.00 -0.80 0.00 0.00 55.06 54.11 1kyz s HIS 13 Cb 0.08 -0.07 0.03 0.00 -1.43 0.00 0.00 32.58 31.18 1kyz s HIS 13 CO 0.60 -0.20 0.01 0.42 -2.00 0.00 0.00 174.74 173.57 1kyz s ILE 14 N -1.05 0.23 1.01 -5.38 -1.09 -1.26 -5.14 121.20 108.52 1kyz s ILE 14 Ca -0.11 0.14 -0.15 0.00 -2.23 0.00 0.00 60.65 58.30 1kyz s ILE 14 Cb -0.07 -0.37 0.20 0.00 -1.58 0.00 0.00 42.46 40.64 1kyz s ILE 14 CO 0.00 0.20 1.18 -0.94 -1.23 0.00 0.00 174.94 174.16 1kyz s SER 15 N 1.58 2.62 0.45 3.58 1.04 -1.26 -4.88 113.70 116.82 1kyz s SER 15 Ca -0.02 0.67 0.25 0.00 0.48 0.00 0.00 55.95 57.33 1kyz s SER 15 Cb -0.13 -1.00 0.62 0.00 0.10 0.00 0.00 66.02 65.62 1kyz s SER 15 CO -0.03 -3.08 1.70 0.44 0.98 0.00 0.00 173.24 173.26 1kyz h ASP 16 N -1.86 0.00 0.82 7.02 3.45 -2.01 -2.69 116.42 121.15 1kyz h ASP 16 Ca -0.47 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 56.83 1kyz h ASP 16 Cb 1.29 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 40.04 1kyz h ASP 16 CO 0.47 0.09 -0.74 1.05 -1.57 0.00 0.00 179.24 178.54 1kyz h GLU 17 N 0.00 0.00 -0.28 3.56 -0.00 -2.06 -3.23 114.58 112.58 1kyz h GLU 17 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1kyz h GLU 17 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.65 1kyz h GLU 17 CO 0.01 0.74 0.00 -0.85 -0.00 0.00 0.00 179.01 178.91 1kyz n GLU 18 N -3.58 2.09 0.09 1.06 0.28 -1.20 -4.49 120.64 114.88 1kyz n GLU 18 Ca -0.00 -1.94 0.06 0.00 -0.16 0.00 0.00 57.16 55.12 1kyz n GLU 18 Cb 0.74 -1.37 0.51 0.00 1.43 0.00 0.00 31.44 32.74 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 3.27 1.83 -0.31 -1.84 0.00 -1.49 -1.50 119.26 119.21 1kyz h ALA 19 Ca 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1kyz h ALA 19 Cb 0.79 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1kyz h ALA 19 CO 0.00 0.15 0.04 -0.97 0.00 0.00 0.00 179.25 178.46 1kyz h ASN 20 N 0.35 0.51 -0.10 0.00 -1.24 -1.81 -1.94 115.58 111.36 1kyz h ASN 20 Ca 0.11 -0.27 -0.09 0.00 0.71 0.00 0.00 56.30 56.75 1kyz h ASN 20 Cb -0.00 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 38.90 1kyz h ASN 20 CO -0.02 0.66 -0.20 -0.07 -1.29 0.00 0.00 177.43 176.50 1kyz h LEU 21 N 0.35 0.50 -0.48 0.34 3.38 -1.64 -1.92 115.31 115.83 1kyz h LEU 21 Ca 0.09 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1kyz h LEU 21 Cb 0.37 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1kyz h LEU 21 CO 0.01 0.71 -0.05 0.15 0.09 0.00 0.00 178.44 179.35 1kyz h PHE 22 N 0.45 0.98 -0.51 1.13 -0.00 -1.22 -1.30 116.94 116.47 1kyz h PHE 22 Ca 0.07 -0.19 -0.00 0.00 -0.00 0.00 0.00 57.97 57.85 1kyz h PHE 22 Cb 0.61 -0.25 -0.03 0.00 -0.00 0.00 0.00 35.95 36.29 1kyz h PHE 22 CO 0.02 0.94 0.31 0.00 -0.00 0.00 0.00 178.31 179.58 1kyz h ALA 23 N 0.91 1.58 -0.25 2.41 0.00 -0.97 -0.68 119.26 122.26 1kyz h ALA 23 Ca 0.13 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 1kyz h ALA 23 Cb 0.58 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1kyz h ALA 23 CO 0.04 0.37 -0.56 0.52 0.00 0.00 0.00 179.25 179.61 1kyz h MET 24 N 0.70 0.77 -0.33 0.00 2.86 -0.95 -1.25 114.93 116.74 1kyz h MET 24 Ca 0.18 -0.50 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1kyz h MET 24 Cb -0.03 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1kyz h MET 24 CO -0.04 1.12 0.21 0.37 1.06 0.00 0.00 176.91 179.64 1kyz h GLN 25 N 0.59 0.43 -0.52 1.72 4.15 -0.23 -2.23 115.11 119.03 1kyz h GLN 25 Ca 0.01 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 1kyz h GLN 25 Cb 1.15 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.72 1kyz h GLN 25 CO 0.12 0.31 0.24 -0.07 -1.93 0.00 0.00 178.83 177.49 1kyz h LEU 26 N 0.43 0.66 -1.84 -2.39 3.38 -1.09 -1.40 115.31 113.07 1kyz h LEU 26 Ca 0.12 -0.06 0.10 0.00 0.09 0.00 0.00 57.88 58.12 1kyz h LEU 26 Cb -0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1kyz h LEU 26 CO -0.02 0.57 0.32 0.00 0.09 0.00 0.00 178.44 179.39 1kyz h ALA 27 N 1.54 2.19 -0.43 1.53 0.00 -0.58 -2.98 119.26 120.52 1kyz h ALA 27 Ca 0.18 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.79 1kyz h ALA 27 Cb 0.09 -0.02 -0.39 0.00 0.00 0.00 0.00 17.79 17.47 1kyz h ALA 27 CO -0.02 -0.30 -1.03 -1.13 0.00 0.00 0.00 179.25 176.77 1kyz n SER 28 N -4.45 2.17 0.03 0.00 3.41 -1.08 -4.89 113.62 108.81 1kyz n SER 28 Ca 0.07 -2.43 0.06 0.00 -0.26 0.00 0.00 58.87 56.32 1kyz n SER 28 Cb 0.40 -0.43 0.28 0.00 -0.26 0.00 0.00 64.21 64.20 1kyz n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kyz n ALA 29 N -0.51 1.45 0.33 7.33 0.00 -0.55 -2.12 120.51 126.45 1kyz n ALA 29 Ca 0.15 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.74 1kyz n ALA 29 Cb 0.87 -1.20 0.56 0.00 0.00 0.00 0.00 19.45 19.67 1kyz n ALA 29 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1kyz h SER 30 N 0.00 0.00 -0.82 0.00 4.64 -1.87 -3.18 113.55 112.32 1kyz h SER 30 Ca 0.00 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.44 1kyz h SER 30 Cb 0.19 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.20 1kyz h SER 30 CO 0.00 0.00 0.44 0.58 -0.87 0.00 0.00 176.83 176.98 1kyz h VAL 31 N 0.00 0.82 0.80 0.95 2.07 -1.82 -2.17 116.25 116.90 1kyz h VAL 31 Ca 0.00 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1kyz h VAL 31 Cb 0.55 0.07 0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1kyz h VAL 31 CO 0.00 0.13 -0.39 0.25 0.02 0.00 0.00 177.57 177.58 1kyz h LEU 32 N 0.69 -0.91 -1.26 2.57 5.85 -1.80 -0.92 115.31 119.53 1kyz h LEU 32 Ca 0.42 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 59.17 1kyz h LEU 32 Cb 0.49 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 1kyz h LEU 32 CO -0.30 -0.56 0.39 1.55 -0.34 0.00 0.00 178.44 179.18 1kyz h PRO 33 N -1.27 0.89 -0.23 5.25 0.13 -1.74 -0.75 132.00 134.28 1kyz h PRO 33 Ca -0.11 -0.08 -0.18 0.00 -0.87 0.00 0.00 66.00 64.77 1kyz h PRO 33 Cb 0.83 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 31.77 1kyz h PRO 33 CO 0.18 0.63 -0.56 0.52 -0.23 0.00 0.00 178.00 178.55 1kyz h MET 34 N 0.91 0.72 -0.35 0.86 2.86 -1.44 -1.25 114.93 117.24 1kyz h MET 34 Ca 0.24 -0.46 -0.15 0.00 -2.06 0.00 0.00 59.70 57.27 1kyz h MET 34 Cb -0.03 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1kyz h MET 34 CO -0.04 1.08 -0.38 0.82 1.06 0.00 0.00 176.91 179.45 1kyz h ILE 35 N 0.55 1.28 -0.46 -1.22 1.08 -0.88 -1.50 117.51 116.36 1kyz h ILE 35 Ca 0.01 -1.55 -0.02 0.00 -0.39 0.00 0.00 64.86 62.91 1kyz h ILE 35 Cb 1.14 1.41 -0.02 0.00 -3.07 0.00 0.00 36.82 36.27 1kyz h ILE 35 CO 0.11 0.51 0.21 0.25 -0.69 0.00 0.00 178.15 178.54 1kyz h LEU 36 N 0.69 0.61 0.02 1.44 6.46 -1.07 -1.00 115.31 122.46 1kyz h LEU 36 Ca 0.06 -0.14 0.02 0.00 -0.12 0.00 0.00 57.88 57.69 1kyz h LEU 36 Cb 0.94 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.69 1kyz h LEU 36 CO 0.09 0.59 -0.11 0.50 -0.62 0.00 0.00 178.44 178.88 1kyz h LYS 37 N 0.60 -0.19 -0.72 1.25 3.64 -1.05 -0.20 116.57 119.89 1kyz h LYS 37 Ca 0.16 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.61 1kyz h LYS 37 Cb 0.15 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.97 1kyz h LYS 37 CO -0.02 -0.13 0.47 0.77 -2.27 0.00 0.00 179.45 178.28 1kyz h SER 38 N -0.20 0.67 -0.23 4.20 0.02 -1.07 0.16 113.55 117.10 1kyz h SER 38 Ca 0.03 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.88 1kyz h SER 38 Cb 0.24 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1kyz h SER 38 CO -0.10 0.43 -0.23 0.00 -1.14 0.00 0.00 176.83 175.80 1kyz h ALA 39 N 1.61 0.94 -0.14 3.77 0.00 -0.50 -1.71 119.26 123.22 1kyz h ALA 39 Ca 0.31 -0.36 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 1kyz h ALA 39 Cb 0.24 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1kyz h ALA 39 CO -0.10 0.61 -0.65 -0.07 0.00 0.00 0.00 179.25 179.04 1kyz h LEU 40 N 0.61 0.62 -1.39 0.00 3.38 0.49 0.54 115.31 119.56 1kyz h LEU 40 Ca 0.09 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 1kyz h LEU 40 Cb 0.71 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1kyz h LEU 40 CO 0.05 1.11 -0.19 -0.33 0.09 0.00 0.00 178.44 179.17 1kyz h GLU 41 N 0.39 0.17 -0.01 1.13 5.08 -0.51 -1.13 114.58 119.70 1kyz h GLU 41 Ca -0.01 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1kyz h GLU 41 Cb 1.21 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1kyz h GLU 41 CO 0.12 0.36 -0.07 1.28 -1.00 0.00 0.00 179.01 179.70 1kyz n LEU 42 N -4.24 0.95 -2.32 1.33 4.77 -0.67 -4.93 117.00 111.89 1kyz n LEU 42 Ca -0.01 -0.26 -0.20 0.00 -0.03 0.00 0.00 56.01 55.50 1kyz n LEU 42 Cb 0.30 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 1kyz n LEU 42 CO 0.38 0.16 -0.26 -0.67 -1.33 0.00 0.00 177.39 175.67 1kyz n ASP 43 N -0.42 -5.82 -0.23 -1.43 4.64 -0.43 -4.91 116.55 107.95 1kyz n ASP 43 Ca 0.17 -0.01 -0.06 0.00 -1.38 0.00 0.00 54.79 53.52 1kyz n ASP 43 Cb 0.30 -4.84 0.04 0.00 -1.04 0.00 0.00 41.12 35.58 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 0.76 -1.10 -2.67 3.38 -1.18 -1.79 115.31 112.71 1kyz h LEU 44 Ca -0.49 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.38 1kyz h LEU 44 Cb 1.36 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 1kyz h LEU 44 CO 0.58 0.59 0.10 -0.07 0.09 0.00 0.00 178.44 179.73 1kyz h LEU 45 N 0.87 0.69 -0.18 1.67 3.38 -1.91 -1.85 115.31 117.97 1kyz h LEU 45 Ca 0.23 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1kyz h LEU 45 Cb -0.04 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 1kyz h LEU 45 CO -0.04 0.69 0.01 -0.33 0.09 0.00 0.00 178.44 178.86 1kyz h GLU 46 N 0.71 0.31 -0.56 1.13 4.39 -1.84 -0.91 114.58 117.81 1kyz h GLU 46 Ca 0.16 -0.09 0.07 0.00 0.34 0.00 0.00 59.36 59.84 1kyz h GLU 46 Cb 0.29 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.85 1kyz h GLU 46 CO 0.00 0.50 0.23 0.82 -1.16 0.00 0.00 179.01 179.40 1kyz h ILE 47 N 0.08 0.84 -0.27 3.13 2.04 -1.07 0.86 117.51 123.12 1kyz h ILE 47 Ca 0.05 -0.15 -0.06 0.00 1.00 0.00 0.00 64.86 65.71 1kyz h ILE 47 Cb 0.35 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1kyz h ILE 47 CO 0.01 0.08 -0.08 0.40 0.00 0.00 0.00 178.15 178.56 1kyz h ILE 48 N 0.43 1.20 -0.34 -0.67 2.04 -1.20 -2.84 117.51 116.13 1kyz h ILE 48 Ca 0.27 -0.86 -0.00 0.00 1.00 0.00 0.00 64.86 65.27 1kyz h ILE 48 Cb 0.28 1.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.43 1kyz h ILE 48 CO -0.25 0.28 0.21 0.00 0.00 0.00 0.00 178.15 178.39 1kyz h ALA 49 N 1.52 0.44 -0.22 1.87 0.00 0.56 -2.40 119.26 121.03 1kyz h ALA 49 Ca 0.08 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1kyz h ALA 49 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1kyz h ALA 49 CO 0.02 -0.06 0.21 0.87 0.00 0.00 0.00 179.25 180.29 1kyz h LYS 50 N 0.45 0.00 0.00 0.00 1.57 -0.90 -0.68 116.57 117.00 1kyz h LYS 50 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1kyz h LYS 50 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1kyz h LYS 50 CO -0.02 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.86 1kyz n ALA 51 N -2.41 1.37 0.00 3.86 0.00 -0.90 -4.97 120.51 117.46 1kyz n ALA 51 Ca 0.02 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1kyz n ALA 51 Cb 0.35 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.47 1kyz n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1kyz n GLY 52 N -0.62 2.28 3.74 0.00 0.00 -0.26 -4.76 105.19 105.57 1kyz n GLY 52 Ca 0.01 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.68 1kyz n GLY 52 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1kyz s PRO 53 N -2.85 4.16 0.00 1.61 0.04 -1.26 -2.14 135.00 134.56 1kyz s PRO 53 Ca 0.00 2.52 0.00 0.00 0.04 0.00 0.00 61.00 63.56 1kyz s PRO 53 Cb 0.00 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1kyz s PRO 53 CO 0.00 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.81 1kyz n GLY 54 N 2.96 0.65 3.78 0.56 0.00 -1.26 -5.00 105.19 106.89 1kyz n GLY 54 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.86 3.19 -0.09 4.61 0.00 -0.91 -5.03 121.76 120.67 1kyz s ALA 55 Ca 0.00 0.55 -0.00 0.00 0.00 0.00 0.00 51.96 52.51 1kyz s ALA 55 Cb 0.00 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.95 