#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kke s ILE 64 N 0.00 2.08 -0.16 2.28 -4.36 0.15 -1.56 121.20 119.61 3kke s ILE 64 Ca 0.00 -1.98 -0.05 0.00 -0.26 0.00 0.00 60.65 58.36 3kke s ILE 64 Cb 0.00 -1.98 -0.03 0.00 1.25 0.00 0.00 42.46 41.70 3kke s ILE 64 CO 0.00 -0.22 0.01 -0.83 0.24 0.00 0.00 174.94 174.14 3kke s GLY 65 N -2.68 1.82 -0.35 6.27 0.00 0.18 -0.85 107.32 111.72 3kke s GLY 65 Ca 0.18 -0.78 -0.08 0.00 0.00 0.00 0.00 44.72 44.04 3kke s GLY 65 CO 0.08 -0.05 0.15 -2.27 0.00 0.00 0.00 173.10 171.01 3kke s LEU 66 N 0.25 4.50 -0.25 0.66 2.96 0.80 0.20 118.68 127.79 3kke s LEU 66 Ca 0.01 -1.12 -0.09 0.00 -0.22 0.00 0.00 54.13 52.71 3kke s LEU 66 Cb -0.13 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 3kke s LEU 66 CO 0.02 -0.36 0.12 -0.63 -1.32 0.00 0.00 176.35 174.18 3kke s ILE 67 N 1.45 4.78 0.20 6.68 -1.09 0.48 -0.67 121.20 133.02 3kke s ILE 67 Ca -0.00 -0.01 0.08 0.00 -2.23 0.00 0.00 60.65 58.48 3kke s ILE 67 Cb -0.20 -3.24 -0.05 0.00 -1.58 0.00 0.00 42.46 37.39 3kke s ILE 67 CO 0.04 0.32 -0.14 0.68 -1.23 0.00 0.00 174.94 174.60 3kke s VAL 68 N 1.53 1.70 0.08 2.92 -7.23 0.79 -1.60 120.40 118.59 3kke s VAL 68 Ca 0.06 -2.16 -0.17 0.00 -1.81 0.00 0.00 61.98 57.90 3kke s VAL 68 Cb -0.15 -2.00 -0.10 0.00 0.56 0.00 0.00 36.38 34.69 3kke s VAL 68 CO 0.06 -0.58 1.40 -0.65 -0.31 0.00 0.00 175.10 175.03 3kke h PRO 69 N 2.66 0.56 -1.77 4.82 0.11 -1.83 -1.76 132.00 134.80 3kke h PRO 69 Ca -0.38 -0.29 0.02 0.00 0.11 0.00 0.00 66.00 65.46 3kke h PRO 69 Cb 1.22 0.00 -0.22 0.00 0.11 0.00 0.00 31.00 32.11 3kke h PRO 69 CO 0.61 0.87 0.36 0.34 -0.21 0.00 0.00 178.00 179.97 3kke s ASP 70 N -6.35 -0.53 0.00 -2.05 -1.08 -1.26 -4.10 116.67 101.30 3kke s ASP 70 Ca -0.13 0.74 0.24 0.00 -0.52 0.00 0.00 52.55 52.88 3kke s ASP 70 Cb 0.07 0.65 1.04 0.00 -1.46 0.00 0.00 42.92 43.22 3kke s ASP 70 CO 0.80 -0.38 1.78 1.33 0.52 0.00 0.00 175.17 179.22 3kke n VAL 71 N 1.34 0.33 0.53 1.11 0.24 -1.26 -2.37 118.33 118.24 3kke n VAL 71 Ca -0.14 0.08 0.12 0.00 -2.04 0.00 0.00 64.34 62.36 3kke n VAL 71 Cb 0.57 -0.66 0.45 0.00 -1.47 0.00 0.00 33.84 32.73 3kke n VAL 71 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3kke n ASN 72 N -1.49 0.54 -4.68 -1.34 3.02 -1.26 -4.79 115.26 105.25 3kke n ASN 72 Ca 0.06 0.60 -0.43 0.00 -0.03 0.00 0.00 54.58 54.79 3kke n ASN 72 Cb 0.28 -0.73 -0.01 0.00 -0.61 0.00 0.00 39.78 38.72 3kke n ASN 72 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3kke n ASN 73 N -2.06 2.52 -0.35 6.41 2.85 -1.00 -4.90 115.26 118.74 3kke n ASN 73 Ca 0.04 1.19 0.07 0.00 -0.11 0.00 0.00 54.58 55.77 3kke n ASN 73 Cb 0.28 -1.46 0.24 0.00 1.24 0.00 0.00 39.78 40.08 3kke n ASN 73 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3kke h ALA 74 N 2.41 1.47 0.00 5.20 0.00 -1.91 -1.87 119.26 124.55 3kke h ALA 74 Ca -0.45 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3kke h ALA 74 Cb 1.29 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3kke h ALA 74 CO 0.62 0.17 -0.22 1.33 0.00 0.00 0.00 179.25 181.15 3kke n VAL 75 N -4.67 0.10 0.15 0.00 0.24 -1.26 -4.44 118.33 108.46 3kke n VAL 75 Ca 0.19 -0.06 -0.13 0.00 -2.04 0.00 0.00 64.34 62.29 3kke n VAL 75 Cb 0.37 -0.24 -0.06 0.00 -1.47 0.00 0.00 33.84 32.43 3kke n VAL 75 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 3kke h PHE 76 N 0.00 -0.61 -0.05 6.34 3.57 -1.66 -2.15 116.94 122.37 3kke h PHE 76 Ca 0.00 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.53 3kke h PHE 76 Cb 0.55 0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.51 3kke h PHE 76 CO 0.00 -0.34 -0.11 0.00 -2.23 0.00 0.00 178.31 175.63 3kke h ALA 77 N 0.24 -0.08 -0.41 2.41 0.00 -1.78 0.28 119.26 119.92 3kke h ALA 77 Ca 0.01 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3kke h ALA 77 Cb 0.46 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3kke h ALA 77 CO -0.08 -0.59 -0.07 -0.44 0.00 0.00 0.00 179.25 178.08 3kke h ASP 78 N -0.17 0.78 -0.28 0.00 3.32 -1.84 -1.94 116.42 116.29 3kke h ASP 78 Ca 0.06 -0.35 0.01 0.00 0.02 0.00 0.00 57.03 56.77 3kke h ASP 78 Cb 0.25 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 3kke h ASP 78 CO -0.15 0.94 0.18 -0.03 -1.72 0.00 0.00 179.24 178.46 3kke h MET 79 N 0.60 0.35 -0.31 3.56 1.85 -1.17 -2.27 114.93 117.55 3kke h MET 79 Ca 0.11 -0.02 -0.01 0.00 -0.61 0.00 0.00 59.70 59.17 3kke h MET 79 Cb 0.58 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 32.52 3kke h MET 79 CO 0.03 0.23 0.17 0.35 -0.40 0.00 0.00 176.91 177.29 3kke h PHE 80 N 0.36 0.43 -0.48 1.39 3.57 -0.39 -0.97 116.94 120.84 3kke h PHE 80 Ca 0.10 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.61 3kke h PHE 80 Cb -0.03 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.55 3kke h PHE 80 CO -0.06 0.35 0.32 0.66 -2.23 0.00 0.00 178.31 177.35 3kke h SER 81 N 0.38 0.50 -0.11 0.41 4.64 -1.18 0.40 113.55 118.59 3kke h SER 81 Ca 0.11 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 3kke h SER 81 Cb 0.07 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3kke h SER 81 CO -0.02 0.35 -0.05 1.23 -0.87 0.00 0.00 176.83 177.48 3kke h GLY 82 N 0.58 0.24 0.71 -0.77 0.00 -1.02 -1.14 103.07 101.68 3kke h GLY 82 Ca 0.19 -0.22 0.04 0.00 0.00 0.00 0.00 47.33 47.34 3kke h GLY 82 CO -0.05 0.20 0.14 -2.08 0.00 0.00 0.00 176.54 174.75 3kke h VAL 83 N -0.13 0.91 -0.09 4.60 2.07 -0.27 -2.14 116.25 121.20 3kke h VAL 83 Ca 0.02 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 3kke h VAL 83 Cb 0.50 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 3kke h VAL 83 CO 0.02 0.06 0.01 -0.61 0.02 0.00 0.00 177.57 177.06 3kke h GLN 84 N 0.30 0.16 -0.58 1.57 4.15 -0.19 -0.10 115.11 120.41 3kke h GLN 84 Ca 0.17 -0.05 0.08 0.00 0.77 0.00 0.00 58.65 59.62 3kke h GLN 84 Cb 0.13 -0.02 -0.07 0.00 0.21 0.00 0.00 27.48 27.73 3kke h GLN 84 CO -0.16 0.39 0.23 0.52 -1.93 0.00 0.00 178.83 177.88 3kke h MET 85 N -0.10 0.40 -0.08 1.69 2.86 -1.14 0.14 114.93 118.71 3kke h MET 85 Ca 0.03 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.60 3kke h MET 85 Cb 0.31 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 3kke h MET 85 CO 0.00 0.27 -0.11 0.00 1.06 0.00 0.00 176.91 178.13 3kke h ALA 86 N 1.39 0.12 -0.19 6.32 0.00 -1.16 -2.58 119.26 123.17 3kke h ALA 86 Ca 0.29 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3kke h ALA 86 Cb 0.33 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3kke h ALA 86 CO -0.28 -0.03 0.09 0.00 0.00 0.00 0.00 179.25 179.04 3kke h ALA 87 N 0.54 0.22 -0.11 0.00 0.00 -0.90 -2.42 119.26 116.60 3kke h ALA 87 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3kke h ALA 87 Cb 0.65 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3kke h ALA 87 CO 0.02 -0.33 -0.10 0.77 0.00 0.00 0.00 179.25 179.62 3kke h SER 88 N 0.20 0.15 -0.56 0.00 0.02 -0.73 -0.65 113.55 111.97 3kke h SER 88 Ca 0.08 -0.02 0.13 0.00 -0.84 0.00 0.00 61.79 61.13 3kke h SER 88 Cb 0.01 -0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.49 3kke h SER 88 CO -0.05 0.27 0.39 1.23 -1.14 0.00 0.00 176.83 177.53 3kke h GLY 89 N 0.58 0.32 -2.72 -3.77 0.00 -1.01 -0.03 103.07 96.45 3kke h GLY 89 Ca 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.21 3kke h GLY 89 CO 0.02 0.04 0.06 1.42 0.00 0.00 0.00 176.54 178.08 3kke n HIS 90 N -4.44 1.66 -3.88 5.60 8.25 -0.46 -4.96 115.22 117.00 3kke n HIS 90 Ca 0.10 -0.96 -0.30 0.00 -0.26 0.00 0.00 57.72 56.30 3kke n HIS 90 Cb 0.49 -0.48 0.02 0.00 1.12 0.00 0.00 29.99 31.14 3kke n HIS 90 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3kke n SER 91 N -0.12 -4.60 -4.38 0.41 7.64 -0.03 -4.97 113.62 107.57 3kke n SER 91 Ca 0.29 -0.76 -0.32 0.00 1.01 0.00 0.00 58.87 59.09 3kke n SER 91 Cb 1.12 -3.69 -0.14 0.00 -1.01 0.00 0.00 64.21 60.48 3kke n SER 91 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3kke s THR 92 N -3.25 2.79 0.25 0.44 2.01 -0.38 -4.91 115.64 112.59 3kke s THR 92 Ca 0.65 -0.79 -0.01 0.00 0.31 0.00 0.00 61.69 61.85 3kke s THR 92 Cb -0.33 -2.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.03 3kke s THR 92 CO 0.80 0.56 0.45 -1.81 -0.69 0.00 0.00 174.62 173.93 3kke s ASP 93 N -0.17 6.37 -0.20 3.53 -0.00 -1.26 -3.43 116.67 121.51 3kke s ASP 93 Ca -0.01 0.45 -0.03 0.00 -0.00 0.00 0.00 52.55 52.96 3kke s ASP 93 Cb -0.14 -2.03 -0.01 0.00 -0.00 0.00 0.00 42.92 40.75 3kke s ASP 93 CO 0.03 -0.13 -0.07 -0.69 -0.00 0.00 0.00 175.17 174.31 3kke s VAL 94 N -2.01 3.17 -0.23 -1.27 1.01 -1.26 -0.68 120.40 119.13 3kke s VAL 94 Ca 0.40 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.73 3kke s VAL 94 Cb -0.10 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 3kke s VAL 94 CO 0.31 0.45 0.08 -0.22 0.00 0.00 0.00 175.10 175.72 3kke s LEU 95 N 1.31 3.59 -0.14 3.92 2.96 -0.03 -4.95 118.68 125.35 3kke s LEU 95 Ca 0.04 -0.11 -0.06 0.00 -0.22 0.00 0.00 54.13 53.77 3kke s LEU 95 Cb -0.14 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 3kke s LEU 95 CO -0.04 0.02 0.09 -0.22 -1.32 0.00 0.00 176.35 174.88 3kke s LEU 96 N 1.30 4.02 0.01 -0.68 2.96 -1.26 -0.14 118.68 124.90 3kke s LEU 96 Ca 0.05 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.22 3kke s LEU 96 Cb -0.15 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 3kke s LEU 96 CO 0.04 0.31 -0.02 -0.83 -1.32 0.00 0.00 176.35 174.52 3kke s GLY 97 N -0.43 0.18 -0.08 7.98 0.00 0.15 -4.94 107.32 110.18 3kke s GLY 97 Ca 0.10 -0.43 0.01 0.00 0.00 0.00 0.00 44.72 44.41 3kke s GLY 97 CO 0.02 -0.48 -0.10 1.62 0.00 0.00 0.00 173.10 174.16 3kke s GLN 98 N -1.05 1.53 -0.09 2.90 0.74 -1.26 -0.15 119.66 122.27 3kke s GLN 98 Ca -0.11 -0.32 0.02 0.00 0.05 0.00 0.00 55.36 55.00 3kke s GLN 98 Cb -0.07 -1.39 -0.02 0.00 1.10 0.00 0.00 33.01 32.63 