#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kyz s ILE 14 N 0.00 5.02 0.71 3.57 1.01 -1.26 -5.05 121.20 125.19 1kyz s ILE 14 Ca 0.00 -0.87 -0.14 0.00 0.00 0.00 0.00 60.65 59.65 1kyz s ILE 14 Cb 0.00 -4.28 0.02 0.00 0.01 0.00 0.00 42.46 38.22 1kyz s ILE 14 CO 0.00 -0.79 1.11 -0.94 0.00 0.00 0.00 174.94 174.32 1kyz s SER 15 N 2.91 4.78 0.20 3.58 1.04 -1.26 -4.87 113.70 120.07 1kyz s SER 15 Ca 0.10 1.99 -0.11 0.00 0.48 0.00 0.00 55.95 58.40 1kyz s SER 15 Cb -0.23 -2.55 0.16 0.00 0.10 0.00 0.00 66.02 63.50 1kyz s SER 15 CO 0.08 -1.85 1.84 0.44 0.98 0.00 0.00 173.24 174.72 1kyz h ASP 16 N -0.40 0.64 -0.43 7.02 3.45 -1.99 -1.63 116.42 123.08 1kyz h ASP 16 Ca -0.46 0.00 0.06 0.00 0.43 0.00 0.00 57.03 57.06 1kyz h ASP 16 Cb 1.25 -0.13 -0.05 0.00 -0.56 0.00 0.00 39.33 39.83 1kyz h ASP 16 CO 0.52 0.44 0.14 1.05 -1.57 0.00 0.00 179.24 179.83 1kyz h GLU 17 N 0.77 0.29 -0.05 3.56 9.09 -1.99 0.39 114.58 126.64 1kyz h GLU 17 Ca 0.25 -0.02 -0.00 0.00 0.05 0.00 0.00 59.36 59.64 1kyz h GLU 17 Cb 0.02 -0.07 -0.00 0.00 -1.65 0.00 0.00 28.75 27.05 1kyz h GLU 17 CO -0.10 0.19 0.03 1.49 0.05 0.00 0.00 179.01 180.67 1kyz h GLU 18 N 0.30 0.08 -0.96 1.06 4.81 -1.82 -0.24 114.58 117.81 1kyz h GLU 18 Ca 0.20 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.49 1kyz h GLU 18 Cb 0.20 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.50 1kyz h GLU 18 CO -0.22 0.17 0.61 0.00 -0.73 0.00 0.00 179.01 178.85 1kyz h ALA 19 N 0.90 1.35 -0.29 2.92 0.00 -1.00 -0.36 119.26 122.78 1kyz h ALA 19 Ca 0.02 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1kyz h ALA 19 Cb 0.12 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1kyz h ALA 19 CO -0.00 0.37 -0.04 -0.97 0.00 0.00 0.00 179.25 178.60 1kyz h ASN 20 N 1.09 0.53 0.16 0.00 -1.24 -0.62 -0.81 115.58 114.70 1kyz h ASN 20 Ca 0.43 -0.34 -0.06 0.00 0.71 0.00 0.00 56.30 57.03 1kyz h ASN 20 Cb 0.21 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.11 1kyz h ASN 20 CO -0.19 0.75 -0.24 -0.07 -1.29 0.00 0.00 177.43 176.40 1kyz h LEU 21 N 0.31 0.14 -0.26 0.34 3.38 -0.61 -0.17 115.31 118.43 1kyz h LEU 21 Ca 0.08 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 1kyz h LEU 21 Cb 0.50 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1kyz h LEU 21 CO 0.02 0.38 -0.34 0.15 0.09 0.00 0.00 178.44 178.74 1kyz h PHE 22 N 0.13 0.85 -0.34 1.13 -0.00 -0.80 -1.83 116.94 116.08 1kyz h PHE 22 Ca 0.02 -0.28 -0.07 0.00 -0.00 0.00 0.00 57.97 57.65 1kyz h PHE 22 Cb 0.50 -0.17 -0.02 0.00 -0.00 0.00 0.00 35.95 36.26 1kyz h PHE 22 CO 0.00 1.03 -0.07 0.00 -0.00 0.00 0.00 178.31 179.28 1kyz h ALA 23 N 0.67 1.25 -0.10 2.41 0.00 -0.76 -1.94 119.26 120.79 1kyz h ALA 23 Ca 0.03 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1kyz h ALA 23 Cb 0.93 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1kyz h ALA 23 CO 0.08 0.49 -0.45 0.52 0.00 0.00 0.00 179.25 179.90 1kyz h MET 24 N 0.53 0.23 -0.26 0.00 2.86 -0.83 0.11 114.93 117.56 1kyz h MET 24 Ca 0.10 -0.12 -0.17 0.00 -2.06 0.00 0.00 59.70 57.46 1kyz h MET 24 Cb 0.44 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1kyz h MET 24 CO 0.02 0.64 -0.50 0.37 1.06 0.00 0.00 176.91 178.50 1kyz h GLN 25 N 0.19 0.80 -0.10 1.72 4.15 -1.00 -2.95 115.11 117.92 1kyz h GLN 25 Ca 0.01 -0.51 -0.10 0.00 0.77 0.00 0.00 58.65 58.82 1kyz h GLN 25 Cb 0.87 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.61 1kyz h GLN 25 CO 0.07 1.14 -0.38 -0.07 -1.93 0.00 0.00 178.83 177.66 1kyz h LEU 26 N 0.56 0.22 -1.43 -2.39 3.38 -1.19 -0.56 115.31 113.90 1kyz h LEU 26 Ca 0.01 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1kyz h LEU 26 Cb 1.10 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 1kyz h LEU 26 CO 0.11 0.58 0.39 0.00 0.09 0.00 0.00 178.44 179.62 1kyz h ALA 27 N 1.43 1.59 -0.56 1.53 0.00 -0.62 -2.97 119.26 119.67 1kyz h ALA 27 Ca 0.02 -0.04 -0.40 0.00 0.00 0.00 0.00 54.91 54.49 1kyz h ALA 27 Cb 0.76 -0.23 -0.38 0.00 0.00 0.00 0.00 17.79 17.94 1kyz h ALA 27 CO 0.06 0.37 -0.87 -1.13 0.00 0.00 0.00 179.25 177.68 1kyz n SER 28 N -4.45 3.60 0.15 0.00 3.41 -1.14 -4.86 113.62 110.32 1kyz n SER 28 Ca 0.06 -3.25 0.11 0.00 -0.26 0.00 0.00 58.87 55.53 1kyz n SER 28 Cb 0.05 -0.39 0.54 0.00 -0.26 0.00 0.00 64.21 64.15 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 -0.67 1.30 0.27 7.33 0.00 -0.23 -1.94 120.51 126.57 1kyz n ALA 29 Ca 0.31 0.15 0.16 0.00 0.00 0.00 0.00 53.44 54.06 1kyz n ALA 29 Cb 0.91 -1.34 0.67 0.00 0.00 0.00 0.00 19.45 19.69 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 -1.86 -3.18 113.55 112.33 1kyz h SER 30 Ca 0.00 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.40 1kyz h SER 30 Cb 0.15 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.18 1kyz h SER 30 CO 0.00 0.03 0.49 0.58 -0.87 0.00 0.00 176.83 177.06 1kyz h VAL 31 N 0.00 0.96 0.96 0.95 2.07 -1.78 -2.12 116.25 117.29 1kyz h VAL 31 Ca -0.00 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.18 1kyz h VAL 31 Cb 0.52 0.04 0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1kyz h VAL 31 CO 0.00 0.16 -0.46 0.25 0.02 0.00 0.00 177.57 177.54 1kyz h LEU 32 N 0.85 -1.09 -1.38 2.57 5.85 -1.79 -0.02 115.31 120.31 1kyz h LEU 32 Ca 0.38 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 59.10 1kyz h LEU 32 Cb 0.28 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 1kyz h LEU 32 CO -0.21 -0.77 0.01 1.55 -0.34 0.00 0.00 178.44 178.67 1kyz h PRO 33 N -1.29 0.42 -0.05 5.25 0.13 -1.74 -0.50 132.00 134.21 1kyz h PRO 33 Ca -0.13 -0.08 -0.24 0.00 -0.87 0.00 0.00 66.00 64.68 1kyz h PRO 33 Cb 0.98 -0.07 0.02 0.00 0.13 0.00 0.00 31.00 32.06 1kyz h PRO 33 CO 0.22 0.44 -0.90 0.52 -0.23 0.00 0.00 178.00 178.05 1kyz h MET 34 N 0.41 0.71 -0.45 0.86 2.86 -1.36 -0.23 114.93 117.72 1kyz h MET 34 Ca 0.09 -0.69 -0.09 0.00 -2.06 0.00 0.00 59.70 56.96 1kyz h MET 34 Cb 0.26 0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 1kyz h MET 34 CO 0.01 1.28 -0.07 0.82 1.06 0.00 0.00 176.91 180.01 1kyz h ILE 35 N 0.39 1.27 -0.65 -1.22 1.08 -0.87 -1.00 117.51 116.51 1kyz h ILE 35 Ca -0.10 -1.16 -0.02 0.00 -0.39 0.00 0.00 64.86 63.19 1kyz h ILE 35 Cb 1.55 1.11 -0.03 0.00 -3.07 0.00 0.00 36.82 36.38 1kyz h ILE 35 CO 0.18 0.40 0.33 0.25 -0.69 0.00 0.00 178.15 178.62 1kyz h LEU 36 N 0.68 0.84 -0.58 1.44 5.85 -1.08 0.23 115.31 122.69 1kyz h LEU 36 Ca 0.12 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1kyz h LEU 36 Cb 0.60 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1kyz h LEU 36 CO 0.04 0.72 0.38 0.50 -0.34 0.00 0.00 178.44 179.74 1kyz h LYS 37 N 0.90 0.75 -0.37 1.25 3.64 -0.82 -0.89 116.57 121.02 1kyz h LYS 37 Ca 0.23 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.49 1kyz h LYS 37 Cb 0.09 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1kyz h LYS 37 CO -0.03 0.50 -0.06 0.77 -2.27 0.00 0.00 179.45 178.35 1kyz h SER 38 N 0.77 0.59 -0.35 4.20 0.02 -0.69 -0.04 113.55 118.06 1kyz h SER 38 Ca 0.21 -0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1kyz h SER 38 Cb -0.08 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 1kyz h SER 38 CO -0.05 0.71 -0.00 0.00 -1.14 0.00 0.00 176.83 176.34 1kyz h ALA 39 N 1.36 1.18 -0.03 3.77 0.00 -0.37 -1.51 119.26 123.66 1kyz h ALA 39 Ca 0.11 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 1kyz h ALA 39 Cb 0.46 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1kyz h ALA 39 CO 0.02 0.54 -0.71 -0.07 0.00 0.00 0.00 179.25 179.03 1kyz h LEU 40 N 0.67 0.18 -1.24 0.00 3.38 -0.42 -1.38 115.31 116.50 1kyz h LEU 40 Ca 0.13 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1kyz h LEU 40 Cb 0.42 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1kyz h LEU 40 CO 0.02 0.83 -0.29 -0.33 0.09 0.00 0.00 178.44 178.76 1kyz h GLU 41 N 0.10 0.00 -0.34 1.13 5.08 -0.54 -2.66 114.58 117.35 1kyz h GLU 41 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1kyz h GLU 41 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1kyz h GLU 41 CO 0.10 0.29 0.00 1.28 -1.00 0.00 0.00 179.01 179.68 1kyz n LEU 42 N -3.62 2.86 -2.87 1.33 4.77 -0.61 -4.96 117.00 113.91 1kyz n LEU 42 Ca -0.01 -1.25 -0.20 0.00 -0.03 0.00 0.00 56.01 54.52 1kyz n LEU 42 Cb 0.42 -0.22 0.01 0.00 -2.33 0.00 0.00 43.42 41.29 1kyz n LEU 42 CO 0.35 0.63 -0.09 0.47 -1.33 0.00 0.00 177.39 177.41 1kyz n ASP 43 N 1.10 -5.18 -0.22 -1.43 8.00 -0.88 -4.89 116.55 113.04 1kyz n ASP 43 Ca 0.18 -0.17 -0.08 0.00 0.71 0.00 0.00 54.79 55.44 1kyz n ASP 43 Cb 0.51 -4.26 0.03 0.00 -0.02 0.00 0.00 41.12 37.37 1kyz n ASP 43 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1kyz h LEU 44 N -0.78 0.94 -0.77 0.64 3.38 -1.55 -0.89 115.31 116.29 1kyz h LEU 44 Ca -0.46 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.17 1kyz h LEU 44 Cb 1.32 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1kyz h LEU 44 CO 0.53 0.93 -0.21 -0.07 0.09 0.00 0.00 178.44 179.70 1kyz h LEU 45 N 0.91 0.71 -0.41 1.67 3.38 -1.91 -1.11 115.31 118.56 1kyz h LEU 45 Ca 0.20 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1kyz h LEU 45 Cb 0.35 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1kyz h LEU 45 CO 0.00 0.91 0.07 -0.33 0.09 0.00 0.00 178.44 179.19 1kyz h GLU 46 N 0.62 0.68 -0.34 1.13 4.39 -1.90 -0.83 114.58 118.34 1kyz h GLU 46 Ca 0.09 -0.18 0.01 0.00 0.34 0.00 0.00 59.36 59.62 1kyz h GLU 46 Cb 0.70 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.25 1kyz h GLU 46 CO 0.05 0.72 0.21 0.82 -1.16 0.00 0.00 179.01 179.66 1kyz h ILE 47 N 0.54 1.07 -0.11 3.13 2.04 -0.82 -1.91 117.51 121.45 1kyz h ILE 47 Ca 0.13 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.75 1kyz h ILE 47 Cb 0.37 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1kyz h ILE 47 CO 0.01 0.08 -0.32 0.40 0.00 0.00 0.00 178.15 178.32 1kyz h ILE 48 N 0.44 1.27 -0.12 -0.67 2.04 -1.08 -3.04 117.51 116.34 1kyz h ILE 48 Ca 0.13 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 64.72 1kyz h ILE 48 Cb -0.03 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.58 1kyz h ILE 48 CO -0.04 0.38 0.07 0.00 0.00 0.00 0.00 178.15 178.56 1kyz h ALA 49 N 1.49 0.15 0.00 1.87 0.00 -0.58 -1.83 119.26 120.36 1kyz h ALA 49 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1kyz h ALA 49 Cb 0.66 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1kyz h ALA 49 CO 0.05 -0.33 0.05 1.63 0.00 0.00 0.00 179.25 180.65 1kyz n LYS 50 N -4.98 0.02 0.08 0.00 5.02 -0.77 -1.06 118.16 116.47 1kyz n LYS 50 Ca -0.05 0.47 0.12 0.00 -2.02 0.00 0.00 58.31 56.84 1kyz n LYS 50 Cb 0.05 -1.61 0.46 0.00 -0.02 0.00 0.00 35.03 33.92 1kyz n LYS 50 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1kyz n ALA 51 N -1.48 2.10 0.00 7.82 0.00 -0.69 -5.02 120.51 123.24 1kyz n ALA 51 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1kyz n ALA 51 Cb 0.06 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.08 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 0.95 2.28 3.64 0.00 0.00 -0.22 -4.75 105.19 107.09 1kyz n GLY 52 Ca 0.05 -1.91 -0.55 0.00 0.00 0.00 0.00 46.02 43.61 1kyz n GLY 52 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1kyz n PRO 53 N 1.79 1.03 -0.97 1.61 -0.02 -1.26 -1.72 135.00 135.46 1kyz n PRO 53 Ca 0.00 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1kyz n PRO 53 Cb 0.00 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 1kyz n PRO 53 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kyz n GLY 54 N 3.19 0.14 3.78 -1.23 0.00 -1.26 -4.97 105.19 104.84 1kyz n GLY 54 Ca 0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.29 2.75 -0.10 4.61 0.00 -0.70 -4.99 121.76 122.03 1kyz s ALA 55 Ca 0.00 0.70 -0.01 0.00 0.00 0.00 0.00 51.96 52.64 1kyz s ALA 55 Cb 0.00 -3.31 0.03 0.00 0.00 0.00 0.00 23.12 19.84 1kyz s ALA 55 CO 0.00 -0.64 -0.01 -0.65 0.00 0.00 0.00 175.76 174.46 1kyz s GLN 56 N -3.38 0.78 0.16 0.00 -0.21 -1.26 -4.09 119.66 111.66 1kyz s GLN 56 Ca 0.70 -0.04 0.10 0.00 0.02 0.00 0.00 55.36 