1kyz s ALA 55 CO 0.00 0.11 -0.06 -0.65 0.00 0.00 0.00 175.76 175.17 1kyz s GLN 56 N -2.16 1.24 0.17 0.00 -0.21 -1.26 -4.00 119.66 113.44 1kyz s GLN 56 Ca 0.52 -0.16 0.09 0.00 0.02 0.00 0.00 55.36 55.82 1kyz s GLN 56 Cb -0.19 -1.34 -0.04 0.00 1.00 0.00 0.00 33.01 32.44 1kyz s GLN 56 CO 0.24 -0.23 -0.19 0.96 -2.12 0.00 0.00 175.29 173.95 1kyz s ILE 57 N 1.59 1.90 0.78 1.08 -4.36 0.11 -4.63 121.20 117.67 1kyz s ILE 57 Ca 0.01 -1.94 -0.12 0.00 -0.26 0.00 0.00 60.65 58.35 1kyz s ILE 57 Cb -0.13 -1.88 0.06 0.00 1.25 0.00 0.00 42.46 41.75 1kyz s ILE 57 CO -0.05 -0.29 1.11 -0.94 0.24 0.00 0.00 174.94 175.01 1kyz s SER 58 N -2.67 4.72 0.50 4.36 1.04 -1.26 -0.27 113.70 120.12 1kyz s SER 58 Ca 0.16 1.15 0.18 0.00 0.48 0.00 0.00 55.95 57.93 1kyz s SER 58 Cb -0.06 -1.86 1.26 0.00 0.10 0.00 0.00 66.02 65.46 1kyz s SER 58 CO 0.07 -1.80 2.10 -0.65 0.98 0.00 0.00 173.24 173.93 1kyz h PRO 59 N -0.98 0.00 -0.16 4.02 0.11 -1.87 -0.83 132.00 132.29 1kyz h PRO 59 Ca -0.47 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.45 1kyz h PRO 59 Cb 1.28 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.39 1kyz h PRO 59 CO 0.62 0.08 -0.66 0.82 -0.21 0.00 0.00 178.00 178.65 1kyz h ILE 60 N 0.00 1.30 -0.31 4.15 2.04 -1.93 0.21 117.51 122.97 1kyz h ILE 60 Ca -0.00 -1.89 -0.03 0.00 1.00 0.00 0.00 64.86 63.94 1kyz h ILE 60 Cb 0.16 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 1kyz h ILE 60 CO 0.01 0.59 0.07 -0.33 0.00 0.00 0.00 178.15 178.50 1kyz h GLU 61 N 0.44 0.49 -0.11 2.37 5.08 -1.78 -0.94 114.58 120.13 1kyz h GLU 61 Ca -0.04 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1kyz h GLU 61 Cb 1.29 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1kyz h GLU 61 CO 0.14 0.57 0.06 0.82 -1.00 0.00 0.00 179.01 179.60 1kyz h ILE 62 N 0.34 1.07 -0.60 3.13 2.04 -1.16 -2.77 117.51 119.55 1kyz h ILE 62 Ca 0.10 -0.20 0.04 0.00 1.00 0.00 0.00 64.86 65.81 1kyz h ILE 62 Cb 0.29 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1kyz h ILE 62 CO 0.00 0.07 0.40 0.00 0.00 0.00 0.00 178.15 178.61 1kyz h ALA 63 N 0.98 1.74 0.00 1.87 0.00 -0.42 -0.48 119.26 122.94 1kyz h ALA 63 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1kyz h ALA 63 Cb 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1kyz h ALA 63 CO -0.01 0.19 0.00 0.66 0.00 0.00 0.00 179.25 180.09 1kyz h SER 64 N 0.65 0.00 -0.44 0.00 4.64 -0.87 -1.13 113.55 116.40 1kyz h SER 64 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1kyz h SER 64 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1kyz h SER 64 CO -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.89 1kyz n GLN 65 N -2.56 2.38 -3.73 4.77 1.13 -0.19 -4.91 117.38 114.27 1kyz n GLN 65 Ca -0.01 -2.11 -0.32 0.00 -1.94 0.00 0.00 57.00 52.62 1kyz n GLN 65 Cb 0.14 -1.49 -0.05 0.00 0.11 0.00 0.00 30.24 28.95 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 -1.34 4.31 -1.17 1.08 1.43 -0.43 -4.98 118.68 117.57 1kyz s LEU 66 Ca 0.39 0.54 -0.08 0.00 -1.03 0.00 0.00 54.13 53.96 1kyz s LEU 66 Cb 0.22 -3.10 -0.09 0.00 0.03 0.00 0.00 46.19 43.25 1kyz s LEU 66 CO 0.30 0.12 2.63 -0.81 0.23 0.00 0.00 176.35 178.82 1kyz n PRO 67 N 0.38 2.84 -3.75 1.29 -0.04 -1.26 -4.82 135.00 129.64 1kyz n PRO 67 Ca -0.05 -1.76 -0.10 0.00 -0.04 0.00 0.00 63.50 61.56 1kyz n PRO 67 Cb 0.52 -2.57 -0.04 0.00 -0.04 0.00 0.00 33.50 31.37 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 2.59 0.03 0.00 0.52 -1.32 -1.26 -5.04 115.64 111.16 1kyz s THR 68 Ca 0.56 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 60.22 1kyz s THR 68 Cb 0.16 -1.60 0.00 0.00 -1.51 0.00 0.00 72.50 69.54 1kyz s THR 68 CO -0.04 -0.12 0.93 0.35 -2.21 0.00 0.00 174.62 173.52 1kyz n THR 69 N -0.34 0.86 -1.64 5.08 -2.24 -1.26 -4.98 114.28 109.76 1kyz n THR 69 Ca -0.10 -0.90 -0.44 0.00 -2.27 0.00 0.00 64.05 60.34 1kyz n THR 69 Cb 0.62 0.57 -0.04 0.00 -2.10 0.00 0.00 70.33 69.39 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 -0.43 3.66 0.30 3.42 5.15 -1.26 -4.85 115.26 121.24 1kyz n ASN 70 Ca 0.00 0.69 0.15 0.00 -0.60 0.00 0.00 54.58 54.82 1kyz n ASN 70 Cb 0.24 -1.49 0.91 0.00 -0.53 0.00 0.00 39.78 38.91 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 11.67 0.00 0.00 1.20 0.11 -2.04 -2.08 132.00 140.86 1kyz h PRO 71 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1kyz h PRO 71 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1kyz h PRO 71 CO 0.95 0.00 -0.32 -0.25 -0.21 0.00 0.00 178.00 178.17 1kyz n ASP 72 N -3.86 0.36 -0.14 -2.05 8.00 -1.26 -4.34 116.55 113.26 1kyz n ASP 72 Ca -0.03 0.06 -0.04 0.00 0.71 0.00 0.00 54.79 55.49 1kyz n ASP 72 Cb 0.08 -0.05 0.02 0.00 -0.02 0.00 0.00 41.12 41.16 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 2.94 0.18 -0.26 2.24 0.00 -1.76 -1.83 119.26 120.77 1kyz h ALA 73 Ca 0.00 0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1kyz h ALA 73 Cb 0.53 0.45 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 1kyz h ALA 73 CO 0.00 -0.52 -0.08 -1.35 0.00 0.00 0.00 179.25 177.30 1kyz h PRO 74 N -0.08 -0.02 -0.75 0.00 0.11 -1.80 0.10 132.00 129.56 1kyz h PRO 74 Ca 0.22 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.29 1kyz h PRO 74 Cb 0.41 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 31.49 1kyz h PRO 74 CO -0.50 -0.01 0.31 0.28 -0.21 0.00 0.00 178.00 177.86 1kyz h VAL 75 N -0.02 1.25 -0.53 3.15 2.07 -1.79 0.66 116.25 121.04 1kyz h VAL 75 Ca 0.13 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1kyz h VAL 75 Cb 0.22 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1kyz h VAL 75 CO -0.28 0.32 0.31 0.24 0.02 0.00 0.00 177.57 178.17 1kyz h MET 76 N 1.07 0.73 -0.50 1.57 2.86 -0.87 -2.15 114.93 117.65 1kyz h MET 76 Ca 0.25 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.79 1kyz h MET 76 Cb 0.20 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1kyz h MET 76 CO -0.02 0.55 0.23 -0.07 1.06 0.00 0.00 176.91 178.66 1kyz h LEU 77 N 0.71 0.65 -0.55 1.22 3.38 -0.39 -2.30 115.31 118.04 1kyz h LEU 77 Ca 0.19 -0.14 0.09 0.00 0.09 0.00 0.00 57.88 58.12 1kyz h LEU 77 Cb 0.02 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.53 1kyz h LEU 77 CO -0.03 0.61 0.15 -0.78 0.09 0.00 0.00 178.44 178.47 1kyz h ASP 78 N 0.66 0.08 -0.39 -0.43 3.58 -0.45 0.30 116.42 119.76 1kyz h ASP 78 Ca 0.17 0.09 -0.07 0.00 0.42 0.00 0.00 57.03 57.64 1kyz h ASP 78 Cb 0.13 0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.27 1kyz h ASP 78 CO -0.02 0.06 0.01 0.03 -2.88 0.00 0.00 179.24 176.44 1kyz h ARG 79 N 0.30 0.77 -0.01 0.28 3.08 -1.12 0.11 114.38 117.78 1kyz h ARG 79 Ca 0.28 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 1kyz h ARG 79 Cb 0.37 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.33 1kyz h ARG 79 CO -0.33 0.77 -0.02 0.52 -1.07 0.00 0.00 179.97 179.84 1kyz h MET 80 N 0.72 0.04 -0.59 0.04 2.86 -0.71 -3.17 114.93 114.11 1kyz h MET 80 Ca 0.14 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.74 1kyz h MET 80 Cb 0.43 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.06 1kyz h MET 80 CO 0.02 0.52 0.27 -0.07 1.06 0.00 0.00 176.91 178.71 1kyz h LEU 81 N -0.45 0.76 -0.81 1.22 -0.00 -0.28 -2.49 115.31 113.27 1kyz h LEU 81 Ca 0.00 -0.08 0.06 0.00 -0.00 0.00 0.00 57.88 57.86 1kyz h LEU 81 Cb 0.52 -0.20 -0.06 0.00 -0.00 0.00 0.00 40.66 40.92 1kyz h LEU 81 CO 0.00 0.66 0.49 -0.09 -0.00 0.00 0.00 178.44 179.51 1kyz h ARG 82 N 0.84 0.89 -0.52 1.13 2.43 -0.81 -0.23 114.38 118.11 1kyz h ARG 82 Ca 0.21 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.28 1kyz h ARG 82 Cb 0.12 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 1kyz h ARG 82 CO -0.02 0.59 0.14 1.25 -1.51 0.00 0.00 179.97 180.42 1kyz h LEU 83 N 0.91 0.77 -1.31 3.80 5.85 -1.43 -2.00 115.31 121.91 1kyz h LEU 83 Ca 0.35 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1kyz h LEU 83 Cb 0.15 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1kyz h LEU 83 CO -0.16 0.79 0.25 -0.07 -0.34 0.00 0.00 178.44 178.91 1kyz h LEU 84 N 0.72 0.65 -0.53 2.25 3.38 -1.02 -2.36 115.31 118.40 1kyz h LEU 84 Ca 0.17 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.93 1kyz h LEU 84 Cb 0.31 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1kyz h LEU 84 CO -0.00 0.55 -0.36 0.00 0.09 0.00 0.00 178.44 178.72 1kyz h ALA 85 N 1.55 0.71 -0.32 1.53 0.00 -0.70 -1.46 119.26 120.58 1kyz h ALA 85 Ca 0.18 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.67 1kyz h ALA 85 Cb 0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1kyz h ALA 85 CO -0.02 0.66 0.21 0.00 0.00 0.00 0.00 179.25 180.10 1kyz n TYR 87 N -4.49 1.05 -3.55 0.00 4.02 -1.04 -4.92 117.16 108.23 1kyz n TYR 87 Ca 0.02 -0.38 -0.26 0.00 -0.01 0.00 0.00 57.90 57.27 1kyz n TYR 87 Cb 0.10 -0.27 0.02 0.00 -0.02 0.00 0.00 39.34 39.17 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 0.41 -1.60 -0.07 -0.72 -0.00 -0.01 -4.84 119.36 112.54 1kyz n ILE 88 Ca 0.15 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.79 1kyz n ILE 88 Cb 0.70 -2.54 -0.15 0.00 -0.00 0.00 0.00 39.64 37.65 1kyz n ILE 88 CO 0.00 0.00 0.00 -0.38 -0.00 0.00 0.00 176.55 176.17 1kyz n ILE 89 N -4.37 1.50 -4.36 1.39 5.41 -0.58 -4.73 119.36 113.63 1kyz n ILE 89 Ca -0.00 -0.80 -0.23 0.00 1.00 0.00 0.00 62.75 62.71 1kyz n ILE 89 Cb 0.55 -0.82 -0.11 0.00 -0.71 0.00 0.00 39.64 38.54 1kyz n ILE 89 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 1kyz s LEU 90 N -5.88 2.44 0.31 1.39 1.43 -1.20 -2.18 118.68 114.99 1kyz s LEU 90 Ca -0.11 -0.86 0.04 0.00 -1.03 0.00 0.00 54.13 52.17 1kyz s LEU 90 Cb 0.07 -0.94 -0.02 0.00 0.03 0.00 0.00 46.19 45.33 1kyz s LEU 90 CO 0.81 0.02 0.46 0.42 0.23 0.00 0.00 176.35 178.28 1kyz s THR 91 N -1.93 4.86 -0.19 5.49 -4.23 0.75 -4.40 115.64 115.98 1kyz s THR 91 Ca 0.17 -0.82 -0.14 0.00 -1.18 0.00 0.00 61.69 59.73 1kyz s THR 91 Cb -0.06 -3.73 0.06 0.00 1.34 0.00 0.00 72.50 70.10 1kyz s THR 91 CO 0.08 -0.35 0.49 0.00 -0.54 0.00 0.00 174.62 174.29 1kyz s SER 93 N 0.90 1.94 0.20 0.00 1.04 -0.61 -4.96 113.70 112.20 1kyz s SER 93 Ca -0.05 -0.50 0.06 0.00 0.48 0.00 0.00 55.95 55.93 1kyz s SER 93 Cb -0.06 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.90 1kyz s SER 93 CO -0.07 0.06 0.19 -0.69 0.98 0.00 0.00 173.24 173.70 1kyz s VAL 94 N -0.90 4.59 -0.26 5.02 1.01 -1.26 -0.16 120.40 128.44 1kyz s VAL 94 Ca 0.03 -1.17 -0.21 0.00 0.00 0.00 0.00 61.98 60.63 1kyz s VAL 94 Cb -0.08 -3.41 0.07 0.00 0.00 0.00 0.00 36.38 32.95 1kyz s VAL 94 CO 0.02 -0.22 0.68 0.00 0.00 0.00 0.00 175.10 175.58 1kyz s ARG 95 N -3.46 0.77 -0.12 2.72 1.70 -0.48 -4.96 118.95 115.10 1kyz s ARG 95 Ca 0.32 1.03 -0.29 0.00 -0.47 0.00 0.00 55.73 56.31 1kyz s ARG 95 Cb -0.09 0.31 -0.01 0.00 -0.57 0.00 0.00 34.95 34.59 1kyz s ARG 95 CO 0.25 -0.11 1.06 0.95 -1.08 0.00 0.00 175.30 176.37 1kyz s THR 96 N 0.73 4.63 0.35 4.99 -4.23 -1.26 -0.70 115.64 120.15 1kyz s THR 96 Ca -0.03 1.93 -0.03 0.00 -1.18 0.00 0.00 61.69 62.37 1kyz s THR 96 Cb -0.05 -4.24 -0.04 0.00 1.34 0.00 0.00 72.50 69.51 1kyz s THR 96 CO -0.05 -0.04 0.60 -1.58 -0.54 0.00 0.00 174.62 173.01 1kyz s GLN 97 N 2.37 3.57 0.57 3.99 2.00 0.18 -4.95 119.66 127.39 1kyz s GLN 97 Ca 0.49 -0.06 0.32 0.00 -2.00 0.00 0.00 55.36 54.11 1kyz s GLN 97 Cb -0.19 -2.59 1.43 0.00 0.80 0.00 0.00 33.01 32.46 1kyz s GLN 97 CO 0.16 0.11 1.78 0.37 -0.50 0.00 0.00 175.29 177.21 1kyz h GLN 98 N 1.09 0.00 -0.45 1.67 5.75 -1.96 0.66 115.11 121.88 1kyz h GLN 98 Ca -0.48 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 1kyz h GLN 98 Cb 1.20 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.75 1kyz h GLN 98 CO 0.64 0.00 0.00 -0.40 -2.65 0.00 0.00 178.83 176.42 1kyz n ASP 99 N -3.87 1.39 0.00 -0.69 5.75 -1.26 -4.85 116.55 113.02 1kyz n ASP 99 Ca 0.18 -2.08 0.00 0.00 -0.01 0.00 0.00 54.79 52.88 1kyz n ASP 99 Cb 1.04 -0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.85 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 0.54 0.57 3.94 6.12 0.00 0.23 -5.00 105.19 111.59 1kyz n GLY 100 