3kke s GLN 98 CO -0.01 -0.09 -0.15 0.42 -0.55 0.00 0.00 175.29 174.92 3kke s ILE 99 N 1.05 2.94 0.72 -2.34 1.09 -0.66 -4.97 121.20 119.04 3kke s ILE 99 Ca -0.07 -0.73 -0.12 0.00 -1.10 0.00 0.00 60.65 58.62 3kke s ILE 99 Cb -0.15 -2.19 0.18 0.00 -1.06 0.00 0.00 42.46 39.24 3kke s ILE 99 CO -0.01 0.56 0.76 0.47 -0.10 0.00 0.00 174.94 176.62 3kke n ASP 100 N 2.98 -1.01 -4.78 3.58 8.00 -1.26 -4.65 116.55 119.41 3kke n ASP 100 Ca -0.18 -1.08 -0.34 0.00 0.71 0.00 0.00 54.79 53.91 3kke n ASP 100 Cb 0.52 -0.65 0.02 0.00 -0.02 0.00 0.00 41.12 41.00 3kke n ASP 100 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kke s ALA 101 N -3.39 2.60 0.41 2.24 0.00 -1.26 -3.95 121.76 118.42 3kke s ALA 101 Ca 0.47 0.65 -0.25 0.00 0.00 0.00 0.00 51.96 52.83 3kke s ALA 101 Cb -0.03 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.68 3kke s ALA 101 CO 0.34 -0.99 1.23 -1.25 0.00 0.00 0.00 175.76 175.09 3kke s PRO 102 N -3.72 3.95 -0.03 0.00 0.05 -1.26 0.12 135.00 134.10 3kke s PRO 102 Ca 0.69 1.98 -0.21 0.00 0.05 0.00 0.00 61.00 63.51 3kke s PRO 102 Cb -0.21 -2.66 -0.28 0.00 0.05 0.00 0.00 34.50 31.39 3kke s PRO 102 CO 0.34 -0.45 0.98 -1.00 0.05 0.00 0.00 177.00 176.92 3kke h PRO 103 N 2.54 0.34 -0.32 0.56 0.13 -2.01 -3.45 132.00 129.80 3kke h PRO 103 Ca -0.49 -0.47 0.06 0.00 -0.87 0.00 0.00 66.00 64.23 3kke h PRO 103 Cb 1.24 0.16 -0.02 0.00 0.13 0.00 0.00 31.00 32.52 3kke h PRO 103 CO 0.62 1.18 0.22 0.00 -0.23 0.00 0.00 178.00 179.79 3kke h ARG 104 N -0.27 0.14 -0.76 0.86 -0.00 -1.90 -1.24 114.38 111.21 3kke h ARG 104 Ca -0.11 -0.01 0.12 0.00 -0.50 0.00 0.00 59.98 59.48 3kke h ARG 104 Cb 1.49 -0.03 -0.09 0.00 0.00 0.00 0.00 29.97 31.34 3kke h ARG 104 CO 0.14 0.09 0.35 0.78 0.00 0.00 0.00 179.97 181.33 3kke h GLY 105 N 0.15 1.16 1.06 0.04 0.00 -0.45 -0.80 103.07 104.23 3kke h GLY 105 Ca 0.14 -0.20 -0.20 0.00 0.00 0.00 0.00 47.33 47.08 3kke h GLY 105 CO -0.02 -0.02 -0.73 0.00 0.00 0.00 0.00 176.54 175.77 3kke h THR 106 N 0.54 1.32 0.27 4.70 1.03 -1.47 -2.70 112.91 116.60 3kke h THR 106 Ca 0.40 -1.98 0.00 0.00 -0.01 0.00 0.00 66.41 64.82 3kke h THR 106 Cb 0.53 2.17 -0.02 0.00 -1.07 0.00 0.00 68.15 69.75 3kke h THR 106 CO -0.34 0.61 -0.29 -0.61 -0.01 0.00 0.00 175.52 174.89 3kke h GLN 107 N 0.33 -0.57 -0.95 0.00 4.15 -1.48 0.15 115.11 116.74 3kke h GLN 107 Ca -0.06 0.04 0.19 0.00 0.77 0.00 0.00 58.65 59.58 3kke h GLN 107 Cb 1.37 0.13 -0.11 0.00 0.21 0.00 0.00 27.48 29.09 3kke h GLN 107 CO 0.15 -0.38 0.54 1.96 -1.93 0.00 0.00 178.83 179.17 3kke h GLN 108 N -0.59 0.66 -0.13 1.69 4.20 -1.20 0.14 115.11 119.88 3kke h GLN 108 Ca -0.01 -0.04 -0.13 0.00 0.06 0.00 0.00 58.65 58.53 3kke h GLN 108 Cb 0.55 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.19 3kke h GLN 108 CO -0.07 0.44 -0.43 1.25 -0.67 0.00 0.00 178.83 179.35 3kke h LEU 109 N 0.68 0.60 -0.44 1.46 5.85 -1.09 0.51 115.31 122.88 3kke h LEU 109 Ca 0.55 -0.61 0.00 0.00 0.84 0.00 0.00 57.88 58.67 3kke h LEU 109 Cb 0.88 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3kke h LEU 109 CO -0.40 1.10 0.28 0.28 -0.34 0.00 0.00 178.44 179.36 3kke h SER 110 N 0.13 0.52 0.24 1.25 0.02 0.16 0.45 113.55 116.33 3kke h SER 110 Ca -0.02 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.88 3kke h SER 110 Cb 1.05 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.46 3kke h SER 110 CO 0.09 0.40 -0.12 0.03 -1.14 0.00 0.00 176.83 176.10 3kke h ARG 111 N 0.59 -0.32 0.00 3.45 -0.00 -0.75 0.48 114.38 117.84 3kke h ARG 111 Ca 0.16 0.02 -0.01 0.00 -0.50 0.00 0.00 59.98 59.66 3kke h ARG 111 Cb -0.03 0.07 -0.00 0.00 0.00 0.00 0.00 29.97 30.01 3kke h ARG 111 CO -0.03 -0.05 -0.03 1.37 0.00 0.00 0.00 179.97 181.22 3kke h LEU 112 N -0.56 0.00 0.01 3.04 -0.00 0.20 0.32 115.31 118.32 3kke h LEU 112 Ca -0.03 0.00 -0.34 0.00 -0.00 0.00 0.00 57.88 57.50 3kke h LEU 112 Cb 0.41 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.02 3kke h LEU 112 CO 0.06 0.03 -1.90 0.52 -0.00 0.00 0.00 178.44 177.15 3kke n VAL 113 N -3.18 1.55 0.29 0.15 0.31 0.16 -4.26 118.33 113.35 3kke n VAL 113 Ca -0.01 -0.25 -0.17 0.00 -0.01 0.00 0.00 64.34 63.91 3kke n VAL 113 Cb 0.26 -1.92 -0.08 0.00 -0.91 0.00 0.00 33.84 31.19 3kke n VAL 113 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3kke h SER 114 N -0.85 -0.92 -0.16 4.52 0.02 -0.79 -3.29 113.55 112.07 3kke h SER 114 Ca -0.51 0.06 0.05 0.00 -0.84 0.00 0.00 61.79 60.56 3kke h SER 114 Cb 1.52 0.29 -0.06 0.00 0.14 0.00 0.00 62.40 64.29 3kke h SER 114 CO -0.26 -0.53 -0.23 -0.33 -1.14 0.00 0.00 176.83 174.33 3kke h GLU 115 N -0.83 -0.26 -5.16 3.45 5.08 -1.11 -3.48 114.58 112.27 3kke h GLU 115 Ca -0.05 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3kke h GLU 115 Cb 0.70 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.97 3kke h GLU 115 CO 0.02 -0.18 -1.17 0.41 -1.00 0.00 0.00 179.01 177.09 3kke n GLY 116 N -1.36 -4.41 2.05 -3.84 0.00 -1.24 -4.92 105.19 91.47 3kke n GLY 116 Ca -0.02 0.87 -0.22 0.00 0.00 0.00 0.00 46.02 46.65 3kke n GLY 116 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3kke n ARG 117 N 1.07 2.10 -4.04 1.61 1.85 -1.26 -4.93 116.66 113.07 3kke n ARG 117 Ca -0.13 -2.55 -0.13 0.00 -1.00 0.00 0.00 57.85 54.04 3kke n ARG 117 Cb 0.22 -2.00 -0.13 0.00 -1.05 0.00 0.00 32.46 29.50 3kke n ARG 117 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 3kke s VAL 118 N -2.97 0.32 0.12 8.89 -7.23 -1.26 -4.92 120.40 113.35 3kke s VAL 118 Ca 0.49 -0.54 0.10 0.00 -1.81 0.00 0.00 61.98 60.22 3kke s VAL 118 Cb 0.40 -0.34 -0.09 0.00 0.56 0.00 0.00 36.38 36.92 3kke s VAL 118 CO 0.07 -0.15 1.43 0.44 -0.31 0.00 0.00 175.10 176.59 3kke h ASP 119 N 5.39 0.00 -5.34 4.85 3.32 -1.64 -3.48 116.42 119.51 3kke h ASP 119 Ca -0.30 0.00 0.18 0.00 0.02 0.00 0.00 57.03 56.93 3kke h ASP 119 Cb 1.20 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.67 3kke h ASP 119 CO 0.46 0.76 0.50 -0.83 -1.72 0.00 0.00 179.24 178.41 3kke s GLY 120 N -4.57 -0.21 -0.06 2.75 0.00 -1.25 -4.72 107.32 99.25 3kke s GLY 120 Ca 0.01 0.10 0.02 0.00 0.00 0.00 0.00 44.72 44.86 3kke s GLY 120 CO 0.78 0.11 -0.12 0.14 0.00 0.00 0.00 173.10 174.01 3kke s VAL 121 N -3.20 1.10 -0.30 1.40 1.01 -0.63 -0.64 120.40 119.14 3kke s VAL 121 Ca 0.13 -0.47 -0.14 0.00 0.00 0.00 0.00 61.98 61.50 3kke s VAL 121 Cb -0.01 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 3kke s VAL 121 CO 0.02 0.34 0.31 -0.76 0.00 0.00 0.00 175.10 175.02 3kke s LEU 122 N 0.60 4.18 -0.21 3.92 1.43 0.13 -1.38 118.68 127.35 3kke s LEU 122 Ca -0.13 0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 52.97 3kke s LEU 122 Cb -0.15 -2.30 0.02 0.00 0.03 0.00 0.00 46.19 43.79 3kke s LEU 122 CO 0.03 -0.20 -0.12 -0.22 0.23 0.00 0.00 176.35 176.08 3kke s LEU 123 N 1.95 2.69 -0.25 1.79 2.96 -0.40 -0.39 118.68 127.04 3kke s LEU 123 Ca 0.11 -0.69 -0.19 0.00 -0.22 0.00 0.00 54.13 53.14 3kke s LEU 123 Cb -0.16 -1.60 -0.02 0.00 0.50 0.00 0.00 46.19 44.91 3kke s LEU 123 CO 0.11 -0.05 0.59 -1.58 -1.32 0.00 0.00 176.35 174.09 3kke s GLN 124 N 1.34 4.10 0.32 1.98 0.74 -0.63 -0.70 119.66 126.80 3kke s GLN 124 Ca 0.03 0.47 -0.27 0.00 0.05 0.00 0.00 55.36 55.63 3kke s GLN 124 Cb -0.15 -3.64 -0.09 0.00 1.10 0.00 0.00 33.01 30.22 3kke s GLN 124 CO -0.08 -0.38 1.04 -0.98 -0.55 0.00 0.00 175.29 174.35 3kke s ARG 125 N 2.39 4.52 0.50 1.67 1.70 -1.26 -4.11 118.95 124.36 3kke s ARG 125 Ca 0.24 1.61 -0.20 0.00 -0.47 0.00 0.00 55.73 56.91 3kke s ARG 125 Cb -0.16 -2.96 -0.07 0.00 -0.57 0.00 0.00 34.95 31.20 3kke s ARG 125 CO 0.09 0.16 1.10 1.03 -1.08 0.00 0.00 175.30 176.60 3kke s ARG 126 N -1.80 3.61 0.39 3.89 0.52 -1.26 -4.85 118.95 119.44 3kke s ARG 126 Ca 0.49 1.55 0.28 0.00 -0.52 0.00 0.00 55.73 57.53 3kke s ARG 126 Cb -0.26 -2.13 1.23 0.00 0.52 0.00 0.00 34.95 34.31 3kke s ARG 126 CO 0.33 -0.63 1.84 1.05 0.02 0.00 0.00 175.30 177.92 3kke h GLU 127 N 1.52 0.00 -0.58 3.54 4.11 -1.99 -2.26 114.58 118.91 3kke h GLU 127 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 3kke h GLU 127 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3kke h GLU 127 CO 0.58 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.26 3kke n ASP 128 N -2.57 3.71 -4.53 3.06 5.68 -1.26 -4.46 116.55 116.18 3kke n ASP 128 Ca 0.01 -2.08 -0.41 0.00 -0.50 0.00 0.00 54.79 51.81 3kke n ASP 128 Cb 0.22 -0.42 -0.10 0.00 -1.14 0.00 0.00 41.12 39.69 3kke n ASP 128 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 3kke s PHE 129 N -1.15 3.22 0.75 2.11 0.40 -0.85 -4.81 117.98 117.65 3kke s PHE 129 Ca 0.41 -0.18 -0.12 0.00 -0.60 0.00 0.00 56.93 56.44 3kke s PHE 129 Cb 0.22 -2.58 0.04 0.00 0.51 0.00 0.00 43.02 41.21 3kke s PHE 129 CO 0.26 -0.42 1.11 0.16 0.70 0.00 0.00 175.22 177.02 3kke s ASP 130 N 1.73 5.02 0.44 1.36 1.47 -1.26 -4.84 116.67 120.59 3kke s ASP 130 Ca 0.08 1.15 0.22 0.00 1.18 0.00 0.00 52.55 55.18 3kke s ASP 130 Cb -0.17 -1.90 1.19 0.00 -0.34 0.00 0.00 42.92 41.71 3kke s ASP 130 CO 0.11 -1.61 1.83 0.44 0.68 0.00 0.00 175.17 176.62 3kke h ASP 131 N -0.85 0.32 0.10 2.11 3.32 -1.98 -1.60 116.42 117.84 3kke h ASP 131 Ca -0.46 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.63 3kke h ASP 131 Cb 1.27 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3kke h ASP 131 CO 0.63 0.10 -0.05 -0.78 -1.72 0.00 0.00 179.24 177.42 3kke h ASP 132 N 0.30 -0.11 0.10 6.45 3.58 -1.98 -1.41 116.42 123.36 3kke h ASP 132 Ca 0.51 -0.19 -0.02 0.00 0.42 0.00 0.00 57.03 57.75 3kke h ASP 132 Cb 1.45 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 42.53 3kke h ASP 132 CO -0.17 0.13 -0.09 0.24 -2.88 0.00 0.00 179.24 176.47 3kke h MET 133 N -0.36 0.00 0.09 0.28 2.86 -1.66 -2.97 114.93 113.17 3kke h MET 133 Ca -0.01 0.00 -0.22 0.00 -2.06 