56.14 1kyz s GLN 56 Cb -0.20 -1.26 -0.04 0.00 1.00 0.00 0.00 33.01 32.51 1kyz s GLN 56 CO 0.26 -0.35 -0.22 0.96 -2.12 0.00 0.00 175.29 173.82 1kyz s ILE 57 N 1.91 2.10 0.76 1.08 -4.36 0.10 -4.57 121.20 118.23 1kyz s ILE 57 Ca 0.04 -1.89 -0.11 0.00 -0.26 0.00 0.00 60.65 58.43 1kyz s ILE 57 Cb -0.13 -1.95 0.05 0.00 1.25 0.00 0.00 42.46 41.68 1kyz s ILE 57 CO -0.06 -0.14 1.08 -0.94 0.24 0.00 0.00 174.94 175.12 1kyz s SER 58 N -2.48 4.72 0.42 4.36 1.04 -1.26 -0.77 113.70 119.73 1kyz s SER 58 Ca 0.16 1.55 0.09 0.00 0.48 0.00 0.00 55.95 58.24 1kyz s SER 58 Cb -0.08 -2.33 0.92 0.00 0.10 0.00 0.00 66.02 64.63 1kyz s SER 58 CO 0.08 -1.86 2.04 -0.65 0.98 0.00 0.00 173.24 173.82 1kyz h PRO 59 N -1.01 0.49 -0.16 4.02 0.11 -1.88 -0.81 132.00 132.76 1kyz h PRO 59 Ca -0.45 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1kyz h PRO 59 Cb 1.24 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1kyz h PRO 59 CO 0.56 0.32 0.04 0.82 -0.21 0.00 0.00 178.00 179.53 1kyz h ILE 60 N 0.50 1.20 -0.41 4.15 2.04 -1.92 0.32 117.51 123.39 1kyz h ILE 60 Ca 0.19 -0.63 -0.03 0.00 1.00 0.00 0.00 64.86 65.38 1kyz h ILE 60 Cb 0.12 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1kyz h ILE 60 CO -0.05 0.19 0.13 -0.08 0.00 0.00 0.00 178.15 178.35 1kyz h GLU 61 N 0.06 0.64 -0.17 2.37 4.81 -1.76 -1.54 114.58 118.98 1kyz h GLU 61 Ca 0.05 -0.14 0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1kyz h GLU 61 Cb 0.26 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.52 1kyz h GLU 61 CO 0.00 0.63 -0.03 0.82 -0.73 0.00 0.00 179.01 179.70 1kyz h ILE 62 N 0.52 0.84 -0.92 2.32 2.04 -1.00 -2.35 117.51 118.96 1kyz h ILE 62 Ca 0.13 -0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.08 1kyz h ILE 62 Cb 0.25 0.83 -0.07 0.00 -0.74 0.00 0.00 36.82 37.09 1kyz h ILE 62 CO -0.00 0.00 0.59 0.00 0.00 0.00 0.00 178.15 178.74 1kyz h ALA 63 N 1.17 1.58 0.00 1.87 0.00 -0.07 -0.68 119.26 123.12 1kyz h ALA 63 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1kyz h ALA 63 Cb 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1kyz h ALA 63 CO -0.17 0.24 0.00 0.66 0.00 0.00 0.00 179.25 179.98 1kyz h SER 64 N 0.95 0.00 -0.21 0.00 4.64 -0.72 0.42 113.55 118.62 1kyz h SER 64 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 1kyz h SER 64 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1kyz h SER 64 CO -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.78 1kyz n GLN 65 N -2.69 2.28 -3.35 4.77 1.13 -0.27 -4.90 117.38 114.36 1kyz n GLN 65 Ca -0.01 -1.90 -0.32 0.00 -1.94 0.00 0.00 57.00 52.82 1kyz n GLN 65 Cb 0.11 -1.48 -0.06 0.00 0.11 0.00 0.00 30.24 28.92 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 -1.72 4.17 -1.31 1.08 1.02 0.13 -4.97 118.68 117.08 1kyz s LEU 66 Ca 0.34 1.01 -0.09 0.00 0.02 0.00 0.00 54.13 55.41 1kyz s LEU 66 Cb 0.21 -3.72 -0.12 0.00 0.02 0.00 0.00 46.19 42.58 1kyz s LEU 66 CO 0.31 -0.08 3.09 -0.81 0.02 0.00 0.00 176.35 178.87 1kyz n PRO 67 N -0.08 3.39 -3.85 1.29 -0.04 -1.26 -4.84 135.00 129.62 1kyz n PRO 67 Ca 0.00 -1.99 -0.09 0.00 -0.04 0.00 0.00 63.50 61.38 1kyz n PRO 67 Cb 0.52 -2.64 -0.05 0.00 -0.04 0.00 0.00 33.50 31.29 1kyz n PRO 67 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1kyz s THR 68 N 1.88 0.04 -0.00 0.52 -1.32 -1.26 -5.03 115.64 110.46 1kyz s THR 68 Ca 0.69 -1.06 0.00 0.00 -1.21 0.00 0.00 61.69 60.11 1kyz s THR 68 Cb 0.21 -1.75 0.00 0.00 -1.51 0.00 0.00 72.50 69.45 1kyz s THR 68 CO -0.05 -0.16 0.77 0.35 -2.21 0.00 0.00 174.62 173.32 1kyz n THR 69 N -0.31 0.55 -1.56 5.08 -2.24 -1.26 -4.96 114.28 109.58 1kyz n THR 69 Ca -0.08 -0.77 -0.50 0.00 -2.27 0.00 0.00 64.05 60.42 1kyz n THR 69 Cb 0.62 0.73 -0.06 0.00 -2.10 0.00 0.00 70.33 69.52 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 -0.27 2.62 0.30 3.42 5.15 -1.26 -4.83 115.26 120.40 1kyz n ASN 70 Ca 0.00 0.64 0.18 0.00 -0.60 0.00 0.00 54.58 54.79 1kyz n ASN 70 Cb 0.14 -1.30 0.96 0.00 -0.53 0.00 0.00 39.78 39.05 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 11.05 0.00 -0.00 1.20 0.11 -2.03 -2.33 132.00 139.99 1kyz h PRO 71 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1kyz h PRO 71 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1kyz h PRO 71 CO 0.99 0.03 -0.38 -0.25 -0.21 0.00 0.00 178.00 178.18 1kyz n ASP 72 N -3.42 0.66 -0.16 -2.05 8.00 -1.26 -4.41 116.55 113.91 1kyz n ASP 72 Ca -0.02 -0.46 -0.02 0.00 0.71 0.00 0.00 54.79 55.00 1kyz n ASP 72 Cb 0.14 0.17 0.06 0.00 -0.02 0.00 0.00 41.12 41.48 1kyz n ASP 72 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1kyz h ALA 73 N 3.27 0.50 -0.08 2.24 0.00 -1.80 -2.71 119.26 120.68 1kyz h ALA 73 Ca 0.00 0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1kyz h ALA 73 Cb 0.49 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 1kyz h ALA 73 CO 0.00 -0.38 -0.30 -1.35 0.00 0.00 0.00 179.25 177.22 1kyz h PRO 74 N 0.13 -0.38 -0.76 0.00 0.11 -1.81 0.16 132.00 129.44 1kyz h PRO 74 Ca 0.26 0.03 0.01 0.00 0.11 0.00 0.00 66.00 66.41 1kyz h PRO 74 Cb 0.39 0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.55 1kyz h PRO 74 CO -0.42 -0.26 0.51 0.28 -0.21 0.00 0.00 178.00 177.90 1kyz h VAL 75 N -0.40 1.19 -0.61 3.15 2.07 -1.84 0.18 116.25 119.98 1kyz h VAL 75 Ca 0.08 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.23 1kyz h VAL 75 Cb 0.52 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.34 1kyz h VAL 75 CO -0.31 0.19 0.29 0.24 0.02 0.00 0.00 177.57 178.00 1kyz h MET 76 N 1.03 0.89 -0.53 1.57 2.86 -1.16 -2.30 114.93 117.28 1kyz h MET 76 Ca 0.28 -0.13 -0.09 0.00 -2.06 0.00 0.00 59.70 57.70 1kyz h MET 76 Cb -0.11 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.38 1kyz h MET 76 CO -0.07 0.72 -0.04 -0.07 1.06 0.00 0.00 176.91 178.51 1kyz h LEU 77 N 0.84 0.92 -0.67 1.22 3.38 -0.38 -2.42 115.31 118.20 1kyz h LEU 77 Ca 0.21 -0.26 0.07 0.00 0.09 0.00 0.00 57.88 57.98 1kyz h LEU 77 Cb 0.13 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 1kyz h LEU 77 CO -0.03 1.00 0.35 -0.78 0.09 0.00 0.00 178.44 179.08 1kyz h ASP 78 N 0.86 0.50 -0.45 -0.43 3.58 -0.25 0.23 116.42 120.46 1kyz h ASP 78 Ca 0.15 0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.56 1kyz h ASP 78 Cb 0.56 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 1kyz h ASP 78 CO 0.03 0.32 -0.02 0.03 -2.88 0.00 0.00 179.24 176.72 1kyz h ARG 79 N 0.64 0.87 -0.00 0.28 3.08 -1.19 -0.95 114.38 117.11 1kyz h ARG 79 Ca 0.31 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 1kyz h ARG 79 Cb 0.24 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1kyz h ARG 79 CO -0.21 0.88 -0.01 0.52 -1.07 0.00 0.00 179.97 180.08 1kyz h MET 80 N 0.80 0.01 -0.72 0.04 2.86 -0.84 -3.16 114.93 113.92 1kyz h MET 80 Ca 0.15 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1kyz h MET 80 Cb 0.51 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.13 1kyz h MET 80 CO 0.03 0.53 0.47 -0.07 1.06 0.00 0.00 176.91 178.93 1kyz h LEU 81 N -0.51 0.84 -0.74 1.22 3.38 -0.53 -2.21 115.31 116.75 1kyz h LEU 81 Ca 0.00 -0.03 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1kyz h LEU 81 Cb 0.53 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 1kyz h LEU 81 CO 0.00 0.62 0.45 -0.09 0.09 0.00 0.00 178.44 179.51 1kyz h ARG 82 N 0.98 0.84 -0.63 1.13 2.43 -1.20 0.99 114.38 118.93 1kyz h ARG 82 Ca 0.26 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1kyz h ARG 82 Cb -0.10 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.23 1kyz h ARG 82 CO -0.06 0.55 0.36 1.25 -1.51 0.00 0.00 179.97 180.57 1kyz h LEU 83 N 0.86 0.76 -0.94 3.80 5.85 -1.37 -1.33 115.31 122.95 1kyz h LEU 83 Ca 0.31 -0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.86 1kyz h LEU 83 Cb 0.09 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1kyz h LEU 83 CO -0.14 0.61 -0.26 -0.07 -0.34 0.00 0.00 178.44 178.25 1kyz h LEU 84 N 0.85 0.47 -0.59 2.25 3.38 -1.10 -2.52 115.31 118.05 1kyz h LEU 84 Ca 0.22 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1kyz h LEU 84 Cb 0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1kyz h LEU 84 CO -0.04 0.73 0.10 0.00 0.09 0.00 0.00 178.44 179.32 1kyz h ALA 85 N 1.31 0.79 -0.86 1.53 0.00 -0.47 -0.78 119.26 120.77 1kyz h ALA 85 Ca 0.06 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1kyz h ALA 85 Cb 0.68 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1kyz h ALA 85 CO 0.05 0.53 0.56 0.00 0.00 0.00 0.00 179.25 180.40 1kyz n TYR 87 N -4.47 0.25 -3.42 0.00 4.02 -0.94 -4.92 117.16 107.68 1kyz n TYR 87 Ca 0.12 -0.13 -0.20 0.00 -0.01 0.00 0.00 57.90 57.68 1kyz n TYR 87 Cb 0.17 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.55 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 0.15 -2.52 -0.10 -0.72 2.08 -0.39 -4.89 119.36 112.96 1kyz n ILE 88 Ca 0.12 0.00 -0.12 0.00 0.56 0.00 0.00 62.75 63.31 1kyz n ILE 88 Cb 0.24 -3.61 -0.15 0.00 -0.75 0.00 0.00 39.64 35.37 1kyz n ILE 88 CO 0.00 0.00 0.00 -0.38 0.56 0.00 0.00 176.55 176.73 1kyz n ILE 89 N -4.63 1.44 -4.36 1.39 5.41 -0.35 -4.73 119.36 113.53 1kyz n ILE 89 Ca 0.01 -0.79 -0.25 0.00 1.00 0.00 0.00 62.75 62.72 1kyz n ILE 89 Cb 0.55 -0.74 -0.12 0.00 -0.71 0.00 0.00 39.64 38.63 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 -5.79 2.40 0.24 1.39 1.43 -1.18 -1.50 118.68 115.67 1kyz s LEU 90 Ca -0.15 -0.82 0.03 0.00 -1.03 0.00 0.00 54.13 52.16 1kyz s LEU 90 Cb 0.07 -0.99 -0.03 0.00 0.03 0.00 0.00 46.19 45.26 1kyz s LEU 90 CO 0.78 0.06 0.39 0.42 0.23 0.00 0.00 176.35 178.23 1kyz s THR 91 N -1.65 5.23 -0.11 5.49 -4.23 0.16 -4.27 115.64 116.25 1kyz s THR 91 Ca 0.15 -0.74 -0.09 0.00 -1.18 0.00 0.00 61.69 59.83 1kyz s THR 91 Cb -0.08 -3.82 0.03 0.00 1.34 0.00 0.00 72.50 69.97 1kyz s THR 91 CO 0.07 -0.32 0.28 0.00 -0.54 0.00 0.00 174.62 174.12 1kyz s SER 93 N 0.32 2.63 -0.19 0.00 0.01 -0.30 -4.95 113.70 111.22 1kyz s SER 93 Ca -0.01 -0.47 -0.06 0.00 1.31 0.00 0.00 55.95 56.72 1kyz s SER 93 Cb -0.03 -0.26 -0.03 0.00 0.21 0.00 0.00 66.02 65.91 1kyz s SER 93 CO -0.01 0.23 0.02 -0.69 0.41 0.00 0.00 173.24 173.20 1kyz s VAL 94 N -0.65 4.19 0.17 3.43 1.01 -1.26 0.14 120.40 127.43 1kyz s VAL 94 Ca 0.09 -0.23 0.09 0.00 0.00 0.00 0.00 61.98 61.92 1kyz s VAL 94 Cb -0.09 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 1kyz s VAL 94 CO 0.00 0.43 -0.20 0.00 0.00 0.00 0.00 175.10 175.34 1kyz s ARG 95 N 0.82 1.34 -0.34 2.72 1.70 0.12 -4.97 118.95 120.33 1kyz s ARG 95 Ca 0.01 -1.43 -0.07 0.00 -0.47 0.00 0.00 55.73 53.77 1kyz s ARG 95 Cb -0.14 -1.47 0.04 0.00 -0.57 0.00 0.00 34.95 32.81 1kyz s ARG 95 CO 0.02 0.31 0.11 0.95 -1.08 0.00 0.00 175.30 175.61 1kyz s THR 96 N -1.92 3.83 0.81 4.99 -4.23 -1.26 0.11 115.64 117.97 1kyz s THR 96 Ca 0.17 -1.13 -0.11 0.00 -1.18 0.00 0.00 61.69 59.44 1kyz s THR 96 Cb -0.06 -3.18 0.08 0.00 1.34 0.00 0.00 72.50 70.68 1kyz s THR 96 CO 0.07 -0.19 1.12 -1.58 -0.54 0.00 0.00 174.62 173.51 1kyz s GLN 97 N 1.41 1.84 0.00 3.99 2.00 0.20 -4.87 119.66 124.23 1kyz s GLN 97 Ca -0.01 1.39 0.06 0.00 -2.00 0.00 0.00 55.36 54.79 1kyz s GLN 97 Cb -0.20 -1.83 0.37 0.00 0.80 0.00 0.00 33.01 32.15 1kyz s GLN 97 CO 0.03 -1.99 0.77 1.04 -0.50 0.00 0.00 175.29 174.65 1kyz n GLN 98 N -3.61 0.26 -0.46 1.67 6.02 -1.26 -1.68 117.38 118.32 1kyz n GLN 98 Ca 0.11 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.18 1kyz n GLN 98 Cb 0.52 -1.37 0.27 0.00 1.02 0.00 0.00 30.24 30.68 1kyz n GLN 98 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1kyz n ASP 99 N -0.87 4.06 0.00 1.08 5.75 -1.26 -4.94 116.55 120.36 1kyz n ASP 99 Ca 0.05 -2.59 0.00 0.00 -0.01 0.00 0.00 54.79 52.24 1kyz n ASP 99 Cb 0.02 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 39.62 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 0.31 0.73 3.70 6.12 0.00 -0.67 -5.02 105.19 110.35 1kyz n GLY 100 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.10 2.73 0.05 1.61 1.02 -1.25 -4.91 119.74 118.88 1kyz s LYS 101 Ca 0.00 -0.69 -0.25 0.00 0.02 