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.44 3.49 -0.23 1.61 -0.14 -1.22 -4.79 119.74 118.02 1kyz s LYS 101 Ca 0.00 -0.25 -0.11 0.00 -1.36 0.00 0.00 55.97 54.25 1kyz s LYS 101 Cb 0.00 -2.61 -0.05 0.00 -1.68 0.00 0.00 37.83 33.49 1kyz s LYS 101 CO 0.00 0.08 0.18 0.14 -0.76 0.00 0.00 175.35 174.99 1kyz s VAL 102 N -2.40 5.35 -0.05 3.17 -7.23 -1.26 0.47 120.40 118.46 1kyz s VAL 102 Ca 0.41 0.25 0.00 0.00 -1.81 0.00 0.00 61.98 60.83 1kyz s VAL 102 Cb -0.10 -3.52 -0.03 0.00 0.56 0.00 0.00 36.38 33.29 1kyz s VAL 102 CO 0.38 0.35 -0.01 -1.58 -0.31 0.00 0.00 175.10 173.93 1kyz s GLN 103 N 0.94 2.85 -0.12 4.82 0.74 0.13 -4.95 119.66 124.07 1kyz s GLN 103 Ca 0.09 -0.52 -0.04 0.00 0.05 0.00 0.00 55.36 54.93 1kyz s GLN 103 Cb -0.13 -2.70 -0.04 0.00 1.10 0.00 0.00 33.01 31.24 1kyz s GLN 103 CO 0.04 0.66 0.04 1.03 -0.55 0.00 0.00 175.29 176.51 1kyz s ARG 104 N -1.16 3.34 -0.14 1.67 0.52 -1.26 -1.39 118.95 120.54 1kyz s ARG 104 Ca 0.16 -0.34 -0.01 0.00 -0.52 0.00 0.00 55.73 55.02 1kyz s ARG 104 Cb -0.11 -2.98 -0.02 0.00 0.52 0.00 0.00 34.95 32.36 1kyz s ARG 104 CO 0.05 0.60 -0.11 -0.51 0.02 0.00 0.00 175.30 175.36 1kyz s LEU 105 N -0.58 2.85 -0.07 2.53 1.43 0.77 -4.21 118.68 121.41 1kyz s LEU 105 Ca 0.10 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.94 1kyz s LEU 105 Cb -0.12 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 1kyz s LEU 105 CO 0.02 0.16 -0.11 -0.31 0.23 0.00 0.00 176.35 176.34 1kyz s TYR 106 N 0.40 2.81 0.33 0.29 1.51 0.63 -1.58 117.35 121.74 1kyz s TYR 106 Ca -0.09 -0.15 0.04 0.00 -1.01 0.00 0.00 57.07 55.86 1kyz s TYR 106 Cb -0.15 -1.70 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 1kyz s TYR 106 CO 0.05 0.19 0.15 0.20 -1.11 0.00 0.00 175.55 175.02 1kyz s GLY 107 N -0.59 2.20 -0.00 0.71 0.00 -0.80 -0.71 107.32 108.12 1kyz s GLY 107 Ca 0.09 -1.68 -0.22 0.00 0.00 0.00 0.00 44.72 42.91 1kyz s GLY 107 CO 0.01 -1.66 0.64 1.08 0.00 0.00 0.00 173.10 173.18 1kyz s LEU 108 N -3.44 4.41 0.37 0.66 1.43 -1.26 -0.18 118.68 120.68 1kyz s LEU 108 Ca 0.33 1.22 -0.25 0.00 -1.03 0.00 0.00 54.13 54.41 1kyz s LEU 108 Cb 0.05 -3.01 -0.09 0.00 0.03 0.00 0.00 46.19 43.17 1kyz s LEU 108 CO 0.17 0.06 1.01 0.00 0.23 0.00 0.00 176.35 177.82 1kyz s ALA 109 N -0.05 3.14 0.52 4.21 0.00 -0.93 -4.56 121.76 124.09 1kyz s ALA 109 Ca 0.33 0.64 0.33 0.00 0.00 0.00 0.00 51.96 53.26 1kyz s ALA 109 Cb -0.19 -3.24 1.47 0.00 0.00 0.00 0.00 23.12 21.17 1kyz s ALA 109 CO 0.18 -0.07 1.83 1.79 0.00 0.00 0.00 175.76 179.49 1kyz h THR 110 N 2.36 0.46 0.00 0.00 1.35 -1.91 0.94 112.91 116.11 1kyz h THR 110 Ca -0.48 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 1kyz h THR 110 Cb 1.21 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 1kyz h THR 110 CO 0.63 0.01 0.00 0.55 -0.25 0.00 0.00 175.52 176.46 1kyz n VAL 111 N -4.27 0.19 0.24 6.82 3.14 -1.26 -3.07 118.33 120.13 1kyz n VAL 111 Ca 0.23 -0.05 0.03 0.00 -2.96 0.00 0.00 64.34 61.59 1kyz n VAL 111 Cb 1.11 -0.55 0.17 0.00 -1.06 0.00 0.00 33.84 33.51 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 -1.57 3.05 -0.13 1.55 0.00 0.32 -4.31 120.51 119.43 1kyz n ALA 112 Ca 0.06 -0.80 -0.04 0.00 0.00 0.00 0.00 53.44 52.66 1kyz n ALA 112 Cb 0.35 -1.05 0.03 0.00 0.00 0.00 0.00 19.45 18.78 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 1.72 0.07 -0.93 0.00 3.64 -1.64 -2.34 116.57 117.09 1kyz h LYS 113 Ca 0.00 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1kyz h LYS 113 Cb 1.09 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1kyz h LYS 113 CO 0.20 0.05 0.00 0.66 -2.27 0.00 0.00 179.45 178.09 1kyz n TYR 114 N -5.24 0.40 0.43 1.91 4.02 -1.26 -3.81 117.16 113.61 1kyz n TYR 114 Ca 0.03 -0.16 0.05 0.00 -0.01 0.00 0.00 57.90 57.81 1kyz n TYR 114 Cb 0.23 -0.19 0.00 0.00 -0.02 0.00 0.00 39.34 39.36 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 0.12 1.25 -4.61 7.72 4.77 -0.88 -2.02 117.00 123.35 1kyz n LEU 115 Ca 0.05 -0.78 -0.29 0.00 -0.03 0.00 0.00 56.01 54.96 1kyz n LEU 115 Cb 0.44 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.44 1kyz n LEU 115 CO 0.06 0.25 -0.39 -0.69 -1.33 0.00 0.00 177.39 175.29 1kyz s VAL 116 N -1.29 3.51 -2.00 4.08 1.01 -1.25 -4.60 120.40 119.86 1kyz s VAL 116 Ca 0.08 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 60.77 1kyz s VAL 116 Cb 0.08 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.78 1kyz s VAL 116 CO 0.24 0.05 0.12 0.29 0.00 0.00 0.00 175.10 175.79 1kyz n LYS 117 N 0.46 0.10 -0.30 2.72 5.02 -1.26 -3.78 118.16 121.12 1kyz n LYS 117 Ca -0.12 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.31 1kyz n LYS 117 Cb 0.53 -1.01 0.31 0.00 -0.02 0.00 0.00 35.03 34.84 1kyz n LYS 117 CO 0.00 0.00 0.00 -2.95 -0.52 0.00 0.00 177.40 173.93 1kyz h ASN 118 N 0.00 0.15 0.00 4.39 -1.07 -1.90 0.45 115.58 117.61 1kyz h ASN 118 Ca 0.00 0.18 -0.35 0.00 0.07 0.00 0.00 56.30 56.20 1kyz h ASN 118 Cb 0.00 0.21 0.00 0.00 -2.07 0.00 0.00 38.32 36.46 1kyz h ASN 118 CO 0.00 -0.10 2.00 1.21 0.07 0.00 0.00 177.43 180.61 1kyz n GLU 119 N -5.15 2.11 -3.23 4.14 0.00 -1.22 -4.52 120.64 112.77 1kyz n GLU 119 Ca 0.22 -1.34 -0.09 0.00 0.00 0.00 0.00 57.16 55.96 1kyz n GLU 119 Cb 0.70 -2.32 0.03 0.00 0.00 0.00 0.00 31.44 29.84 1kyz n GLU 119 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1kyz n ASP 120 N 3.65 -7.02 -0.81 4.31 9.92 -0.90 -2.02 116.55 123.67 1kyz n ASP 120 Ca 0.45 -0.42 -0.08 0.00 -0.53 0.00 0.00 54.79 54.21 1kyz n ASP 120 Cb 0.29 -4.85 -0.03 0.00 -0.64 0.00 0.00 41.12 35.89 1kyz n ASP 120 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1kyz n GLY 121 N -1.59 0.77 3.13 0.44 0.00 0.15 -4.90 105.19 103.19 1kyz n GLY 121 Ca -0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.54 1.64 0.16 1.61 1.01 -0.85 -4.93 120.40 117.49 1kyz s VAL 122 Ca 0.00 -0.77 -0.21 0.00 0.00 0.00 0.00 61.98 61.00 1kyz s VAL 122 Cb 0.00 -1.44 0.06 0.00 0.00 0.00 0.00 36.38 34.99 1kyz s VAL 122 CO 0.00 0.47 0.55 -0.94 0.00 0.00 0.00 175.10 175.17 1kyz s SER 123 N 0.50 -0.46 0.31 3.32 1.04 -1.26 -3.43 113.70 113.71 1kyz s SER 123 Ca -0.17 -0.12 0.25 0.00 0.48 0.00 0.00 55.95 56.39 1kyz s SER 123 Cb -0.17 0.57 1.09 0.00 0.10 0.00 0.00 66.02 67.61 1kyz s SER 123 CO 0.06 -0.95 1.74 0.40 0.98 0.00 0.00 173.24 175.47 1kyz h ILE 124 N 2.10 0.00 0.00 -1.02 2.04 -1.75 -2.89 117.51 116.00 1kyz h ILE 124 Ca -0.33 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 1kyz h ILE 124 Cb 1.29 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1kyz h ILE 124 CO 0.40 0.00 -0.05 0.28 0.00 0.00 0.00 178.15 178.78 1kyz h SER 125 N 0.00 0.00 0.39 1.72 0.02 -1.81 -1.61 113.55 112.26 1kyz h SER 125 Ca 0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1kyz h SER 125 Cb 0.29 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 1kyz h SER 125 CO 0.00 0.05 -0.28 0.00 -1.14 0.00 0.00 176.83 175.46 1kyz h ALA 126 N 1.95 1.37 -0.22 3.77 0.00 -1.86 -2.51 119.26 121.76 1kyz h ALA 126 Ca -0.00 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 1kyz h ALA 126 Cb 0.12 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1kyz h ALA 126 CO 0.01 0.35 -0.41 -0.07 0.00 0.00 0.00 179.25 179.12 1kyz h LEU 127 N 0.00 0.54 -0.82 0.00 4.07 -1.52 -2.60 115.31 114.98 1kyz h LEU 127 Ca -0.00 -0.24 -0.06 0.00 0.08 0.00 0.00 57.88 57.65 1kyz h LEU 127 Cb 0.55 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 42.11 1kyz h LEU 127 CO 0.04 0.89 0.17 -1.13 -1.08 0.00 0.00 178.44 177.33 1kyz h ASN 128 N 0.42 0.99 -0.05 -0.43 -0.73 -1.52 0.19 115.58 114.45 1kyz h ASN 128 Ca 0.03 -0.20 -0.05 0.00 1.87 0.00 0.00 56.30 57.95 1kyz h ASN 128 Cb 0.90 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 39.22 1kyz h ASN 128 CO 0.08 0.95 -0.11 -0.07 -0.37 0.00 0.00 177.43 177.91 1kyz h LEU 129 N 1.01 0.32 0.06 0.34 3.38 -1.35 -1.68 115.31 117.39 1kyz h LEU 129 Ca 0.21 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1kyz h LEU 129 Cb 0.34 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1kyz h LEU 129 CO -0.00 0.46 -0.03 -0.03 0.09 0.00 0.00 178.44 178.93 1kyz h MET 130 N 0.32 -0.08 -0.93 1.13 4.05 -0.98 -2.94 114.93 115.51 1kyz h MET 130 Ca 0.06 0.01 0.19 0.00 -0.28 0.00 0.00 59.70 59.68 1kyz h MET 130 Cb 0.39 0.02 -0.08 0.00 -0.80 0.00 0.00 31.60 31.13 1kyz h MET 130 CO 0.02 -0.06 0.60 -0.91 0.23 0.00 0.00 176.91 176.80 1kyz h ASN 131 N -0.50 0.55 -0.52 1.39 -0.26 -0.73 -0.50 115.58 115.01 1kyz h ASN 131 Ca -0.01 0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 1kyz h ASN 131 Cb 0.07 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 1kyz h ASN 131 CO 0.01 0.23 0.00 0.00 -1.06 0.00 0.00 177.43 176.61 1kyz n GLN 132 N -4.58 2.27 -2.14 0.81 3.00 -0.63 -4.39 117.38 111.73 1kyz n GLN 132 Ca 0.20 -1.97 -0.39 0.00 -0.01 0.00 0.00 57.00 54.83 1kyz n GLN 132 Cb 0.62 -1.44 -0.01 0.00 0.00 0.00 0.00 30.24 29.42 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 -1.08 6.38 0.55 1.08 -1.08 -0.20 -4.83 116.67 117.49 1kyz s ASP 133 Ca 0.37 2.55 0.31 0.00 -0.52 0.00 0.00 52.55 55.25 1kyz s ASP 133 Cb 0.20 -2.63 1.47 0.00 -1.46 0.00 0.00 42.92 40.50 1kyz s ASP 133 CO 0.26 -0.79 1.89 0.07 0.52 0.00 0.00 175.17 177.12 1kyz h LYS 134 N 2.67 0.00 0.64 4.34 -0.00 -1.90 -1.76 116.57 120.56 1kyz h LYS 134 Ca -0.49 0.00 -0.03 0.00 -0.00 0.00 0.00 60.65 60.13 1kyz h LYS 134 Cb 1.24 0.00 0.01 0.00 -0.00 0.00 0.00 32.23 33.48 1kyz h LYS 134 CO 0.63 0.00 -0.31 0.28 -0.00 0.00 0.00 179.45 180.05 1kyz h VAL 135 N 0.00 0.28 0.00 0.07 2.07 -1.92 -2.76 116.25 113.99 1kyz h VAL 135 Ca 0.38 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.60 1kyz h VAL 135 Cb 1.59 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1kyz h VAL 135 CO -0.00 0.03 -0.32 -0.07 0.02 0.00 0.00 177.57 177.23 1kyz h LEU 136 N -1.03 0.00 -1.66 2.57 3.38 -1.74 -2.57 115.31 114.27 1kyz h LEU 136 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1kyz h LEU 136 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1kyz h LEU 136 CO 0.14 0.32 0.00 0.24 0.09 0.00 0.00 178.44 179.23 1kyz h MET 137 N 0.00 0.00 -0.33 1.13 2.86 -1.27 -2.88 114.93 114.44 1kyz h MET 137 Ca -0.00 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.53 1kyz h MET 137 Cb 0.65 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.30 1kyz h MET 137 CO 0.04 0.00 -0.22 1.49 1.06 0.00 0.00 176.91 179.28 1kyz h GLU 138 N 0.00 0.63 -0.89 1.72 4.57 -1.15 -3.13 114.58 116.32 1kyz h GLU 138 Ca 0.00 -0.24 0.14 0.00 -1.18 0.00 0.00 59.36 58.08 1kyz h GLU 138 Cb 0.39 -0.04 -0.09 0.00 -0.16 0.00 0.00 28.75 28.85 1kyz h GLU 138 CO 0.00 0.81 0.50 0.77 -1.18 0.00 0.00 179.01 179.91 1kyz h SER 139 N 0.56 0.65 -0.69 1.04 0.02 -1.66 -2.23 113.55 111.23 1kyz h SER 139 Ca 0.08 0.08 0.17 0.00 -0.84 0.00 0.00 61.79 61.29 1kyz h SER 139 Cb 0.69 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.16 1kyz h SER 139 CO 0.05 0.29 0.48 -0.50 -1.14 0.00 0.00 176.83 176.01 1kyz h TRP 140 N 0.72 0.21 0.00 3.45 4.06 -1.72 -0.08 115.95 122.59 1kyz h TRP 140 Ca 0.48 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.44 1kyz h TRP 140 Cb 0.64 -0.07 0.00 0.00 -1.00 0.00 0.00 29.16 28.73 1kyz h TRP 140 CO -0.06 0.07 0.00 0.66 -3.56 0.00 0.00 178.44 175.55 1kyz n TYR 141 N -4.41 0.44 -0.14 0.49 4.02 -0.84 -3.08 117.16 113.64 1kyz n TYR 141 Ca 0.13 0.16 0.05 0.00 -0.01 0.00 0.00 57.90 58.23 1kyz n TYR 141 Cb 0.64 -0.75 0.12 0.00 -0.02 0.00 0.00 39.34 39.33 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 -1.88 0.38 -0.16 -0.72 8.25 -0.05 -4.62 115.22 116.41 1kyz n HIS 142 Ca 0.04 -0.50 -0.11 0.00 -0.26 0.00 0.00 57.72 56.89 1kyz n HIS 142 Cb 0.26 -0.03 -0.00 0.00 1.12 0.00 0.00 29.99 31.34 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 1.66 0.99 -0.88 2.41 5.85 -1.48 0.12 115.31 123.98 1kyz h LEU 143 Ca 0.00 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.38 1kyz h LEU 143 Cb 0.69 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1kyz h LEU 143 CO 0.00 1.15 0.56 0.50 -0.34 0.00 0.00 178.44 180.31 1kyz h LYS 144 N 0.83 1.04 -0.22 1.25 3.64 -1.82 -1.16 116.57 120.13 1kyz h LYS 144 Ca 0.12 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.30 1kyz h LYS 144 Cb 0.74 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.32 1kyz h LYS 144 CO 0.06 0.69 -0.44 -0.44 -2.27 0.00 0.00 179.45 177.05 1kyz h ASP 145 N 1.07 0.59 -0.40 4.20 3.32 -1.78 -2.13 116.42 121.30 1kyz h ASP 145 Ca 0.36 -0.27 -0.07 0.00 0.02 0.00 0.00 57.03 57.06 1kyz h ASP 145 Cb 0.05 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1kyz h ASP 145 CO -0.13 0.95 0.02 0.00 -1.72 0.00 0.00 179.24 178.36 1kyz h ALA 146 N 1.07 1.14 0.13 3.45 0.00 -0.13 0.10 119.26 125.03 1kyz h ALA 146 Ca 0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1kyz h ALA 146 Cb 0.94 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1kyz h ALA 146 CO 0.08 0.56 -0.06 0.28 0.00 0.00 0.00 179.25 180.11 1kyz h VAL 147 N 0.73 1.04 0.00 0.00 2.07 -1.11 0.21 116.25 119.20 1kyz h VAL 147 Ca 0.15 -0.83 -0.13 0.00 0.82 0.00 0.00 66.70 66.71 1kyz h VAL 147 Cb 0.42 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1kyz h VAL 147 CO 0.02 0.19 -0.63 -0.07 0.02 0.00 0.00 177.57 177.10 1kyz h LEU 148 N -0.57 0.00 -0.04 2.57 3.38 -1.29 -3.35 115.31 116.01 1kyz h LEU 148 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1kyz h LEU 148 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1kyz h LEU 148 CO 0.03 0.63 -0.19 0.47 0.09 0.00 0.00 178.44 179.47 1kyz n ASP 149 N -3.78 0.24 0.00 -0.43 8.00 0.35 -5.09 116.55 115.83 1kyz n ASP 149 Ca -0.01 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 54.87 1kyz n ASP 149 Cb 0.63 0.97 0.00 0.00 -0.02 0.00 0.00 41.12 42.69 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 1.07 0.01 0.00 0.44 0.00 0.75 -5.01 105.19 102.46 1kyz n GLY 150 Ca 0.01 -1.80 0.00 0.00 0.00 0.00 0.00 46.02 44.23 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 0.18 -3.56 3.41 -0.02 0.00 -1.25 -4.44 105.19 99.50 1kyz n GLY 151 Ca 0.00 -2.11 -0.33 0.00 0.00 0.00 0.00 46.02 43.58 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 -0.73 3.38 0.22 -0.61 1.01 -1.26 -4.80 121.20 118.41 1kyz s ILE 152 Ca 0.00 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 59.95 1kyz s ILE 152 Cb 0.00 -2.46 0.24 0.00 0.01 0.00 0.00 42.46 40.25 1kyz s ILE 152 CO 0.00 0.50 1.58 -0.65 0.00 0.00 0.00 174.94 176.37 1kyz h PRO 153 N 6.90 -0.06 0.00 2.79 0.11 -1.80 0.16 132.00 140.11 1kyz h PRO 153 Ca -0.30 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 1kyz h PRO 153 Cb 1.20 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1kyz h PRO 153 CO 0.59 -0.04 -0.13 0.35 -0.21 0.00 0.00 178.00 178.56 1kyz h PHE 154 N -0.06 0.00 0.19 0.65 3.57 -1.50 -2.48 116.94 117.31 1kyz h PHE 154 Ca 0.32 0.00 -0.32 0.00 3.53 0.00 0.00 57.97 61.50 1kyz h PHE 154 Cb 0.58 0.00 0.02 0.00 2.79 0.00 0.00 35.95 39.34 1kyz h PHE 154 CO -0.71 0.13 -1.51 -0.91 -2.23 0.00 0.00 178.31 173.08 1kyz h ASN 155 N 0.00 0.63 0.89 0.41 -0.26 -1.00 -3.11 115.58 113.14 1kyz h ASN 155 Ca -0.00 -0.76 0.00 0.00 -0.56 0.00 0.00 56.30 54.98 1kyz h ASN 155 Cb 0.32 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.38 1kyz h ASN 155 CO 0.02 1.61 0.00 0.29 -1.06 0.00 0.00 177.43 178.29 1kyz n LYS 156 N -3.60 0.15 -0.05 0.81 5.02 -0.09 -1.59 118.16 118.80 1kyz n LYS 156 Ca -0.17 0.29 -0.10 0.00 -2.02 0.00 0.00 58.31 56.31 1kyz n LYS 156 Cb 1.07 -1.74 -0.15 0.00 -0.02 0.00 0.00 35.03 34.20 1kyz n LYS 156 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1kyz n ALA 157 N -1.69 1.47 -0.31 7.82 0.00 -0.96 -4.83 120.51 122.01 1kyz n ALA 157 Ca 0.04 -0.99 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1kyz n ALA 157 Cb 0.28 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1kyz n ALA 157 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1kyz n TYR 158 N -2.95 0.00 0.00 0.00 4.02 -1.16 -5.09 117.16 111.98 1kyz n TYR 158 Ca -0.24 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.65 1kyz n TYR 158 Cb 1.09 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.41 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 2.79 0.34 0.00 2.72 0.00 -0.62 -5.07 105.19 105.34 1kyz n GLY 159 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1kyz n GLY 159 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1kyz n MET 160 N 0.00 0.00 0.00 1.61 0.00 -1.26 -5.11 117.12 112.36 1kyz n MET 160 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1kyz n MET 160 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.22 1kyz n MET 160 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1kyz n THR 161 N -0.07 0.00 -0.07 3.17 -2.24 -1.26 -4.50 114.28 109.31 1kyz n THR 161 Ca 0.00 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.60 1kyz n THR 161 Cb 0.00 0.00 -0.13 0.00 -2.10 0.00 0.00 70.33 68.10 1kyz n THR 161 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kyz h ALA 162 N -1.94 0.13 -0.22 6.98 0.00 -1.95 -3.09 119.26 119.17 1kyz h ALA 162 Ca 0.00 -0.87 0.06 0.00 0.00 0.00 0.00 54.91 54.10 1kyz h ALA 162 Cb 0.00 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1kyz h ALA 162 CO 0.00 0.41 0.40 0.74 0.00 0.00 0.00 179.25 180.80 1kyz h PHE 163 N -0.88 0.00 0.00 0.00 -1.00 -1.94 -2.23 116.94 110.89 1kyz h PHE 163 Ca -0.19 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.59 1kyz h PHE 163 Cb 1.25 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.81 1kyz h PHE 163 CO 0.18 0.00 -0.03 0.93 -1.61 0.00 0.00 178.31 177.78 1kyz h GLU 164 N 0.00 0.00 -1.07 1.51 5.08 -1.91 -3.37 114.58 114.82 1kyz h GLU 164 Ca 0.11 0.00 0.29 0.00 -1.00 0.00 0.00 59.36 58.76 1kyz h GLU 164 Cb 0.91 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.05 1kyz h GLU 164 CO -0.00 0.24 0.68 -0.92 -1.00 0.00 0.00 179.01 178.00 1kyz h TYR 165 N -1.00 0.71 0.00 4.33 3.20 -1.32 0.12 116.97 123.01 1kyz h TYR 165 Ca -0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1kyz h TYR 165 Cb 0.26 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.33 1kyz h TYR 165 CO 0.06 0.00 0.32 0.45 -1.64 0.00 0.00 178.16 177.35 1kyz h HIS 166 N 0.37 0.00 -0.02 -3.82 3.86 -1.68 0.37 115.15 114.23 1kyz h HIS 166 Ca 0.65 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.86 1kyz h HIS 166 Cb 1.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.10 1kyz h HIS 166 CO -0.00 0.00 -0.19 0.41 0.86 0.00 0.00 177.93 179.00 1kyz n GLY 167 N -1.26 0.42 0.59 2.45 0.00 0.41 -4.16 105.19 103.64 1kyz n GLY 167 Ca -0.01 -0.63 0.07 0.00 0.00 0.00 0.00 46.02 45.45 1kyz n GLY 167 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1kyz n THR 168 N 0.58 2.17 0.00 2.61 -2.24 0.13 -4.91 114.28 112.62 1kyz n THR 168 Ca 0.13 -2.26 0.00 0.00 -2.27 0.00 0.00 64.05 59.64 1kyz n THR 168 Cb 0.51 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1kyz n THR 168 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1kyz n ASP 169 N -1.00 0.00 -0.14 3.42 2.03 -1.22 -5.04 116.55 114.60 1kyz n ASP 169 Ca 0.21 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.40 1kyz n ASP 169 Cb 0.80 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 41.19 1kyz n ASP 169 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1kyz h PRO 170 N 0.00 0.97 -0.63 -0.67 0.13 -1.91 -2.52 132.00 127.38 1kyz h PRO 170 Ca 0.00 -0.46 0.11 0.00 -0.87 0.00 0.00 66.00 64.78 1kyz h PRO 170 Cb 0.00 -0.01 -0.12 0.00 0.13 0.00 0.00 31.00 31.00 1kyz h PRO 170 CO 0.00 1.13 -0.35 -0.09 -0.23 0.00 0.00 178.00 178.46 1kyz h ARG 171 N 0.81 -0.15 -0.11 0.86 2.43 -1.96 1.55 114.38 117.81 1kyz h ARG 171 Ca 0.09 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1kyz h ARG 171 Cb 0.88 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1kyz h ARG 171 CO 0.08 -0.10 0.06 0.35 -1.51 0.00 0.00 179.97 178.85 1kyz h PHE 172 N -0.15 0.15 -0.74 2.20 3.57 -1.95 -2.47 116.94 117.55 1kyz h PHE 172 Ca 0.24 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.78 1kyz h PHE 172 Cb 0.56 -0.05 -0.04 0.00 2.79 0.00 0.00 35.95 39.21 1kyz h PHE 172 CO -0.67 0.19 0.48 -0.97 -2.23 0.00 0.00 178.31 175.12 1kyz h ASN 173 N 0.07 0.74 -0.34 0.41 -1.24 -0.42 -0.55 115.58 114.26 1kyz h ASN 173 Ca 0.04 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.05 1kyz h ASN 173 Cb 0.09 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 38.96 1kyz h ASN 173 CO -0.01 0.50 0.22 0.11 -1.29 0.00 0.00 177.43 176.96 1kyz h LYS 174 N 0.86 0.45 -0.28 6.67 1.57 0.24 -1.44 116.57 124.63 1kyz h LYS 174 Ca 0.30 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.04 1kyz h LYS 174 Cb 0.12 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1kyz h LYS 174 CO -0.09 0.31 0.12 0.28 -0.57 0.00 0.00 179.45 179.50 1kyz h VAL 175 N 0.45 1.17 0.17 0.50 2.07 -0.85 -2.69 116.25 117.07 1kyz h VAL 175 Ca 0.12 -0.51 0.01 0.00 0.82 0.00 0.00 66.70 67.15 1kyz h VAL 175 Cb -0.04 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1kyz h VAL 175 CO -0.03 0.18 -0.27 0.15 0.02 0.00 0.00 177.57 177.62 1kyz h PHE 176 N 0.31 -0.73 0.00 1.57 3.57 -0.87 -1.84 116.94 118.95 1kyz h PHE 176 Ca 0.10 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 1kyz h PHE 176 Cb 0.16 0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.20 1kyz h PHE 176 CO -0.01 -0.38 -0.03 -0.91 -2.23 0.00 0.00 178.31 174.75 1kyz h ASN 177 N -0.51 0.00 0.03 0.41 2.35 -1.26 -1.39 115.58 115.21 1kyz h ASN 177 Ca 0.02 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.51 1kyz h ASN 177 Cb 0.52 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.91 1kyz h ASN 177 CO -0.13 0.03 -1.02 0.50 -1.65 0.00 0.00 177.43 175.16 1kyz h LYS 178 N 0.00 0.63 0.70 0.81 1.63 -1.10 -2.08 116.57 117.16 1kyz h LYS 178 Ca -0.00 -0.72 -0.03 0.00 -0.85 0.00 0.00 60.65 59.04 1kyz h LYS 178 Cb 0.07 0.22 0.01 0.00 -0.60 0.00 0.00 32.23 31.92 1kyz h LYS 178 CO 0.00 1.31 -0.34 0.78 -3.45 0.00 0.00 179.45 177.75 1kyz h GLY 179 N 0.26 -0.98 0.44 5.01 0.00 -0.48 0.21 103.07 107.52 1kyz h GLY 179 Ca -0.14 0.37 0.09 0.00 0.00 0.00 0.00 47.33 47.65 1kyz h GLY 179 CO 0.20 -0.36 0.29 -0.33 0.00 0.00 0.00 176.54 176.34 1kyz h MET 180 N -0.99 0.49 0.67 4.80 2.86 -1.43 0.19 114.93 121.53 1kyz h MET 180 Ca -0.10 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.49 1kyz h MET 180 Cb 0.72 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 1kyz h MET 180 CO 0.16 0.33 -0.49 1.03 1.06 0.00 0.00 176.91 178.99 1kyz h SER 181 N 0.51 -1.29 -0.20 1.22 0.87 -1.34 0.98 113.55 114.29 1kyz h SER 181 Ca 0.33 0.09 0.06 0.00 -1.23 0.00 0.00 61.79 61.03 1kyz h SER 181 Cb 0.37 0.40 -0.06 0.00 -0.44 0.00 0.00 62.40 62.67 1kyz h SER 181 CO -0.28 -0.72 -0.22 0.44 -0.53 0.00 0.00 176.83 175.52 1kyz h ASP 182 N -1.12 -0.70 -0.16 6.23 5.19 -0.62 0.11 116.42 125.34 1kyz h ASP 182 Ca -0.09 0.13 0.05 0.00 -0.62 0.00 0.00 57.03 56.50 1kyz h ASP 182 Cb 0.93 0.33 -0.06 0.00 0.18 0.00 0.00 39.33 40.71 1kyz h ASP 182 CO 0.04 -0.26 -0.20 -0.74 -3.12 0.00 0.00 179.24 174.96 1kyz h HIS 183 N -0.25 -0.51 -0.29 4.55 2.76 -0.40 -0.96 115.15 120.05 1kyz h HIS 183 Ca 0.12 0.03 0.04 0.00 -2.20 0.00 0.00 60.37 58.36 1kyz h HIS 183 Cb 0.43 0.25 -0.04 0.00 1.55 0.00 0.00 27.41 29.61 1kyz h HIS 183 CO -0.36 -0.27 0.07 1.03 -1.30 0.00 0.00 177.93 177.10 1kyz h SER 184 N -0.23 0.04 -0.21 3.26 0.87 0.17 -0.35 113.55 117.09 1kyz h SER 184 Ca 0.11 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.74 1kyz h SER 184 Cb 0.39 0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.38 1kyz h SER 184 CO -0.30 0.06 0.04 0.74 -0.53 0.00 0.00 176.83 176.84 1kyz h THR 185 N 0.18 0.90 -0.44 2.23 2.02 -0.44 0.37 112.91 117.74 1kyz h THR 185 Ca 0.13 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 1kyz h THR 185 Cb 0.13 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 1kyz h THR 185 CO -0.17 0.02 0.23 0.40 0.37 0.00 0.00 175.52 176.37 1kyz h ILE 186 N 0.12 1.17 0.13 3.11 2.04 -0.90 -1.51 117.51 121.68 1kyz h ILE 186 Ca 0.10 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1kyz