0.00 0.00 59.70 57.41 3kke h MET 133 Cb 0.30 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.96 3kke h MET 133 CO 0.02 0.09 -1.09 -0.07 1.06 0.00 0.00 176.91 176.92 3kke h LEU 134 N 0.00 0.30 -0.86 1.22 3.38 -1.44 -3.32 115.31 114.59 3kke h LEU 134 Ca -0.00 -0.85 0.12 0.00 0.09 0.00 0.00 57.88 57.24 3kke h LEU 134 Cb 0.17 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.74 3kke h LEU 134 CO 0.01 1.48 0.48 0.00 0.09 0.00 0.00 178.44 180.50 3kke h ALA 135 N -0.08 1.26 -0.22 1.53 0.00 -1.18 -0.38 119.26 120.20 3kke h ALA 135 Ca -0.24 0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 3kke h ALA 135 Cb 1.58 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.26 3kke h ALA 135 CO 0.03 0.05 -0.20 0.00 0.00 0.00 0.00 179.25 179.14 3kke h ALA 136 N 1.50 0.32 -0.82 0.00 0.00 -1.70 -2.09 119.26 116.46 3kke h ALA 136 Ca 0.43 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3kke h ALA 136 Cb 0.48 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 3kke h ALA 136 CO -0.29 0.25 0.38 0.28 0.00 0.00 0.00 179.25 179.87 3kke h VAL 137 N 0.20 1.26 -0.00 0.00 2.07 -1.59 -3.04 116.25 115.14 3kke h VAL 137 Ca 0.04 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.81 3kke h VAL 137 Cb 0.74 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 3kke h VAL 137 CO 0.05 0.31 -0.11 0.18 0.02 0.00 0.00 177.57 178.02 3kke n LEU 138 N -4.30 0.19 -4.66 2.57 4.77 -0.17 -4.78 117.00 110.62 3kke n LEU 138 Ca 0.08 0.26 -0.51 0.00 -0.03 0.00 0.00 56.01 55.81 3kke n LEU 138 Cb 0.15 -0.35 -0.06 0.00 -2.33 0.00 0.00 43.42 40.84 3kke n LEU 138 CO 0.40 0.04 1.19 -0.62 -1.33 0.00 0.00 177.39 177.08 3kke n GLU 139 N -1.34 1.58 -1.13 3.23 -0.58 -0.79 -2.04 120.64 119.57 3kke n GLU 139 Ca 0.10 0.58 -0.05 0.00 -0.42 0.00 0.00 57.16 57.37 3kke n GLU 139 Cb 0.31 -2.30 -0.02 0.00 -0.57 0.00 0.00 31.44 28.86 3kke n GLU 139 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3kke n GLY 140 N 3.53 0.64 3.26 0.62 0.00 -1.26 -5.00 105.19 106.97 3kke n GLY 140 Ca 0.21 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 3kke n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kke s VAL 141 N -1.83 2.50 -0.22 1.61 1.01 -0.87 -5.07 120.40 117.54 3kke s VAL 141 Ca 0.00 -0.84 -0.28 0.00 0.00 0.00 0.00 61.98 60.86 3kke s VAL 141 Cb 0.00 -2.03 -0.05 0.00 0.00 0.00 0.00 36.38 34.30 3kke s VAL 141 CO 0.00 0.53 2.21 -2.16 0.00 0.00 0.00 175.10 175.68 3kke s PRO 142 N 0.65 3.14 -0.11 2.72 0.04 -1.26 -4.91 135.00 135.26 3kke s PRO 142 Ca -0.09 2.03 -0.10 0.00 0.04 0.00 0.00 61.00 62.88 3kke s PRO 142 Cb -0.16 -4.37 0.03 0.00 0.04 0.00 0.00 34.50 30.04 3kke s PRO 142 CO 0.02 -2.10 0.30 0.00 0.04 0.00 0.00 177.00 175.27 3kke s ALA 143 N 8.26 -0.74 -0.15 8.56 0.00 -1.26 -1.60 121.76 134.84 3kke s ALA 143 Ca 1.00 0.90 0.02 0.00 0.00 0.00 0.00 51.96 53.88 3kke s ALA 143 Cb -0.33 -0.53 0.02 0.00 0.00 0.00 0.00 23.12 22.27 3kke s ALA 143 CO 0.35 -0.16 -0.19 0.08 0.00 0.00 0.00 175.76 175.85 3kke s VAL 144 N 0.37 1.86 0.24 0.00 1.01 -0.48 -4.69 120.40 118.71 3kke s VAL 144 Ca -0.02 -0.84 -0.26 0.00 0.00 0.00 0.00 61.98 60.86 3kke s VAL 144 Cb -0.03 -1.68 -0.09 0.00 0.00 0.00 0.00 36.38 34.58 3kke s VAL 144 CO -0.02 0.51 0.87 0.42 0.00 0.00 0.00 175.10 176.88 3kke s THR 145 N 1.11 4.25 -0.06 3.92 -4.23 -0.33 -1.27 115.64 119.03 3kke s THR 145 Ca -0.01 1.82 0.05 0.00 -1.18 0.00 0.00 61.69 62.36 3kke s THR 145 Cb -0.14 -4.14 -0.00 0.00 1.34 0.00 0.00 72.50 69.56 3kke s THR 145 CO -0.07 0.38 -0.21 0.27 -0.54 0.00 0.00 174.62 174.45 3kke s ILE 146 N -1.32 1.77 -1.91 2.99 -4.36 0.12 -0.64 121.20 117.85 3kke s ILE 146 Ca 0.42 -0.89 0.00 0.00 -0.26 0.00 0.00 60.65 59.92 3kke s ILE 146 Cb -0.22 -1.52 0.00 0.00 1.25 0.00 0.00 42.46 41.97 3kke s ILE 146 CO 0.27 0.50 0.00 -3.20 0.24 0.00 0.00 174.94 172.75 3kke n ASN 147 N 3.20 -5.55 -3.59 4.36 5.15 0.21 -4.35 115.26 114.68 3kke n ASN 147 Ca -0.18 0.24 -0.08 0.00 -0.60 0.00 0.00 54.58 53.95 3kke n ASN 147 Cb 0.52 -4.69 -0.05 0.00 -0.53 0.00 0.00 39.78 35.04 3kke n ASN 147 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 3kke s SER 148 N -2.44 -0.27 -0.04 1.20 0.15 -1.26 -4.70 113.70 106.34 3kke s SER 148 Ca 0.00 0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.92 3kke s SER 148 Cb 0.00 0.22 0.03 0.00 -1.71 0.00 0.00 66.02 64.56 3kke s SER 148 CO 0.00 -0.26 -0.01 -0.60 1.20 0.00 0.00 173.24 173.57 3kke s ARG 149 N -1.20 0.50 -0.16 5.44 3.52 -1.26 -4.39 118.95 121.40 3kke s ARG 149 Ca 0.02 0.04 -0.14 0.00 -0.13 0.00 0.00 55.73 55.52 3kke s ARG 149 Cb -0.01 -0.69 -0.05 0.00 -1.56 0.00 0.00 34.95 32.65 3kke s ARG 149 CO -0.02 -0.16 0.32 0.08 -0.81 0.00 0.00 175.30 174.71 3kke s VAL 150 N 1.24 5.28 0.42 7.11 1.01 -1.26 -4.92 120.40 129.28 3kke s VAL 150 Ca -0.06 0.60 -0.25 0.00 0.00 0.00 0.00 61.98 62.27 3kke s VAL 150 Cb -0.13 -3.66 -0.10 0.00 0.00 0.00 0.00 36.38 32.48 3kke s VAL 150 CO -0.02 0.36 1.18 -2.65 0.00 0.00 0.00 175.10 173.98 3kke n PRO 151 N 3.71 1.72 -0.91 2.72 -0.02 -1.26 -3.33 135.00 137.62 3kke n PRO 151 Ca -0.11 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 3kke n PRO 151 Cb 0.52 -2.26 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 3kke n PRO 151 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kke n GLY 152 N 0.94 0.53 3.25 -1.23 0.00 -1.26 -4.99 105.19 102.43 3kke n GLY 152 Ca 0.08 -0.11 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 3kke n GLY 152 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3kke s ARG 153 N -0.27 1.09 -0.01 1.61 1.70 -1.21 -5.16 118.95 116.70 3kke s ARG 153 Ca 0.00 -1.37 0.07 0.00 -0.47 0.00 0.00 55.73 53.97 3kke s ARG 153 Cb 0.00 0.31 -0.02 0.00 -0.57 0.00 0.00 34.95 34.66 3kke s ARG 153 CO 0.00 -0.36 -0.23 0.54 -1.08 0.00 0.00 175.30 174.17 3kke s VAL 154 N -4.04 2.32 0.00 4.99 0.11 -1.26 -4.82 120.40 117.70 3kke s VAL 154 Ca 0.24 -1.11 0.00 0.00 -2.93 0.00 0.00 61.98 58.18 3kke s VAL 154 Cb 0.05 -1.86 0.00 0.00 -1.53 0.00 0.00 36.38 33.04 3kke s VAL 154 CO 0.03 0.51 0.00 0.61 -3.33 0.00 0.00 175.10 172.93 3kke n GLY 155 N 2.19 0.79 3.46 6.54 0.00 -0.93 -4.82 105.19 112.42 3kke n GLY 155 Ca -0.16 -0.49 -0.17 0.00 0.00 0.00 0.00 46.02 45.20 3kke n GLY 155 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kke s SER 156 N 0.00 -0.57 -0.07 1.61 1.04 -0.32 -1.19 113.70 114.21 3kke s SER 156 Ca 0.00 0.58 0.00 0.00 0.48 0.00 0.00 55.95 57.02 3kke s SER 156 Cb 0.00 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.64 3kke s SER 156 CO 0.00 -0.58 -0.05 -0.69 0.98 0.00 0.00 173.24 172.90 3kke s VAL 157 N -1.26 0.66 0.30 5.02 1.01 0.19 -1.66 120.40 124.65 3kke s VAL 157 Ca -0.11 -0.13 0.07 0.00 0.00 0.00 0.00 61.98 61.81 3kke s VAL 157 Cb -0.01 -0.70 -0.06 0.00 0.00 0.00 0.00 36.38 35.61 3kke s VAL 157 CO 0.09 0.28 -0.06 0.27 0.00 0.00 0.00 175.10 175.67 3kke s ILE 158 N 1.32 1.76 0.60 2.22 -4.36 -0.85 -0.62 121.20 121.27 3kke s ILE 158 Ca -0.04 -2.13 -0.05 0.00 -0.26 0.00 0.00 60.65 58.16 3kke s ILE 158 Cb -0.14 -2.52 0.02 0.00 1.25 0.00 0.00 42.46 41.07 3kke s ILE 158 CO -0.02 -0.26 0.90 -0.76 0.24 0.00 0.00 174.94 175.04 3kke s LEU 159 N -3.49 3.20 -1.37 0.37 1.43 -1.26 -1.05 118.68 116.51 3kke s LEU 159 Ca 0.31 0.63 -0.15 0.00 -1.03 0.00 0.00 54.13 53.89 3kke s LEU 159 Cb 0.04 -3.44 0.02 0.00 0.03 0.00 0.00 46.19 42.84 3kke s LEU 159 CO 0.13 -1.12 2.17 -0.67 0.23 0.00 0.00 176.35 177.08 3kke n ASP 160 N -2.60 3.76 -0.17 2.29 -0.08 -1.23 -4.77 116.55 113.75 3kke n ASP 160 Ca 0.05 -2.82 -0.04 0.00 -1.51 0.00 0.00 54.79 50.47 3kke n ASP 160 Cb 0.58 -1.60 0.15 0.00 2.34 0.00 0.00 41.12 42.59 3kke n ASP 160 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 3kke h ASP 161 N 6.34 0.86 -0.15 1.67 3.45 -1.93 -1.10 116.42 125.55 3kke h ASP 161 Ca 0.54 -0.16 -0.03 0.00 0.43 0.00 0.00 57.03 57.81 3kke h ASP 161 Cb 0.66 -0.22 -0.00 0.00 -0.56 0.00 0.00 39.33 39.20 3kke h ASP 161 CO 1.87 0.83 -0.03 1.56 -1.57 0.00 0.00 179.24 181.91 3kke h GLN 162 N 0.88 0.28 -0.23 3.56 7.50 -1.86 -0.50 115.11 124.74 3kke h GLN 162 Ca 0.19 -0.10 -0.05 0.00 0.50 0.00 0.00 58.65 59.19 3kke h GLN 162 Cb 0.32 -0.02 -0.01 0.00 0.05 0.00 0.00 27.48 27.81 3kke h GLN 162 CO -0.00 0.55 -0.06 -0.22 -1.50 0.00 0.00 178.83 177.60 3kke h LYS 163 N -0.01 0.35 -0.05 1.46 3.64 -1.84 0.74 116.57 120.87 3kke h LYS 163 Ca 0.04 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3kke h LYS 163 Cb 0.44 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 3kke h LYS 163 CO 0.01 0.43 0.02 0.78 -2.27 0.00 0.00 179.45 178.42 3kke h GLY 164 N 0.74 0.07 1.32 5.01 0.00 -0.74 0.15 103.07 109.63 3kke h GLY 164 Ca 0.07 -0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.40 3kke h GLY 164 CO 0.01 0.04 0.38 -1.33 0.00 0.00 0.00 176.54 175.64 3kke h GLY 165 N -0.07 0.76 0.86 4.60 0.00 -0.88 -2.08 103.07 106.26 3kke h GLY 165 Ca 0.02 -0.26 -0.10 0.00 0.00 0.00 0.00 47.33 46.99 3kke h GLY 165 CO -0.00 0.23 -0.25 -1.33 0.00 0.00 0.00 176.54 175.19 3kke h GLY 166 N 0.67 0.58 0.97 4.60 0.00 -0.47 -1.68 103.07 107.74 3kke h GLY 166 Ca 0.23 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 3kke h GLY 166 CO -0.06 0.56 0.10 -2.22 0.00 0.00 0.00 176.54 174.92 3kke h ILE 167 N 0.21 1.24 0.15 2.60 2.04 -0.84 0.23 117.51 123.14 3kke h ILE 167 Ca 0.03 -0.86 0.01 0.00 1.00 0.00 0.00 64.86 65.03 3kke h ILE 167 Cb 0.81 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 3kke h ILE 167 CO 0.06 0.31 -0.18 0.00 0.00 0.00 0.00 178.15 178.34 3kke h ALA 168 N 0.98 -0.34 -0.05 1.87 0.00 -1.30 -2.16 119.26 118.26 3kke h ALA 168 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3kke h ALA 168 Cb 0.35 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3kke h ALA 168 CO 0.00 -0.72 0.03 1.15 0.00 0.00 0.00 179.25 179.72 3kke h THR 169 N -0.38 1.01 -0.95 0.00 2.02 -1.12 -2.89 112.91 110.60 3kke h THR 169 Ca 0.01 -0.02 0.11 0.00 0.77 0.00 0.00 66.41 67.28 3kke h THR 169 Cb 0.37 0.94 -0.07 0.00 -1.74 0.00 0.00 68.15 67.65 3kke h THR 169 CO -0.07 0.01 0.61 -0.08 0.37 0.00 0.00 175.52 176.36 3kke h GLU 170 N 0.07 0.90 -0.67 6.66 4.57 -0.46 -1.32 114.58 124.34 3kke h GLU 170 Ca 0.02 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.12 3kke h GLU 170 Cb -0.01 -0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 28.35 3kke h GLU 170 CO -0.00 0.60 0.32 1.25 -1.18 0.00 0.00 179.01 179.99 3kke h HIS 171 N 0.93 0.96 -0.17 0.92 2.76 -1.19 -1.43 115.15 117.94 3kke h HIS 171 Ca 0.46 -0.05 -0.10 0.00 -2.20 0.00 0.00 60.37 58.48 3kke h HIS 171 Cb 0.47 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.12 3kke h HIS 171 CO -0.00 0.72 -0.32 -0.07 -1.30 0.00 0.00 177.93 176.96 3kke h LEU 172 N 0.92 0.35 -0.55 0.26 3.38 -1.17 -2.79 115.31 115.72 3kke h LEU 172 Ca 0.23 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 3kke h LEU 172 Cb 0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 3kke h LEU 172 CO -0.03 0.66 -0.46 0.40 0.09 0.00 0.00 178.44 179.09 3kke h ILE 173 N 0.30 1.30 0.00 1.22 2.04 -0.94 -1.76 117.51 119.67 3kke h ILE 173 Ca 0.04 -1.66 -0.07 0.00 1.00 0.00 0.00 64.86 64.17 3kke h ILE 173 Cb 0.71 1.