0.00 0.00 55.97 55.04 1kyz s LYS 101 Cb 0.00 -2.64 -0.05 0.00 -0.52 0.00 0.00 37.83 34.62 1kyz s LYS 101 CO 0.00 0.59 0.79 0.08 -0.92 0.00 0.00 175.35 175.89 1kyz s VAL 102 N -1.20 4.71 -0.03 3.17 1.01 -1.26 0.60 120.40 127.40 1kyz s VAL 102 Ca 0.23 1.67 0.04 0.00 0.00 0.00 0.00 61.98 63.93 1kyz s VAL 102 Cb -0.12 -4.14 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 1kyz s VAL 102 CO 0.14 0.36 -0.16 -1.58 0.00 0.00 0.00 175.10 173.86 1kyz s GLN 103 N -0.03 1.60 -0.15 2.72 0.74 0.30 -4.89 119.66 119.94 1kyz s GLN 103 Ca 0.39 -0.58 -0.11 0.00 0.05 0.00 0.00 55.36 55.11 1kyz s GLN 103 Cb -0.21 -1.44 -0.05 0.00 1.10 0.00 0.00 33.01 32.42 1kyz s GLN 103 CO 0.24 0.27 0.20 1.03 -0.55 0.00 0.00 175.29 176.48 1kyz s ARG 104 N -0.08 3.96 -0.17 1.67 0.52 -1.26 0.10 118.95 123.69 1kyz s ARG 104 Ca -0.01 -0.05 -0.04 0.00 -0.52 0.00 0.00 55.73 55.11 1kyz s ARG 104 Cb -0.10 -3.34 -0.03 0.00 0.52 0.00 0.00 34.95 32.01 1kyz s ARG 104 CO 0.01 0.46 -0.02 -0.51 0.02 0.00 0.00 175.30 175.26 1kyz s LEU 105 N -0.15 3.27 -0.08 2.53 1.43 0.12 -4.25 118.68 121.55 1kyz s LEU 105 Ca 0.14 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 1kyz s LEU 105 Cb -0.12 -1.80 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1kyz s LEU 105 CO 0.03 0.14 -0.07 -0.31 0.23 0.00 0.00 176.35 176.36 1kyz s TYR 106 N 0.56 2.93 0.37 0.29 1.51 0.05 -1.14 117.35 121.91 1kyz s TYR 106 Ca -0.02 -0.06 0.03 0.00 -1.01 0.00 0.00 57.07 56.01 1kyz s TYR 106 Cb -0.14 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 39.92 1kyz s TYR 106 CO 0.02 0.25 0.09 0.20 -1.11 0.00 0.00 175.55 175.00 1kyz s GLY 107 N -0.60 2.35 -0.07 0.71 0.00 -0.05 -0.72 107.32 108.94 1kyz s GLY 107 Ca 0.09 -1.59 -0.19 0.00 0.00 0.00 0.00 44.72 43.03 1kyz s GLY 107 CO 0.02 -1.83 0.51 1.08 0.00 0.00 0.00 173.10 172.88 1kyz s LEU 108 N -3.55 4.34 0.75 0.66 1.43 -1.26 0.36 118.68 121.40 1kyz s LEU 108 Ca 0.29 0.95 -0.07 0.00 -1.03 0.00 0.00 54.13 54.27 1kyz s LEU 108 Cb 0.05 -2.76 0.10 0.00 0.03 0.00 0.00 46.19 43.61 1kyz s LEU 108 CO 0.14 0.06 1.05 0.00 0.23 0.00 0.00 176.35 177.83 1kyz s ALA 109 N 0.21 3.16 0.20 4.21 0.00 -0.56 -4.59 121.76 124.39 1kyz s ALA 109 Ca 0.28 -1.18 -0.11 0.00 0.00 0.00 0.00 51.96 50.95 1kyz s ALA 109 Cb -0.16 -2.47 0.25 0.00 0.00 0.00 0.00 23.12 20.74 1kyz s ALA 109 CO 0.13 -1.51 1.73 1.15 0.00 0.00 0.00 175.76 177.26 1kyz h THR 110 N -0.73 0.74 -0.15 0.00 2.02 -1.86 -1.60 112.91 111.33 1kyz h THR 110 Ca -0.42 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 66.62 1kyz h THR 110 Cb 1.29 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 1kyz h THR 110 CO 0.51 0.06 -0.01 1.62 0.37 0.00 0.00 175.52 178.08 1kyz h VAL 111 N 0.33 1.11 -0.12 3.16 3.04 -1.85 -1.12 116.25 120.80 1kyz h VAL 111 Ca 0.29 -0.41 -0.22 0.00 -1.01 0.00 0.00 66.70 65.35 1kyz h VAL 111 Cb 0.37 1.00 0.01 0.00 -2.01 0.00 0.00 31.29 30.66 1kyz h VAL 111 CO -0.32 0.14 -0.77 0.00 -1.01 0.00 0.00 177.57 175.61 1kyz h ALA 112 N 1.78 0.26 -0.96 3.17 0.00 -1.49 -2.46 119.26 119.56 1kyz h ALA 112 Ca 0.05 -0.60 0.04 0.00 0.00 0.00 0.00 54.91 54.40 1kyz h ALA 112 Cb 0.16 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1kyz h ALA 112 CO 0.00 0.63 0.63 0.87 0.00 0.00 0.00 179.25 181.38 1kyz h LYS 113 N 0.44 1.17 0.00 0.00 1.57 -0.77 0.26 116.57 119.24 1kyz h LYS 113 Ca -0.06 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 1kyz h LYS 113 Cb 1.41 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 1kyz h LYS 113 CO 0.16 0.78 -0.17 -0.92 -0.57 0.00 0.00 179.45 178.72 1kyz h TYR 114 N 1.21 0.00 -0.00 -1.35 3.20 -1.07 -1.91 116.97 117.05 1kyz h TYR 114 Ca 0.39 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.26 1kyz h TYR 114 Cb 0.02 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1kyz h TYR 114 CO -0.01 0.17 -0.14 1.28 -1.64 0.00 0.00 178.16 177.82 1kyz n LEU 115 N -3.98 0.55 -4.72 2.82 4.77 0.03 -4.74 117.00 111.73 1kyz n LEU 115 Ca -0.02 -0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.52 1kyz n LEU 115 Cb 0.26 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1kyz n LEU 115 CO 0.34 0.10 1.07 -0.69 -1.33 0.00 0.00 177.39 176.88 1kyz s VAL 116 N -2.52 3.22 0.47 4.08 1.01 -0.72 -4.61 120.40 121.33 1kyz s VAL 116 Ca 0.27 0.90 -0.24 0.00 0.00 0.00 0.00 61.98 62.90 1kyz s VAL 116 Cb 0.20 -3.57 -0.08 0.00 0.00 0.00 0.00 36.38 32.92 1kyz s VAL 116 CO 0.49 0.08 1.32 0.29 0.00 0.00 0.00 175.10 177.28 1kyz n LYS 117 N 3.74 1.91 -1.15 2.72 5.02 -1.26 -4.88 118.16 124.26 1kyz n LYS 117 Ca 0.11 0.69 -0.13 0.00 -2.02 0.00 0.00 58.31 56.96 1kyz n LYS 117 Cb 0.42 -2.48 0.08 0.00 -0.02 0.00 0.00 35.03 33.03 1kyz n LYS 117 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1kyz n ASN 118 N -0.20 0.28 -0.10 4.39 0.23 -0.64 -4.84 115.26 114.37 1kyz n ASN 118 Ca 0.07 -1.35 0.22 0.00 -0.53 0.00 0.00 54.58 53.00 1kyz n ASN 118 Cb 0.42 -0.42 0.66 0.00 -2.08 0.00 0.00 39.78 38.36 1kyz n ASN 118 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1kyz h GLU 119 N 0.00 0.08 -0.25 -3.83 3.07 -1.95 0.84 114.58 112.54 1kyz h GLU 119 Ca -0.19 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.67 1kyz h GLU 119 Cb 0.57 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.46 1kyz h GLU 119 CO 0.15 0.06 0.00 -0.25 -1.40 0.00 0.00 179.01 177.57 1kyz n ASP 120 N -4.36 2.49 -0.21 1.42 8.00 -1.26 -4.92 116.55 117.70 1kyz n ASP 120 Ca 0.14 -1.85 -0.02 0.00 0.71 0.00 0.00 54.79 53.77 1kyz n ASP 120 Cb 0.73 -0.16 -0.01 0.00 -0.02 0.00 0.00 41.12 41.66 1kyz n ASP 120 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1kyz n GLY 121 N 1.30 0.41 3.88 0.44 0.00 0.29 -5.04 105.19 106.48 1kyz n GLY 121 Ca 0.17 -0.89 -0.36 0.00 0.00 0.00 0.00 46.02 44.94 1kyz n GLY 121 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kyz s VAL 122 N -2.10 5.48 -0.12 1.61 1.01 -1.26 -4.79 120.40 120.24 1kyz s VAL 122 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 61.98 61.82 1kyz s VAL 122 Cb 0.00 -3.44 0.12 0.00 0.00 0.00 0.00 36.38 33.06 1kyz s VAL 122 CO 0.00 0.55 1.00 -0.55 0.00 0.00 0.00 175.10 176.10 1kyz s SER 123 N -1.25 -0.33 0.62 3.32 0.15 -1.26 -1.62 113.70 113.33 1kyz s SER 123 Ca 0.18 0.21 0.39 0.00 0.70 0.00 0.00 55.95 57.44 1kyz s SER 123 Cb -0.12 0.30 2.05 0.00 -1.71 0.00 0.00 66.02 66.53 1kyz s SER 123 CO 0.08 -0.41 2.25 0.40 1.20 0.00 0.00 173.24 176.76 1kyz h ILE 124 N 2.29 0.11 -0.43 6.45 1.08 -1.85 -2.47 117.51 122.68 1kyz h ILE 124 Ca -0.18 -0.18 0.13 0.00 -0.39 0.00 0.00 64.86 64.24 1kyz h ILE 124 Cb 1.19 1.15 -0.02 0.00 -3.07 0.00 0.00 36.82 36.08 1kyz h ILE 124 CO 0.30 0.01 0.40 0.77 -0.69 0.00 0.00 178.15 178.94 1kyz h SER 125 N 0.00 0.00 0.11 1.72 4.64 -1.93 0.40 113.55 118.48 1kyz h SER 125 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1kyz h SER 125 Cb 0.15 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1kyz h SER 125 CO 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 176.83 175.85 1kyz h ALA 126 N 1.60 1.79 -0.03 5.18 0.00 -1.79 -0.43 119.26 125.58 1kyz h ALA 126 Ca 0.21 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 1kyz h ALA 126 Cb 1.01 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1kyz h ALA 126 CO -0.00 0.16 -0.81 -0.07 0.00 0.00 0.00 179.25 178.53 1kyz h LEU 127 N 0.02 0.36 -0.13 0.00 3.38 -0.41 -1.22 115.31 117.30 1kyz h LEU 127 Ca 0.00 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1kyz h LEU 127 Cb 0.22 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1kyz h LEU 127 CO 0.02 1.03 0.07 0.78 0.09 0.00 0.00 178.44 180.42 1kyz h ASN 128 N 0.18 0.16 -0.05 -0.43 2.35 -1.03 0.44 115.58 117.20 1kyz h ASN 128 Ca -0.04 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 1kyz h ASN 128 Cb 1.41 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.73 1kyz h ASN 128 CO 0.13 0.19 -0.07 -0.07 -1.65 0.00 0.00 177.43 175.97 1kyz h LEU 129 N 0.12 0.26 0.08 1.61 3.38 -1.12 -2.71 115.31 116.92 1kyz h LEU 129 Ca 0.05 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1kyz h LEU 129 Cb 0.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1kyz h LEU 129 CO -0.01 0.37 -0.04 -0.03 0.09 0.00 0.00 178.44 178.82 1kyz h MET 130 N 0.27 -0.11 -0.81 1.13 4.05 -0.77 -3.13 114.93 115.57 1kyz h MET 130 Ca 0.06 0.01 0.14 0.00 -0.28 0.00 0.00 59.70 59.62 1kyz h MET 130 Cb 0.30 0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 31.07 1kyz h MET 130 CO 0.01 0.02 0.53 -0.91 0.23 0.00 0.00 176.91 176.79 1kyz h ASN 131 N -1.02 0.53 -0.61 1.39 -0.26 -0.99 -1.40 115.58 113.22 1kyz h ASN 131 Ca -0.01 0.03 -0.06 0.00 -0.56 0.00 0.00 56.30 55.69 1kyz h ASN 131 Cb 0.17 -0.08 -0.04 0.00 -1.06 0.00 0.00 38.32 37.32 1kyz h ASN 131 CO 0.02 0.28 0.08 0.00 -1.06 0.00 0.00 177.43 176.74 1kyz n GLN 132 N -4.51 4.48 -2.56 0.81 3.00 -1.02 -4.46 117.38 113.11 1kyz n GLN 132 Ca 0.15 -3.14 -0.39 0.00 -0.01 0.00 0.00 57.00 53.62 1kyz n GLN 132 Cb 0.47 -2.24 -0.05 0.00 0.00 0.00 0.00 30.24 28.43 1kyz n GLN 132 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1kyz s ASP 133 N -0.93 7.15 0.51 1.08 -1.08 -0.53 -4.86 116.67 118.00 1kyz s ASP 133 Ca 0.54 2.12 0.30 0.00 -0.52 0.00 0.00 52.55 54.99 1kyz s ASP 133 Cb 0.42 -2.61 1.41 0.00 -1.46 0.00 0.00 42.92 40.68 1kyz s ASP 133 CO 0.15 -0.21 1.84 0.07 0.52 0.00 0.00 175.17 177.54 1kyz h LYS 134 N 3.37 0.10 -0.07 4.34 2.10 -1.91 -1.55 116.57 122.95 1kyz h LYS 134 Ca -0.47 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.17 1kyz h LYS 134 Cb 1.21 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1kyz h LYS 134 CO 0.65 0.06 0.02 0.28 -2.00 0.00 0.00 179.45 178.47 1kyz h VAL 135 N 0.10 1.16 -0.00 0.07 2.07 -1.93 -2.70 116.25 115.02 1kyz h VAL 135 Ca 0.50 -0.49 -0.16 0.00 0.82 0.00 0.00 66.70 67.37 1kyz h VAL 135 Cb 1.79 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 32.90 1kyz h VAL 135 CO -0.07 0.14 -0.76 -0.07 0.02 0.00 0.00 177.57 176.83 1kyz h LEU 136 N -0.07 0.03 -1.80 2.57 3.38 -1.66 -3.13 115.31 114.63 1kyz h LEU 136 Ca 0.02 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1kyz h LEU 136 Cb 0.20 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1kyz h LEU 136 CO -0.00 0.78 -0.11 0.24 0.09 0.00 0.00 178.44 179.44 1kyz h MET 137 N 0.02 0.00 -0.34 1.13 2.86 -1.24 -2.62 114.93 114.74 1kyz h MET 137 Ca -0.01 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1kyz h MET 137 Cb 1.34 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.99 1kyz h MET 137 CO 0.10 0.11 0.18 1.49 1.06 0.00 0.00 176.91 179.85 1kyz h GLU 138 N 0.00 0.46 -0.71 1.72 4.57 -1.42 -2.49 114.58 116.72 1kyz h GLU 138 Ca -0.00 -0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.27 1kyz h GLU 138 Cb 0.19 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 28.64 1kyz h GLU 138 CO 0.01 0.35 0.47 0.77 -1.18 0.00 0.00 179.01 179.43 1kyz h SER 139 N 0.47 0.40 -0.14 1.04 0.02 -1.62 -2.30 113.55 111.42 1kyz h SER 139 Ca 0.12 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1kyz h SER 139 Cb 0.02 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1kyz h SER 139 CO -0.02 0.22 0.06 -0.50 -1.14 0.00 0.00 176.83 175.45 1kyz h TRP 140 N 0.43 0.24 0.00 3.45 4.06 -1.62 -1.60 115.95 120.91 1kyz h TRP 140 Ca 0.34 -0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.29 1kyz h TRP 140 Cb 0.72 -0.08 0.00 0.00 -1.00 0.00 0.00 29.16 28.80 1kyz h TRP 140 CO -0.00 0.20 0.00 0.66 -3.56 0.00 0.00 178.44 175.74 1kyz n TYR 141 N -4.45 0.11 0.61 0.49 4.02 -0.86 -2.84 117.16 114.24 1kyz n TYR 141 Ca -0.00 0.04 0.07 0.00 -0.01 0.00 0.00 57.90 58.00 1kyz n TYR 141 Cb 0.12 -0.57 0.04 0.00 -0.02 0.00 0.00 39.34 38.91 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 -1.60 0.00 -0.17 -0.72 8.25 -0.61 -4.61 115.22 115.75 1kyz n HIS 142 Ca 0.04 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.47 1kyz n HIS 142 Cb 0.22 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.39 