h ILE 186 Cb 0.09 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1kyz h ILE 186 CO -0.13 0.18 -0.06 0.74 0.00 0.00 0.00 178.15 178.88 1kyz h THR 187 N 0.57 1.03 -0.77 -0.27 2.02 -0.77 -2.92 112.91 111.79 1kyz h THR 187 Ca 0.15 -0.76 0.17 0.00 0.77 0.00 0.00 66.41 66.74 1kyz h THR 187 Cb 0.08 1.50 -0.11 0.00 -1.74 0.00 0.00 68.15 67.88 1kyz h THR 187 CO -0.02 0.18 0.26 -0.03 0.37 0.00 0.00 175.52 176.27 1kyz h MET 188 N -0.54 0.34 -0.43 6.66 -1.53 -0.21 -0.37 114.93 118.85 1kyz h MET 188 Ca -0.02 -0.02 0.05 0.00 -3.44 0.00 0.00 59.70 56.27 1kyz h MET 188 Cb 0.43 -0.08 -0.05 0.00 -0.55 0.00 0.00 31.60 31.35 1kyz h MET 188 CO 0.03 0.22 0.16 -0.22 0.14 0.00 0.00 176.91 177.24 1kyz h LYS 189 N 0.35 0.33 0.00 0.39 3.64 -1.22 -1.22 116.57 118.84 1kyz h LYS 189 Ca 0.44 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.75 1kyz h LYS 189 Cb 0.75 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1kyz h LYS 189 CO -0.48 0.22 -0.26 -0.22 -2.27 0.00 0.00 179.45 176.43 1kyz h LYS 190 N 0.34 0.00 -0.10 1.90 1.63 -0.93 -2.93 116.57 116.48 1kyz h LYS 190 Ca 0.20 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.98 1kyz h LYS 190 Cb 0.17 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.80 1kyz h LYS 190 CO -0.19 0.26 -0.01 0.82 -3.45 0.00 0.00 179.45 176.88 1kyz h ILE 191 N 0.00 1.27 0.00 2.00 2.04 -0.02 -2.46 117.51 120.34 1kyz h ILE 191 Ca -0.00 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.97 1kyz h ILE 191 Cb 0.55 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 1kyz h ILE 191 CO 0.03 0.25 0.00 -0.07 0.00 0.00 0.00 178.15 178.37 1kyz h LEU 192 N -0.11 0.00 0.00 1.44 -0.00 -1.23 0.54 115.31 115.96 1kyz h LEU 192 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.91 1kyz h LEU 192 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.06 1kyz h LEU 192 CO 0.01 0.00 -0.85 -0.62 -0.00 0.00 0.00 178.44 176.97 1kyz n GLU 193 N -2.62 0.38 0.00 1.13 1.02 -1.03 -4.38 120.64 115.14 1kyz n GLU 193 Ca -0.00 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1kyz n GLU 193 Cb 0.15 -1.70 0.00 0.00 -0.02 0.00 0.00 31.44 29.88 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 -2.23 0.00 -3.76 2.62 -2.24 -0.68 -4.99 114.28 102.99 1kyz n THR 194 Ca 0.02 -0.29 -0.37 0.00 -2.27 0.00 0.00 64.05 61.14 1kyz n THR 194 Cb 0.47 0.85 -0.13 0.00 -2.10 0.00 0.00 70.33 69.42 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 -0.94 3.18 -0.09 4.78 5.04 0.18 -4.68 117.35 124.82 1kyz s TYR 195 Ca 0.00 -1.16 0.09 0.00 -2.44 0.00 0.00 57.07 53.56 1kyz s TYR 195 Cb 0.00 -2.26 -0.24 0.00 0.35 0.00 0.00 41.96 39.82 1kyz s TYR 195 CO 0.00 -0.64 0.48 2.41 -1.34 0.00 0.00 175.55 176.46 1kyz n THR 196 N 4.84 1.61 0.09 4.34 -1.04 -1.26 -4.16 114.28 118.71 1kyz n THR 196 Ca -0.14 -0.76 0.04 0.00 -2.04 0.00 0.00 64.05 61.14 1kyz n THR 196 Cb 0.47 -1.14 0.19 0.00 -1.82 0.00 0.00 70.33 68.04 1kyz n THR 196 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1kyz n GLY 197 N 1.71 -0.47 0.15 3.41 0.00 -1.26 -1.71 105.19 107.03 1kyz n GLY 197 Ca -0.24 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1kyz n GLY 197 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1kyz n PHE 198 N -1.71 0.00 0.00 1.61 -0.00 -1.26 -3.93 117.46 112.17 1kyz n PHE 198 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1kyz n PHE 198 Cb 0.28 -0.01 0.00 0.00 -0.00 0.00 0.00 39.48 39.74 1kyz n PHE 198 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.76 177.15 1kyz n GLU 199 N -0.27 0.00 -3.08 -4.13 -0.58 -0.69 -4.94 120.64 106.95 1kyz n GLU 199 Ca 0.00 0.12 -0.24 0.00 -0.42 0.00 0.00 57.16 56.62 1kyz n GLU 199 Cb 0.04 -1.12 0.02 0.00 -0.57 0.00 0.00 31.44 29.81 1kyz n GLU 199 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1kyz n GLY 200 N -0.60 0.12 3.51 0.62 0.00 -1.25 -4.57 105.19 103.02 1kyz n GLY 200 Ca 0.00 0.71 -0.40 0.00 0.00 0.00 0.00 46.02 46.33 1kyz n GLY 200 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1kyz n LEU 201 N 0.25 0.88 -1.39 0.99 4.77 -1.26 -4.55 117.00 116.69 1kyz n LEU 201 Ca -0.05 0.01 0.11 0.00 -0.03 0.00 0.00 56.01 56.05 1kyz n LEU 201 Cb 0.55 -1.11 -0.06 0.00 -2.33 0.00 0.00 43.42 40.47 1kyz n LEU 201 CO 0.34 -0.95 -0.53 1.17 -1.33 0.00 0.00 177.39 176.08 1kyz n LYS 202 N 8.61 -3.10 -1.67 3.23 4.81 0.15 -4.92 118.16 125.28 1kyz n LYS 202 Ca 0.58 2.51 -0.01 0.00 -0.87 0.00 0.00 58.31 60.51 1kyz n LYS 202 Cb 0.17 -3.52 -0.01 0.00 0.02 0.00 0.00 35.03 31.69 1kyz n LYS 202 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 1kyz n SER 203 N -3.79 -3.12 -3.65 3.14 7.64 -0.96 -4.57 113.62 108.30 1kyz n SER 203 Ca -0.06 0.57 -0.03 0.00 1.01 0.00 0.00 58.87 60.36 1kyz n SER 203 Cb 0.56 -2.50 -0.06 0.00 -1.01 0.00 0.00 64.21 61.20 1kyz n SER 203 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1kyz s LEU 204 N -0.22 -1.00 -0.29 -3.43 2.96 -1.04 -3.28 118.68 112.37 1kyz s LEU 204 Ca -0.05 1.41 -0.06 0.00 -0.22 0.00 0.00 54.13 55.21 1kyz s LEU 204 Cb 0.00 2.03 0.01 0.00 0.50 0.00 0.00 46.19 48.74 1kyz s LEU 204 CO 0.13 -0.22 0.07 0.54 -1.32 0.00 0.00 176.35 175.55 1kyz s VAL 205 N 2.80 3.82 -0.51 1.68 0.11 -0.73 0.52 120.40 128.10 1kyz s VAL 205 Ca -0.05 -0.77 -0.24 0.00 -2.93 0.00 0.00 61.98 57.99 1kyz s VAL 205 Cb -0.12 -2.99 0.04 0.00 -1.53 0.00 0.00 36.38 31.78 1kyz s VAL 205 CO -0.17 0.07 0.88 -0.62 -3.33 0.00 0.00 175.10 171.93 1kyz s ASP 206 N 1.47 6.37 0.14 3.54 2.15 -0.16 -1.95 116.67 128.24 1kyz s ASP 206 Ca 0.02 -0.27 -0.30 0.00 0.43 0.00 0.00 52.55 52.42 1kyz s ASP 206 Cb -0.17 -2.42 -0.07 0.00 -0.30 0.00 0.00 42.92 39.96 1kyz s ASP 206 CO 0.02 -1.11 1.20 -0.69 -0.17 0.00 0.00 175.17 174.42 1kyz s VAL 207 N 3.68 3.72 -1.38 1.11 1.01 0.14 -1.23 120.40 127.46 1kyz s VAL 207 Ca 0.30 1.37 -0.07 0.00 0.00 0.00 0.00 61.98 63.58 1kyz s VAL 207 Cb -0.13 -3.87 0.03 0.00 0.00 0.00 0.00 36.38 32.41 1kyz s VAL 207 CO 0.20 0.18 0.97 0.61 0.00 0.00 0.00 175.10 177.07 1kyz n GLY 208 N 2.56 -0.44 0.19 4.51 0.00 0.28 -4.64 105.19 107.66 1kyz n GLY 208 Ca 0.06 0.18 0.14 0.00 0.00 0.00 0.00 46.02 46.40 1kyz n GLY 208 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1kyz h GLY 209 N -2.17 0.00 0.00 -0.02 0.00 -1.17 -3.48 103.07 96.23 1kyz h GLY 209 Ca -0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.74 1kyz h GLY 209 CO 0.59 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.74 1kyz n GLY 210 N 0.64 1.03 0.19 4.60 0.00 -1.26 -3.23 105.19 107.16 1kyz n GLY 210 Ca 0.03 -0.58 0.07 0.00 0.00 0.00 0.00 46.02 45.54 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 0.76 0.00 2.61 2.02 -1.95 -3.41 112.91 112.93 1kyz h THR 211 Ca 0.00 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.72 1kyz h THR 211 Cb 0.00 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1kyz h THR 211 CO 0.00 0.33 0.00 0.61 0.37 0.00 0.00 175.52 176.83 1kyz n GLY 212 N 0.33 1.21 0.00 2.16 0.00 -1.20 -4.24 105.19 103.45 1kyz n GLY 212 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1kyz n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kyz n ALA 213 N 0.00 0.00 0.10 4.61 0.00 -1.26 0.39 120.51 124.34 1kyz n ALA 213 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1kyz n ALA 213 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1kyz n ALA 213 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1kyz h VAL 214 N 0.00 0.00 0.03 0.00 2.07 -1.95 -3.28 116.25 113.12 1kyz h VAL 214 Ca 0.00 0.00 -0.36 0.00 0.82 0.00 0.00 66.70 67.16 1kyz h VAL 214 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 1kyz h VAL 214 CO 0.00 0.00 -2.17 0.00 0.02 0.00 0.00 177.57 175.42 1kyz n ILE 215 N -5.01 1.55 0.00 4.57 3.06 0.28 -2.77 119.36 121.04 1kyz n ILE 215 Ca -0.07 -0.73 0.00 0.00 -2.50 0.00 0.00 62.75 59.45 1kyz n ILE 215 Cb 0.35 -1.12 0.00 0.00 0.54 0.00 0.00 39.64 39.41 1kyz n ILE 215 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 1kyz n ASN 216 N -3.11 0.00 0.00 9.51 2.85 1.26 -3.33 115.26 122.45 1kyz n ASN 216 Ca -0.32 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.15 1kyz n ASN 216 Cb 1.07 0.00 0.00 0.00 1.24 0.00 0.00 39.78 42.09 1kyz n ASN 216 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 1kyz n THR 217 N -2.56 0.00 -0.07 -0.44 5.66 -1.26 -4.59 114.28 111.03 1kyz n THR 217 Ca 0.00 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.89 1kyz n THR 217 Cb 0.00 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 68.71 1kyz n THR 217 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1kyz h ILE 218 N 0.00 0.00 -0.49 1.09 2.04 -1.67 -1.21 117.51 117.28 1kyz h ILE 218 Ca 0.00 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.73 1kyz h ILE 218 Cb 0.00 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.07 1kyz h ILE 218 CO 0.00 0.00 -0.20 0.58 0.00 0.00 0.00 178.15 178.53 1kyz h VAL 219 N -0.36 1.27 0.00 1.67 2.07 -1.61 -2.78 116.25 116.52 1kyz h VAL 219 Ca 0.04 -1.36 0.00 0.00 0.82 0.00 0.00 66.70 66.20 1kyz h VAL 219 Cb 0.47 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1kyz h VAL 219 CO -0.40 0.47 0.26 -1.20 0.02 0.00 0.00 177.57 176.72 1kyz n SER 220 N -4.11 0.23 -0.25 0.57 7.64 -0.67 -1.56 113.62 115.46 1kyz n SER 220 Ca 0.00 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.36 1kyz n SER 220 Cb 0.45 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1kyz n SER 220 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1kyz n LYS 221 N -1.81 0.27 -3.53 1.43 4.76 -0.55 -1.71 118.16 117.02 1kyz n LYS 221 Ca -0.01 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.16 1kyz n LYS 221 Cb 0.27 -1.07 -0.09 0.00 -1.84 0.00 0.00 35.03 32.30 1kyz n LYS 221 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1kyz n TYR 222 N -0.06 3.21 -0.19 2.13 4.02 -0.60 -5.01 117.16 120.66 1kyz n TYR 222 Ca 0.00 -4.15 -0.02 0.00 -0.01 0.00 0.00 57.90 53.72 1kyz n TYR 222 Cb 0.03 -0.55 -0.01 0.00 -0.02 0.00 0.00 39.34 38.80 1kyz n TYR 222 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1kyz n PRO 223 N 1.22 -0.15 0.00 -0.72 -0.02 -0.69 -0.18 135.00 134.45 1kyz n PRO 223 Ca 0.27 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1kyz n PRO 223 Cb 0.40 -1.06 0.02 0.00 -0.02 0.00 0.00 33.50 32.84 1kyz n PRO 223 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1kyz n THR 224 N -4.65 0.00 -4.34 3.45 -2.24 -1.26 -4.54 114.28 100.70 1kyz n THR 224 Ca 0.03 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.47 1kyz n THR 224 Cb 0.16 -0.65 -0.13 0.00 -2.10 0.00 0.00 70.33 67.61 1kyz n THR 224 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1kyz s ILE 225 N -2.00 3.76 -0.40 2.28 1.09 0.75 -0.67 121.20 126.01 1kyz s ILE 225 Ca 0.01 -0.40 -0.12 0.00 -1.10 0.00 0.00 60.65 59.04 1kyz s ILE 225 Cb 0.00 -2.66 0.04 0.00 -1.06 0.00 0.00 42.46 38.79 1kyz s ILE 225 CO 0.01 0.48 0.25 -0.54 -0.10 0.00 0.00 174.94 175.03 1kyz s LYS 226 N 0.58 2.82 0.43 2.79 -0.14 -1.26 -4.80 119.74 120.17 1kyz s LYS 226 Ca -0.03 -1.15 -0.07 0.00 -1.36 0.00 0.00 55.97 53.35 1kyz s LYS 226 Cb -0.14 -3.82 -0.05 0.00 -1.68 0.00 0.00 37.83 32.14 1kyz s LYS 226 CO 0.03 -0.78 0.76 0.20 -0.76 0.00 0.00 175.35 174.80 1kyz s GLY 227 N 1.74 1.71 -0.26 -3.33 0.00 0.27 -2.26 107.32 105.19 1kyz s GLY 227 Ca 0.03 -0.39 -0.02 0.00 0.00 0.00 0.00 44.72 44.34 1kyz s GLY 227 CO 0.07 -0.22 0.06 -0.42 0.00 0.00 0.00 173.10 172.59 1kyz s ILE 228 N -2.54 0.75 -0.63 0.90 1.01 0.19 -0.69 121.20 120.19 1kyz s ILE 228 Ca 0.49 -1.03 -0.28 0.00 0.00 0.00 0.00 60.65 59.83 1kyz s ILE 228 Cb -0.10 -1.40 0.03 0.00 0.01 0.00 0.00 42.46 40.99 1kyz s ILE 228 CO 0.38 -0.45 1.25 0.21 0.00 0.00 0.00 174.94 176.33 1kyz s ASN 229 N 1.72 6.32 -0.18 3.58 3.84 0.69 -0.98 114.94 129.92 1kyz s ASN 229 Ca 0.04 -0.04 -0.07 0.00 0.21 0.00 0.00 52.86 53.01 1kyz s ASN 229 Cb -0.17 -2.55 -0.04 0.00 -0.55 0.00 0.00 41.25 37.94 1kyz s ASN 229 CO -0.18 -1.62 0.04 0.12 -2.79 0.00 0.00 177.10 172.67 1kyz s PHE 230 N 5.36 3.20 0.00 0.43 5.36 -0.37 -0.92 117.98 131.04 