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 3kke h ILE 173 CO 0.05 0.53 -0.34 0.74 0.00 0.00 0.00 178.15 179.13 3kke h THR 174 N 0.51 1.02 0.00 -0.27 2.02 -1.14 -2.37 112.91 112.67 3kke h THR 174 Ca 0.03 -1.28 0.00 0.00 0.77 0.00 0.00 66.41 65.93 3kke h THR 174 Cb 1.00 1.74 0.00 0.00 -1.74 0.00 0.00 68.15 69.15 3kke h THR 174 CO 0.09 0.34 0.00 0.18 0.37 0.00 0.00 175.52 176.50 3kke n LEU 175 N -3.80 0.00 0.00 2.58 4.77 -1.06 -4.92 117.00 114.57 3kke n LEU 175 Ca -0.01 0.46 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 3kke n LEU 175 Cb 0.42 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3kke n LEU 175 CO 0.37 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3kke n GLY 176 N 1.21 1.20 3.77 -0.72 0.00 -0.89 -3.82 105.19 105.93 3kke n GLY 176 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 3kke n GLY 176 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3kke s HIS 177 N -2.00 3.90 -0.08 1.61 3.76 -0.67 -4.75 115.29 117.06 3kke s HIS 177 Ca 0.00 1.67 0.05 0.00 -0.15 0.00 0.00 55.06 56.63 3kke s HIS 177 Cb 0.00 -2.82 -0.08 0.00 1.11 0.00 0.00 32.58 30.79 3kke s HIS 177 CO 0.00 0.47 -0.01 0.43 -0.85 0.00 0.00 174.74 174.78 3kke n SER 178 N 1.75 3.17 -4.14 1.40 7.64 -1.26 -4.42 113.62 117.76 3kke n SER 178 Ca -0.04 -0.02 -0.35 0.00 1.01 0.00 0.00 58.87 59.47 3kke n SER 178 Cb 0.49 0.44 -0.13 0.00 -1.01 0.00 0.00 64.21 64.00 3kke n SER 178 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3kke s ARG 179 N -2.19 2.17 -0.09 1.43 0.52 -1.26 -4.66 118.95 114.88 3kke s ARG 179 Ca -0.06 -1.57 0.01 0.00 -0.52 0.00 0.00 55.73 53.59 3kke s ARG 179 Cb 0.03 -3.39 0.02 0.00 0.52 0.00 0.00 34.95 32.12 3kke s ARG 179 CO 0.28 -0.86 -0.11 0.42 0.02 0.00 0.00 175.30 175.05 3kke s ILE 180 N 1.19 1.16 0.48 1.52 1.01 -1.26 -0.93 121.20 124.36 3kke s ILE 180 Ca 0.03 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.26 3kke s ILE 180 Cb -0.21 -1.10 0.01 0.00 0.01 0.00 0.00 42.46 41.17 3kke s ILE 180 CO -0.03 0.37 0.69 0.00 0.00 0.00 0.00 174.94 175.97 3kke s ALA 181 N 1.11 3.91 -0.04 9.38 0.00 0.17 -4.92 121.76 131.37 3kke s ALA 181 Ca -0.06 -1.24 -0.02 0.00 0.00 0.00 0.00 51.96 50.64 3kke s ALA 181 Cb -0.14 -2.04 0.03 0.00 0.00 0.00 0.00 23.12 20.97 3kke s ALA 181 CO -0.02 -0.49 0.05 0.12 0.00 0.00 0.00 175.76 175.42 3kke s PHE 182 N -2.59 0.11 -0.41 0.00 2.19 0.48 -1.43 117.98 116.32 3kke s PHE 182 Ca 0.52 0.20 -0.13 0.00 0.33 0.00 0.00 56.93 57.85 3kke s PHE 182 Cb -0.10 -0.48 0.04 0.00 -1.31 0.00 0.00 43.02 41.17 3kke s PHE 182 CO 0.37 -0.19 0.28 0.42 1.83 0.00 0.00 175.22 177.94 3kke s ILE 183 N 2.00 4.90 0.75 3.12 1.01 -0.20 -1.17 121.20 131.62 3kke s ILE 183 Ca 0.03 -0.90 -0.03 0.00 0.00 0.00 0.00 60.65 59.75 3kke s ILE 183 Cb -0.12 -3.81 0.14 0.00 0.01 0.00 0.00 42.46 38.68 3kke s ILE 183 CO -0.03 -0.36 1.04 -0.55 0.00 0.00 0.00 174.94 175.03 3kke s SER 184 N 1.87 4.17 0.00 3.58 0.15 0.21 -0.71 113.70 122.97 3kke s SER 184 Ca 0.03 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.40 3kke s SER 184 Cb -0.21 -0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.06 3kke s SER 184 CO 0.07 -1.99 0.00 0.61 1.20 0.00 0.00 173.24 173.14 3kke n GLY 185 N -2.96 -1.01 3.80 9.45 0.00 -1.26 -2.00 105.19 111.21 3kke n GLY 185 Ca 0.15 -1.52 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 3kke n GLY 185 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3kke s THR 186 N 0.00 3.73 0.45 2.61 -4.23 -1.26 -1.86 115.64 115.07 3kke s THR 186 Ca 0.00 0.56 0.14 0.00 -1.18 0.00 0.00 61.69 61.21 3kke s THR 186 Cb 0.00 -3.20 0.18 0.00 1.34 0.00 0.00 72.50 70.82 3kke s THR 186 CO 0.00 -0.73 1.99 0.00 -0.54 0.00 0.00 174.62 175.34 3kke h ALA 187 N -0.89 1.70 -0.23 3.99 0.00 -1.90 -2.88 119.26 119.04 3kke h ALA 187 Ca -0.44 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.21 3kke h ALA 187 Cb 1.22 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3kke h ALA 187 CO 0.55 0.23 -0.29 0.82 0.00 0.00 0.00 179.25 180.56 3kke h ILE 188 N 0.01 1.27 -3.40 0.00 2.04 -1.92 -3.44 117.51 112.07 3kke h ILE 188 Ca -0.00 -1.32 -0.57 0.00 1.00 0.00 0.00 64.86 63.96 3kke h ILE 188 Cb 0.32 1.41 -0.07 0.00 -0.74 0.00 0.00 36.82 37.74 3kke h ILE 188 CO 0.02 0.42 0.81 -2.28 0.00 0.00 0.00 178.15 177.12 3kke s HIS 189 N -4.43 3.09 0.48 1.37 2.46 -1.09 -4.86 115.29 112.31 3kke s HIS 189 Ca -0.07 1.06 0.16 0.00 0.47 0.00 0.00 55.06 56.68 3kke s HIS 189 Cb 0.14 -3.78 1.15 0.00 -0.13 0.00 0.00 32.58 29.96 3kke s HIS 189 CO 0.79 -0.84 2.07 0.38 -2.47 0.00 0.00 174.74 174.67 3kke h ASP 190 N 8.31 0.00 -0.51 9.88 2.03 -1.87 -1.84 116.42 132.42 3kke h ASP 190 Ca -0.21 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 55.99 3kke h ASP 190 Cb 1.06 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.55 3kke h ASP 190 CO 1.04 0.10 -0.06 0.74 -1.03 0.00 0.00 179.24 180.03 3kke h THR 191 N 0.00 1.27 -0.91 1.15 2.02 -1.91 -1.78 112.91 112.75 3kke h THR 191 Ca -0.00 -1.18 -0.00 0.00 0.77 0.00 0.00 66.41 66.00 3kke h THR 191 Cb 0.18 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 3kke h THR 191 CO 0.01 0.41 0.55 0.00 0.37 0.00 0.00 175.52 176.87 3kke h ALA 192 N 0.92 1.15 -0.18 6.16 0.00 -1.64 -2.26 119.26 123.41 3kke h ALA 192 Ca 0.14 -0.09 -0.19 0.00 0.00 0.00 0.00 54.91 54.76 3kke h ALA 192 Cb 0.60 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3kke h ALA 192 CO 0.04 0.60 -0.66 1.96 0.00 0.00 0.00 179.25 181.19 3kke h GLN 193 N 1.24 0.69 -0.58 0.00 1.08 -1.31 -0.77 115.11 115.47 3kke h GLN 193 Ca 0.33 -0.50 0.00 0.00 -1.45 0.00 0.00 58.65 57.03 3kke h GLN 193 Cb -0.07 0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.42 3kke h GLN 193 CO -0.06 1.12 0.37 0.00 -0.95 0.00 0.00 178.83 179.30 3kke h ARG 194 N 0.50 0.77 -0.75 1.46 3.08 -1.20 0.14 114.38 118.38 3kke h ARG 194 Ca -0.02 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 3kke h ARG 194 Cb 1.25 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 3kke h ARG 194 CO 0.13 0.53 0.24 0.00 -1.07 0.00 0.00 179.97 179.80 3kke h ARG 195 N 0.78 1.16 -0.85 0.04 3.08 -1.11 -2.08 114.38 115.41 3kke h ARG 195 Ca 0.21 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 3kke h ARG 195 Cb -0.06 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.78 3kke h ARG 195 CO -0.04 0.98 0.50 -0.22 -1.07 0.00 0.00 179.97 180.12 3kke h LYS 196 N 1.11 1.15 -0.61 0.04 3.64 -0.65 -2.45 116.57 118.80 3kke h LYS 196 Ca 0.24 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.49 3kke h LYS 196 Cb 0.30 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 3kke h LYS 196 CO -0.01 0.81 0.26 0.93 -2.27 0.00 0.00 179.45 179.17 3kke h GLU 197 N 1.17 0.90 -0.44 1.90 5.08 -0.56 -0.06 114.58 122.56 3kke h GLU 197 Ca 0.30 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.52 3kke h GLU 197 Cb -0.04 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.03 3kke h GLU 197 CO -0.06 0.75 0.28 0.78 -1.00 0.00 0.00 179.01 179.76 3kke h GLY 198 N 0.84 0.62 0.90 -3.84 0.00 -1.09 0.88 103.07 101.38 3kke h GLY 198 Ca 0.21 -0.21 0.02 0.00 0.00 0.00 0.00 47.33 47.34 3kke h GLY 198 CO -0.02 0.20 0.20 -1.82 0.00 0.00 0.00 176.54 175.10 3kke h TYR 199 N 0.56 0.38 -0.60 5.60 5.03 -1.31 -1.43 116.97 125.20 3kke h TYR 199 Ca 0.17 0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.43 3kke h TYR 199 Cb -0.02 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.11 3kke h TYR 199 CO -0.06 0.22 0.12 -0.07 -1.32 0.00 0.00 178.16 177.05 3kke h LEU 200 N 0.41 0.94 -0.15 2.82 3.38 -0.46 -1.62 115.31 120.63 3kke h LEU 200 Ca 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3kke h LEU 200 Cb 0.02 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 3kke h LEU 200 CO -0.07 0.94 0.02 -0.33 0.09 0.00 0.00 178.44 179.09 3kke h GLU 201 N 0.89 0.25 -0.82 1.13 5.08 -0.80 -1.95 114.58 118.35 3kke h GLU 201 Ca 0.19 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3kke h GLU 201 Cb 0.39 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.57 3kke h GLU 201 CO 0.01 0.43 0.54 1.15 -1.00 0.00 0.00 179.01 180.14 3kke h THR 202 N 0.02 1.20 -0.37 1.13 2.02 -1.13 0.06 112.91 115.84 3kke h THR 202 Ca 0.04 -0.38 -0.02 0.00 0.77 0.00 0.00 66.41 66.82 3kke h THR 202 Cb 0.31 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 