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 2.38 0.33 -0.19 2.41 6.46 -1.42 -0.15 115.31 125.12 1kyz h LEU 143 Ca 0.00 0.04 0.05 0.00 -0.12 0.00 0.00 57.88 57.85 1kyz h LEU 143 Cb 0.56 -0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 40.41 1kyz h LEU 143 CO 0.00 0.23 -0.16 0.50 -0.62 0.00 0.00 178.44 178.38 1kyz h LYS 144 N 0.48 -0.17 -0.96 1.25 3.64 -1.81 -0.65 116.57 118.34 1kyz h LYS 144 Ca 0.24 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1kyz h LYS 144 Cb 0.18 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 31.99 1kyz h LYS 144 CO -0.19 -0.11 0.62 -0.44 -2.27 0.00 0.00 179.45 177.06 1kyz h ASP 145 N -0.18 1.12 -0.49 4.20 3.45 -1.72 -1.85 116.42 120.96 1kyz h ASP 145 Ca 0.12 -0.04 -0.04 0.00 0.43 0.00 0.00 57.03 57.50 1kyz h ASP 145 Cb 0.35 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.82 1kyz h ASP 145 CO -0.30 0.83 0.18 0.00 -1.57 0.00 0.00 179.24 178.38 1kyz h ALA 146 N 1.37 1.31 -0.25 3.45 0.00 -0.13 0.69 119.26 125.71 1kyz h ALA 146 Ca 0.35 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1kyz h ALA 146 Cb -0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1kyz h ALA 146 CO -0.07 0.50 -0.22 0.28 0.00 0.00 0.00 179.25 179.74 1kyz h VAL 147 N 0.78 1.31 0.06 0.00 2.07 -0.55 0.94 116.25 120.86 1kyz h VAL 147 Ca 0.18 -1.37 -0.28 0.00 0.82 0.00 0.00 66.70 66.05 1kyz h VAL 147 Cb 0.21 1.65 0.03 0.00 -1.52 0.00 0.00 31.29 31.65 1kyz h VAL 147 CO -0.01 0.43 -1.13 -0.07 0.02 0.00 0.00 177.57 176.81 1kyz h LEU 148 N 0.30 0.90 0.00 2.57 3.38 -1.08 -3.36 115.31 118.02 1kyz h LEU 148 Ca 0.04 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.23 1kyz h LEU 148 Cb 0.77 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1kyz h LEU 148 CO 0.06 1.57 -0.94 0.47 0.09 0.00 0.00 178.44 179.69 1kyz n ASP 149 N -3.84 0.84 0.00 -0.43 8.00 0.24 -5.09 116.55 116.27 1kyz n ASP 149 Ca -0.12 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.53 1kyz n ASP 149 Cb 0.93 1.07 0.00 0.00 -0.02 0.00 0.00 41.12 43.10 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 1.43 -1.09 0.00 0.44 0.00 0.33 -5.00 105.19 101.29 1kyz n GLY 150 Ca 0.03 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1kyz n GLY 150 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kyz n GLY 151 N -1.18 -1.62 3.19 -0.02 0.00 -1.26 -4.56 105.19 99.73 1kyz n GLY 151 Ca 0.00 -2.09 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 1kyz n GLY 151 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1kyz s ILE 152 N -0.06 1.70 0.20 -0.61 2.07 -1.26 -4.83 121.20 118.42 1kyz s ILE 152 Ca 0.00 -0.86 -0.20 0.00 -1.41 0.00 0.00 60.65 58.17 1kyz s ILE 152 Cb 0.00 -1.46 0.16 0.00 0.13 0.00 0.00 42.46 41.29 1kyz s ILE 152 CO 0.00 0.48 1.57 -0.65 -1.91 0.00 0.00 174.94 174.43 1kyz h PRO 153 N 6.27 -0.08 0.16 3.50 0.11 -1.81 -1.30 132.00 138.84 1kyz h PRO 153 Ca -0.31 0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.82 1kyz h PRO 153 Cb 1.18 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1kyz h PRO 153 CO 0.47 -0.06 -0.22 0.35 -0.21 0.00 0.00 178.00 178.34 1kyz h PHE 154 N -0.09 -0.59 -0.97 0.65 3.57 -1.45 -1.65 116.94 116.42 1kyz h PHE 154 Ca 0.28 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.91 1kyz h PHE 154 Cb 0.57 0.24 -0.08 0.00 2.79 0.00 0.00 35.95 39.47 1kyz h PHE 154 CO -0.78 -0.32 0.62 -0.91 -2.23 0.00 0.00 178.31 174.68 1kyz h ASN 155 N -0.44 0.86 -0.61 0.41 -0.26 -1.51 -0.43 115.58 113.60 1kyz h ASN 155 Ca 0.02 0.04 -0.10 0.00 -0.56 0.00 0.00 56.30 55.70 1kyz h ASN 155 Cb 0.44 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.55 1kyz h ASN 155 CO -0.10 0.46 0.01 0.11 -1.06 0.00 0.00 177.43 176.85 1kyz h LYS 156 N 0.92 1.08 -0.47 0.81 1.57 -0.91 0.65 116.57 120.23 1kyz h LYS 156 Ca 0.48 -0.34 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 1kyz h LYS 156 Cb 0.53 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1kyz h LYS 156 CO -0.24 1.04 -0.14 0.00 -0.57 0.00 0.00 179.45 179.54 1kyz h ALA 157 N 1.01 0.65 -0.00 3.86 0.00 -0.17 -3.34 119.26 121.26 1kyz h ALA 157 Ca 0.18 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1kyz h ALA 157 Cb 0.55 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1kyz h ALA 157 CO 0.03 0.57 -0.43 0.66 0.00 0.00 0.00 179.25 180.08 1kyz n TYR 158 N -4.21 0.00 -1.19 0.00 4.02 -0.45 -5.00 117.16 110.33 1kyz n TYR 158 Ca -0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.82 1kyz n TYR 158 Cb 0.41 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.70 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 1.16 0.86 3.77 2.72 0.00 0.23 -4.97 105.19 108.96 1kyz n GLY 159 Ca 0.04 -0.50 -0.07 0.00 0.00 0.00 0.00 46.02 45.48 1kyz n GLY 159 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1kyz s MET 160 N -2.28 1.60 0.71 1.61 0.23 -1.22 -5.05 119.30 114.91 1kyz s MET 160 Ca 0.00 -0.85 -0.11 0.00 -1.03 0.00 0.00 55.69 53.70 1kyz s MET 160 Cb 0.00 0.57 0.02 0.00 -1.53 0.00 0.00 34.83 33.89 1kyz s MET 160 CO 0.00 -0.73 1.07 0.95 -2.03 0.00 0.00 175.02 174.28 1kyz s THR 161 N -3.77 3.81 0.10 3.16 -4.23 -1.26 -4.08 115.64 109.37 1kyz s THR 161 Ca 0.10 0.60 -0.28 0.00 -1.18 0.00 0.00 61.69 60.92 1kyz s THR 161 Cb -0.04 -3.26 -0.11 0.00 1.34 0.00 0.00 72.50 70.43 1kyz s THR 161 CO 0.03 -0.76 1.63 0.00 -0.54 0.00 0.00 174.62 174.99 1kyz h ALA 162 N -0.78 -0.55 0.00 3.99 0.00 -1.94 0.16 119.26 120.14 1kyz h ALA 162 Ca -0.44 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1kyz h ALA 162 Cb 1.22 0.42 0.00 0.00 0.00 0.00 0.00 17.79 19.43 1kyz h ALA 162 CO 0.55 -0.85 0.00 1.19 0.00 0.00 0.00 179.25 180.15 1kyz n PHE 163 N -5.40 0.00 -0.04 0.00 3.01 -1.26 -0.96 117.46 112.81 1kyz n PHE 163 Ca -0.08 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.32 1kyz n PHE 163 Cb 0.30 -0.48 -0.14 0.00 -0.01 0.00 0.00 39.48 39.16 1kyz n PHE 163 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1kyz n GLU 164 N -1.48 0.65 0.05 -1.08 2.13 -0.36 -4.20 120.64 116.35 1kyz n GLU 164 Ca 0.02 0.14 -0.11 0.00 0.66 0.00 0.00 57.16 57.87 1kyz n GLU 164 Cb 0.09 -1.68 0.01 0.00 0.27 0.00 0.00 31.44 30.13 1kyz n GLU 164 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 1kyz h TYR 165 N 0.00 0.59 -0.91 4.31 3.20 0.11 -3.30 116.97 120.98 1kyz h TYR 165 Ca -0.33 -0.27 0.21 0.00 3.14 0.00 0.00 58.73 61.48 1kyz h TYR 165 Cb 1.92 -0.09 -0.07 0.00 1.54 0.00 0.00 36.73 40.03 1kyz h TYR 165 CO 0.00 1.03 0.60 0.45 -1.64 0.00 0.00 178.16 178.60 1kyz h HIS 166 N 0.29 0.53 0.00 -3.82 3.86 -1.61 0.14 115.15 114.55 1kyz h HIS 166 Ca -0.04 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1kyz h HIS 166 Cb 1.33 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.64 1kyz h HIS 166 CO 0.05 0.13 0.00 0.41 0.86 0.00 0.00 177.93 179.38 1kyz n GLY 167 N -1.52 -1.04 0.42 2.45 0.00 -1.24 -3.07 105.19 101.19 1kyz n GLY 167 Ca 0.19 -0.17 0.05 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.10 0.17 -3.41 2.61 -2.24 0.49 -4.86 114.28 105.95 1kyz n THR 168 Ca 0.19 -0.59 -0.24 0.00 -2.27 0.00 0.00 64.05 61.15 1kyz n THR 168 Cb 0.15 1.08 -0.10 0.00 -2.10 0.00 0.00 70.33 69.36 1kyz n THR 168 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1kyz s ASP 169 N -0.85 2.13 0.34 3.42 -1.08 -1.16 -5.01 116.67 114.46 1kyz s ASP 169 Ca 0.13 -1.94 0.02 0.00 -0.52 0.00 0.00 52.55 50.23 1kyz s ASP 169 Cb 0.09 0.03 0.61 0.00 -1.46 0.00 0.00 42.92 42.18 1kyz s ASP 169 CO 0.12 -0.28 1.97 1.55 0.52 0.00 0.00 175.17 179.06 1kyz h PRO 170 N 6.99 0.89 0.30 4.34 0.13 -1.89 0.53 132.00 143.28 1kyz h PRO 170 Ca 0.06 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1kyz h PRO 170 Cb 1.01 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1kyz h PRO 170 CO 0.23 0.59 -0.14 -0.09 -0.23 0.00 0.00 178.00 178.36 1kyz h ARG 171 N 0.91 -0.38 -0.55 0.86 2.43 -1.95 -2.38 114.38 113.33 1kyz h ARG 171 Ca 0.29 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.46 1kyz h ARG 171 Cb 0.03 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.64 1kyz h ARG 171 CO -0.08 -0.17 0.23 0.35 -1.51 0.00 0.00 179.97 178.80 1kyz h PHE 172 N -0.53 0.82 -0.83 2.20 3.57 -1.91 -2.55 116.94 117.71 1kyz h PHE 172 Ca -0.04 -0.05 0.15 0.00 3.53 0.00 0.00 57.97 61.56 1kyz h PHE 172 Cb 0.39 -0.25 -0.10 0.00 2.79 0.00 0.00 35.95 38.79 1kyz h PHE 172 CO -0.02 0.66 0.39 -0.97 -2.23 0.00 0.00 178.31 176.13 1kyz h ASN 173 N 0.74 0.43 -0.28 0.41 -1.24 -0.81 0.31 115.58 115.13 1kyz h ASN 173 Ca 0.18 0.10 -0.09 0.00 0.71 0.00 0.00 56.30 57.21 1kyz h ASN 173 Cb 0.17 0.05 -0.01 0.00 0.73 0.00 0.00 38.32 39.26 1kyz h ASN 173 CO -0.02 0.16 -0.17 0.11 -1.29 0.00 0.00 177.43 176.21 1kyz h LYS 174 N 0.54 0.60 -0.47 6.67 1.79 -1.18 -0.99 116.57 123.54 1kyz h LYS 174 Ca 0.46 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.65 1kyz h LYS 174 Cb 0.70 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.32 1kyz h LYS 174 CO -0.40 0.86 0.30 0.28 -1.08 0.00 0.00 179.45 179.42 1kyz h VAL 175 N 0.34 1.13 0.17 0.50 2.07 -0.88 -1.26 116.25 118.32 1kyz h VAL 175 Ca 0.06 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1kyz h VAL 175 Cb 0.71 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1kyz h VAL 175 CO 0.05 0.13 -0.08 0.15 0.02 0.00 0.00 177.57 177.83 1kyz h PHE 176 N 0.63 -0.21 -0.50 1.57 3.57 -0.34 -1.69 116.94 119.96 1kyz h PHE 176 Ca 0.17 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.71 1kyz h PHE 176 Cb -0.05 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 1kyz h PHE 176 CO -0.04 -0.13 0.26 -0.91 -2.23 0.00 0.00 178.31 175.26 1kyz h ASN 177 N -0.23 0.39 -0.73 0.41 2.35 -1.01 -1.71 115.58 115.05 1kyz h ASN 177 Ca -0.02 0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1kyz h ASN 177 Cb 0.18 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.46 1kyz h ASN 177 CO 0.04 0.27 0.32 0.50 -1.65 0.00 0.00 177.43 176.91 1kyz h LYS 178 N 0.52 1.08 -0.11 0.81 3.64 -1.10 0.34 116.57 121.75 1kyz h LYS 178 Ca 0.22 -0.18 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1kyz h LYS 178 Cb 0.11 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1kyz h LYS 178 CO -0.14 0.87 0.05 0.78 -2.27 0.00 0.00 179.45 178.74 1kyz h GLY 179 N 1.04 0.17 1.61 5.01 0.00 -0.95 -0.37 103.07 109.58 1kyz h GLY 179 Ca 0.25 -0.09 -0.11 0.00 0.00 0.00 0.00 47.33 47.38 1kyz h GLY 179 CO -0.03 0.08 -0.33 -0.33 0.00 0.00 0.00 176.54 175.93 1kyz h MET 180 N 0.04 0.45 0.20 4.80 2.86 -1.15 -1.85 114.93 120.27 1kyz h MET 180 Ca 0.04 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.47 1kyz h MET 180 Cb 0.13 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1kyz h MET 180 CO -0.00 0.73 -0.09 1.03 1.06 0.00 0.00 176.91 179.63 1kyz h SER 181 N 0.38 -0.22 -0.82 1.22 0.87 -0.18 -0.95 113.55 113.86 1kyz h SER 181 Ca 0.05 -0.22 -0.01 0.00 -1.23 0.00 0.00 61.79 60.37 1kyz h SER 181 Cb 0.77 0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.75 1kyz h SER 181 CO 0.06 0.11 0.48 0.44 -0.53 0.00 0.00 176.83 177.39 1kyz h ASP 182 N -0.58 1.00 -0.36 6.23 5.19 -1.06 -0.31 116.42 126.52 1kyz h ASP 182 Ca -0.03 -0.08 -0.01 0.00 -0.62 0.00 0.00 57.03 56.30 1kyz h ASP 182 Cb 0.43 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.67 1kyz h ASP 182 CO 0.04 0.78 0.19 -0.74 -3.12 0.00 0.00 179.24 176.40 1kyz h HIS 183 N 1.13 0.51 0.04 4.55 2.76 -1.32 -0.58 115.15 122.24 1kyz h HIS 183 Ca 0.29 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.44 1kyz h HIS 183 Cb -0.01 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 28.79 1kyz h HIS 183 CO -0.00 0.41 -0.02 1.03 -1.30 0.00 0.00 177.93 178.05 1kyz h SER 184 N 0.46 -0.05 -0.12 3.26 0.87 -0.83 -1.65 113.55 115.49 1kyz h SER 184 Ca 0.13 -0.03 0.04 0.00 -1.23 0.00 0.00 61.79 60.70 1kyz h SER 184 Cb 0.08 0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 62.00 1kyz h SER 184 CO -0.02 -0.01 -0.19 0.74 -0.53 0.00 0.00 176.83 176.83 1kyz h THR 185 N -0.08 0.52 -0.66 2.23 2.02 -0.84 0.23 