1kyz s PHE 230 Ca 0.42 -0.01 0.00 0.00 -0.96 0.00 0.00 56.93 56.38 1kyz s PHE 230 Cb -0.08 -2.06 0.00 0.00 -0.34 0.00 0.00 43.02 40.54 1kyz s PHE 230 CO 0.22 0.11 0.00 -3.47 -1.46 0.00 0.00 175.22 170.62 1kyz n ASP 231 N 3.56 0.00 -4.82 6.13 -0.08 -1.16 0.10 116.55 120.28 1kyz n ASP 231 Ca -0.17 -0.48 -0.33 0.00 -1.51 0.00 0.00 54.79 52.31 1kyz n ASP 231 Cb 0.52 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.97 1kyz n ASP 231 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1kyz s LEU 232 N 0.00 3.58 0.09 -2.67 1.43 -1.26 -1.40 118.68 118.45 1kyz s LEU 232 Ca 0.00 1.74 -0.20 0.00 -1.03 0.00 0.00 54.13 54.64 1kyz s LEU 232 Cb 0.00 -4.53 -0.06 0.00 0.03 0.00 0.00 46.19 41.63 1kyz s LEU 232 CO 0.00 -0.93 1.33 -0.65 0.23 0.00 0.00 176.35 176.34 1kyz h PRO 233 N 0.72 -0.14 -0.41 1.29 0.11 -1.88 -2.07 132.00 129.62 1kyz h PRO 233 Ca -0.47 0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.74 1kyz h PRO 233 Cb 1.21 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1kyz h PRO 233 CO 0.59 -0.09 0.28 1.12 -0.21 0.00 0.00 178.00 179.69 1kyz h HIS 234 N -0.15 0.17 -0.02 0.65 2.07 -1.99 -1.65 115.15 114.23 1kyz h HIS 234 Ca 0.07 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.49 1kyz h HIS 234 Cb 0.32 -0.05 -0.01 0.00 2.57 0.00 0.00 27.41 30.23 1kyz h HIS 234 CO -0.80 0.08 -0.46 0.28 -3.07 0.00 0.00 177.93 173.95 1kyz h VAL 235 N 0.16 1.34 0.20 6.12 2.07 -1.76 -3.29 116.25 121.08 1kyz h VAL 235 Ca 0.19 -1.61 -0.34 0.00 0.82 0.00 0.00 66.70 65.75 1kyz h VAL 235 Cb 0.54 1.84 0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1kyz h VAL 235 CO -0.03 0.46 -1.68 0.40 0.02 0.00 0.00 177.57 176.75 1kyz h ILE 236 N 0.04 1.00 -0.72 4.57 1.08 -1.05 -3.37 117.51 119.06 1kyz h ILE 236 Ca -0.00 -2.53 0.14 0.00 -0.39 0.00 0.00 64.86 62.07 1kyz h ILE 236 Cb 0.84 2.81 -0.13 0.00 -3.07 0.00 0.00 36.82 37.27 1kyz h ILE 236 CO 0.06 0.84 -0.20 -1.84 -0.69 0.00 0.00 178.15 176.33 1kyz n GLU 237 N -3.64 -0.08 0.09 2.37 0.28 -0.94 0.46 120.64 119.18 1kyz n GLU 237 Ca -0.23 1.12 -0.07 0.00 -0.16 0.00 0.00 57.16 57.81 1kyz n GLU 237 Cb 1.07 -1.67 0.01 0.00 1.43 0.00 0.00 31.44 32.28 1kyz n GLU 237 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1kyz h ASP 238 N 0.00 0.19 -1.09 -1.84 3.32 -1.76 -3.47 116.42 111.78 1kyz h ASP 238 Ca 0.33 -0.16 -0.52 0.00 0.02 0.00 0.00 57.03 56.70 1kyz h ASP 238 Cb 0.51 -0.06 0.11 0.00 0.22 0.00 0.00 39.33 40.11 1kyz h ASP 238 CO -0.74 0.95 -0.60 0.00 -1.72 0.00 0.00 179.24 177.13 1kyz n ALA 239 N -2.44 -2.60 -2.34 3.45 0.00 0.17 -4.92 120.51 111.83 1kyz n ALA 239 Ca -0.03 0.22 -0.38 0.00 0.00 0.00 0.00 53.44 53.25 1kyz n ALA 239 Cb 0.79 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.81 4.11 0.25 0.00 0.04 -1.26 -5.06 135.00 132.28 1kyz s PRO 240 Ca 0.50 0.64 -0.29 0.00 0.04 0.00 0.00 61.00 61.88 1kyz s PRO 240 Cb -0.63 -3.21 -0.09 0.00 0.04 0.00 0.00 34.50 30.60 1kyz s PRO 240 CO 0.48 0.64 0.95 -1.54 0.04 0.00 0.00 177.00 177.57 1kyz s SER 241 N -1.14 7.58 0.15 6.66 1.04 -1.26 -4.99 113.70 121.74 1kyz s SER 241 Ca 0.28 1.95 -0.09 0.00 0.48 0.00 0.00 55.95 58.58 1kyz s SER 241 Cb -0.18 -2.61 -0.01 0.00 0.10 0.00 0.00 66.02 63.32 1kyz s SER 241 CO 0.18 0.11 0.27 -0.31 0.98 0.00 0.00 173.24 174.46 1kyz s TYR 242 N -1.24 0.38 0.07 5.02 4.12 -1.26 -5.11 117.35 119.33 1kyz s TYR 242 Ca 0.43 -0.75 -0.37 0.00 0.02 0.00 0.00 57.07 56.39 1kyz s TYR 242 Cb -0.25 -0.07 -0.18 0.00 -1.52 0.00 0.00 41.96 39.94 1kyz s TYR 242 CO 0.31 -0.69 1.14 -0.35 0.02 0.00 0.00 175.55 175.98 1kyz n PRO 243 N -0.19 0.55 -1.35 -1.71 -0.04 -1.26 -1.85 135.00 129.15 1kyz n PRO 243 Ca -0.08 0.20 -0.12 0.00 -0.04 0.00 0.00 63.50 63.46 1kyz n PRO 243 Cb 0.63 -1.72 -0.05 0.00 -0.04 0.00 0.00 33.50 32.32 1kyz n PRO 243 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1kyz n GLY 244 N 1.96 1.16 3.03 0.55 0.00 -1.26 -4.85 105.19 105.78 1kyz n GLY 244 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.03 1.54 0.04 1.61 1.01 -0.77 -0.56 120.40 121.24 1kyz s VAL 245 Ca 0.00 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.36 1kyz s VAL 245 Cb 0.00 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1kyz s VAL 245 CO 0.00 0.45 0.06 -0.70 0.00 0.00 0.00 175.10 174.91 1kyz s GLU 246 N 1.29 2.90 -0.24 2.72 2.12 0.13 -4.29 118.70 123.33 1kyz s GLU 246 Ca 0.00 -0.62 -0.01 0.00 0.36 0.00 0.00 54.97 54.70 1kyz s GLU 246 Cb -0.14 -2.74 0.03 0.00 0.26 0.00 0.00 34.13 31.54 1kyz s GLU 246 CO -0.07 0.60 -0.08 -1.01 -0.54 0.00 0.00 175.26 174.16 1kyz s HIS 247 N -1.27 3.06 0.23 5.30 3.76 -1.26 -0.22 115.29 124.88 1kyz s HIS 247 Ca 0.25 -1.64 0.09 0.00 -0.15 0.00 0.00 55.06 53.61 1kyz s HIS 247 Cb -0.12 -2.03 -0.04 0.00 1.11 0.00 0.00 32.58 31.49 1kyz s HIS 247 CO 0.17 -0.75 -0.01 0.08 -0.85 0.00 0.00 174.74 173.38 1kyz s VAL 248 N 1.30 3.50 0.03 -0.90 1.01 -0.10 -4.93 120.40 120.30 1kyz s VAL 248 Ca -0.00 -1.74 0.03 0.00 0.00 0.00 0.00 61.98 60.27 1kyz s VAL 248 Cb -0.17 -2.82 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 1kyz s VAL 248 CO -0.05 -0.27 -0.11 -0.83 0.00 0.00 0.00 175.10 173.84 1kyz s GLY 249 N -3.37 0.60 0.00 4.51 0.00 -1.26 -2.99 107.32 104.82 1kyz s GLY 249 Ca 0.29 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 44.34 1kyz s GLY 249 CO 0.19 -0.67 0.00 0.61 0.00 0.00 0.00 173.10 173.23 1kyz n GLY 250 N 2.04 -0.81 2.65 0.20 0.00 -0.49 -4.83 105.19 103.95 1kyz n GLY 250 Ca -0.18 -0.27 -0.26 0.00 0.00 0.00 0.00 46.02 45.31 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 -4.00 2.42 0.45 1.61 2.15 -1.26 -4.24 116.67 113.80 1kyz s ASP 251 Ca 0.00 -0.62 0.21 0.00 0.43 0.00 0.00 52.55 52.57 1kyz s ASP 251 Cb 0.00 -0.34 1.16 0.00 -0.30 0.00 0.00 42.92 43.44 1kyz s ASP 251 CO 0.00 -0.33 1.60 0.00 -0.17 0.00 0.00 175.17 176.27 1kyz h MET 252 N 8.37 0.00 -0.00 4.34 -0.00 -1.95 0.27 114.93 125.96 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 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.74 1kyz h MET 252 CO 0.30 0.00 -0.33 1.19 -0.00 0.00 0.00 176.91 178.06 1kyz n PHE 253 N -2.40 0.00 -0.08 -0.10 3.01 -1.26 -4.30 117.46 112.34 1kyz n PHE 253 Ca -0.01 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.36 1kyz n PHE 253 Cb 0.28 -0.23 -0.03 0.00 -0.01 0.00 0.00 39.48 39.49 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 -1.21 1.47 -3.48 -4.37 0.31 0.91 -4.93 118.33 107.04 1kyz n VAL 254 Ca 0.09 0.14 -0.14 0.00 -0.01 0.00 0.00 64.34 64.41 1kyz n VAL 254 Cb 0.33 -2.25 -0.04 0.00 -0.91 0.00 0.00 33.84 30.97 1kyz n VAL 254 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1kyz s SER 255 N -5.99 -0.59 -0.03 4.52 0.15 -0.96 -5.05 113.70 105.75 1kyz s SER 255 Ca -0.27 0.34 0.06 0.00 0.70 0.00 0.00 55.95 56.79 1kyz s SER 255 Cb 0.04 0.55 -0.02 0.00 -1.71 0.00 0.00 66.02 64.88 1kyz s SER 255 CO 0.39 -0.76 -0.21 -0.63 1.20 0.00 0.00 173.24 173.23 1kyz s ILE 256 N -2.45 2.45 0.33 6.45 -1.09 -1.26 -4.20 121.20 121.43 1kyz s ILE 256 Ca -0.04 -0.96 -0.29 0.00 -2.23 0.00 0.00 60.65 57.13 1kyz s ILE 256 Cb -0.01 -1.90 -0.11 0.00 -1.58 0.00 0.00 42.46 38.87 1kyz s ILE 256 CO -0.02 0.58 1.55 -2.84 -1.23 0.00 0.00 174.94 172.99 1kyz s PRO 257 N -0.63 4.11 0.51 2.79 0.02 -1.26 -4.66 135.00 135.89 1kyz s PRO 257 Ca 0.10 2.59 -0.23 0.00 0.02 0.00 0.00 61.00 63.48 1kyz s PRO 257 Cb -0.10 -3.00 -0.06 0.00 0.02 0.00 0.00 34.50 31.36 1kyz s PRO 257 CO -0.00 -0.60 1.33 0.15 -0.33 0.00 0.00 177.00 177.55 1kyz s LYS 258 N -1.20 3.38 -0.11 5.54 -0.14 -1.26 -4.87 119.74 121.08 1kyz s LYS 258 Ca 0.59 2.16 -0.33 0.00 -1.36 0.00 0.00 55.97 57.03 1kyz s LYS 258 Cb -0.47 -2.37 0.13 0.00 -1.68 0.00 0.00 37.83 33.44 1kyz s LYS 258 CO 0.55 -0.98 1.24 0.00 -0.76 0.00 0.00 175.35 175.40 1kyz s ALA 259 N -1.34 -2.14 -0.15 5.17 0.00 -1.02 -4.91 121.76 117.38 1kyz s ALA 259 Ca 0.68 1.17 0.30 0.00 0.00 0.00 0.00 51.96 54.10 1kyz s ALA 259 Cb -0.38 0.11 1.09 0.00 0.00 0.00 0.00 23.12 23.94 1kyz s ALA 259 CO 0.46 -0.81 1.86 -0.44 0.00 0.00 0.00 175.76 176.83 1kyz h ASP 260 N 2.00 0.00 -4.93 0.00 5.19 -1.79 -3.37 116.42 113.51 1kyz h ASP 260 Ca -0.19 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.20 1kyz h ASP 260 Cb 1.18 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.54 1kyz h ASP 260 CO 0.25 0.00 0.24 0.00 -3.12 0.00 0.00 179.24 176.61 1kyz s ALA 261 N -3.49 -1.69 -0.01 3.45 0.00 -1.21 -3.91 121.76 114.90 1kyz s ALA 261 Ca 0.03 0.88 0.08 0.00 0.00 0.00 0.00 51.96 52.95 1kyz s ALA 261 Cb 0.09 0.46 -0.02 0.00 0.00 0.00 0.00 23.12 23.64 1kyz s ALA 261 CO 0.54 -0.60 -0.24 0.08 0.00 0.00 0.00 175.76 175.54 1kyz s VAL 262 N -2.66 2.27 -0.02 0.00 1.01 -0.56 -1.77 120.40 118.68 1kyz s VAL 262 Ca -0.03 -1.12 0.06 0.00 0.00 0.00 0.00 61.98 60.89 1kyz s VAL 262 Cb -0.01 -1.84 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 1kyz s VAL 262 CO -0.04 0.52 -0.20 0.12 0.00 0.00 0.00 175.10 175.50 1kyz s PHE 263 N -0.69 1.85 0.09 5.22 5.36 -0.82 0.72 117.98 129.69 1kyz s PHE 263 Ca 0.11 -0.38 0.00 0.00 -0.96 0.00 0.00 56.93 55.70 1kyz s PHE 263 Cb -0.10 -1.20 0.00 0.00 -0.34 0.00 0.00 43.02 41.38 1kyz s PHE 263 CO 0.00 -0.05 0.00 -1.33 -1.46 0.00 0.00 175.22 172.38 1kyz n MET 264 N 2.64 0.00 -2.41 10.12 2.81 -1.06 -0.68 117.12 128.54 1kyz n MET 264 Ca -0.16 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.72 1kyz n MET 264 Cb 0.53 -0.28 -0.01 0.00 -0.71 0.00 0.00 33.22 32.75 1kyz n MET 264 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1kyz n LYS 265 N -3.16 -3.66 -2.73 0.03 4.81 -1.25 -4.45 118.16 107.74 1kyz n LYS 265 Ca 0.00 2.71 -0.19 0.00 -0.87 0.00 0.00 58.31 59.96 1kyz n LYS 265 Cb 0.00 -3.58 0.02 0.00 0.02 0.00 0.00 35.03 31.49 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 1.93 -1.43 -0.09 5.64 8.01 -0.58 -4.91 117.44 126.00 1kyz n TRP 266 Ca -0.09 0.31 -0.15 0.00 -1.31 0.00 0.00 57.50 56.26 1kyz n TRP 266 Cb 0.15 -3.90 -0.07 0.00 -2.01 0.00 0.00 31.31 25.47 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 -4.25 0.99 0.11 -0.99 2.08 -1.26 -4.68 119.36 111.36 1kyz n ILE 267 Ca -0.14 -0.33 -0.13 0.00 0.56 0.00 0.00 62.75 62.71 1kyz n ILE 267 Cb 0.62 -1.35 -0.08 0.00 -0.75 0.00 0.00 39.64 38.09 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 -5.12 0.00 -0.24 0.00 1.44 -1.26 -0.54 115.22 109.49 1kyz n HIS 269 Ca -0.09 -0.05 0.00 0.00 -2.01 0.00 0.00 57.72 55.57 1kyz n HIS 269 Cb 0.16 -0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.20 1kyz n HIS 269 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 1kyz n ASP 270 N 0.62 0.10 -4.30 4.39 4.64 -1.07 -3.41 116.55 117.52 1kyz n ASP 270 Ca 0.00 -0.44 -0.17 0.00 -1.38 0.00 0.00 54.79 52.80 1kyz n ASP 270 Cb 0.09 0.20 -0.10 0.00 -1.04 0.00 0.00 41.12 40.26 1kyz n ASP 270 CO 0.00 0.00 0.00 0.26 -0.82 0.00 0.00 177.20 176.64 1kyz s TRP 271 N -0.20 1.51 0.72 -0.67 0.51 0.29 -4.06 118.94 117.05 1kyz s TRP 271 Ca 0.00 -0.65 -0.11 0.00 -2.12 0.00 0.00 56.10 53.22 1kyz s TRP 271 Cb 0.00 -0.73 0.02 0.00 -0.81 0.00 0.00 33.47 31.95 1kyz s TRP 271 CO 0.00 0.24 1.08 -1.54 -0.51 0.00 0.00 176.95 176.22 1kyz s SER 272 N -3.23 5.31 0.31 2.95 1.04 -1.26 -4.71 113.70 114.11 1kyz s SER 272 Ca 0.20 1.28 0.04 0.00 0.48 0.00 0.00 55.95 57.94 1kyz s SER 272 Cb 0.01 -2.11 0.63 0.00 0.10 0.00 0.00 66.02 64.65 1kyz s SER 272 CO 0.04 -1.45 1.85 0.44 0.98 0.00 0.00 173.24 175.11 1kyz h ASP 273 N -0.72 0.84 -0.13 7.02 5.19 -1.94 0.21 116.42 126.89 1kyz h ASP 273 Ca -0.45 0.04 0.02 0.00 -0.62 0.00 0.00 57.03 56.02 1kyz h ASP 273 Cb 1.24 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 40.61 1kyz h ASP 273 CO 0.61 0.45 -0.01 -0.08 -3.12 0.00 0.00 179.24 177.10 1kyz h GLU 274 N 0.90 0.03 -0.07 3.56 4.81 -2.00 -2.25 114.58 119.57 1kyz h GLU 274 Ca 0.48 -0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.47 1kyz h GLU 274 Cb 0.54 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.92 1kyz h GLU 274 CO -0.24 0.02 -0.90 0.45 -0.73 0.00 0.00 179.01 177.61 1kyz