66.71 3kke h THR 202 CO 0.00 0.20 0.13 -0.07 0.37 0.00 0.00 175.52 176.16 3kke h LEU 203 N 1.10 0.52 -0.35 2.58 3.38 -1.21 -2.57 115.31 118.77 3kke h LEU 203 Ca 0.30 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 3kke h LEU 203 Cb -0.12 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 3kke h LEU 203 CO -0.07 0.56 0.16 0.00 0.09 0.00 0.00 178.44 179.18 3kke h ALA 204 N 0.98 0.45 -0.11 1.53 0.00 -0.75 0.11 119.26 121.47 3kke h ALA 204 Ca 0.12 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3kke h ALA 204 Cb 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3kke h ALA 204 CO -0.01 0.03 -0.14 0.77 0.00 0.00 0.00 179.25 179.90 3kke h SER 205 N 0.42 0.16 0.00 0.00 0.02 -1.00 -0.37 113.55 112.79 3kke h SER 205 Ca 0.12 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3kke h SER 205 Cb 0.15 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.65 3kke h SER 205 CO -0.01 0.32 0.00 0.00 -1.14 0.00 0.00 176.83 176.00 3kke n ALA 206 N -2.49 2.47 -1.20 3.77 0.00 -0.84 -4.89 120.51 117.33 3kke n ALA 206 Ca -0.01 -0.12 -0.07 0.00 0.00 0.00 0.00 53.44 53.24 3kke n ALA 206 Cb 0.26 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 3kke n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kke n GLY 207 N 0.60 0.92 3.89 0.00 0.00 -0.15 -5.03 105.19 105.41 3kke n GLY 207 Ca 0.14 -0.65 -0.24 0.00 0.00 0.00 0.00 46.02 45.27 3kke n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kke s LEU 208 N -1.59 4.08 0.12 0.99 1.43 -0.03 -5.00 118.68 118.67 3kke s LEU 208 Ca 0.00 -0.04 0.06 0.00 -1.03 0.00 0.00 54.13 53.12 3kke s LEU 208 Cb 0.00 -2.64 -0.04 0.00 0.03 0.00 0.00 46.19 43.54 3kke s LEU 208 CO 0.00 -0.00 0.01 0.00 0.23 0.00 0.00 176.35 176.59 3kke s ARG 209 N -3.58 2.54 0.50 1.70 1.04 -1.26 -3.85 118.95 116.03 3kke s ARG 209 Ca 0.33 -0.92 0.04 0.00 -1.04 0.00 0.00 55.73 54.14 3kke s ARG 209 Cb -0.09 -2.49 -0.01 0.00 -2.04 0.00 0.00 34.95 30.31 3kke s ARG 209 CO 0.27 0.51 0.16 0.45 -0.04 0.00 0.00 175.30 176.64 3kke s SER 210 N -2.59 4.32 0.04 -2.89 0.15 -1.26 -4.76 113.70 106.72 3kke s SER 210 Ca 0.27 -1.41 0.02 0.00 0.70 0.00 0.00 55.95 55.53 3kke s SER 210 Cb -0.11 0.26 -0.02 0.00 -1.71 0.00 0.00 66.02 64.44 3kke s SER 210 CO 0.19 -0.86 -0.07 -0.70 1.20 0.00 0.00 173.24 173.00 3kke s GLU 211 N -4.00 0.49 0.29 5.44 2.56 -1.26 -5.03 118.70 117.19 3kke s GLU 211 Ca 0.22 -0.72 0.04 0.00 0.00 0.00 0.00 54.97 54.52 3kke s GLU 211 Cb 0.01 -0.23 0.69 0.00 2.00 0.00 0.00 34.13 36.60 3kke s GLU 211 CO 0.13 0.04 1.76 0.00 -0.56 0.00 0.00 175.26 176.62 3kke h ALA 212 N 4.57 1.52 0.00 6.30 0.00 -2.02 -1.87 119.26 127.77 3kke h ALA 212 Ca -0.35 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3kke h ALA 212 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3kke h ALA 212 CO 0.41 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.53 3kke h ALA 213 N 1.64 1.00 -0.01 0.00 0.00 -2.00 -2.59 119.26 117.30 3kke h ALA 213 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.46 3kke h ALA 213 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3kke h ALA 213 CO -0.41 0.00 -0.29 0.91 0.00 0.00 0.00 179.25 179.46 3kke n TRP 214 N -2.98 0.00 -4.01 0.00 8.01 -0.71 -4.79 117.44 112.97 3kke n TRP 214 Ca -0.01 0.00 -0.33 0.00 -1.31 0.00 0.00 57.50 55.85 3kke n TRP 214 Cb 0.18 -0.10 -0.15 0.00 -2.01 0.00 0.00 31.31 29.24 3kke n TRP 214 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 3kke s VAL 215 N -2.48 2.52 -0.13 -0.99 1.01 -0.98 -0.39 120.40 118.96 3kke s VAL 215 Ca 0.24 -1.41 0.01 0.00 0.00 0.00 0.00 61.98 60.81 3kke s VAL 215 Cb 0.19 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 3kke s VAL 215 CO 0.52 0.03 -0.16 -0.69 0.00 0.00 0.00 175.10 174.80 3kke s VAL 216 N 1.20 2.78 -0.29 2.92 1.01 -0.32 -4.96 120.40 122.74 3kke s VAL 216 Ca -0.05 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 60.88 3kke s VAL 216 Cb -0.19 -2.15 0.01 0.00 0.00 0.00 0.00 36.38 34.05 3kke s VAL 216 CO -0.04 0.53 1.06 -1.81 0.00 0.00 0.00 175.10 174.83 3kke s ASP 217 N 0.42 6.98 0.00 3.32 1.01 -1.26 -0.62 116.67 126.52 3kke s ASP 217 Ca -0.12 1.15 0.00 0.00 0.71 0.00 0.00 52.55 54.30 3kke s ASP 217 Cb -0.16 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.23 3kke s ASP 217 CO 0.06 -0.80 0.00 0.00 0.21 0.00 0.00 175.17 174.63 3kke n ALA 218 N 6.67 1.41 0.00 5.23 0.00 -0.78 -4.90 120.51 128.13 3kke n ALA 218 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 3kke n ALA 218 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 3kke n ALA 218 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kke n GLY 219 N 3.85 0.49 0.18 0.00 0.00 -0.85 -4.00 105.19 104.86 3kke n GLY 219 Ca 0.00 -1.10 0.11 0.00 0.00 0.00 0.00 46.02 45.03 3kke n GLY 219 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3kke h TRP 220 N 0.00 0.00 -1.90 1.61 -0.00 -1.92 -3.38 115.95 110.36 3kke h TRP 220 Ca 0.00 0.00 -0.46 0.00 -0.00 0.00 0.00 58.89 58.43 3kke h TRP 220 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.15 3kke h TRP 220 CO 0.00 0.02 -0.39 -1.21 -0.00 0.00 0.00 178.44 176.86 3kke s GLU 221 N -3.25 3.10 0.18 0.49 0.41 -1.26 -1.37 118.70 116.99 3kke s GLU 221 Ca 0.04 -1.02 -0.18 0.00 -0.41 0.00 0.00 54.97 53.41 3kke s GLU 221 Cb 0.07 -2.76 0.13 0.00 -1.78 0.00 0.00 34.13 29.79 3kke s GLU 221 CO 0.72 0.15 1.63 0.00 -0.49 0.00 0.00 175.26 177.27 3kke h ALA 222 N 1.04 0.18 -0.78 5.21 0.00 -1.85 -1.68 119.26 121.38 3kke h ALA 222 Ca -0.47 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 3kke h ALA 222 Cb 1.25 0.47 -0.04 0.00 0.00 0.00 0.00 17.79 19.48 3kke h ALA 222 CO 0.56 -0.52 0.45 0.38 0.00 0.00 0.00 179.25 180.11 3kke h ASP 223 N -0.08 0.94 -0.33 0.00 2.03 -1.93 0.66 116.42 117.71 3kke h ASP 223 Ca 0.22 -0.06 -0.17 0.00 -0.73 0.00 0.00 57.03 56.29 3kke h ASP 223 Cb 0.43 -0.24 -0.00 0.00 -0.83 0.00 0.00 39.33 38.69 3kke h ASP 223 CO -0.52 0.74 -0.44 0.00 -1.03 0.00 0.00 179.24 177.98 3kke h ALA 224 N 1.42 0.49 -0.34 4.15 0.00 -1.78 -0.47 119.26 122.72 3kke h ALA 224 Ca 0.28 -0.48 0.04 0.00 0.00 0.00 0.00 54.91 54.75 3kke h ALA 224 Cb -0.01 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3kke h ALA 224 CO -0.05 0.64 0.11 0.78 0.00 0.00 0.00 179.25 180.73 3kke h GLY 225 N 0.67 0.43 0.69 0.00 0.00 -0.82 -0.51 103.07 103.53 3kke h GLY 225 Ca 0.04 -0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.34 3kke h GLY 225 CO 0.10 0.02 0.07 1.76 0.00 0.00 0.00 176.54 178.50 3kke h SER 226 N 0.26 0.05 -0.78 0.19 0.02 -0.76 -1.14 113.55 111.38 3kke h SER 226 Ca 0.16 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.13 3kke h SER 226 Cb 0.13 0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 3kke h SER 226 CO -0.16 0.06 0.43 0.00 -1.14 0.00 0.00 176.83 176.02 3kke h ALA 227 N 1.21 1.26 -0.23 3.77 0.00 -0.83 -1.92 119.26 122.53 3kke h ALA 227 Ca 0.14 -0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 3kke h ALA 227 Cb 0.13 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3kke h ALA 227 CO -0.16 0.60 -0.62 0.00 0.00 0.00 0.00 179.25 179.07 3kke h ALA 228 N 1.36 0.48 0.33 0.00 0.00 -0.65 -2.17 119.26 118.60 3kke h ALA 228 Ca 0.28 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3kke h ALA 228 Cb 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3kke h ALA 228 CO -0.04 0.69 -0.17 1.25 0.00 0.00 0.00 179.25 180.98 3kke h LEU 229 N 0.57 -0.40 -0.84 0.00 7.12 -0.97 -1.05 115.31 119.73 3kke h LEU 229 Ca -0.01 0.02 0.21 0.00 0.13 0.00 0.00 57.88 58.23 3kke h LEU 229 Cb 1.22 0.11 -0.14 0.00 -0.53 0.00 0.00 40.66 41.32 3kke h LEU 229 CO 0.13 -0.28 0.17 0.78 -0.13 0.00 0.00 178.44 179.11 3kke h ASN 230 N -0.46 -0.10 -0.65 1.25 2.35 -1.32 0.26 115.58 116.91 3kke h ASN 230 Ca -0.04 0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.83 3kke h ASN 230 Cb 0.36 0.29 -0.03 0.00 0.05 0.00 0.00 38.32 38.99 3kke h ASN 230 CO 0.07 -0.16 0.14 0.74 -1.65 0.00 0.00 177.43 176.57 3kke h THR 231 N 0.18 1.26 -0.49 2.81 2.02 -1.04 -1.03 112.91 116.62 3kke h THR 231 Ca 0.51 -0.97 -0.09 0.00 0.77 0.00 0.00 66.41 66.62 3kke h THR 231 Cb 0.98 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 3kke h THR 231 CO -0.65 0.37 -0.06 -0.07 0.37 0.00 0.00 175.52 175.48 3kke h LEU 232 N 0.98 0.90 0.21 2.58 3.38 0.18 -1.01 115.31 122.53 3kke h LEU 232 Ca 0.20 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3kke h LEU 232 Cb 0.39 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3kke h LEU 232 CO 0.01 1.02 -0.10 0.22 0.09 0.00 0.00 178.44 179.68 3kke h TYR 233 N 0.76 -0.26 -0.38 1.13 3.20 -0.43 0.44 116.97 121.43 3kke h TYR 233 Ca 0.13 -0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.85 3kke h TYR 233 Cb 0.59 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 3kke h TYR 233 CO 0.04 -0.04 -0.35 0.00 -1.64 0.00 0.00 178.16 176.18 3kke h ARG 234 N -0.46 0.89 0.01 1.82 2.47 -1.25 -3.16 114.38 114.70 3kke h ARG 234 Ca -0.03 -0.45 -0.37 0.00 -1.26 0.00 0.00 59.98 57.88 3kke h ARG 234 Cb 0.35 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.61 3kke h ARG 234 CO 0.05 1.10 -2.32 0.41 0.56 0.00 0.00 179.97 179.77 3kke n GLY 235 N 0.06 -0.84 0.60 0.04 0.00 -0.38 -4.61 105.19 100.05 3kke n GLY 235 Ca -0.02 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.81 3kke n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kke n ALA 236 N -2.85 2.41 -2.49 4.61 0.00 0.15 -4.97 120.51 117.38 3kke n ALA 236 Ca -0.34 -0.76 -0.21 0.00 0.00 0.00 0.00 53.44 52.14 3kke n ALA 236 Cb 1.11 -0.47 -0.00 0.00 0.00 0.00 0.00 19.45 20.08 3kke n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3kke n ASN 237 N 0.75 -5.89 -4.70 0.00 3.02 -1.00 -4.27 115.26 103.17 3kke n