112.91 116.33 1kyz h THR 185 Ca -0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.21 1kyz h THR 185 Cb 0.07 0.52 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 1kyz h THR 185 CO 0.01 0.00 0.41 0.40 0.37 0.00 0.00 175.52 176.71 1kyz h ILE 186 N -0.24 1.08 -0.20 3.11 1.08 -1.02 -2.23 117.51 119.08 1kyz h ILE 186 Ca 0.10 -0.27 -0.11 0.00 -0.39 0.00 0.00 64.86 64.19 1kyz h ILE 186 Cb 0.38 0.21 -0.00 0.00 -3.07 0.00 0.00 36.82 34.34 1kyz h ILE 186 CO -0.26 0.15 -0.29 0.74 -0.69 0.00 0.00 178.15 177.79 1kyz h THR 187 N 0.80 1.33 -0.33 -0.27 2.02 -0.87 -3.07 112.91 112.52 1kyz h THR 187 Ca 0.27 -1.50 0.02 0.00 0.77 0.00 0.00 66.41 65.97 1kyz h THR 187 Cb 0.03 1.83 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 1kyz h THR 187 CO -0.11 0.46 0.18 0.24 0.37 0.00 0.00 175.52 176.66 1kyz h MET 188 N 0.21 0.37 -0.96 6.66 2.86 -0.43 0.35 114.93 123.99 1kyz h MET 188 Ca 0.02 -0.02 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1kyz h MET 188 Cb 0.87 -0.08 -0.07 0.00 0.06 0.00 0.00 31.60 32.37 1kyz h MET 188 CO 0.07 0.24 0.61 -0.22 1.06 0.00 0.00 176.91 178.67 1kyz h LYS 189 N 0.38 1.02 -0.22 1.72 3.64 -1.46 0.29 116.57 121.94 1kyz h LYS 189 Ca 0.13 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.30 1kyz h LYS 189 Cb 0.02 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 1kyz h LYS 189 CO -0.07 0.68 -0.50 -0.22 -2.27 0.00 0.00 179.45 177.06 1kyz h LYS 190 N 1.05 0.60 0.13 1.90 1.63 -1.34 -2.83 116.57 117.70 1kyz h LYS 190 Ca 0.44 -0.35 -0.01 0.00 -0.85 0.00 0.00 60.65 59.88 1kyz h LYS 190 Cb 0.27 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.94 1kyz h LYS 190 CO -0.21 0.96 -0.06 0.82 -3.45 0.00 0.00 179.45 177.51 1kyz h ILE 191 N 0.47 1.00 0.00 2.00 2.04 0.74 -1.88 117.51 121.88 1kyz h ILE 191 Ca 0.02 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1kyz h ILE 191 Cb 1.04 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1kyz h ILE 191 CO 0.10 0.12 0.00 0.18 0.00 0.00 0.00 178.15 178.55 1kyz n LEU 192 N -5.05 0.27 -0.02 1.44 4.77 0.86 -0.12 117.00 119.14 1kyz n LEU 192 Ca -0.09 0.62 -0.14 0.00 -0.03 0.00 0.00 56.01 56.38 1kyz n LEU 192 Cb 0.18 -0.66 -0.14 0.00 -2.33 0.00 0.00 43.42 40.48 1kyz n LEU 192 CO 0.33 -0.71 -0.72 -0.62 -1.33 0.00 0.00 177.39 174.33 1kyz n GLU 193 N -1.86 0.69 -0.11 3.23 1.02 -0.86 -4.59 120.64 118.16 1kyz n GLU 193 Ca -0.01 0.25 -0.12 0.00 -0.02 0.00 0.00 57.16 57.27 1kyz n GLU 193 Cb 0.02 -1.73 -0.15 0.00 -0.02 0.00 0.00 31.44 29.56 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 -3.20 1.39 -3.61 2.62 -2.24 -0.30 -4.93 114.28 104.01 1kyz n THR 194 Ca -0.25 -0.77 -0.38 0.00 -2.27 0.00 0.00 64.05 60.38 1kyz n THR 194 Cb 1.06 -0.72 -0.11 0.00 -2.10 0.00 0.00 70.33 68.46 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 -2.49 3.21 -1.06 4.78 5.04 0.83 -4.85 117.35 122.82 1kyz s TYR 195 Ca -0.16 0.08 0.14 0.00 -2.44 0.00 0.00 57.07 54.69 1kyz s TYR 195 Cb 0.07 -2.36 0.41 0.00 0.35 0.00 0.00 41.96 40.42 1kyz s TYR 195 CO 0.75 -0.17 1.34 0.25 -1.34 0.00 0.00 175.55 176.39 1kyz n THR 196 N 5.01 1.16 0.23 4.34 -2.24 -1.26 -4.56 114.28 116.96 1kyz n THR 196 Ca -0.14 -1.09 0.02 0.00 -2.27 0.00 0.00 64.05 60.57 1kyz n THR 196 Cb 0.52 0.41 0.12 0.00 -2.10 0.00 0.00 70.33 69.28 1kyz n THR 196 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1kyz n GLY 197 N 0.66 -0.39 0.08 3.38 0.00 -1.26 -1.24 105.19 106.43 1kyz n GLY 197 Ca 0.16 -0.02 0.14 0.00 0.00 0.00 0.00 46.02 46.29 1kyz n GLY 197 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1kyz n PHE 198 N -1.24 0.00 0.00 1.61 3.01 -1.26 -4.62 117.46 114.97 1kyz n PHE 198 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1kyz n PHE 198 Cb 0.03 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 1kyz n PHE 198 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1kyz n GLU 199 N -1.07 0.00 -2.48 -1.08 1.02 -0.37 -4.19 120.64 112.47 1kyz n GLU 199 Ca 0.14 0.05 -0.41 0.00 -0.02 0.00 0.00 57.16 56.91 1kyz n GLU 199 Cb 0.28 -0.55 -0.03 0.00 -0.02 0.00 0.00 31.44 31.11 1kyz n GLU 199 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1kyz s GLY 200 N 0.00 0.89 -0.28 0.62 0.00 -1.26 -4.94 107.32 102.35 1kyz s GLY 200 Ca 0.00 -1.01 -0.18 0.00 0.00 0.00 0.00 44.72 43.52 1kyz s GLY 200 CO 0.00 2.71 0.76 1.08 0.00 0.00 0.00 173.10 177.66 1kyz s LEU 201 N 5.88 -0.81 -0.07 0.66 1.43 -1.26 -5.03 118.68 119.48 1kyz s LEU 201 Ca 0.44 1.35 0.09 0.00 -1.03 0.00 0.00 54.13 54.97 1kyz s LEU 201 Cb -0.09 2.27 -0.24 0.00 0.03 0.00 0.00 46.19 48.16 1kyz s LEU 201 CO 0.20 -0.22 0.54 1.17 0.23 0.00 0.00 176.35 178.28 1kyz n LYS 202 N 3.75 0.66 -3.93 1.70 3.00 -1.26 -4.21 118.16 117.87 1kyz n LYS 202 Ca -0.18 0.27 -0.09 0.00 -0.00 0.00 0.00 58.31 58.30 1kyz n LYS 202 Cb 0.58 -1.75 -0.07 0.00 0.00 0.00 0.00 35.03 33.79 1kyz n LYS 202 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1kyz s SER 203 N -6.26 0.03 -0.26 3.14 1.04 -1.26 -0.07 113.70 110.05 1kyz s SER 203 Ca -0.09 -0.82 -0.15 0.00 0.48 0.00 0.00 55.95 55.36 1kyz s SER 203 Cb 0.08 0.44 0.08 0.00 0.10 0.00 0.00 66.02 66.71 1kyz s SER 203 CO 0.81 -0.89 0.65 -0.22 0.98 0.00 0.00 173.24 174.57 1kyz s LEU 204 N -2.95 -0.80 -0.21 2.42 2.96 -1.14 -3.71 118.68 115.25 1kyz s LEU 204 Ca 0.15 1.42 -0.05 0.00 -0.22 0.00 0.00 54.13 55.43 1kyz s LEU 204 Cb 0.03 2.23 -0.03 0.00 0.50 0.00 0.00 46.19 48.92 1kyz s LEU 204 CO -0.01 -0.23 0.01 0.54 -1.32 0.00 0.00 176.35 175.34 1kyz s VAL 205 N 1.56 4.05 -0.51 1.68 0.11 -0.90 -0.44 120.40 125.94 1kyz s VAL 205 Ca -0.10 -0.28 -0.17 0.00 -2.93 0.00 0.00 61.98 58.51 1kyz s VAL 205 Cb -0.06 -2.84 0.08 0.00 -1.53 0.00 0.00 36.38 32.04 1kyz s VAL 205 CO -0.18 0.42 0.51 -0.62 -3.33 0.00 0.00 175.10 171.89 1kyz s ASP 206 N 1.04 6.18 0.07 3.54 2.15 -0.37 -0.99 116.67 128.29 1kyz s ASP 206 Ca 0.02 -1.34 -0.31 0.00 0.43 0.00 0.00 52.55 51.36 1kyz s ASP 206 Cb -0.14 -2.23 -0.07 0.00 -0.30 0.00 0.00 42.92 40.18 1kyz s ASP 206 CO 0.02 -0.80 1.41 -0.69 -0.17 0.00 0.00 175.17 174.94 1kyz s VAL 207 N 1.98 3.45 -0.56 1.11 1.01 -0.09 -2.54 120.40 124.77 1kyz s VAL 207 Ca 0.07 0.97 -0.01 0.00 0.00 0.00 0.00 61.98 63.02 1kyz s VAL 207 Cb -0.24 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.52 1kyz s VAL 207 CO 0.07 0.04 0.09 0.61 0.00 0.00 0.00 175.10 175.91 1kyz n GLY 208 N 3.58 0.17 0.00 4.51 0.00 0.00 -4.68 105.19 108.77 1kyz n GLY 208 Ca 0.12 -0.54 0.04 0.00 0.00 0.00 0.00 46.02 45.64 1kyz n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kyz n GLY 209 N -1.01 -0.60 7.00 -0.02 0.00 -1.06 -4.91 105.19 104.59 1kyz n GLY 209 Ca -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1kyz n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kyz n GLY 210 N 0.15 1.36 0.12 -0.02 0.00 -1.26 0.17 105.19 105.70 1kyz n GLY 210 Ca 0.07 0.66 0.13 0.00 0.00 0.00 0.00 46.02 46.87 1kyz n GLY 210 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1kyz h THR 211 N 0.00 0.00 0.00 2.61 2.02 -1.91 -3.42 112.91 112.22 1kyz h THR 211 Ca 0.00 -0.58 0.00 0.00 0.77 0.00 0.00 66.41 66.60 1kyz h THR 211 Cb 0.00 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1kyz h THR 211 CO 0.00 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.50 1kyz n GLY 212 N 1.28 0.85 0.25 2.16 0.00 0.45 -4.47 105.19 105.71 1kyz n GLY 212 Ca 0.05 -0.16 0.01 0.00 0.00 0.00 0.00 46.02 45.92 1kyz n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kyz h ALA 213 N 0.00 1.41 -0.09 4.61 0.00 -1.93 -2.41 119.26 120.86 1kyz h ALA 213 Ca 0.00 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.53 1kyz h ALA 213 Cb 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.68 1kyz h ALA 213 CO 0.00 0.41 -0.59 0.28 0.00 0.00 0.00 179.25 179.35 1kyz h VAL 214 N 0.37 1.36 -0.45 0.00 2.07 -1.94 -2.96 116.25 114.71 1kyz h VAL 214 Ca 0.08 -1.91 -0.11 0.00 0.82 0.00 0.00 66.70 65.58 1kyz h VAL 214 Cb 0.37 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1kyz h VAL 214 CO 0.02 0.58 -0.14 -0.29 0.02 0.00 0.00 177.57 177.76 1kyz h ILE 215 N 0.15 1.27 0.00 4.57 6.09 -1.90 -2.60 117.51 125.10 1kyz h ILE 215 Ca -0.05 -1.27 -0.00 0.00 -1.37 0.00 0.00 64.86 62.17 1kyz h ILE 215 Cb 1.24 1.16 -0.00 0.00 0.47 0.00 0.00 36.82 39.69 1kyz h ILE 215 CO 0.12 0.43 -0.01 -1.13 -3.07 0.00 0.00 178.15 174.49 1kyz h ASN 216 N 0.72 0.00 0.88 2.19 -0.73 -1.49 0.28 115.58 117.43 1kyz h ASN 216 Ca 0.11 0.00 -0.20 0.00 1.87 0.00 0.00 56.30 58.08 1kyz h ASN 216 Cb 0.69 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.25 1kyz h ASN 216 CO 0.05 0.01 -1.21 0.74 -0.37 0.00 0.00 177.43 176.65 1kyz h THR 217 N 0.00 0.95 0.18 -3.57 2.02 -1.29 -2.44 112.91 108.76 1kyz h THR 217 Ca -0.00 -2.56 -0.24 0.00 0.77 0.00 0.00 66.41 64.38 1kyz h THR 217 Cb 0.07 2.41 0.03 0.00 -1.74 0.00 0.00 68.15 68.91 1kyz h THR 217 CO 0.00 0.54 -1.07 0.40 0.37 0.00 0.00 175.52 175.76 1kyz h ILE 218 N 0.00 1.41 0.00 3.11 2.04 -0.79 -3.06 117.51 120.21 1kyz h ILE 218 Ca -0.13 -2.58 -0.04 0.00 1.00 0.00 0.00 64.86 63.11 1kyz h ILE 218 Cb 1.70 3.12 -0.01 0.00 -0.74 0.00 0.00 36.82 40.90 1kyz h ILE 218 CO 0.08 0.75 -0.20 0.58 0.00 0.00 0.00 178.15 179.36 1kyz h VAL 219 N -0.20 0.78 -0.28 1.67 2.07 -0.64 -0.87 116.25 118.78 1kyz h VAL 219 Ca -0.19 -0.80 -0.16 0.00 0.82 0.00 0.00 66.70 66.37 1kyz h VAL 219 Cb 1.82 1.49 -0.00 0.00 -1.52 0.00 0.00 31.29 33.08 1kyz h VAL 219 CO 0.19 0.20 -0.44 -1.28 0.02 0.00 0.00 177.57 176.26 1kyz h SER 220 N 0.00 0.87 0.09 0.57 0.87 -1.45 0.44 113.55 114.94 1kyz h SER 220 Ca -0.00 -0.52 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 1kyz h SER 220 Cb 0.47 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1kyz h SER 220 CO 0.03 1.22 -0.07 0.29 -0.53 0.00 0.00 176.83 177.76 1kyz n LYS 221 N -4.12 1.29 -3.00 2.24 5.02 -1.05 -4.27 118.16 114.27 1kyz n LYS 221 Ca -0.04 -0.67 -0.17 0.00 -2.02 0.00 0.00 58.31 55.41 1kyz n LYS 221 Cb 0.56 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 34.08 1kyz n LYS 221 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1kyz n TYR 222 N -0.27 -1.49 0.04 2.13 4.02 -0.36 -4.99 117.16 116.24 1kyz n TYR 222 Ca 0.17 -2.88 0.02 0.00 -0.01 0.00 0.00 57.90 55.20 1kyz n TYR 222 Cb 0.32 0.45 0.11 0.00 -0.02 0.00 0.00 39.34 40.20 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 0.03 0.13 -0.72 -0.02 0.13 -1.03 135.00 134.74 1kyz n PRO 223 Ca 0.16 0.45 0.13 0.00 -2.02 0.00 0.00 63.50 62.22 1kyz n PRO 223 Cb 0.60 -1.69 0.33 0.00 -0.02 0.00 0.00 33.50 32.72 1kyz n PRO 223 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1kyz h THR 224 N 0.00 0.00 -3.38 3.45 2.02 -1.91 -3.44 112.91 109.64 1kyz h THR 224 Ca 0.00 -0.63 -0.58 0.00 0.77 0.00 0.00 66.41 65.97 1kyz h THR 224 Cb 0.20 1.60 -0.08 0.00 -1.74 0.00 0.00 68.15 68.13 1kyz h THR 224 CO 0.00 0.00 -0.04 -0.63 0.37 0.00 0.00 175.52 175.22 1kyz s ILE 225 N -3.14 5.12 -0.87 3.11 1.01 -0.20 -4.70 121.20 121.54 1kyz s ILE 225 Ca 0.09 1.06 -0.20 0.00 0.00 0.00 0.00 60.65 61.61 1kyz s ILE 225 Cb 0.10 -3.88 0.11 0.00 0.01 0.00 0.00 42.46 38.81 1kyz s ILE 225 CO 0.62 0.25 1.10 -0.54 0.00 0.00 0.00 174.94 176.37 1kyz s LYS 226 N 1.09 3.48 0.35 2.79 -0.14 0.89 -4.84 119.74 123.36 1kyz s LYS 226 Ca 0.28 -1.51 -0.22 0.00 -1.36 0.00 0.00 55.97 53.16 1kyz s LYS 226 Cb -0.16 -4.77 -0.10 0.00 -1.68 0.00 0.00 37.83 31.12 1kyz s LYS 226 CO 0.11 -1.80 0.89 0.20 -0.76 0.00 0.00 175.35 173.99 1kyz s GLY 227 N 3.73 2.57 -0.12 -3.33 0.00 -1.09 -2.89 107.32 106.18 1kyz s GLY 227 Ca 0.31 0.37 0.03 0.00 0.00 0.00 0.00 44.72 45.43 1kyz s GLY 227 CO -0.05 0.72 -0.23 -0.42 0.00 0.00 0.00 173.10 173.12 1kyz s ILE 228 N -1.85 2.04 -0.60 0.90 1.01 0.41 -1.90 121.20 121.23 1kyz s ILE 228 Ca 0.54 -0.98 -0.20 0.00 0.00 0.00 0.00 60.65 60.01 1kyz s ILE 228 Cb -0.14 -1.79 0.09 0.00 0.01 0.00 0.00 42.46 40.63 1kyz s ILE 228 CO 0.19 0.55 0.76 0.21 0.00 0.00 0.00 174.94 176.64 1kyz s ASN 229 N 0.65 6.19 -0.28 