h HIS 275 N 0.03 0.93 -0.86 0.92 3.86 -1.73 -3.12 115.15 115.18 1kyz h HIS 275 Ca 0.06 -0.46 0.10 0.00 -1.16 0.00 0.00 60.37 58.91 1kyz h HIS 275 Cb 0.08 -0.12 -0.08 0.00 1.06 0.00 0.00 27.41 28.35 1kyz h HIS 275 CO -0.15 1.29 0.50 0.00 0.86 0.00 0.00 177.93 180.43 1kyz h LEU 277 N 0.83 0.75 0.38 0.00 3.38 -1.43 -0.08 115.31 119.14 1kyz h LEU 277 Ca 0.42 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 1kyz h LEU 277 Cb 0.40 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1kyz h LEU 277 CO -0.25 0.78 -0.18 0.50 0.09 0.00 0.00 178.44 179.38 1kyz h LYS 278 N 0.75 -0.49 0.00 1.13 1.63 -0.98 -1.50 116.57 117.12 1kyz h LYS 278 Ca 0.16 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.99 1kyz h LYS 278 Cb 0.38 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 1kyz h LYS 278 CO 0.01 -0.25 0.00 0.27 -3.45 0.00 0.00 179.45 176.03 1kyz h PHE 279 N -0.65 0.00 -0.01 1.91 -5.15 -1.35 -3.06 116.94 108.62 1kyz h PHE 279 Ca -0.05 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.55 1kyz h PHE 279 Cb 0.47 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 36.62 1kyz h PHE 279 CO -0.02 0.00 -0.75 -0.07 -2.00 0.00 0.00 178.31 175.48 1kyz h LEU 280 N 0.00 0.14 -1.02 2.10 3.38 -0.93 -1.59 115.31 117.39 1kyz h LEU 280 Ca 0.00 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 1kyz h LEU 280 Cb 0.86 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1kyz h LEU 280 CO 0.00 0.83 -0.45 0.11 0.09 0.00 0.00 178.44 179.02 1kyz h LYS 281 N 0.07 0.00 -0.05 1.13 1.57 -1.17 -1.78 116.57 116.34 1kyz h LYS 281 Ca -0.02 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.57 1kyz h LYS 281 Cb 1.31 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.62 1kyz h LYS 281 CO 0.11 0.45 -0.80 -0.91 -0.57 0.00 0.00 179.45 177.73 1kyz h ASN 282 N 0.00 0.47 -0.78 0.86 2.35 -1.42 -2.46 115.58 114.59 1kyz h ASN 282 Ca -0.00 -0.33 -0.04 0.00 -0.55 0.00 0.00 56.30 55.37 1kyz h ASN 282 Cb 0.87 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.06 1kyz h ASN 282 CO 0.06 1.09 0.32 0.00 -1.65 0.00 0.00 177.43 177.25 1kyz h TYR 284 N 1.14 0.15 0.00 0.00 3.20 -1.16 -2.27 116.97 118.03 1kyz h TYR 284 Ca 0.26 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.11 1kyz h TYR 284 Cb 0.21 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 1kyz h TYR 284 CO 0.02 0.07 -0.18 0.93 -1.64 0.00 0.00 178.16 177.36 1kyz h GLU 285 N 0.19 0.00 0.00 1.82 4.39 -0.94 -2.58 114.58 117.47 1kyz h GLU 285 Ca 0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1kyz h GLU 285 Cb 0.08 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1kyz h GLU 285 CO -0.12 0.18 0.00 0.00 -1.16 0.00 0.00 179.01 177.91 1kyz h ALA 286 N 1.82 1.00 -2.63 3.43 0.00 -0.64 -3.46 119.26 118.79 1kyz h ALA 286 Ca -0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 1kyz h ALA 286 Cb 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1kyz h ALA 286 CO 0.02 0.00 -0.22 -0.51 0.00 0.00 0.00 179.25 178.54 1kyz s LEU 287 N -5.21 4.23 0.00 0.00 1.43 -0.97 -2.44 118.68 115.71 1kyz s LEU 287 Ca 0.08 0.75 -0.08 0.00 -1.03 0.00 0.00 54.13 53.85 1kyz s LEU 287 Cb 0.09 -3.45 0.12 0.00 0.03 0.00 0.00 46.19 42.98 1kyz s LEU 287 CO 0.59 0.01 0.46 -0.81 0.23 0.00 0.00 176.35 176.83 1kyz n PRO 288 N 0.05 -1.65 0.29 1.29 -0.04 -1.26 -4.81 135.00 128.87 1kyz n PRO 288 Ca -0.01 -0.73 0.15 0.00 -0.04 0.00 0.00 63.50 62.87 1kyz n PRO 288 Cb 0.52 -0.64 0.86 0.00 -0.04 0.00 0.00 33.50 34.20 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 -1.54 0.00 -0.26 3.54 3.32 -1.96 -2.67 116.42 116.85 1kyz h ASP 289 Ca -0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1kyz h ASP 289 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1kyz h ASP 289 CO 0.11 0.05 0.00 -0.46 -1.72 0.00 0.00 179.24 177.23 1kyz n ASN 290 N -3.61 2.88 -3.05 6.45 0.23 -1.26 -2.95 115.26 113.95 1kyz n ASN 290 Ca -0.02 -2.18 -0.13 0.00 -0.53 0.00 0.00 54.58 51.71 1kyz n ASN 290 Cb 0.16 -0.24 0.12 0.00 -2.08 0.00 0.00 39.78 37.74 1kyz n ASN 290 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1kyz n GLY 291 N 0.12 -3.48 3.57 4.83 0.00 -1.01 -4.70 105.19 104.52 1kyz n GLY 291 Ca 0.11 -1.32 -0.09 0.00 0.00 0.00 0.00 46.02 44.72 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 -3.94 0.60 -0.19 1.61 -2.85 -1.25 -1.55 119.74 112.15 1kyz s LYS 292 Ca 0.29 0.04 -0.05 0.00 -1.00 0.00 0.00 55.97 55.25 1kyz s LYS 292 Cb -0.04 0.28 -0.03 0.00 -2.06 0.00 0.00 37.83 35.98 1kyz s LYS 292 CO 0.24 -0.21 0.01 0.08 0.10 0.00 0.00 175.35 175.57 1kyz s VAL 293 N -1.55 4.14 -0.46 1.79 1.01 0.28 -1.50 120.40 124.11 1kyz s VAL 293 Ca 0.01 -0.25 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 1kyz s VAL 293 Cb -0.01 -2.87 0.05 0.00 0.00 0.00 0.00 36.38 33.55 1kyz s VAL 293 CO -0.01 0.43 0.45 -0.63 0.00 0.00 0.00 175.10 175.34 1kyz s ILE 294 N 0.84 5.11 -0.20 2.22 1.01 0.22 -0.48 121.20 129.92 1kyz s ILE 294 Ca 0.01 -0.65 -0.08 0.00 0.00 0.00 0.00 60.65 59.93 1kyz s ILE 294 Cb -0.14 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 1kyz s ILE 294 CO 0.02 -0.55 0.08 -0.69 0.00 0.00 0.00 174.94 173.81 1kyz s VAL 295 N 2.03 4.83 -0.32 2.92 1.01 0.47 -2.56 120.40 128.78 1kyz s VAL 295 Ca 0.09 -0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.05 1kyz s VAL 295 Cb -0.20 -3.20 0.06 0.00 0.00 0.00 0.00 36.38 33.04 1kyz s VAL 295 CO 0.10 0.42 0.04 0.00 0.00 0.00 0.00 175.10 175.66 1kyz s ALA 296 N 0.68 2.88 0.13 5.51 0.00 -1.26 0.12 121.76 129.82 1kyz s ALA 296 Ca 0.04 -1.95 -0.12 0.00 0.00 0.00 0.00 51.96 49.94 1kyz s ALA 296 Cb -0.13 -2.02 0.01 0.00 0.00 0.00 0.00 23.12 20.98 1kyz s ALA 296 CO 0.02 -1.39 0.31 -1.21 0.00 0.00 0.00 175.76 173.48 1kyz s GLU 297 N 1.21 1.04 0.09 0.00 0.41 -0.93 -1.52 118.70 119.00 1kyz s GLU 297 Ca -0.02 -0.92 -0.27 0.00 -0.41 0.00 0.00 54.97 53.35 1kyz s GLU 297 Cb -0.20 0.41 -0.06 0.00 -1.78 0.00 0.00 34.13 32.49 1kyz s GLU 297 CO -0.02 -0.38 0.84 0.00 -0.49 0.00 0.00 175.26 175.21 1kyz s ILE 299 N -0.26 5.35 -0.15 0.00 1.01 -1.26 -4.47 121.20 121.42 1kyz s ILE 299 Ca 0.41 0.40 -0.20 0.00 0.00 0.00 0.00 60.65 61.25 1kyz s ILE 299 Cb -0.22 -3.55 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1kyz s ILE 299 CO 0.26 0.44 0.58 -0.22 0.00 0.00 0.00 174.94 176.00 1kyz s LEU 300 N 0.20 4.21 0.75 2.97 2.96 0.19 -4.96 118.68 125.00 1kyz s LEU 300 Ca 0.14 0.85 -0.11 0.00 -0.22 0.00 0.00 54.13 54.79 1kyz s LEU 300 Cb -0.12 -2.83 0.04 0.00 0.50 0.00 0.00 46.19 43.78 1kyz s LEU 300 CO 0.02 -0.15 1.08 -2.16 -1.32 0.00 0.00 176.35 173.82 1kyz s PRO 301 N 1.32 2.51 0.00 0.98 0.04 -1.26 -3.91 135.00 134.67 1kyz s PRO 301 Ca 0.28 1.00 -0.20 0.00 0.04 0.00 0.00 61.00 62.13 1kyz s PRO 301 Cb -0.16 -1.94 -0.25 0.00 0.04 0.00 0.00 34.50 32.20 1kyz s PRO 301 CO 0.11 -1.42 1.08 0.28 0.04 0.00 0.00 177.00 177.09 1kyz h VAL 302 N -0.95 1.43 -2.76 -0.36 2.07 -1.99 -3.45 116.25 110.23 1kyz h VAL 302 Ca -0.44 -2.16 -0.65 0.00 0.82 0.00 0.00 66.70 64.27 1kyz h VAL 302 Cb 1.23 2.66 -0.06 0.00 -1.52 0.00 0.00 31.29 33.60 1kyz h VAL 302 CO 0.55 0.63 -0.45 0.00 0.02 0.00 0.00 177.57 178.32 1kyz s ALA 303 N -3.11 3.88 0.62 1.67 0.00 -1.26 -5.09 121.76 118.48 1kyz s ALA 303 Ca -0.13 -0.63 -0.15 0.00 0.00 0.00 0.00 51.96 51.05 1kyz s ALA 303 Cb 0.03 -1.99 -0.02 0.00 0.00 0.00 0.00 23.12 21.14 1kyz s ALA 303 CO 0.83 0.65 1.08 -2.14 0.00 0.00 0.00 175.76 176.18 1kyz s PRO 304 N -1.41 3.08 0.18 0.00 0.02 -1.26 -5.06 135.00 130.55 1kyz s PRO 304 Ca 0.21 1.29 -0.17 0.00 0.02 0.00 0.00 61.00 62.36 1kyz s PRO 304 Cb -0.13 -1.99 0.03 0.00 0.02 0.00 0.00 34.50 32.42 1kyz s PRO 304 CO 0.11 -1.01 0.48 0.16 -0.33 0.00 0.00 177.00 176.41 1kyz s ASP 305 N -2.68 -0.23 0.00 2.53 -4.77 -1.26 -5.07 116.67 105.18 1kyz s ASP 305 Ca 0.65 -0.48 0.20 0.00 -3.30 0.00 0.00 52.55 49.63 1kyz s ASP 305 Cb -0.18 0.55 0.88 0.00 -1.09 0.00 0.00 42.92 43.08 1kyz s ASP 305 CO 0.39 -1.00 1.61 -1.54 0.70 0.00 0.00 175.17 175.33 1kyz n SER 306 N -0.31 1.10 -4.74 2.11 3.41 -1.26 -4.59 113.62 109.34 1kyz n SER 306 Ca -0.11 -1.60 -0.34 0.00 -0.26 0.00 0.00 58.87 56.56 1kyz n SER 306 Cb 0.63 -0.07 0.07 0.00 -0.26 0.00 0.00 64.21 64.58 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 -1.59 4.59 0.33 4.04 1.04 -1.26 -4.87 113.70 115.98 1kyz s SER 307 Ca 0.31 2.18 0.03 0.00 0.48 0.00 0.00 55.95 58.96 1kyz s SER 307 Cb 0.16 -2.57 0.57 0.00 0.10 0.00 0.00 66.02 64.28 1kyz s SER 307 CO 0.25 -1.99 1.86 -0.07 0.98 0.00 0.00 173.24 174.27 1kyz h LEU 308 N -0.18 0.54 -0.08 2.42 3.38 -1.98 -1.83 115.31 117.57 1kyz h LEU 308 Ca -0.47 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.40 1kyz h LEU 308 Cb 1.27 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1kyz h LEU 308 CO 0.51 0.60 0.04 0.00 0.09 0.00 0.00 178.44 179.68 1kyz h ALA 309 N 1.47 0.10 -0.48 1.53 0.00 -1.97 0.14 119.26 120.05 1kyz h ALA 309 Ca 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1kyz h ALA 309 Cb 0.33 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1kyz h ALA 309 CO 0.01 -0.35 0.12 1.15 0.00 0.00 0.00 179.25 180.18 1kyz h THR 310 N 0.02 1.24 -0.43 0.00 2.02 -1.85 -2.64 112.91 111.27 1kyz h THR 310 Ca 0.03 -0.82 -0.03 0.00 0.77 0.00 0.00 66.41 66.36 1kyz h THR 310 Cb 0.10 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1kyz h THR 310 CO -0.00 0.30 0.15 0.11 0.37 0.00 0.00 175.52 176.44 1kyz h LYS 311 N 0.65 0.63 -0.52 6.66 1.57 -1.16 -0.87 116.57 123.52 1kyz h LYS 311 Ca 0.15 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1kyz h LYS 311 Cb 0.32 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 1kyz h LYS 311 CO 0.00 0.54 0.34 0.78 -0.57 0.00 0.00 179.45 180.54 1kyz h GLY 312 N 0.80 0.73 0.88 3.86 0.00 -0.37 0.67 103.07 109.64 1kyz h GLY 312 Ca 0.15 -0.28 -0.15 0.00 0.00 0.00 0.00 47.33 47.05 1kyz h GLY 312 CO -0.01 0.27 -0.52 -0.24 0.00 0.00 0.00 176.54 176.04 1kyz h VAL 313 N 0.70 1.37 -0.31 4.60 3.04 -1.25 -3.13 116.25 121.27 1kyz h VAL 313 Ca 0.19 -1.85 -0.03 0.00 -1.01 0.00 0.00 66.70 63.99 1kyz h VAL 313 Cb -0.08 2.23 -0.02 0.00 -2.01 0.00 0.00 31.29 31.41 1kyz h VAL 313 CO -0.04 0.56 0.06 0.58 -1.01 0.00 0.00 177.57 177.71 1kyz h VAL 314 N 0.11 1.16 -0.24 1.51 2.07 -1.06 -1.67 116.25 118.13 1kyz h VAL 314 Ca -0.04 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 66.92 1kyz h VAL 314 Cb 1.17 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1kyz h VAL 314 CO 0.11 0.21 0.08 0.45 0.02 0.00 0.00 177.57 178.44 1kyz h HIS 315 N 0.45 0.15 -0.75 1.57 3.86 -0.85 -2.16 115.15 117.43 1kyz h HIS 315 Ca 0.11 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.31 1kyz h HIS 315 Cb 0.21 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.62 1kyz h HIS 315 CO 0.01 0.07 0.39 0.82 0.86 0.00 0.00 177.93 180.07 1kyz h ILE 316 N 0.19 1.23 -0.82 2.45 1.08 -1.34 -2.04 117.51 118.26 1kyz h ILE 316 Ca 0.10 -0.62 0.08 0.00 -0.39 0.00 0.00 64.86 64.03 1kyz h ILE 316 Cb 0.07 0.27 -0.07 0.00 -3.07 0.00 0.00 36.82 34.02 1kyz h ILE 316 CO -0.11 0.27 0.49 -0.78 -0.69 0.00 0.00 178.15 177.33 1kyz h ASP 317 N 1.04 0.74 0.82 1.72 3.58 -0.77 0.15 116.42 123.70 1kyz h ASP 317 Ca 0.26 0.03 -0.18 0.00 0.42 0.00 0.00 57.03 57.57 1kyz h ASP 317 Cb 0.07 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1kyz h ASP 317 CO -0.04 0.45 -0.84 -0.37 -2.88 0.00 0.00 179.24 175.56 1kyz h VAL 318 N 0.86 1.59 -0.66 2.25 -1.51 -1.16 -1.11 116.25 116.52 1kyz h VAL 318 Ca 0.38 -2.85 -0.07 0.00 -1.23 0.00 0.00 66.70 62.92 1kyz h VAL 318 Cb 0.25 2.54 -0.03 0.00 -2.13 0.00 0.00 31.29 31.93 1kyz h VAL 318 CO -0.20 0.82 0.12 0.40 -1.23 0.00 0.00 177.57 177.47 1kyz h ILE 319 N 0.01 1.26 -0.60 7.19 2.04 -0.64 -0.55 117.51 126.21 1kyz h ILE 319 Ca -0.01 -1.00 -0.03 0.00 1.00 0.00 0.00 64.86 64.82 1kyz h ILE 319 Cb 1.48 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 38.16 1kyz h ILE 319 CO 0.11 0.38 0.26 -0.03 0.00 0.00 0.00 178.15 178.87 1kyz h MET 320 N 1.01 0.89 -0.71 2.37 4.05 -0.49 -1.23 114.93 120.82 1kyz