ASN 237 Ca 0.10 -0.06 -0.43 0.00 -0.03 0.00 0.00 54.58 54.16 3kke n ASN 237 Cb 0.37 -4.87 -0.03 0.00 -0.61 0.00 0.00 39.78 34.64 3kke n ASN 237 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3kke n LEU 238 N -3.11 3.83 0.00 3.41 7.94 -1.02 -0.67 117.00 127.38 3kke n LEU 238 Ca -0.22 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 55.73 3kke n LEU 238 Cb 0.68 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 43.09 3kke n LEU 238 CO 0.31 0.09 0.00 0.61 -1.11 0.00 0.00 177.39 177.29 3kke n GLY 239 N 3.90 2.79 4.03 -3.96 0.00 -0.85 -4.62 105.19 106.48 3kke n GLY 239 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.99 3kke n GLY 239 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kke s LYS 240 N -0.08 2.35 0.00 1.61 0.00 0.16 -4.93 119.74 118.85 3kke s LYS 240 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 55.97 54.47 3kke s LYS 240 Cb 0.00 -2.64 0.00 0.00 0.00 0.00 0.00 37.83 35.19 3kke s LYS 240 CO 0.00 -0.80 0.16 -0.35 0.00 0.00 0.00 175.35 174.36 3kke n PRO 241 N -2.22 0.00 -0.23 1.78 -0.05 -1.26 -2.45 135.00 130.56 3kke n PRO 241 Ca 0.14 0.16 0.08 0.00 -0.05 0.00 0.00 63.50 63.82 3kke n PRO 241 Cb 0.61 -0.25 0.20 0.00 -0.05 0.00 0.00 33.50 34.01 3kke n PRO 241 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 175.50 175.05 3kke n ASP 242 N -1.64 3.23 -3.82 3.54 3.85 -1.26 -5.03 116.55 115.42 3kke n ASP 242 Ca 0.00 -1.99 -0.24 0.00 -0.71 0.00 0.00 54.79 51.86 3kke n ASP 242 Cb 0.00 -0.31 0.15 0.00 -1.35 0.00 0.00 41.12 39.62 3kke n ASP 242 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3kke n GLY 243 N 0.89 -0.77 3.75 6.12 0.00 -1.03 -5.03 105.19 109.12 3kke n GLY 243 Ca 0.16 -1.81 -0.38 0.00 0.00 0.00 0.00 46.02 43.99 3kke n GLY 243 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kke s PRO 244 N -5.25 3.21 0.00 1.61 0.04 -1.26 -4.73 135.00 128.61 3kke s PRO 244 Ca 0.62 2.06 0.20 0.00 0.04 0.00 0.00 61.00 63.92 3kke s PRO 244 Cb -0.02 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.32 3kke s PRO 244 CO 0.43 -1.08 1.02 0.25 0.04 0.00 0.00 177.00 177.65 3kke n THR 245 N -1.06 0.00 -3.66 1.26 -2.24 -0.11 -2.00 114.28 106.47 3kke n THR 245 Ca 0.11 -0.31 -0.14 0.00 -2.27 0.00 0.00 64.05 61.43 3kke n THR 245 Cb 0.47 1.26 -0.07 0.00 -2.10 0.00 0.00 70.33 69.89 3kke n THR 245 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kke s ALA 246 N -2.19 -1.11 -0.01 6.98 0.00 -1.22 -1.78 121.76 122.42 3kke s ALA 246 Ca 0.17 0.53 0.01 0.00 0.00 0.00 0.00 51.96 52.68 3kke s ALA 246 Cb 0.16 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.49 3kke s ALA 246 CO 0.48 -0.39 -0.04 0.54 0.00 0.00 0.00 175.76 176.35 3kke s VAL 247 N -1.88 0.39 -0.17 0.00 0.11 -0.66 -0.65 120.40 117.53 3kke s VAL 247 Ca -0.09 -0.16 -0.10 0.00 -2.93 0.00 0.00 61.98 58.71 3kke s VAL 247 Cb -0.02 -0.36 -0.05 0.00 -1.53 0.00 0.00 36.38 34.42 3kke s VAL 247 CO 0.02 0.13 0.16 -0.69 -3.33 0.00 0.00 175.10 171.40 3kke s VAL 248 N 0.21 5.42 -0.16 2.04 1.01 -0.52 -2.14 120.40 126.26 3kke s VAL 248 Ca -0.02 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.22 3kke s VAL 248 Cb -0.06 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.85 3kke s VAL 248 CO -0.00 0.49 -0.16 -0.69 0.00 0.00 0.00 175.10 174.74 3kke s VAL 249 N -0.08 2.53 0.48 2.92 1.01 0.15 -1.03 120.40 126.38 3kke s VAL 249 Ca 0.12 -0.81 0.27 0.00 0.00 0.00 0.00 61.98 61.56 3kke s VAL 249 Cb -0.12 -2.07 0.31 0.00 0.00 0.00 0.00 36.38 34.51 3kke s VAL 249 CO 0.01 0.52 2.13 0.00 0.00 0.00 0.00 175.10 177.76 3kke h ALA 250 N 7.43 1.40 -2.92 5.51 0.00 -1.21 -1.63 119.26 127.82 3kke h ALA 250 Ca -0.35 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.33 3kke h ALA 250 Cb 1.18 -0.01 -0.21 0.00 0.00 0.00 0.00 17.79 18.75 3kke h ALA 250 CO 0.58 0.10 -0.61 0.45 0.00 0.00 0.00 179.25 179.77 3kke s SER 251 N -6.21 0.13 0.39 0.00 0.15 -1.26 -4.36 113.70 102.54 3kke s SER 251 Ca -0.04 -0.33 0.10 0.00 0.70 0.00 0.00 55.95 56.38 3kke s SER 251 Cb 0.14 0.15 0.79 0.00 -1.71 0.00 0.00 66.02 65.39 3kke s SER 251 CO 0.58 -0.31 1.92 1.62 1.20 0.00 0.00 173.24 178.25 3kke h VAL 252 N 4.51 1.17 -0.27 4.45 3.04 -1.51 -2.38 116.25 125.27 3kke h VAL 252 Ca -0.31 -0.76 -0.10 0.00 -1.01 0.00 0.00 66.70 64.52 3kke h VAL 252 Cb 1.20 1.20 -0.01 0.00 -2.01 0.00 0.00 31.29 31.67 3kke h VAL 252 CO 0.41 0.24 -0.22 0.78 -1.01 0.00 0.00 177.57 177.76 3kke h ASN 253 N 0.23 0.66 -0.60 3.17 2.35 -1.90 -0.66 115.58 118.82 3kke h ASN 253 Ca 0.05 -0.46 0.10 0.00 -0.55 0.00 0.00 56.30 55.44 3kke h ASN 253 Cb 0.36 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.51 3kke h ASN 253 CO 0.02 0.98 0.41 0.00 -1.65 0.00 0.00 177.43 177.18 3kke h ALA 254 N 0.70 2.01 -0.21 -0.83 0.00 -0.92 -1.47 119.26 118.54 3kke h ALA 254 Ca 0.05 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 3kke h ALA 254 Cb 0.77 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3kke h ALA 254 CO 0.06 -0.14 -0.30 0.00 0.00 0.00 0.00 179.25 178.86 3kke h ALA 255 N 1.69 1.10 -0.17 0.00 0.00 -0.81 0.81 119.26 121.89 3kke h ALA 255 Ca 0.28 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 3kke h ALA 255 Cb 0.54 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3kke h ALA 255 CO -0.08 0.56 -0.40 0.28 0.00 0.00 0.00 179.25 179.62 3kke h VAL 256 N 0.36 1.34 -0.63 0.00 2.07 -0.26 -0.95 116.25 118.18 3kke h VAL 256 Ca 0.05 -1.65 0.08 0.00 0.82 0.00 0.00 66.70 65.99 3kke h VAL 256 Cb 0.72 1.97 -0.06 0.00 -1.52 0.00 0.00 31.29 32.39 3kke h VAL 256 CO 0.05 0.50 0.30 1.23 0.02 0.00 0.00 177.57 179.68 3kke h GLY 257 N 0.21 0.92 0.98 2.17 0.00 -1.18 -1.54 103.07 104.63 3kke h GLY 257 Ca -0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 3kke h GLY 257 CO 0.09 0.06 0.20 0.00 0.00 0.00 0.00 176.54 176.89 3kke h ALA 258 N 1.38 0.70 -0.26 3.60 0.00 -0.66 -1.78 119.26 122.24 3kke h ALA 258 Ca 0.30 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3kke h ALA 258 Cb 0.29 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3kke h ALA 258 CO -0.24 0.34 0.07 1.25 0.00 0.00 0.00 179.25 180.66 3kke h LEU 259 N 0.74 0.38 -0.31 0.00 5.85 -0.98 -0.12 115.31 120.88 3kke h LEU 259 Ca 0.18 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.72 3kke h LEU 259 Cb 0.23 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 3kke h LEU 259 CO -0.01 0.50 0.09 0.28 -0.34 0.00 0.00 178.44 178.96 3kke h SER 260 N 0.24 0.08 -0.62 1.25 0.02 -1.16 -0.72 113.55 112.64 3kke h SER 260 Ca 0.08 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.00 3kke h SER 260 Cb 0.26 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 3kke h SER 260 CO -0.00 0.08 0.13 0.74 -1.14 0.00 0.00 176.83 176.64 3kke h THR 261 N 0.22 1.25 -0.55 -2.27 2.02 -1.09 0.20 112.91 112.70 3kke h THR 261 Ca 0.14 -0.97 0.01 0.00 0.77 0.00 0.00 66.41 66.36 3kke h THR 261 Cb 0.12 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.12 3kke h THR 261 CO -0.16 0.36 0.36 0.00 0.37 0.00 0.00 175.52 176.46 3kke h ALA 262 N 1.16 0.70 -0.27 6.16 0.00 -0.60 0.09 119.26 126.49 3kke h ALA 262 Ca 0.20 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 3kke h ALA 262 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3kke h ALA 262 CO 0.01 0.12 0.08 -0.07 0.00 0.00 0.00 179.25 179.38 3kke h LEU 263 N 0.73 0.39 -0.87 0.00 3.38 -0.70 -1.61 115.31 116.63 3kke h LEU 263 Ca 0.20 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3kke h LEU 263 Cb -0.07 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 3kke h LEU 263 CO -0.05 0.50 0.53 0.03 0.09 0.00 0.00 178.44 179.53 3kke h ARG 264 N 0.26 1.17 0.00 1.13 3.08 -0.70 -0.58 114.38 118.76 3kke h ARG 264 Ca 0.09 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3kke h ARG 264 Cb 0.25 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3kke h ARG 264 CO -0.00 0.82 0.00 1.28 -1.07 0.00 0.00 179.97 181.00 3kke n LEU 265 N -4.42 0.35 0.00 3.04 4.77 -0.01 -4.86 117.00 115.87 3kke n LEU 265 Ca 0.09 0.64 0.00 0.00 -0.03 0.00 0.00 56.01 56.71 3kke n LEU 265 Cb 0.05 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.48 3kke n LEU 265 CO 0.37 -0.68 0.00 0.61 -1.33 0.00 0.00 177.39 176.36 3kke n GLY 266 N -1.03 0.55 3.72 -0.72 0.00 -0.22 -5.06 105.19 102.42 3kke n GLY 266 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3kke n GLY 266 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kke s LEU 267 N 0.00 4.40 0.06 0.99 1.43 -0.63 -5.00 118.68 119.94 3kke s LEU 267 Ca 0.00 2.14 -0.31 0.00 -1.03 0.00 0.00 54.13 54.94 3kke s LEU 267 Cb 0.00 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.57 3kke s LEU 267 CO 0.00 -0.46 1.20 -0.13 0.23 0.00 0.00 176.35 177.20 3kke s ARG 268 N 0.56 4.43 -0.19 1.70 0.52 -1.26 -4.26 118.95 120.44 3kke s ARG 268 Ca 0.57 1.78 0.00 0.00 -0.52 0.00 0.00 55.73 57.56 3kke s ARG 268 Cb -0.32 -3.34 0.01 0.00 0.52 0.00 0.00 34.95 31.82 3kke s ARG 268 CO 0.32 -0.26 -0.17 0.08 0.02 0.00 0.00 175.30 175.30 3kke s VAL 269 N 1.04 2.32 -2.21 3.52 1.01 -1.26 -0.23 120.40 124.59 3kke s VAL 269 Ca 0.59 -0.85 0.27 0.00 0.00 0.00 0.00 61.98 61.98 3kke s VAL 269 Cb -0.30 -1.99 0.37 0.00 0.00 0.00 0.00 36.38 34.46 3kke s VAL 269 CO 0.29 0.52 1.59 -0.81 0.00 0.00 0.00 175.10 176.69 3kke n PRO 270 N 4.64 1.35 0.07 2.72 -0.04 -1.26 -4.88 135.00 137.60 3kke n PRO 270 Ca -0.20 -0.85 -0.13 0.00 -0.04 0.00 0.00 63.50 62.28 3kke n PRO 270 Cb 0.50 -1.48 -0.07 0.00 -0.04 0.00 0.00 33.50 32.40 3kke n PRO 270 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3kke h GLU 271 N 2.08 -0.10 0.00 0.54 3.07 -1.88 -2.86 114.58 115.43 3kke h GLU 271 Ca 0.00 0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 58.78 3kke h GLU 271 Cb 0.56 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.48 