3.58 3.04 -0.40 -1.23 114.94 126.48 1kyz s ASN 229 Ca -0.11 -1.25 -0.11 0.00 0.04 0.00 0.00 52.86 51.42 1kyz s ASN 229 Cb -0.16 -2.33 -0.05 0.00 -1.54 0.00 0.00 41.25 37.17 1kyz s ASN 229 CO 0.02 -1.16 0.21 0.12 -3.04 0.00 0.00 177.10 173.24 1kyz s PHE 230 N 3.00 3.22 0.35 0.43 5.36 -1.05 -0.93 117.98 128.36 1kyz s PHE 230 Ca 0.15 0.12 -0.17 0.00 -0.96 0.00 0.00 56.93 56.06 1kyz s PHE 230 Cb -0.22 -2.40 0.05 0.00 -0.34 0.00 0.00 43.02 40.11 1kyz s PHE 230 CO 0.08 -0.18 0.77 0.34 -1.46 0.00 0.00 175.22 174.77 1kyz s ASP 231 N 1.75 -0.07 0.58 6.13 2.15 -0.96 -0.82 116.67 125.43 1kyz s ASP 231 Ca 0.08 -0.98 -0.19 0.00 0.43 0.00 0.00 52.55 51.88 1kyz s ASP 231 Cb -0.16 0.81 -0.05 0.00 -0.30 0.00 0.00 42.92 43.22 1kyz s ASP 231 CO 0.11 -1.58 1.05 0.18 -0.17 0.00 0.00 175.17 174.75 1kyz n LEU 232 N -0.51 4.02 -0.09 -1.34 4.77 -1.24 -1.27 117.00 121.33 1kyz n LEU 232 Ca -0.07 0.85 -0.00 0.00 -0.03 0.00 0.00 56.01 56.76 1kyz n LEU 232 Cb 0.60 -1.42 0.27 0.00 -2.33 0.00 0.00 43.42 40.54 1kyz n LEU 232 CO 0.23 -1.58 1.06 1.55 -1.33 0.00 0.00 177.39 177.32 1kyz h PRO 233 N 0.72 0.74 -0.95 3.23 0.13 -1.83 0.48 132.00 134.51 1kyz h PRO 233 Ca -0.49 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 1kyz h PRO 233 Cb 1.35 -0.14 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 1kyz h PRO 233 CO 0.52 0.60 0.60 0.45 -0.23 0.00 0.00 178.00 179.95 1kyz h HIS 234 N 0.73 1.23 -0.00 1.56 3.86 -1.96 -2.86 115.15 117.71 1kyz h HIS 234 Ca 0.18 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.39 1kyz h HIS 234 Cb 0.14 -0.41 0.00 0.00 1.06 0.00 0.00 27.41 28.20 1kyz h HIS 234 CO 0.01 0.79 -0.04 0.28 0.86 0.00 0.00 177.93 179.83 1kyz h VAL 235 N 1.30 1.59 -1.14 2.45 2.07 -1.72 -3.37 116.25 117.43 1kyz h VAL 235 Ca 0.34 -1.78 -0.68 0.00 0.82 0.00 0.00 66.70 65.41 1kyz h VAL 235 Cb -0.10 2.77 -0.10 0.00 -1.52 0.00 0.00 31.29 32.34 1kyz h VAL 235 CO -0.07 0.47 1.96 -0.63 0.02 0.00 0.00 177.57 179.32 1kyz s ILE 236 N -3.23 4.26 0.00 4.57 -1.09 0.16 -3.64 121.20 122.23 1kyz s ILE 236 Ca -0.17 -1.90 0.00 0.00 -2.23 0.00 0.00 60.65 56.34 1kyz s ILE 236 Cb -0.00 -5.13 0.00 0.00 -1.58 0.00 0.00 42.46 35.75 1kyz s ILE 236 CO 0.69 -1.94 0.00 1.21 -1.23 0.00 0.00 174.94 173.67 1kyz n GLU 237 N 7.96 0.07 0.00 2.79 2.13 -1.22 -4.66 120.64 127.71 1kyz n GLU 237 Ca 0.45 0.00 0.02 0.00 0.66 0.00 0.00 57.16 58.29 1kyz n GLU 237 Cb 0.46 -0.07 -0.00 0.00 0.27 0.00 0.00 31.44 32.10 1kyz n GLU 237 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1kyz n ASP 238 N -0.46 0.69 -4.66 4.31 10.43 -1.24 -5.02 116.55 120.60 1kyz n ASP 238 Ca 0.00 -0.84 -0.47 0.00 2.57 0.00 0.00 54.79 56.05 1kyz n ASP 238 Cb 0.00 0.57 -0.04 0.00 1.84 0.00 0.00 41.12 43.49 1kyz n ASP 238 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1kyz n ALA 239 N -0.52 1.10 -1.74 2.24 0.00 -1.26 -4.93 120.51 115.42 1kyz n ALA 239 Ca 0.01 0.22 -0.37 0.00 0.00 0.00 0.00 53.44 53.31 1kyz n ALA 239 Cb 0.08 -2.57 0.06 0.00 0.00 0.00 0.00 19.45 17.02 1kyz n ALA 239 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1kyz s PRO 240 N 4.41 2.70 0.10 0.00 0.02 -1.26 -4.96 135.00 136.00 1kyz s PRO 240 Ca 0.93 2.00 -0.27 0.00 0.02 0.00 0.00 61.00 63.68 1kyz s PRO 240 Cb -0.62 -1.88 -0.06 0.00 0.02 0.00 0.00 34.50 31.96 1kyz s PRO 240 CO 0.48 -1.47 0.86 -1.54 -0.33 0.00 0.00 177.00 175.00 1kyz s SER 241 N -1.43 7.38 0.06 2.53 1.04 -1.26 -4.96 113.70 117.05 1kyz s SER 241 Ca 0.81 1.64 0.08 0.00 0.48 0.00 0.00 55.95 58.96 1kyz s SER 241 Cb -0.36 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.20 1kyz s SER 241 CO 0.38 0.02 -0.20 -0.31 0.98 0.00 0.00 173.24 174.10 1kyz s TYR 242 N -0.24 2.49 0.19 5.02 1.51 -1.26 -5.07 117.35 119.98 1kyz s TYR 242 Ca 0.42 -0.30 -0.32 0.00 -1.01 0.00 0.00 57.07 55.86 1kyz s TYR 242 Cb -0.22 -1.42 -0.11 0.00 -0.11 0.00 0.00 41.96 40.09 1kyz s TYR 242 CO 0.27 0.25 1.74 -1.25 -1.11 0.00 0.00 175.55 175.45 1kyz s PRO 243 N -1.54 4.13 -0.10 -1.71 0.04 -1.26 -1.35 135.00 133.21 1kyz s PRO 243 Ca 0.14 2.59 0.00 0.00 0.04 0.00 0.00 61.00 63.78 1kyz s PRO 243 Cb -0.10 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1kyz s PRO 243 CO 0.05 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.74 1kyz n GLY 244 N 4.03 0.46 3.19 0.56 0.00 -1.26 -4.94 105.19 107.22 1kyz n GLY 244 Ca 0.16 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 1kyz n GLY 244 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kyz s VAL 245 N -1.87 1.96 -0.22 1.61 1.01 -0.46 -2.68 120.40 119.75 1kyz s VAL 245 Ca 0.00 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 1kyz s VAL 245 Cb 0.00 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.67 1kyz s VAL 245 CO 0.00 0.54 -0.08 -0.70 0.00 0.00 0.00 175.10 174.86 1kyz s GLU 246 N 0.51 3.16 0.10 2.72 2.12 -0.80 -4.42 118.70 122.10 1kyz s GLU 246 Ca -0.15 -0.76 -0.30 0.00 0.36 0.00 0.00 54.97 54.12 1kyz s GLU 246 Cb -0.17 -2.92 -0.06 0.00 0.26 0.00 0.00 34.13 31.25 1kyz s GLU 246 CO 0.06 -0.25 0.96 -1.01 -0.54 0.00 0.00 175.26 174.47 1kyz s HIS 247 N 1.40 3.80 -0.16 5.30 3.76 -1.26 -1.28 115.29 126.86 1kyz s HIS 247 Ca 0.04 1.80 -0.01 0.00 -0.15 0.00 0.00 55.06 56.73 1kyz s HIS 247 Cb -0.15 -3.06 0.04 0.00 1.11 0.00 0.00 32.58 30.53 1kyz s HIS 247 CO -0.06 0.19 -0.02 0.08 -0.85 0.00 0.00 174.74 174.09 1kyz s VAL 248 N 0.05 0.81 0.01 -0.90 1.01 -0.11 -4.91 120.40 116.36 1kyz s VAL 248 Ca 0.47 -0.48 -0.24 0.00 0.00 0.00 0.00 61.98 61.73 1kyz s VAL 248 Cb -0.23 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 1kyz s VAL 248 CO 0.30 0.05 0.73 -0.83 0.00 0.00 0.00 175.10 175.35 1kyz s GLY 249 N 1.76 2.73 0.00 4.51 0.00 -1.26 -2.27 107.32 112.80 1kyz s GLY 249 Ca 0.01 0.22 0.00 0.00 0.00 0.00 0.00 44.72 44.95 1kyz s GLY 249 CO -0.07 1.09 0.00 0.61 0.00 0.00 0.00 173.10 174.72 1kyz n GLY 250 N 2.58 0.84 2.94 0.20 0.00 -0.40 -4.78 105.19 106.57 1kyz n GLY 250 Ca -0.02 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 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 0.17 3.59 0.47 1.61 3.68 -1.26 -3.71 116.67 121.22 1kyz s ASP 251 Ca 0.00 -1.04 0.28 0.00 2.13 0.00 0.00 52.55 53.93 1kyz s ASP 251 Cb 0.00 -1.13 1.54 0.00 -1.45 0.00 0.00 42.92 41.88 1kyz s ASP 251 CO 0.00 -0.21 1.85 0.00 0.13 0.00 0.00 175.17 176.94 1kyz h MET 252 N 7.99 0.00 0.00 4.34 -0.00 -1.96 0.20 114.93 125.50 1kyz h MET 252 Ca -0.21 0.00 -0.06 0.00 -0.00 0.00 0.00 59.70 59.44 1kyz h MET 252 Cb 1.08 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.67 1kyz h MET 252 CO 0.42 0.00 -0.56 0.74 -0.00 0.00 0.00 176.91 177.51 1kyz h PHE 253 N 0.00 0.00 0.00 -0.10 -1.00 -1.94 -3.38 116.94 110.52 1kyz h PHE 253 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1kyz h PHE 253 Cb 0.18 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.74 1kyz h PHE 253 CO 0.00 0.24 -0.30 0.28 -1.61 0.00 0.00 178.31 176.92 1kyz h VAL 254 N 0.00 0.00 -2.62 -0.55 2.07 -1.04 -3.45 116.25 110.66 1kyz h VAL 254 Ca -0.02 -0.80 0.06 0.00 0.82 0.00 0.00 66.70 66.75 1kyz h VAL 254 Cb 1.21 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.85 1kyz h VAL 254 CO 0.03 0.00 0.36 -0.94 0.02 0.00 0.00 177.57 177.04 1kyz s SER 255 N -5.22 -0.43 -0.03 0.57 1.04 -0.71 -4.95 113.70 103.97 1kyz s SER 255 Ca -0.09 -0.05 0.05 0.00 0.48 0.00 0.00 55.95 56.34 1kyz s SER 255 Cb 0.01 0.50 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 1kyz s SER 255 CO 0.13 -0.82 -0.18 -0.63 0.98 0.00 0.00 173.24 172.72 1kyz s ILE 256 N -3.43 1.45 0.04 -1.02 1.01 -1.26 -4.18 121.20 113.81 1kyz s ILE 256 Ca 0.04 -0.76 -0.37 0.00 0.00 0.00 0.00 60.65 59.57 1kyz s ILE 256 Cb -0.01 -1.22 -0.16 0.00 0.01 0.00 0.00 42.46 41.07 1kyz s ILE 256 CO -0.09 0.41 1.43 -2.65 0.00 0.00 0.00 174.94 174.04 1kyz n PRO 257 N 2.87 1.28 -2.09 2.79 -0.02 -1.26 -4.58 135.00 134.00 1kyz n PRO 257 Ca -0.16 0.46 -0.35 0.00 -2.02 0.00 0.00 63.50 61.43 1kyz n PRO 257 Cb 0.53 -2.13 0.02 0.00 -0.02 0.00 0.00 33.50 31.90 1kyz n PRO 257 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1kyz s LYS 258 N 1.00 3.11 0.15 -0.52 0.00 -1.26 -4.86 119.74 117.37 1kyz s LYS 258 Ca 0.86 1.66 -0.24 0.00 0.00 0.00 0.00 55.97 58.25 1kyz s LYS 258 Cb -0.93 -1.97 0.08 0.00 0.00 0.00 0.00 37.83 35.01 1kyz s LYS 258 CO 0.48 -1.05 1.06 0.00 0.00 0.00 0.00 175.35 175.84 1kyz s ALA 259 N -1.79 -1.73 -1.63 0.59 0.00 -1.19 -4.93 121.76 111.09 1kyz s ALA 259 Ca 0.74 -0.15 0.31 0.00 0.00 0.00 0.00 51.96 52.86 1kyz s ALA 259 Cb -0.26 0.72 1.63 0.00 0.00 0.00 0.00 23.12 25.21 1kyz s ALA 259 CO 0.31 -1.07 2.10 -0.25 0.00 0.00 0.00 175.76 176.86 1kyz n ASP 260 N -1.02 0.04 -3.64 0.00 10.43 -1.24 -4.17 116.55 116.94 1kyz n ASP 260 Ca -0.03 -0.45 -0.02 0.00 2.57 0.00 0.00 54.79 56.86 1kyz n ASP 260 Cb 0.60 -0.18 -0.04 0.00 1.84 0.00 0.00 41.12 43.34 1kyz n ASP 260 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1kyz s ALA 261 N -2.38 -2.12 0.04 2.24 0.00 -1.25 -2.45 121.76 115.83 1kyz s ALA 261 Ca 0.35 1.89 0.07 0.00 0.00 0.00 0.00 51.96 54.27 1kyz s ALA 261 Cb 0.21 -1.53 -0.03 0.00 0.00 0.00 0.00 23.12 21.77 1kyz s ALA 261 CO 0.43 -0.24 -0.17 0.08 0.00 0.00 0.00 175.76 175.86 1kyz s VAL 262 N -1.00 2.86 -0.07 0.00 1.01 0.43 -2.12 120.40 121.51 1kyz s VAL 262 Ca 0.09 -1.15 0.04 0.00 0.00 0.00 0.00 61.98 60.95 1kyz s VAL 262 Cb -0.01 -2.21 0.00 0.00 0.00 0.00 0.00 36.38 34.17 1kyz s VAL 262 CO -0.08 0.34 -0.20 0.12 0.00 0.00 0.00 175.10 175.28 1kyz s PHE 263 N -0.93 2.08 0.00 5.22 5.36 -0.16 0.40 117.98 129.94 1kyz s PHE 263 Ca 0.15 -0.75 0.00 0.00 -0.96 0.00 0.00 56.93 55.37 1kyz s PHE 263 Cb -0.11 -1.41 0.00 0.00 -0.34 0.00 0.00 43.02 41.16 1kyz s PHE 263 CO 0.05 -0.30 0.00 -1.33 -1.46 0.00 0.00 175.22 172.18 1kyz n MET 264 N 3.43 0.00 -1.75 10.12 2.81 -0.77 -0.91 117.12 130.06 1kyz n MET 264 Ca -0.20 0.00 -0.00 0.00 -1.81 0.00 0.00 57.70 55.69 1kyz n MET 264 Cb 0.52 -0.05 -0.00 0.00 -0.71 0.00 0.00 33.22 32.99 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 -1.49 -2.89 -2.49 0.03 4.81 -1.26 -4.52 118.16 110.36 1kyz n LYS 265 Ca 0.00 2.32 -0.14 0.00 -0.87 0.00 0.00 58.31 59.61 1kyz n LYS 265 Cb 0.00 -2.85 -0.01 0.00 0.02 0.00 0.00 35.03 32.20 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 1.02 -1.38 -3.52 5.64 8.01 -0.09 -4.88 117.44 122.23 1kyz n TRP 266 Ca -0.00 0.03 -0.27 0.00 -1.31 0.00 0.00 57.50 55.96 1kyz n TRP 266 Cb 0.00 -2.98 -0.09 0.00 -2.01 0.00 0.00 31.31 26.22 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 -3.53 0.85 0.00 -0.99 2.08 -1.26 -4.59 119.36 111.92 1kyz n ILE 267 Ca -0.15 -4.53 0.00 0.00 0.56 0.00 0.00 62.75 58.63 1kyz n ILE 267 Cb 0.62 -2.01 0.00 0.00 -0.75 0.00 0.00 39.64 37.50 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 0.00 0.00 1.04 0.00 1.44 -1.26 -3.01 115.22 113.43 1kyz n HIS 269 Ca 0.00 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.82 1kyz n HIS 269 Cb 0.00 -0.22 0.05 0.00 0.12 0.00 0.00 29.99 29.94 1kyz n HIS 269 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1kyz n ASP 270 N -1.15 1.85 -4.20 4.39 8.00 -1.26 -0.14 116.55 124.03 1kyz n ASP 270 Ca 0.15 -1.40 -0.16 0.00 0.71 0.00 0.00 54.79 54.09 1kyz n ASP 270 Cb 0.24 0.44 -0.11 0.00 -0.02 0.00 0.00 41.12 41.67 1kyz n ASP 270 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1kyz s TRP 271 N -2.50 1.20 1.01 1.24 0.51 -1.17 -4.00 118.94 115.24 1kyz s TRP 271 Ca 0.19 -0.62 -0.12 0.00 -2.12 0.00 0.00 56.10 53.43 1kyz s TRP 271 Cb 0.18 -0.64 0.19 0.00 -0.81 0.00 0.00 33.47 32.39 1kyz s TRP 271 CO 0.57 0.06 1.09 -1.54 -0.51 0.00 0.00 176.95 176.62 1kyz s SER 272 N -2.47 2.50 0.23 2.95 1.04 -1.17 -4.58 113.70 112.20 1kyz s SER 272 Ca 0.07 1.24 -0.06 0.00 0.48 0.00 0.00 55.95 57.67 1kyz s SER 272 Cb -0.03 -1.91 0.33 0.00 0.10 0.00 0.00 66.02 64.50 1kyz s SER 272 CO 0.01 -3.21 1.81 0.44 0.98 0.00 0.00 173.24 173.27 1kyz h ASP 273 N -1.95 0.61 0.06 7.02 3.32 -1.92 0.03 116.42 123.59 1kyz h ASP 