h MET 320 Ca 0.20 -0.15 0.05 0.00 -0.28 0.00 0.00 59.70 59.52 1kyz h MET 320 Cb 0.41 -0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 31.02 1kyz h MET 320 CO 0.01 0.75 0.47 1.25 0.23 0.00 0.00 176.91 179.62 1kyz h LEU 321 N 0.84 0.68 -0.03 3.39 5.85 -0.29 0.65 115.31 126.40 1kyz h LEU 321 Ca 0.20 -0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.66 1kyz h LEU 321 Cb 0.18 -0.15 0.01 0.00 0.37 0.00 0.00 40.66 41.07 1kyz h LEU 321 CO -0.02 0.45 -1.08 0.00 -0.34 0.00 0.00 178.44 177.45 1kyz h ALA 322 N 1.60 0.19 0.00 1.25 0.00 -0.24 -3.41 119.26 118.65 1kyz h ALA 322 Ca 0.30 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1kyz h ALA 322 Cb 0.20 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1kyz h ALA 322 CO -0.10 0.78 -0.40 0.72 0.00 0.00 0.00 179.25 180.25 1kyz n HIS 323 N -3.75 0.00 -2.13 0.00 8.25 -0.55 -1.43 115.22 115.60 1kyz n HIS 323 Ca -0.10 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.07 1kyz n HIS 323 Cb 0.91 0.00 0.02 0.00 1.12 0.00 0.00 29.99 32.04 1kyz n HIS 323 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1kyz s ASN 324 N -1.37 5.92 -0.12 0.41 2.20 0.23 -4.62 114.94 117.59 1kyz s ASN 324 Ca 0.00 1.11 -0.07 0.00 -0.94 0.00 0.00 52.86 52.95 1kyz s ASN 324 Cb 0.00 -2.14 -0.06 0.00 -2.00 0.00 0.00 41.25 37.05 1kyz s ASN 324 CO 0.00 -0.97 0.12 1.55 -2.94 0.00 0.00 177.10 174.86 1kyz h PRO 325 N -0.27 0.00 0.00 3.55 0.13 -1.90 -3.44 132.00 130.08 1kyz h PRO 325 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1kyz h PRO 325 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1kyz h PRO 325 CO 0.62 0.22 -0.39 0.41 -0.23 0.00 0.00 178.00 178.63 1kyz n GLY 326 N 1.71 0.16 3.79 1.56 0.00 -1.26 -5.02 105.19 106.13 1kyz n GLY 326 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.78 1.94 -0.19 -0.02 0.00 -1.26 -4.04 107.32 102.98 1kyz s GLY 327 Ca 0.00 0.33 -0.34 0.00 0.00 0.00 0.00 44.72 44.71 1kyz s GLY 327 CO 0.00 0.66 1.21 -1.59 0.00 0.00 0.00 173.10 173.38 1kyz s LYS 328 N -4.45 0.31 0.34 2.90 -2.85 -1.22 -4.66 119.74 110.10 1kyz s LYS 328 Ca 0.63 -0.10 -0.07 0.00 -1.00 0.00 0.00 55.97 55.43 1kyz s LYS 328 Cb -0.17 0.14 -0.05 0.00 -2.06 0.00 0.00 37.83 35.69 1kyz s LYS 328 CO 0.46 -0.13 0.64 -1.21 0.10 0.00 0.00 175.35 175.20 1kyz s GLU 329 N -2.28 3.68 0.24 1.78 0.41 -1.26 -4.45 118.70 116.82 1kyz s GLU 329 Ca 0.09 0.17 0.06 0.00 -0.41 0.00 0.00 54.97 54.88 1kyz s GLU 329 Cb -0.01 -2.55 -0.05 0.00 -1.78 0.00 0.00 34.13 29.74 1kyz s GLU 329 CO -0.05 0.11 -0.07 1.03 -0.49 0.00 0.00 175.26 175.79 1kyz s ARG 330 N -3.72 1.43 0.62 1.61 0.52 -1.26 -4.94 118.95 113.21 1kyz s ARG 330 Ca 0.47 -1.70 -0.01 0.00 -0.52 0.00 0.00 55.73 53.96 1kyz s ARG 330 Cb -0.10 -1.00 0.06 0.00 0.52 0.00 0.00 34.95 34.42 1kyz s ARG 330 CO 0.31 0.04 0.88 -0.08 0.02 0.00 0.00 175.30 176.47 1kyz s THR 331 N -3.11 2.47 0.21 0.02 -1.32 -1.25 0.54 115.64 113.20 1kyz s THR 331 Ca 0.27 -0.54 -0.10 0.00 -1.21 0.00 0.00 61.69 60.11 1kyz s THR 331 Cb 0.03 -2.94 0.15 0.00 -1.51 0.00 0.00 72.50 68.23 1kyz s THR 331 CO 0.09 0.00 1.85 -0.61 -2.21 0.00 0.00 174.62 173.74 1kyz h GLN 332 N -0.22 1.02 -0.48 7.08 4.15 -1.93 -2.07 115.11 122.66 1kyz h GLN 332 Ca -0.42 -0.09 -0.05 0.00 0.77 0.00 0.00 58.65 58.86 1kyz h GLN 332 Cb 1.30 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 28.75 1kyz h GLN 332 CO 0.53 0.72 0.09 -0.22 -1.93 0.00 0.00 178.83 178.02 1kyz h LYS 333 N 1.02 0.74 -0.01 1.69 3.64 -1.94 -0.79 116.57 120.93 1kyz h LYS 333 Ca 0.27 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.40 1kyz h LYS 333 Cb -0.03 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1kyz h LYS 333 CO -0.05 0.69 -0.44 0.93 -2.27 0.00 0.00 179.45 178.31 1kyz h GLU 334 N 0.71 0.02 -0.08 1.90 5.08 -1.80 0.63 114.58 121.04 1kyz h GLU 334 Ca 0.16 -0.01 -0.25 0.00 -1.00 0.00 0.00 59.36 58.26 1kyz h GLU 334 Cb 0.31 -0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.57 1kyz h GLU 334 CO 0.00 0.46 -0.91 0.74 -1.00 0.00 0.00 179.01 178.30 1kyz h PHE 335 N 0.02 1.05 -0.78 4.33 -1.00 -0.84 -2.54 116.94 117.18 1kyz h PHE 335 Ca -0.00 -0.52 -0.05 0.00 2.81 0.00 0.00 57.97 60.21 1kyz h PHE 335 Cb 0.79 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 40.18 1kyz h PHE 335 CO 0.00 1.35 0.31 1.49 -1.61 0.00 0.00 178.31 179.85 1kyz h GLU 336 N 0.47 1.16 -0.49 1.51 4.22 -0.78 -0.06 114.58 120.61 1kyz h GLU 336 Ca -0.09 -0.21 -0.08 0.00 0.08 0.00 0.00 59.36 59.06 1kyz h GLU 336 Cb 1.55 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.59 1kyz h GLU 336 CO 0.18 0.94 -0.01 -0.44 -2.18 0.00 0.00 179.01 177.50 1kyz h ASP 337 N 1.13 0.79 -0.31 1.04 3.32 -0.86 -0.49 116.42 121.04 1kyz h ASP 337 Ca 0.26 -0.20 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 1kyz h ASP 337 Cb 0.22 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 1kyz h ASP 337 CO -0.02 0.86 -0.05 -0.07 -1.72 0.00 0.00 179.24 178.24 1kyz h LEU 338 N 0.76 0.58 -0.21 1.55 3.38 -0.99 0.13 115.31 120.51 1kyz h LEU 338 Ca 0.15 -0.35 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1kyz h LEU 338 Cb 0.47 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1kyz h LEU 338 CO 0.02 0.79 0.12 0.00 0.09 0.00 0.00 178.44 179.47 1kyz h ALA 339 N 0.81 0.26 -0.59 1.53 0.00 -0.75 -0.09 119.26 120.43 1kyz h ALA 339 Ca 0.08 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1kyz h ALA 339 Cb 0.52 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1kyz h ALA 339 CO 0.03 -0.28 0.11 0.87 0.00 0.00 0.00 179.25 179.98 1kyz h LYS 340 N 0.26 0.93 -0.14 0.00 1.57 -1.03 -1.89 116.57 116.27 1kyz h LYS 340 Ca 0.08 -0.21 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 1kyz h LYS 340 Cb -0.01 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1kyz h LYS 340 CO -0.03 0.85 -0.09 0.78 -0.57 0.00 0.00 179.45 180.38 1kyz h GLY 341 N 1.01 0.22 -0.27 3.86 0.00 -0.08 -0.70 103.07 107.11 1kyz h GLY 341 Ca 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1kyz h GLY 341 CO 0.00 0.11 0.00 0.00 0.00 0.00 0.00 176.54 176.66 1kyz n ALA 342 N -2.50 2.56 -0.78 3.60 0.00 -0.11 -4.92 120.51 118.37 1kyz n ALA 342 Ca -0.01 -0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1kyz n ALA 342 Cb 0.23 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 1.03 0.63 0.04 0.00 0.00 -0.27 -4.62 105.19 102.00 1kyz n GLY 343 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1kyz n GLY 343 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1kyz n PHE 344 N -2.73 0.20 -0.15 1.61 3.01 -0.77 -4.83 117.46 113.80 1kyz n PHE 344 Ca 0.00 0.09 -0.00 0.00 1.01 0.00 0.00 57.45 58.55 1kyz n PHE 344 Cb 0.00 -0.64 -0.00 0.00 -0.01 0.00 0.00 39.48 38.82 1kyz n PHE 344 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1kyz n GLN 345 N -1.69 -1.96 -3.67 -1.08 0.00 -1.26 -4.06 117.38 103.66 1kyz n GLN 345 Ca 0.01 0.06 -0.08 0.00 0.00 0.00 0.00 57.00 57.00 1kyz n GLN 345 Cb 0.10 -2.85 -0.09 0.00 0.00 0.00 0.00 30.24 27.41 1kyz n GLN 345 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1kyz s GLY 346 N -0.27 -0.45 0.13 2.61 0.00 -1.15 -4.98 107.32 103.21 1kyz s GLY 346 Ca 0.00 1.81 0.06 0.00 0.00 0.00 0.00 44.72 46.59 1kyz s GLY 346 CO 0.00 2.24 -0.14 -0.12 0.00 0.00 0.00 173.10 175.08 1kyz s PHE 347 N 2.04 1.46 -0.30 1.90 5.36 -1.26 0.24 117.98 127.42 1kyz s PHE 347 Ca -0.07 -0.56 -0.14 0.00 -0.96 0.00 0.00 56.93 55.20 1kyz s PHE 347 Cb -0.09 -0.75 0.18 0.00 -0.34 0.00 0.00 43.02 42.01 1kyz s PHE 347 CO -0.15 0.18 1.07 0.21 -1.46 0.00 0.00 175.22 175.07 1kyz s LYS 348 N -2.84 0.18 0.11 10.12 2.47 -0.90 -4.91 119.74 123.98 1kyz s LYS 348 Ca 0.11 0.33 -0.26 0.00 -1.56 0.00 0.00 55.97 54.59 1kyz s LYS 348 Cb -0.04 0.18 -0.07 0.00 -1.46 0.00 0.00 37.83 36.44 1kyz s LYS 348 CO 0.03 -0.18 0.81 0.08 0.16 0.00 0.00 175.35 176.26 1kyz s VAL 349 N 2.88 4.51 0.00 4.02 1.01 -1.26 -0.15 120.40 131.41 1kyz s VAL 349 Ca -0.02 1.76 0.00 0.00 0.00 0.00 0.00 61.98 63.72 1kyz s VAL 349 Cb -0.09 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.11 1kyz s VAL 349 CO -0.11 0.43 0.00 1.41 0.00 0.00 0.00 175.10 176.82 1kyz n HIS 350 N 2.26 0.00 -0.79 5.22 8.25 0.64 -4.95 115.22 125.85 1kyz n HIS 350 Ca -0.03 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.09 1kyz n HIS 350 Cb 0.49 0.00 0.13 0.00 1.12 0.00 0.00 29.99 31.73 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 -1.73 4.71 -0.50 0.00 3.84 -1.26 -3.03 114.94 116.97 1kyz s ASN 352 Ca 0.52 -1.16 -0.03 0.00 0.21 0.00 0.00 52.86 52.41 1kyz s ASN 352 Cb -0.13 -1.69 0.13 0.00 -0.55 0.00 0.00 41.25 39.00 1kyz s ASN 352 CO 0.68 -0.22 0.30 0.00 -2.79 0.00 0.00 177.10 175.08 1kyz s ALA 353 N 1.27 3.34 -1.09 1.71 0.00 0.18 -4.77 121.76 122.40 1kyz s ALA 353 Ca -0.04 -2.84 -0.18 0.00 0.00 0.00 0.00 51.96 48.91 1kyz s ALA 353 Cb -0.19 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.39 1kyz s ALA 353 CO -0.02 -1.93 0.79 1.19 0.00 0.00 0.00 175.76 175.79 1kyz n PHE 354 N 4.14 -2.03 0.00 0.00 0.99 -1.26 -0.81 117.46 118.49 1kyz n PHE 354 Ca 0.02 0.54 0.00 0.00 -0.00 0.00 0.00 57.45 58.01 1kyz n PHE 354 Cb 0.40 -3.49 0.00 0.00 -1.00 0.00 0.00 39.48 35.39 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 -2.65 0.00 -4.63 4.37 4.05 -1.26 -4.92 115.26 110.21 1kyz n ASN 355 Ca -0.10 0.00 -0.40 0.00 0.45 0.00 0.00 54.58 54.53 1kyz n ASN 355 Cb 0.59 -0.41 -0.07 0.00 1.23 0.00 0.00 39.78 41.12 1kyz n ASN 355 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1kyz s THR 356 N -1.02 5.05 0.19 -0.44 2.01 0.01 -4.31 115.64 117.13 1kyz s THR 356 Ca 0.00 1.00 -0.01 0.00 0.31 0.00 0.00 61.69 62.99 1kyz s THR 356 Cb 0.00 -3.87 -0.04 0.00 0.01 0.00 0.00 72.50 68.59 1kyz s THR 356 CO 0.00 0.09 0.38 -0.31 -0.69 0.00 0.00 174.62 174.09 1kyz s TYR 357 N 2.17 3.48 -0.36 4.92 1.51 -0.58 0.51 117.35 129.01 1kyz s TYR 357 Ca 0.24 0.37 -0.05 0.00 -1.01 0.00 0.00 57.07 56.62 1kyz s TYR 357 Cb -0.16 -1.87 0.07 0.00 -0.11 0.00 0.00 41.96 39.89 1kyz s TYR 357 CO 0.09 0.40 0.14 0.42 -1.11 0.00 0.00 175.55 175.49 1kyz s ILE 358 N -1.82 3.59 0.18 2.71 -1.09 -1.17 -2.18 121.20 121.41 1kyz s ILE 358 Ca 0.39 -1.46 -0.06 0.00 -2.23 0.00 0.00 60.65 57.29 1kyz s ILE 358 Cb -0.11 -3.17 -0.06 0.00 -1.58 0.00 0.00 42.46 37.54 1kyz s ILE 358 CO 0.28 -0.35 0.43 -0.04 -1.23 0.00 0.00 174.94 174.03 1kyz s MET 359 N 1.31 3.65 -0.27 2.79 -1.94 0.34 -0.26 119.30 124.92 1kyz s MET 359 Ca 0.01 -0.02 0.02 0.00 -1.71 0.00 0.00 55.69 53.99 1kyz s MET 359 Cb -0.21 -2.78 0.07 0.00 2.01 0.00 0.00 34.83 33.91 1kyz s MET 359 CO 0.00 0.41 -0.05 -2.00 -0.01 0.00 0.00 175.02 173.37 1kyz s GLU 360 N -2.82 1.77 -0.65 2.03 2.12 0.79 -0.40 118.70 121.54 1kyz s GLU 360 Ca 0.43 -1.27 -0.24 0.00 0.36 0.00 0.00 54.97 54.24 1kyz s GLU 360 Cb -0.12 -2.77 0.05 0.00 0.26 0.00 0.00 34.13 31.56 1kyz s GLU 360 CO 0.25 -0.67 1.06 -0.06 -0.54 0.00 0.00 175.26 175.29 1kyz s PHE 361 N 1.22 2.60 -0.00 5.30 0.40 0.36 -2.11 117.98 125.75 1kyz s PHE 361 Ca -0.03 -0.23 -0.24 0.00 -0.60 0.00 0.00 56.93 55.83 1kyz s PHE 361 Cb -0.19 -4.34 -0.05 0.00 0.51 0.00 0.00 43.02 38.95 1kyz s PHE 361 CO -0.07 -1.68 0.72 -0.51 0.70 0.00 0.00 175.22 174.37 1kyz s LEU 362 N 4.53 4.40 -0.13 -0.37 1.43 0.14 -0.55 118.68 128.13 1kyz s LEU 362 Ca 0.29 1.32 -0.03 0.00 -1.03 0.00 0.00 54.13 54.68 1kyz s LEU 362 Cb -0.13 -3.14 -0.03 0.00 0.03 0.00 0.00 46.19 42.92 1kyz s LEU 362 CO 0.15 -0.02 -0.03 -0.75 0.23 0.00 0.00 176.35 175.93 1kyz s LYS 363 N 0.21 3.38 -0.29 1.70 2.20 -0.60 -2.91 119.74 123.43 1kyz s LYS 363 Ca 0.37 -0.49 0.04 0.00 -0.36 0.00 0.00 55.97 55.53 1kyz s LYS 363 Cb -0.19 -2.85 0.18 0.00 -1.51 0.00 0.00 37.83 33.46 1kyz s LYS 363 CO 0.20 0.42 0.51 0.21 -0.36 0.00 0.00 175.35 176.33 1kyz s LYS 364 N -0.12 0.49 0.00 4.03 2.20 -1.21 -3.97 119.74 121.17 1kyz s LYS 364 Ca 0.03 0.42 0.00 0.00 -0.36 0.00 0.00 55.97 56.06 1kyz s LYS 364 Cb -0.13 0.02 0.00 0.00 -1.51 0.00 0.00 37.83 36.21 1kyz s LYS 364 CO 0.02 -0.99 0.30 1.55 -0.36 0.00 0.00 175.35 175.87