3kke h GLU 271 CO 0.00 -0.02 -0.83 -0.44 -1.40 0.00 0.00 179.01 176.31 3kke h ASP 272 N -0.16 0.00 -2.69 1.42 3.45 -0.97 -3.36 116.42 114.11 3kke h ASP 272 Ca -0.01 0.00 0.01 0.00 0.43 0.00 0.00 57.03 57.46 3kke h ASP 272 Cb 0.13 0.00 -0.22 0.00 -0.56 0.00 0.00 39.33 38.68 3kke h ASP 272 CO 0.02 0.36 -0.10 -0.22 -1.57 0.00 0.00 179.24 177.73 3kke s LEU 273 N -5.99 -0.87 0.20 1.55 2.96 -0.93 -4.46 118.68 111.13 3kke s LEU 273 Ca 0.01 1.41 -0.13 0.00 -0.22 0.00 0.00 54.13 55.20 3kke s LEU 273 Cb 0.08 2.14 -0.07 0.00 0.50 0.00 0.00 46.19 48.83 3kke s LEU 273 CO 0.77 -0.23 0.58 -0.44 -1.32 0.00 0.00 176.35 175.71 3kke s SER 274 N 2.07 6.77 -0.04 3.68 0.01 -0.73 -4.15 113.70 121.31 3kke s SER 274 Ca -0.08 1.06 0.01 0.00 1.31 0.00 0.00 55.95 58.25 3kke s SER 274 Cb -0.08 -2.28 0.02 0.00 0.21 0.00 0.00 66.02 63.89 3kke s SER 274 CO -0.18 0.01 -0.04 -0.63 0.41 0.00 0.00 173.24 172.81 3kke s ILE 275 N -1.64 0.46 -0.07 1.44 1.01 0.11 -1.66 121.20 120.85 3kke s ILE 275 Ca 0.43 -0.08 0.04 0.00 0.00 0.00 0.00 60.65 61.03 3kke s ILE 275 Cb -0.13 -0.49 0.00 0.00 0.01 0.00 0.00 42.46 41.85 3kke s ILE 275 CO 0.20 0.20 -0.18 -0.69 0.00 0.00 0.00 174.94 174.47 3kke s VAL 276 N 0.90 1.58 0.17 2.92 1.01 -0.91 -4.14 120.40 121.93 3kke s VAL 276 Ca -0.11 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.16 3kke s VAL 276 Cb -0.14 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 3kke s VAL 276 CO -0.00 0.45 0.09 -0.83 0.00 0.00 0.00 175.10 174.82 3kke s GLY 277 N 0.35 1.72 -0.15 4.51 0.00 -0.51 -0.68 107.32 112.57 3kke s GLY 277 Ca -0.13 -1.26 -0.07 0.00 0.00 0.00 0.00 44.72 43.27 3kke s GLY 277 CO 0.05 -1.27 0.08 -0.42 0.00 0.00 0.00 173.10 171.54 3kke s ILE 278 N -1.74 4.98 0.00 0.90 1.01 -0.61 -1.47 121.20 124.26 3kke s ILE 278 Ca 0.30 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.97 3kke s ILE 278 Cb -0.10 -3.20 0.00 0.00 0.01 0.00 0.00 42.46 39.17 3kke s ILE 278 CO 0.22 0.53 0.00 0.59 0.00 0.00 0.00 174.94 176.28 3kke n ASN 279 N 2.85 0.00 -3.88 3.58 3.02 0.80 -1.54 115.26 120.09 3kke n ASN 279 Ca -0.18 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.24 3kke n ASN 279 Cb 0.53 0.06 -0.14 0.00 -0.61 0.00 0.00 39.78 39.62 3kke n ASN 279 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3kke s THR 280 N -3.06 0.08 0.23 3.41 2.01 -1.26 -4.28 115.64 112.76 3kke s THR 280 Ca 0.00 -0.03 0.01 0.00 0.31 0.00 0.00 61.69 61.98 3kke s THR 280 Cb 0.00 -0.08 -0.05 0.00 0.01 0.00 0.00 72.50 72.38 3kke s THR 280 CO 0.00 0.03 0.09 0.42 -0.69 0.00 0.00 174.62 174.47 3kke s THR 281 N 0.06 0.45 0.40 -0.82 -4.23 -1.26 -5.02 115.64 105.22 3kke s THR 281 Ca -0.00 -1.99 0.14 0.00 -1.18 0.00 0.00 61.69 58.65 3kke s THR 281 Cb -0.01 -2.51 0.35 0.00 1.34 0.00 0.00 72.50 71.67 3kke s THR 281 CO -0.00 -0.09 1.88 4.11 -0.54 0.00 0.00 174.62 179.97 3kke h TRP 282 N 2.49 0.64 -0.48 3.99 5.08 -1.98 -1.81 115.95 123.89 3kke h TRP 282 Ca -0.37 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.62 3kke h TRP 282 Cb 1.24 -0.20 -0.02 0.00 -3.00 0.00 0.00 29.16 27.18 3kke h TRP 282 CO 0.45 0.21 0.31 0.28 -1.28 0.00 0.00 178.44 178.40 3kke h VAL 283 N 0.52 1.13 0.00 0.12 2.07 -1.98 0.27 116.25 118.39 3kke h VAL 283 Ca 0.44 -0.27 -0.08 0.00 0.82 0.00 0.00 66.70 67.61 3kke h VAL 283 Cb 0.92 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 3kke h VAL 283 CO -0.18 0.13 -0.38 0.77 0.02 0.00 0.00 177.57 177.93 3kke h SER 284 N 0.64 0.00 0.81 0.57 4.64 -1.72 -2.16 113.55 116.33 3kke h SER 284 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3kke h SER 284 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3kke h SER 284 CO -0.04 0.38 -0.52 0.47 -0.87 0.00 0.00 176.83 176.26 3kke n ASP 285 N -3.76 0.60 -0.13 4.97 8.00 -0.91 -1.11 116.55 124.21 3kke n ASP 285 Ca -0.01 0.07 -0.24 0.00 0.71 0.00 0.00 54.79 55.32 3kke n ASP 285 Cb 0.46 0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.54 3kke n ASP 285 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3kke n THR 286 N -1.91 1.52 -0.67 -3.53 -1.04 0.06 -4.88 114.28 103.82 3kke n THR 286 Ca 0.04 -0.46 -0.31 0.00 -2.04 0.00 0.00 64.05 61.28 3kke n THR 286 Cb 0.40 -1.68 0.17 0.00 -1.82 0.00 0.00 70.33 67.40 3kke n THR 286 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 3kke n VAL 287 N -3.80 0.00 -4.06 12.58 0.24 -0.85 -4.84 118.33 117.60 3kke n VAL 287 Ca -0.50 -0.17 -0.29 0.00 -2.04 0.00 0.00 64.34 61.34 3kke n VAL 287 Cb 0.93 -0.84 -0.17 0.00 -1.47 0.00 0.00 33.84 32.30 3kke n VAL 287 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 3kke s TYR 288 N -2.48 2.04 0.59 6.34 5.04 -1.26 -2.05 117.35 125.57 3kke s TYR 288 Ca 0.63 -1.11 -0.17 0.00 -2.44 0.00 0.00 57.07 53.98 3kke s TYR 288 Cb -0.22 -1.52 -0.03 0.00 0.35 0.00 0.00 41.96 40.54 3kke s TYR 288 CO 0.63 -0.62 1.10 -1.25 -1.34 0.00 0.00 175.55 174.07 3kke s PRO 289 N 1.46 3.17 0.06 4.97 0.04 -1.26 -5.11 135.00 138.33 3kke s PRO 289 Ca 0.03 1.44 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 3kke s PRO 289 Cb -0.13 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 3kke s PRO 289 CO -0.09 -0.97 1.06 0.00 0.04 0.00 0.00 177.00 177.04 3kke s ALA 290 N -2.11 3.27 0.04 8.56 0.00 -0.87 -4.89 121.76 125.75 3kke s ALA 290 Ca 0.69 0.67 -0.30 0.00 0.00 0.00 0.00 51.96 53.02 3kke s ALA 290 Cb -0.21 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.49 3kke s ALA 290 CO 0.34 -0.25 1.45 -0.51 0.00 0.00 0.00 175.76 176.78 3kke s LEU 291 N 0.65 4.34 0.16 0.00 1.43 -0.26 -0.79 118.68 124.21 3kke s LEU 291 Ca 0.53 2.23 -0.31 0.00 -1.03 0.00 0.00 54.13 55.54 3kke s LEU 291 Cb -0.25 -3.57 -0.09 0.00 0.03 0.00 0.00 46.19 42.31 3kke s LEU 291 CO 0.30 -0.74 1.49 -0.89 0.23 0.00 0.00 176.35 176.74 3kke s THR 292 N 2.19 2.84 0.22 5.49 2.01 -1.26 -4.65 115.64 122.48 3kke s THR 292 Ca 0.66 0.62 -0.00 0.00 0.31 0.00 0.00 61.69 63.28 3kke s THR 292 Cb -0.34 -3.39 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 3kke s THR 292 CO 0.28 0.06 0.11 0.42 -0.69 0.00 0.00 174.62 174.80 3kke s THR 293 N 0.94 0.25 -0.25 -0.82 -4.23 -0.77 -1.42 115.64 109.33 3kke s THR 293 Ca 0.67 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.19 3kke s THR 293 Cb -0.41 -2.55 0.05 0.00 1.34 0.00 0.00 72.50 70.93 3kke s THR 293 CO 0.33 -0.01 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.60 3kke s VAL 294 N -3.98 2.34 -0.05 2.29 1.01 -0.54 -0.55 120.40 120.92 3kke s VAL 294 Ca 0.38 -1.44 -0.30 0.00 0.00 0.00 0.00 61.98 60.62 3kke s VAL 294 Cb 0.07 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.13 3kke s VAL 294 CO 0.12 0.06 1.04 -0.60 0.00 0.00 0.00 175.10 175.72 3kke s ARG 295 N 1.17 4.46 0.14 2.72 3.52 0.44 -0.14 118.95 131.26 3kke s ARG 295 Ca -0.06 1.46 0.06 0.00 -0.13 0.00 0.00 55.73 57.07 3kke s ARG 295 Cb -0.19 -3.50 -0.04 0.00 -1.56 0.00 0.00 34.95 29.66 3kke s ARG 295 CO -0.06 -0.23 -0.01 -0.51 -0.81 0.00 0.00 175.30 173.68 3kke s LEU 296 N 1.62 3.33 -1.37 -0.88 1.43 -1.26 -1.09 118.68 120.46 3kke s LEU 296 Ca 0.51 -0.32 -0.16 0.00 -1.03 0.00 0.00 54.13 53.14 3kke s LEU 296 Cb -0.21 -2.03 0.06 0.00 0.03 0.00 0.00 46.19 44.04 3kke s LEU 296 CO 0.23 0.13 1.95 -0.81 0.23 0.00 0.00 176.35 178.08 3kke n PRO 297 N 0.23 3.06 -0.01 1.29 -0.04 -1.26 -4.74 135.00 133.53 3kke n PRO 297 Ca -0.11 -3.00 -0.07 0.00 -0.04 0.00 0.00 63.50 60.28 3kke n PRO 297 Cb 0.54 -3.37 0.10 0.00 -0.04 0.00 0.00 33.50 30.73 3kke n PRO 297 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3kke h LEU 298 N 11.20 0.61 -0.14 1.53 3.38 -1.96 -1.70 115.31 128.23 3kke h LEU 298 Ca 0.50 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 58.16 3kke h LEU 298 Cb 0.76 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 3kke h LEU 298 CO 1.65 0.94 -0.05 -0.61 0.09 0.00 0.00 178.44 180.45 3kke h GLN 299 N 0.48 0.29 -0.94 1.13 4.15 -1.85 -2.18 115.11 116.19 3kke h GLN 299 Ca 0.04 -0.12 0.09 0.00 0.77 0.00 0.00 58.65 59.44 3kke h GLN 299 Cb 0.89 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 28.50 3kke h GLN 299 CO 0.08 0.60 0.61 -0.09 -1.93 0.00 0.00 178.83 178.10 3kke h ARG 300 N -0.03 0.96 -0.72 1.69 9.65 -1.84 -1.57 114.38 122.51 3kke h ARG 300 Ca 0.03 -0.06 0.02 0.00 -1.10 0.00 0.00 59.98 58.87 3kke h ARG 300 Cb 0.51 -0.22 -0.04 0.00 -1.39 0.00 0.00 29.97 28.83 3kke h ARG 300 CO 0.02 0.63 0.46 1.25 2.80 0.00 0.00 179.97 185.14 3kke h LEU 301 N 0.99 0.79 -0.66 3.80 5.85 -0.72 -0.29 115.31 125.06 3kke h LEU 301 Ca 0.44 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 59.03 3kke h LEU 301 Cb 0.36 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 3kke h LEU 301 CO -0.19 0.56 -0.23 1.23 -0.34 0.00 0.00 178.44 179.47 3kke h GLY 302 N 0.93 0.86 0.77 3.75 0.00 -0.74 -2.17 103.07 106.48 3kke h GLY 302 Ca 0.27 -0.74 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 3kke h GLY 302 CO -0.08 0.68 0.00 0.83 0.00 0.00 0.00 176.54 177.97 3kke h GLU 303 N 0.69 0.22 -0.39 4.80 5.08 -0.93 -1.78 114.58 122.27 3kke h GLU 303 Ca 0.09 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3kke h GLU 303 Cb 0.75 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 3kke h GLU 303 CO 0.06 0.46 0.22 0.28 -1.00 0.00 0.00 179.01 179.03 3kke h VAL 304 N -0.04 1.14 -0.49 3.13 2.07 -1.08 -1.28 116.25 119.70 3kke h VAL 304 Ca 0.04 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 67.14 3kke h VAL 304 Cb 0.36 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3kke h VAL 304 CO 0.01 0.15 0.09 0.00 0.02 0.00 0.00 177.57 177.83 3kke h ALA 305 N 1.08 0.64 -0.59 1.67 0.00 -1.37 0.20 119.26 120.89 3kke h ALA 305 Ca 0.14 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.86 3kke h ALA 305 Cb 