273 Ca -0.55 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.54 1kyz h ASP 273 Cb 1.33 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 1kyz h ASP 273 CO 0.57 0.36 -0.04 -0.08 -1.72 0.00 0.00 179.24 178.33 1kyz h GLU 274 N 0.74 -0.09 -0.77 3.56 4.81 -1.99 -1.04 114.58 119.79 1kyz h GLU 274 Ca 0.36 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.60 1kyz h GLU 274 Cb 0.29 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.66 1kyz h GLU 274 CO -0.23 -0.06 0.51 0.45 -0.73 0.00 0.00 179.01 178.95 1kyz h HIS 275 N -0.10 0.97 0.43 0.92 3.86 -1.75 -2.45 115.15 117.04 1kyz h HIS 275 Ca -0.01 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1kyz h HIS 275 Cb 0.08 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 28.22 1kyz h HIS 275 CO -0.08 0.62 -0.21 0.00 0.86 0.00 0.00 177.93 179.12 1kyz h LEU 277 N -0.59 -0.03 0.27 0.00 3.38 -1.04 0.22 115.31 117.53 1kyz h LEU 277 Ca -0.06 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1kyz h LEU 277 Cb 0.45 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 1kyz h LEU 277 CO 0.10 -0.08 -0.18 0.50 0.09 0.00 0.00 178.44 178.86 1kyz h LYS 278 N 0.24 -0.42 0.00 1.13 3.64 -1.20 -1.11 116.57 118.85 1kyz h LYS 278 Ca 0.46 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.84 1kyz h LYS 278 Cb 0.82 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.74 1kyz h LYS 278 CO -0.57 -0.28 -0.11 0.27 -2.27 0.00 0.00 179.45 176.49 1kyz h PHE 279 N -0.43 0.00 0.00 1.91 -5.15 -1.23 -0.25 116.94 111.79 1kyz h PHE 279 Ca -0.04 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.70 1kyz h PHE 279 Cb 0.35 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.52 1kyz h PHE 279 CO 0.00 0.11 -0.15 -0.07 -2.00 0.00 0.00 178.31 176.20 1kyz h LEU 280 N 0.00 0.00 -0.01 2.10 3.38 -0.41 -1.55 115.31 118.82 1kyz h LEU 280 Ca -0.00 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 1kyz h LEU 280 Cb 0.29 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.05 1kyz h LEU 280 CO 0.01 0.15 -0.53 0.11 0.09 0.00 0.00 178.44 178.27 1kyz h LYS 281 N 0.00 0.37 -0.72 1.13 1.57 0.28 -2.45 116.57 116.74 1kyz h LYS 281 Ca -0.00 -0.39 0.06 0.00 -1.87 0.00 0.00 60.65 58.44 1kyz h LYS 281 Cb 0.66 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 33.04 1kyz h LYS 281 CO 0.02 1.07 0.48 -0.91 -0.57 0.00 0.00 179.45 179.53 1kyz h ASN 282 N -0.16 0.69 0.37 0.86 -0.26 -1.16 0.22 115.58 116.14 1kyz h ASN 282 Ca -0.06 -0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.66 1kyz h ASN 282 Cb 1.25 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 38.36 1kyz h ASN 282 CO 0.11 0.46 -0.19 0.00 -1.06 0.00 0.00 177.43 176.74 1kyz h TYR 284 N -0.52 0.92 -0.18 0.00 3.20 -0.75 0.47 116.97 120.11 1kyz h TYR 284 Ca -0.05 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.80 1kyz h TYR 284 Cb 0.41 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 1kyz h TYR 284 CO -0.06 0.39 -0.08 0.93 -1.64 0.00 0.00 178.16 177.70 1kyz h GLU 285 N 0.82 0.37 0.00 1.82 5.08 -0.50 -2.66 114.58 119.51 1kyz h GLU 285 Ca 0.43 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1kyz h GLU 285 Cb 0.53 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1kyz h GLU 285 CO -0.20 0.67 0.00 0.00 -1.00 0.00 0.00 179.01 178.48 1kyz n ALA 286 N -2.38 1.59 -2.55 3.43 0.00 0.56 -4.59 120.51 116.58 1kyz n ALA 286 Ca -0.05 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 52.95 1kyz n ALA 286 Cb 0.30 -1.24 -0.07 0.00 0.00 0.00 0.00 19.45 18.44 1kyz n ALA 286 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1kyz s LEU 287 N -3.31 4.39 0.00 0.00 1.43 0.06 -3.15 118.68 118.09 1kyz s LEU 287 Ca 0.06 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1kyz s LEU 287 Cb 0.09 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.62 1kyz s LEU 287 CO 0.26 -0.62 0.98 -2.65 0.23 0.00 0.00 176.35 174.55 1kyz n PRO 288 N 6.00 0.66 -1.53 1.29 -0.02 -1.26 -4.66 135.00 135.49 1kyz n PRO 288 Ca -0.03 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.43 1kyz n PRO 288 Cb 0.48 -1.17 -0.01 0.00 -0.02 0.00 0.00 33.50 32.79 1kyz n PRO 288 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1kyz n ASP 289 N 1.14 -0.97 -0.07 2.55 5.75 -1.26 -4.63 116.55 119.06 1kyz n ASP 289 Ca 0.00 0.18 0.11 0.00 -0.01 0.00 0.00 54.79 55.08 1kyz n ASP 289 Cb 0.33 -1.18 0.10 0.00 -1.03 0.00 0.00 41.12 39.34 1kyz n ASP 289 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1kyz n ASN 290 N -0.02 0.89 0.00 -1.12 2.85 -1.26 -4.97 115.26 111.62 1kyz n ASN 290 Ca -0.03 -0.72 0.00 0.00 -0.11 0.00 0.00 54.58 53.72 1kyz n ASN 290 Cb 0.23 0.55 0.00 0.00 1.24 0.00 0.00 39.78 41.80 1kyz n ASN 290 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1kyz n GLY 291 N 1.48 4.48 0.00 8.20 0.00 -1.03 -4.89 105.19 113.43 1kyz n GLY 291 Ca 0.06 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1kyz n GLY 291 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1kyz n LYS 292 N 0.00 0.00 -4.69 1.61 0.00 -1.23 -4.94 118.16 108.90 1kyz n LYS 292 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 57.98 1kyz n LYS 292 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 35.03 34.88 1kyz n LYS 292 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1kyz s VAL 293 N -2.42 2.88 -0.41 0.58 1.01 -0.72 -0.43 120.40 120.88 1kyz s VAL 293 Ca 0.00 -0.71 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 1kyz s VAL 293 Cb 0.00 -2.21 0.06 0.00 0.00 0.00 0.00 36.38 34.23 1kyz s VAL 293 CO 0.00 0.52 0.27 -0.63 0.00 0.00 0.00 175.10 175.26 1kyz s ILE 294 N 0.54 4.55 -0.25 2.22 1.01 0.16 0.22 121.20 129.66 1kyz s ILE 294 Ca -0.09 -1.15 -0.10 0.00 0.00 0.00 0.00 60.65 59.31 1kyz s ILE 294 Cb -0.16 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1kyz s ILE 294 CO 0.04 -0.43 0.14 -0.69 0.00 0.00 0.00 174.94 174.00 1kyz s VAL 295 N 1.51 5.07 -0.39 2.92 1.01 0.13 -1.84 120.40 128.82 1kyz s VAL 295 Ca 0.03 0.08 -0.07 0.00 0.00 0.00 0.00 61.98 62.02 1kyz s VAL 295 Cb -0.22 -3.37 0.07 0.00 0.00 0.00 0.00 36.38 32.86 1kyz s VAL 295 CO 0.05 0.33 0.19 0.00 0.00 0.00 0.00 175.10 175.67 1kyz s ALA 296 N 1.31 3.18 0.18 5.51 0.00 -1.26 -1.18 121.76 129.51 1kyz s ALA 296 Ca 0.07 -2.05 -0.16 0.00 0.00 0.00 0.00 51.96 49.82 1kyz s ALA 296 Cb -0.14 -2.48 0.02 0.00 0.00 0.00 0.00 23.12 20.52 1kyz s ALA 296 CO 0.06 -1.55 0.46 -1.21 0.00 0.00 0.00 175.76 173.52 1kyz s GLU 297 N 1.38 1.32 0.62 0.00 0.41 -0.79 -0.91 118.70 120.72 1kyz s GLU 297 Ca 0.02 -0.92 -0.12 0.00 -0.41 0.00 0.00 54.97 53.54 1kyz s GLU 297 Cb -0.22 0.49 -0.04 0.00 -1.78 0.00 0.00 34.13 32.58 1kyz s GLU 297 CO 0.02 -0.54 1.03 0.00 -0.49 0.00 0.00 175.26 175.27 1kyz s ILE 299 N -3.10 1.08 0.04 0.00 1.01 -1.26 -4.54 121.20 114.44 1kyz s ILE 299 Ca 0.56 -0.45 -0.20 0.00 0.00 0.00 0.00 60.65 60.56 1kyz s ILE 299 Cb -0.11 -1.00 -0.06 0.00 0.01 0.00 0.00 42.46 41.30 1kyz s ILE 299 CO 0.52 0.34 0.57 -0.76 0.00 0.00 0.00 174.94 175.62 1kyz s LEU 300 N 0.70 4.49 0.59 2.97 1.43 -0.32 -4.97 118.68 123.57 1kyz s LEU 300 Ca -0.14 1.22 -0.12 0.00 -1.03 0.00 0.00 54.13 54.06 1kyz s LEU 300 Cb -0.16 -2.90 -0.05 0.00 0.03 0.00 0.00 46.19 43.12 1kyz s LEU 300 CO 0.03 0.22 1.01 -2.84 0.23 0.00 0.00 176.35 175.00 1kyz s PRO 301 N -0.79 3.68 0.16 1.29 0.02 -1.26 -4.07 135.00 134.03 1kyz s PRO 301 Ca 0.30 0.77 -0.10 0.00 0.02 0.00 0.00 61.00 61.98 1kyz s PRO 301 Cb -0.19 -2.11 0.01 0.00 0.02 0.00 0.00 34.50 32.23 1kyz s PRO 301 CO 0.18 -0.49 1.56 0.28 -0.33 0.00 0.00 177.00 178.20 1kyz h VAL 302 N -0.01 1.27 -2.82 3.83 2.07 -1.99 -3.43 116.25 115.16 1kyz h VAL 302 Ca -0.45 -1.34 -0.64 0.00 0.82 0.00 0.00 66.70 65.10 1kyz h VAL 302 Cb 1.19 1.09 -0.06 0.00 -1.52 0.00 0.00 31.29 31.99 1kyz h VAL 302 CO 0.62 0.46 -0.37 0.00 0.02 0.00 0.00 177.57 178.31 1kyz s ALA 303 N -4.73 3.81 0.60 1.67 0.00 -1.26 -5.08 121.76 116.77 1kyz s ALA 303 Ca -0.12 -0.48 -0.15 0.00 0.00 0.00 0.00 51.96 51.21 1kyz s ALA 303 Cb 0.12 -2.13 -0.03 0.00 0.00 0.00 0.00 23.12 21.08 1kyz s ALA 303 CO 0.86 0.58 1.05 -1.25 0.00 0.00 0.00 175.76 177.00 1kyz s PRO 304 N -1.20 3.34 0.23 0.00 0.04 -1.26 -5.05 135.00 131.09 1kyz s PRO 304 Ca 0.21 1.13 -0.15 0.00 0.04 0.00 0.00 61.00 62.24 1kyz s PRO 304 Cb -0.14 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.37 1kyz s PRO 304 CO 0.10 -0.79 0.50 0.16 0.04 0.00 0.00 177.00 177.01 1kyz s ASP 305 N -2.98 -0.14 -0.09 6.66 -4.77 -1.26 -5.07 116.67 109.03 1kyz s ASP 305 Ca 0.62 -0.77 0.11 0.00 -3.30 0.00 0.00 52.55 49.21 1kyz s ASP 305 Cb -0.15 0.59 0.47 0.00 -1.09 0.00 0.00 42.92 42.74 1kyz s ASP 305 CO 0.39 -1.12 1.31 -1.54 0.70 0.00 0.00 175.17 174.91 1kyz n SER 306 N -0.36 3.34 -4.80 2.11 3.41 -1.26 -4.58 113.62 111.48 1kyz n SER 306 Ca -0.05 -2.34 -0.33 0.00 -0.26 0.00 0.00 58.87 55.89 1kyz n SER 306 Cb 0.62 -0.49 -0.01 0.00 -0.26 0.00 0.00 64.21 64.07 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 -0.70 6.05 0.33 4.04 1.04 -1.26 -4.88 113.70 118.33 1kyz s SER 307 Ca 0.33 1.86 0.02 0.00 0.48 0.00 0.00 55.95 58.64 1kyz s SER 307 Cb 0.22 -2.54 0.59 0.00 0.10 0.00 0.00 66.02 64.38 1kyz s SER 307 CO 0.15 -0.98 1.94 -0.07 0.98 0.00 0.00 173.24 175.26 1kyz h LEU 308 N 0.94 0.68 -0.50 2.42 3.38 -1.98 -0.21 115.31 120.04 1kyz h LEU 308 Ca -0.48 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.39 1kyz h LEU 308 Cb 1.22 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1kyz h LEU 308 CO 0.58 0.58 0.16 0.00 0.09 0.00 0.00 178.44 179.85 1kyz h ALA 309 N 1.53 0.65 -0.14 1.53 0.00 -1.98 0.91 119.26 121.76 1kyz h ALA 309 Ca 0.19 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1kyz h ALA 309 Cb 0.08 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1kyz h ALA 309 CO -0.03 0.30 -0.06 1.15 0.00 0.00 0.00 179.25 180.62 1kyz h THR 310 N 0.67 1.31 -0.64 0.00 2.02 -1.80 -2.76 112.91 111.71 1kyz h THR 310 Ca 0.16 -1.06 0.03 0.00 0.77 0.00 0.00 66.41 66.31 1kyz h THR 310 Cb 0.27 1.71 -0.04 0.00 -1.74 0.00 0.00 68.15 68.35 1kyz h THR 310 CO -0.01 0.31 0.42 0.11 0.37 0.00 0.00 175.52 176.73 1kyz h LYS 311 N -0.03 0.74 -0.80 6.66 1.57 -0.94 -1.30 116.57 122.46 1kyz h LYS 311 Ca 0.03 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1kyz h LYS 311 Cb 0.51 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.60 1kyz h LYS 311 CO 0.02 0.49 0.51 0.78 -0.57 0.00 0.00 179.45 180.68 1kyz h GLY 312 N 0.76 1.17 0.65 3.86 0.00 -0.56 0.16 103.07 109.12 1kyz h GLY 312 Ca 0.25 -0.39 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 1kyz h GLY 312 CO -0.07 0.32 -0.24 -2.08 0.00 0.00 0.00 176.54 174.47 1kyz h VAL 313 N 0.99 1.42 -0.25 4.60 2.07 -1.03 -3.14 116.25 120.90 1kyz h VAL 313 Ca 0.32 -1.61 -0.04 0.00 0.82 0.00 0.00 66.70 66.20 1kyz h VAL 313 Cb 0.03 2.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1kyz h VAL 313 CO -0.12 0.46 -0.02 0.58 0.02 0.00 0.00 177.57 178.48 1kyz h VAL 314 N -0.19 1.17 -0.38 2.57 2.07 -1.12 -1.18 116.25 119.20 1kyz h VAL 314 Ca -0.01 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 66.87 1kyz h VAL 314 Cb 0.86 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1kyz h VAL 314 CO 0.05 0.23 0.18 0.45 0.02 0.00 0.00 177.57 178.50 1kyz h HIS 315 N 0.37 0.33 -0.14 1.57 3.86 -0.68 -0.85 115.15 119.61 1kyz h HIS 315 Ca 0.08 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.19 1kyz h HIS 315 Cb 0.29 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 1kyz h HIS 315 CO 0.01 0.17 -0.44 0.82 0.86 0.00 0.00 177.93 179.35 1kyz h ILE 316 N 0.37 1.32 -0.65 2.45 2.04 -1.37 -1.75 117.51 119.92 1kyz h ILE 316 Ca 0.16 -1.61 -0.05 0.00 1.00 0.00 0.00 64.86 64.36 1kyz h ILE 316 Cb 0.08 1.