0.04 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 3kke h ALA 305 CO -0.02 0.36 0.33 0.00 0.00 0.00 0.00 179.25 179.92 3kke h ALA 306 N 0.97 0.77 -0.31 0.00 0.00 -1.24 -1.46 119.26 117.99 3kke h ALA 306 Ca 0.15 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3kke h ALA 306 Cb 0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3kke h ALA 306 CO 0.01 0.03 0.03 -0.44 0.00 0.00 0.00 179.25 178.88 3kke h ASP 307 N 0.64 0.51 -0.77 0.00 3.32 -0.62 -0.25 116.42 119.25 3kke h ASP 307 Ca 0.25 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 57.05 3kke h ASP 307 Cb 0.11 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 3kke h ASP 307 CO -0.14 0.65 0.50 0.58 -1.72 0.00 0.00 179.24 179.11 3kke h VAL 308 N 0.34 1.15 0.31 -1.35 2.07 -0.51 0.42 116.25 118.68 3kke h VAL 308 Ca 0.09 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.26 3kke h VAL 308 Cb 0.37 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 3kke h VAL 308 CO 0.01 0.18 -0.15 0.25 0.02 0.00 0.00 177.57 177.88 3kke h LEU 309 N 0.99 -0.35 -0.72 2.57 5.85 -0.99 -1.42 115.31 121.23 3kke h LEU 309 Ca 0.29 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 3kke h LEU 309 Cb -0.05 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 3kke h LEU 309 CO -0.09 -0.08 0.43 0.24 -0.34 0.00 0.00 178.44 178.60 3kke h MET 310 N -0.63 0.98 -1.00 1.25 2.86 -0.90 -1.04 114.93 116.45 3kke h MET 310 Ca -0.04 -0.09 0.04 0.00 -2.06 0.00 0.00 59.70 57.54 3kke h MET 310 Cb 0.45 -0.20 -0.06 0.00 0.06 0.00 0.00 31.60 31.85 3kke h MET 310 CO 0.07 0.70 0.65 0.93 1.06 0.00 0.00 176.91 180.32 3kke h GLU 311 N 0.98 1.22 -0.09 1.72 4.39 -0.91 -1.47 114.58 120.43 3kke h GLU 311 Ca 0.26 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.82 3kke h GLU 311 Cb -0.03 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 28.34 3kke h GLU 311 CO -0.05 0.81 -0.23 1.25 -1.16 0.00 0.00 179.01 179.63 3kke h HIS 312 N 1.26 0.16 0.00 4.33 2.76 -0.28 -1.16 115.15 122.21 3kke h HIS 312 Ca 0.40 -0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.44 3kke h HIS 312 Cb 0.01 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 3kke h HIS 312 CO -0.00 0.37 -0.49 -0.07 -1.30 0.00 0.00 177.93 176.44 3kke h LEU 313 N 0.14 0.00 -0.38 0.26 3.38 -0.36 -2.38 115.31 115.97 3kke h LEU 313 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3kke h LEU 313 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3kke h LEU 313 CO 0.03 0.49 0.00 0.61 0.09 0.00 0.00 178.44 179.66 3kke n GLY 314 N 0.80 -0.57 0.00 0.83 0.00 -0.64 -4.92 105.19 100.69 3kke n GLY 314 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3kke n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kke n GLY 315 N 0.92 1.06 3.84 -0.02 0.00 -0.90 -5.07 105.19 105.03 3kke n GLY 315 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3kke n GLY 315 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kke s ARG 316 N -0.28 3.40 0.32 1.61 0.52 -0.48 -4.95 118.95 119.09 3kke s ARG 316 Ca 0.00 0.94 -0.29 0.00 -0.52 0.00 0.00 55.73 55.86 3kke s ARG 316 Cb 0.00 -2.05 -0.11 0.00 0.52 0.00 0.00 34.95 33.31 3kke s ARG 316 CO 0.00 -0.73 1.46 0.00 0.02 0.00 0.00 175.30 176.05 3kke s ALA 317 N -2.90 3.61 0.44 2.13 0.00 -1.26 -4.06 121.76 119.72 3kke s ALA 317 Ca 0.58 1.44 -0.25 0.00 0.00 0.00 0.00 51.96 53.73 3kke s ALA 317 Cb -0.13 -3.58 -0.08 0.00 0.00 0.00 0.00 23.12 19.33 3kke s ALA 317 CO 0.47 -0.87 1.38 -0.51 0.00 0.00 0.00 175.76 176.23 3kke s LEU 318 N -1.28 4.14 0.43 0.00 1.43 -1.26 -4.75 118.68 117.40 3kke s LEU 318 Ca 0.56 2.82 0.03 0.00 -1.03 0.00 0.00 54.13 56.51 3kke s LEU 318 Cb -0.44 -3.93 -0.03 0.00 0.03 0.00 0.00 46.19 41.81 3kke s LEU 318 CO 0.53 -1.07 0.05 0.42 0.23 0.00 0.00 176.35 176.51 3kke s THR 319 N -1.23 1.11 -0.21 5.49 -4.23 -1.26 -4.66 115.64 110.65 3kke s THR 319 Ca 0.60 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.11 3kke s THR 319 Cb -0.42 -2.45 0.05 0.00 1.34 0.00 0.00 72.50 71.03 3kke s THR 319 CO 0.53 0.00 -0.05 -1.81 -0.54 0.00 0.00 174.62 172.75 3kke s ASP 320 N -3.70 3.47 0.21 3.99 1.01 -1.26 -1.17 116.67 119.22 3kke s ASP 320 Ca 0.21 -0.98 0.04 0.00 0.71 0.00 0.00 52.55 52.52 3kke s ASP 320 Cb 0.04 -1.08 -0.05 0.00 1.01 0.00 0.00 42.92 42.84 3kke s ASP 320 CO 0.11 -0.21 -0.02 0.42 0.21 0.00 0.00 175.17 175.67 3kke s THR 321 N 1.49 1.07 -0.10 -1.27 -4.23 -0.67 -4.95 115.64 106.97 3kke s THR 321 Ca -0.03 -2.04 0.03 0.00 -1.18 0.00 0.00 61.69 58.47 3kke s THR 321 Cb -0.17 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.42 3kke s THR 321 CO -0.07 -0.41 -0.21 -0.69 -0.54 0.00 0.00 174.62 172.70 3kke s VAL 322 N -3.40 1.88 -0.41 2.29 1.01 -1.26 -2.01 120.40 118.51 3kke s VAL 322 Ca 0.26 -0.91 -0.28 0.00 0.00 0.00 0.00 61.98 61.05 3kke s VAL 322 Cb 0.05 -1.65 0.02 0.00 0.00 0.00 0.00 36.38 34.80 3kke s VAL 322 CO 0.07 0.52 1.07 -0.69 0.00 0.00 0.00 175.10 176.08 3kke s VAL 323 N 0.53 4.38 -0.72 2.92 1.01 -0.22 -4.86 120.40 123.44 3kke s VAL 323 Ca -0.15 1.37 0.09 0.00 0.00 0.00 0.00 61.98 63.29 3kke s VAL 323 Cb -0.17 -4.49 -0.04 0.00 0.00 0.00 0.00 36.38 31.68 3kke s VAL 323 CO 0.05 -0.76 0.53 0.35 0.00 0.00 0.00 175.10 175.28 3kke n THR 324 N 6.37 0.00 -4.30 3.92 -2.24 -1.26 -3.55 114.28 113.21 3kke n THR 324 Ca 0.11 -0.36 -0.19 0.00 -2.27 0.00 0.00 64.05 61.34 3kke n THR 324 Cb 0.48 1.07 -0.15 0.00 -2.10 0.00 0.00 70.33 69.63 3kke n THR 324 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3kke s GLN 325 N -1.52 0.84 0.81 -0.78 -1.52 -1.26 -3.79 119.66 112.44 3kke s GLN 325 Ca 0.06 -0.24 -0.11 0.00 -1.95 0.00 0.00 55.36 53.12 3kke s GLN 325 Cb 0.07 -0.80 0.08 0.00 -0.22 0.00 0.00 33.01 32.14 3kke s GLN 325 CO 0.29 0.07 1.13 -1.25 -0.25 0.00 0.00 175.29 175.28 3kke s PRO 326 N 0.30 1.85 0.91 2.91 0.04 -1.26 -4.99 135.00 134.75 3kke s PRO 326 Ca -0.04 1.42 -0.12 0.00 0.04 0.00 0.00 61.00 62.30 3kke s PRO 326 Cb -0.09 -1.83 0.14 0.00 0.04 0.00 0.00 34.50 32.76 3kke s PRO 326 CO 0.00 -1.99 1.09 0.95 0.04 0.00 0.00 177.00 177.10 3kke s THR 327 N -2.62 2.55 0.47 1.26 -4.23 -1.25 -4.69 115.64 107.13 3kke s THR 327 Ca 0.66 0.18 -0.23 0.00 -1.18 0.00 0.00 61.69 61.11 3kke s THR 327 Cb -0.21 -2.70 -0.07 0.00 1.34 0.00 0.00 72.50 70.85 3kke s THR 327 CO 0.54 -0.23 1.25 -2.84 -0.54 0.00 0.00 174.62 172.79 3kke s PRO 328 N -4.98 3.65 -0.29 3.99 0.02 -1.26 -4.89 135.00 131.24 3kke s PRO 328 Ca 0.64 2.00 -0.03 0.00 0.02 0.00 0.00 61.00 63.62 3kke s PRO 328 Cb -0.18 -2.46 0.03 0.00 0.02 0.00 0.00 34.50 31.92 3kke s PRO 328 CO 0.57 -0.70 0.00 -2.00 -0.33 0.00 0.00 177.00 174.54 3kke s GLU 329 N -2.63 2.68 -0.05 5.54 2.12 -0.25 -4.91 118.70 121.20 3kke s GLU 329 Ca 0.64 -1.10 -0.30 0.00 0.36 0.00 0.00 54.97 54.57 3kke s GLU 329 Cb -0.34 -3.17 -0.06 0.00 0.26 0.00 0.00 34.13 30.82 3kke s GLU 329 CO 0.42 -0.52 1.77 -1.17 -0.54 0.00 0.00 175.26 175.22 3kke s LEU 330 N 1.33 4.26 -0.54 2.70 2.96 -1.26 -0.42 118.68 127.71 3kke s LEU 330 Ca -0.02 2.28 -0.07 0.00 -0.22 0.00 0.00 54.13 56.10 3kke s LEU 330 Cb -0.18 -3.53 0.14 0.00 0.50 0.00 0.00 46.19 43.12 3kke s LEU 330 CO -0.01 -1.06 0.39 -0.76 -1.32 0.00 0.00 176.35 173.60 3kke s LEU 331 N 4.52 5.65 -0.29 -0.68 1.43 0.29 -4.97 118.68 124.63 3kke s LEU 331 Ca 0.79 -2.23 -0.29 0.00 -1.03 0.00 0.00 54.13 51.37 3kke s LEU 331 Cb -0.35 -1.97 0.01 0.00 0.03 0.00 0.00 46.19 43.91 3kke s LEU 331 CO 0.33 -0.59 1.09 -0.69 0.23 0.00 0.00 176.35 176.73 3kke s VAL 332 N 0.87 4.51 0.00 -1.59 1.01 -1.26 -1.85 120.40 122.09 3kke s VAL 332 Ca 0.10 1.77 0.00 0.00 0.00 0.00 0.00 61.98 63.85 3kke s VAL 332 Cb -0.23 -4.36 0.00 0.00 0.00 0.00 0.00 36.38 31.79 3kke s VAL 332 CO -0.03 -0.40 0.00 0.54 0.00 0.00 0.00 175.10 175.21 3kke n ARG 333 N 6.77 0.00 0.00 2.72 5.12 -1.26 -4.98 116.66 125.03 3kke n ARG 333 Ca 0.12 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.04 3kke n ARG 333 Cb 0.47 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.77 3kke n ARG 333 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3kke n GLU 334 N 0.00 0.82 -0.27 5.56 1.02 0.03 -4.76 120.64 123.03 3kke n GLU 334 Ca 0.00 -0.76 0.07 0.00 -0.02 0.00 0.00 57.16 56.45 3kke n GLU 334 Cb 0.00 -0.77 0.20 0.00 -0.02 0.00 0.00 31.44 30.85 3kke n GLU 334 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3kke n THR 335 N -0.17 1.24 -4.54 2.62 -2.24 -1.19 -4.17 114.28 105.83 3kke n THR 335 Ca 0.00 -1.13 -0.24 0.00 -2.27 0.00 0.00 64.05 60.41 3kke n THR 335 Cb 0.27 0.37 -0.16 0.00 -2.10 0.00 0.00 70.33 68.70 3kke n THR 335 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3kke s THR 336 N -1.31 1.06 0.26 4.28 -4.23 -1.26 0.05 115.64 114.50 3kke s THR 336 Ca 0.31 -0.44 -0.11 0.00 -1.18 0.00 0.00 61.69 60.28 3kke s THR 336 Cb 0.18 -0.97 -0.00 0.00 1.34 0.00 0.00 72.50 73.05 3kke s THR 336 CO 0.18 0.34 0.47 0.00 -0.54 0.00 0.00 174.62 175.06 3kke s ALA 337 N 0.65 -0.02 0.68 3.99 0.00 -1.26 -4.97 121.76 120.82 3kke s ALA 337 Ca -0.14 -1.02 -0.17 0.00 0.00 0.00 0.00 51.96 50.64 3kke s ALA 337 Cb -0.15 1.09 -0.01 0.00 0.00 0.00 0.00 23.12 24.04 3kke s ALA 337 CO 0.03 -0.84 0.99 -2.30 0.00 0.00 0.00 175.76 173.65 3kke n PRO 338 N -0.41 0.69 -1.37 0.00 -0.02 -1.25 -4.81 135.00 127.83 3kke n PRO 338 Ca -0.01 0.29 -0.29 0.00 -2.02 0.00 0.00 63.50 61.47 3kke n PRO 338 Cb 0.62 -2.23 0.17 0.00 -0.02 0.00 0.00 33.50 32.04 3kke n PRO 338 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3kke s PRO 339 N -3.14 0.47 0.00 0.52 0.04 -1.26 -4.90 135.00 126.73 3kke s PRO 339 Ca 0.75 0.25 0.30 0.00 0.04 0.00 0.00 61.00 62.34 3kke s PRO 339 Cb -0.37 -1.77 1.52 0.00 0.04 0.00 0.00 34.50 33.92 3kke s PRO 339 CO 0.48 -2.64 2.01 2.41 0.04 0.00 0.00 177.00 179.30