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 1kyz h ILE 316 CO -0.12 0.49 0.20 -0.78 0.00 0.00 0.00 178.15 177.94 1kyz h ASP 317 N 0.27 0.93 -0.10 1.72 3.58 -0.57 -0.35 116.42 121.90 1kyz h ASP 317 Ca 0.02 -0.16 -0.20 0.00 0.42 0.00 0.00 57.03 57.11 1kyz h ASP 317 Cb 0.89 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.70 1kyz h ASP 317 CO 0.07 0.87 -0.66 0.58 -2.88 0.00 0.00 179.24 177.23 1kyz h VAL 318 N 0.97 1.30 -0.62 2.25 2.07 -0.95 -2.34 116.25 118.93 1kyz h VAL 318 Ca 0.21 -1.89 -0.02 0.00 0.82 0.00 0.00 66.70 65.83 1kyz h VAL 318 Cb 0.28 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1kyz h VAL 318 CO -0.01 0.60 0.32 0.40 0.02 0.00 0.00 177.57 178.90 1kyz h ILE 319 N 0.52 1.21 -0.89 4.57 2.04 -1.07 -1.91 117.51 121.98 1kyz h ILE 319 Ca -0.02 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.36 1kyz h ILE 319 Cb 1.26 0.44 -0.06 0.00 -0.74 0.00 0.00 36.82 37.71 1kyz h ILE 319 CO 0.13 0.23 0.56 -0.03 0.00 0.00 0.00 178.15 179.04 1kyz h MET 320 N 0.84 0.99 -0.90 2.37 4.05 -0.96 -1.66 114.93 119.66 1kyz h MET 320 Ca 0.21 -0.06 0.07 0.00 -0.28 0.00 0.00 59.70 59.64 1kyz h MET 320 Cb 0.08 -0.22 -0.07 0.00 -0.80 0.00 0.00 31.60 30.59 1kyz h MET 320 CO -0.03 0.65 0.56 1.25 0.23 0.00 0.00 176.91 179.57 1kyz h LEU 321 N 1.02 0.87 -0.45 3.39 6.46 -0.80 0.27 115.31 126.07 1kyz h LEU 321 Ca 0.39 0.02 -0.17 0.00 -0.12 0.00 0.00 57.88 57.99 1kyz h LEU 321 Cb 0.16 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 39.93 1kyz h LEU 321 CO -0.17 0.54 -0.66 0.00 -0.62 0.00 0.00 178.44 177.53 1kyz h ALA 322 N 1.43 0.64 0.00 1.25 0.00 -0.92 -3.39 119.26 118.27 1kyz h ALA 322 Ca 0.40 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1kyz h ALA 322 Cb 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1kyz h ALA 322 CO -0.19 0.73 -0.09 0.72 0.00 0.00 0.00 179.25 180.43 1kyz n HIS 323 N -3.88 0.00 -5.28 0.00 8.25 -1.03 -1.33 115.22 111.94 1kyz n HIS 323 Ca -0.04 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.11 1kyz n HIS 323 Cb 0.67 -0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.62 1kyz n HIS 323 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1kyz s ASN 324 N -1.11 3.01 -0.31 0.41 3.84 0.95 -4.73 114.94 117.00 1kyz s ASN 324 Ca 0.00 -0.47 -0.26 0.00 0.21 0.00 0.00 52.86 52.34 1kyz s ASN 324 Cb 0.00 -0.41 0.01 0.00 -0.55 0.00 0.00 41.25 40.31 1kyz s ASN 324 CO 0.02 0.30 0.91 -2.84 -2.79 0.00 0.00 177.10 172.71 1kyz s PRO 325 N -0.54 4.02 0.00 0.43 0.02 -1.26 -4.00 135.00 133.66 1kyz s PRO 325 Ca 0.08 0.81 0.00 0.00 0.02 0.00 0.00 61.00 61.91 1kyz s PRO 325 Cb -0.10 -3.73 0.00 0.00 0.02 0.00 0.00 34.50 30.69 1kyz s PRO 325 CO -0.00 -0.76 0.00 0.41 -0.33 0.00 0.00 177.00 176.31 1kyz n GLY 326 N 4.02 1.69 3.77 0.52 0.00 -1.26 -4.63 105.19 109.30 1kyz n GLY 326 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.00 2.86 -0.11 -0.02 0.00 -1.26 -3.03 107.32 103.76 1kyz s GLY 327 Ca 0.00 0.90 -0.33 0.00 0.00 0.00 0.00 44.72 45.30 1kyz s GLY 327 CO 0.00 1.41 1.12 -1.59 0.00 0.00 0.00 173.10 174.04 1kyz s LYS 328 N -2.23 0.48 0.33 2.90 0.00 0.81 -4.60 119.74 117.42 1kyz s LYS 328 Ca 0.56 -0.19 -0.14 0.00 0.00 0.00 0.00 55.97 56.19 1kyz s LYS 328 Cb -0.29 0.21 -0.09 0.00 0.00 0.00 0.00 37.83 37.67 1kyz s LYS 328 CO 0.37 -0.21 0.73 -1.21 0.00 0.00 0.00 175.35 175.03 1kyz s GLU 329 N -2.63 3.97 0.19 1.78 0.41 -1.26 -4.39 118.70 116.77 1kyz s GLU 329 Ca 0.09 0.63 0.08 0.00 -0.41 0.00 0.00 54.97 55.36 1kyz s GLU 329 Cb -0.01 -2.43 -0.04 0.00 -1.78 0.00 0.00 34.13 29.87 1kyz s GLU 329 CO -0.05 0.14 -0.16 1.03 -0.49 0.00 0.00 175.26 175.72 1kyz s ARG 330 N -3.08 1.32 0.73 1.61 0.52 -1.26 -4.94 118.95 113.85 1kyz s ARG 330 Ca 0.54 -1.53 -0.08 0.00 -0.52 0.00 0.00 55.73 54.14 1kyz s ARG 330 Cb -0.10 -1.22 0.06 0.00 0.52 0.00 0.00 34.95 34.21 1kyz s ARG 330 CO 0.19 0.22 1.06 -0.08 0.02 0.00 0.00 175.30 176.72 1kyz s THR 331 N -2.61 2.25 0.17 0.02 -1.32 -1.26 -1.17 115.64 111.72 1kyz s THR 331 Ca 0.20 -0.17 -0.12 0.00 -1.21 0.00 0.00 61.69 60.40 1kyz s THR 331 Cb -0.03 -3.02 0.07 0.00 -1.51 0.00 0.00 72.50 68.01 1kyz s THR 331 CO 0.07 -0.03 1.71 -0.61 -2.21 0.00 0.00 174.62 173.56 1kyz h GLN 332 N -0.73 0.91 -0.86 7.08 4.15 -1.94 -1.86 115.11 121.87 1kyz h GLN 332 Ca -0.45 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 58.78 1kyz h GLN 332 Cb 1.32 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 28.83 1kyz h GLN 332 CO 0.62 0.80 0.52 -0.22 -1.93 0.00 0.00 178.83 178.62 1kyz h LYS 333 N 0.83 1.16 -0.33 1.69 1.63 -1.94 -1.54 116.57 118.07 1kyz h LYS 333 Ca 0.19 -0.10 -0.08 0.00 -0.85 0.00 0.00 60.65 59.82 1kyz h LYS 333 Cb 0.25 -0.24 -0.02 0.00 -0.60 0.00 0.00 32.23 31.62 1kyz h LYS 333 CO -0.01 0.81 -0.12 0.93 -3.45 0.00 0.00 179.45 177.61 1kyz h GLU 334 N 1.18 0.57 -0.16 1.90 5.08 -1.83 -1.42 114.58 119.90 1kyz h GLU 334 Ca 0.31 -0.17 -0.11 0.00 -1.00 0.00 0.00 59.36 58.39 1kyz h GLU 334 Cb -0.05 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1kyz h GLU 334 CO -0.06 0.68 -0.38 0.74 -1.00 0.00 0.00 179.01 178.99 1kyz h PHE 335 N 0.53 0.41 0.59 4.33 -1.00 -0.67 -2.60 116.94 118.52 1kyz h PHE 335 Ca 0.10 -0.11 -0.03 0.00 2.81 0.00 0.00 57.97 60.74 1kyz h PHE 335 Cb 0.51 -0.09 0.01 0.00 3.61 0.00 0.00 35.95 39.99 1kyz h PHE 335 CO 0.02 0.69 -0.28 0.93 -1.61 0.00 0.00 178.31 178.05 1kyz h GLU 336 N 0.30 -0.76 -0.21 1.51 5.08 -0.63 -1.87 114.58 117.99 1kyz h GLU 336 Ca 0.03 0.05 0.06 0.00 -1.00 0.00 0.00 59.36 58.50 1kyz h GLU 336 Cb 0.81 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1kyz h GLU 336 CO 0.06 -0.45 0.26 -0.44 -1.00 0.00 0.00 179.01 177.44 1kyz h ASP 337 N -0.98 0.00 0.58 1.42 3.32 -1.27 0.70 116.42 120.19 1kyz h ASP 337 Ca -0.08 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.77 1kyz h ASP 337 Cb 0.66 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1kyz h ASP 337 CO 0.13 0.00 -0.91 -0.07 -1.72 0.00 0.00 179.24 176.68 1kyz h LEU 338 N 0.00 0.27 0.49 1.55 3.38 -1.19 0.89 115.31 120.70 1kyz h LEU 338 Ca 0.10 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.82 1kyz h LEU 338 Cb 0.62 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1kyz h LEU 338 CO -0.00 1.04 -0.23 0.00 0.09 0.00 0.00 178.44 179.34 1kyz h ALA 339 N 0.93 -0.65 -0.77 1.53 0.00 0.12 -2.13 119.26 118.29 1kyz h ALA 339 Ca -0.05 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.73 1kyz h ALA 339 Cb 1.55 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 19.53 1kyz h ALA 339 CO 0.14 -0.69 0.46 0.87 0.00 0.00 0.00 179.25 180.03 1kyz h LYS 340 N -1.01 0.83 -0.74 0.00 1.57 -1.06 0.21 116.57 116.36 1kyz h LYS 340 Ca -0.07 -0.05 0.10 0.00 -1.87 0.00 0.00 60.65 58.76 1kyz h LYS 340 Cb 0.59 -0.19 -0.05 0.00 0.08 0.00 0.00 32.23 32.67 1kyz h LYS 340 CO 0.11 0.55 0.49 0.78 -0.57 0.00 0.00 179.45 180.80 1kyz h GLY 341 N 0.85 0.90 0.65 3.86 0.00 -0.79 0.33 103.07 108.87 1kyz h GLY 341 Ca 0.34 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1kyz h GLY 341 CO -0.17 0.15 -0.43 0.00 0.00 0.00 0.00 176.54 176.08 1kyz n ALA 342 N -2.47 3.43 -1.79 3.60 0.00 -0.47 -5.02 120.51 117.80 1kyz n ALA 342 Ca 0.12 -0.38 -0.01 0.00 0.00 0.00 0.00 53.44 53.17 1kyz n ALA 342 Cb 0.35 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 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 1.44 -3.38 0.00 0.00 0.00 0.12 -4.75 105.19 98.62 1kyz n GLY 343 Ca 0.08 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.16 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 0.31 0.00 0.00 1.61 3.01 -1.18 -4.95 117.46 116.26 1kyz n PHE 344 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.40 1kyz n PHE 344 Cb 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 1kyz n PHE 344 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 1kyz n GLN 345 N 0.00 0.00 -4.39 -1.08 0.00 -1.26 -3.52 117.38 107.13 1kyz n GLN 345 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.00 56.70 1kyz n GLN 345 Cb 0.01 -0.35 -0.12 0.00 0.00 0.00 0.00 30.24 29.78 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 0.00 1.67 -0.14 1.69 0.00 -1.20 -4.97 107.32 104.38 1kyz s GLY 346 Ca 0.00 -1.29 -0.06 0.00 0.00 0.00 0.00 44.72 43.37 1kyz s GLY 346 CO 0.00 -1.25 0.30 -0.12 0.00 0.00 0.00 173.10 172.04 1kyz s PHE 347 N -1.09 -0.47 -0.00 1.90 5.36 -1.26 0.24 117.98 122.65 1kyz s PHE 347 Ca 0.17 1.04 0.02 0.00 -0.96 0.00 0.00 56.93 57.20 1kyz s PHE 347 Cb -0.11 0.09 -0.00 0.00 -0.34 0.00 0.00 43.02 42.66 1kyz s PHE 347 CO 0.09 -0.33 -0.06 0.15 -1.46 0.00 0.00 175.22 173.62 1kyz s LYS 348 N 1.85 0.45 -0.29 10.12 1.02 -1.07 -5.01 119.74 126.82 1kyz s LYS 348 Ca -0.05 -0.20 -0.06 0.00 0.02 0.00 0.00 55.97 55.68 1kyz s LYS 348 Cb -0.11 -0.43 0.01 0.00 -0.52 0.00 0.00 37.83 36.78 1kyz s LYS 348 CO -0.10 0.12 0.06 0.08 -0.92 0.00 0.00 175.35 174.59 1kyz s VAL 349 N -0.15 3.85 0.00 3.17 1.01 -1.26 -1.01 120.40 126.01 1kyz s VAL 349 Ca 0.02 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.28 1kyz s VAL 349 Cb -0.02 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1kyz s VAL 349 CO -0.00 0.10 0.00 1.41 0.00 0.00 0.00 175.10 176.61 1kyz n HIS 350 N 4.84 0.00 -1.93 5.22 8.25 0.13 -4.99 115.22 126.75 1kyz n HIS 350 Ca -0.15 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 56.98 1kyz n HIS 350 Cb 0.48 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.61 1kyz n HIS 350 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1kyz s ASN 352 N -2.73 4.92 -0.30 0.00 2.20 -1.26 -2.39 114.94 115.38 1kyz s ASN 352 Ca 0.65 -0.13 -0.09 0.00 -0.94 0.00 0.00 52.86 52.35 1kyz s ASN 352 Cb -0.18 -1.82 -0.01 0.00 -2.00 0.00 0.00 41.25 37.24 1kyz s ASN 352 CO 0.39 0.13 0.13 0.00 -2.94 0.00 0.00 177.10 174.81 1kyz s ALA 353 N 0.63 3.24 -1.22 3.54 0.00 0.39 -4.68 121.76 123.66 1kyz s ALA 353 Ca -0.01 -1.35 -0.28 0.00 0.00 0.00 0.00 51.96 50.32 1kyz s ALA 353 Cb -0.14 -2.30 0.03 0.00 0.00 0.00 0.00 23.12 20.70 1kyz s ALA 353 CO 0.02 -0.83 0.67 1.19 0.00 0.00 0.00 175.76 176.81 1kyz n PHE 354 N 4.96 -1.53 -0.90 0.00 0.99 -1.26 -0.39 117.46 119.32 1kyz n PHE 354 Ca -0.14 0.22 0.00 0.00 -0.00 0.00 0.00 57.45 57.53 1kyz n PHE 354 Cb 0.49 -3.00 0.00 0.00 -1.00 0.00 0.00 39.48 35.97 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 -2.37 -2.83 -4.37 4.37 4.05 -1.26 -4.98 115.26 107.87 1kyz n ASN 355 Ca -0.12 0.00 -0.35 0.00 0.45 0.00 0.00 54.58 54.56 1kyz n ASN 355 Cb 0.58 -1.78 -0.13 0.00 1.23 0.00 0.00 39.78 39.68 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 -1.84 3.64 0.12 -0.44 2.01 0.47 -4.42 115.64 115.18 1kyz s THR 356 Ca 0.00 -0.41 -0.11 0.00 0.31 0.00 0.00 61.69 61.48 1kyz s THR 356 Cb 0.00 -2.65 -0.06 0.00 0.01 0.00 0.00 72.50 69.79 1kyz s THR 356 CO 0.00 0.42 0.45 -0.31 -0.69 0.00 0.00 174.62 174.50 1kyz s TYR 357 N 1.27 3.57 -0.23 4.92 1.51 0.57 0.15 117.35 129.11 1kyz s TYR 357 Ca 0.03 0.86 -0.05 0.00 -1.01 0.00 0.00 57.07 56.90 1kyz s TYR 357 Cb -0.14 -2.22 -0.02 0.00 -0.11 0.00 0.00 41.96 39.47 1kyz s TYR 357 CO -0.00 0.47 0.00 0.42 -1.11 0.00 0.00 175.55 175.32 1kyz s ILE 358 N -1.47 3.74 0.08 2.71 -1.09 -1.01 -1.89 121.20 122.28 1kyz s ILE 358 Ca 0.36 -0.37 0.04 0.00 -2.23 0.00 0.00 60.65 58.45 1kyz s ILE 358 Cb -0.14 -2.72 -0.03 0.00 -1.58 0.00 0.00 42.46 37.99 1kyz s ILE 358 CO 0.19 0.39 -0.11 0.00 -1.23 0.00 0.00 174.94 174.18 1kyz s MET 359 N 1.53 0.80 0.02 2.79 0.23 -0.32 0.18 119.30 124.52 1kyz s MET 359 Ca 0.06 -1.04 0.08 0.00 -1.03 0.00 0.00 55.69 53.75 1kyz s MET 359 Cb -0.15 -0.61 -0.03 0.00 -1.53 0.00 0.00 34.83 32.52 1kyz s MET 359 CO -0.01 0.11 -0.23 -1.83 -2.03 0.00 0.00 175.02 171.04 1kyz s GLU 360 N -2.29 2.02 -0.20 3.16 -1.05 -0.18 0.20 118.70 120.36 1kyz s GLU 360 Ca 0.01 -0.99 -0.09 0.00 -0.15 0.00 0.00 54.97 53.75 1kyz s GLU 360 Cb -0.06 -2.09 -0.05 0.00 -0.44 0.00 0.00 34.13 31.50 1kyz s GLU 360 CO 0.01 0.54 0.11 -0.06 0.95 0.00 0.00 175.26 176.81 1kyz s PHE 361 N -0.77 3.35 0.00 4.83 0.40 0.13 -2.59 117.98 123.33 1kyz s PHE 361 Ca 0.12 0.23 0.00 0.00 -0.60 0.00 0.00 56.93 56.68 1kyz s PHE 361 Cb -0.10 -2.14 0.00 0.00 0.51 0.00 0.00 43.02 41.29 1kyz s PHE 361 CO 0.02 0.23 0.00 -0.11 0.70 0.00 0.00 175.22 176.05