#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bil s ILE 68 N 0.00 2.75 -0.07 12.58 -4.36 0.36 -1.21 121.20 131.25 3bil s ILE 68 Ca 0.00 -1.79 0.03 0.00 -0.26 0.00 0.00 60.65 58.62 3bil s ILE 68 Cb 0.00 -2.92 -0.02 0.00 1.25 0.00 0.00 42.46 40.77 3bil s ILE 68 CO 0.00 -0.15 -0.13 -0.83 0.24 0.00 0.00 174.94 174.06 3bil s GLY 69 N -3.81 1.55 -0.03 6.27 0.00 0.55 -1.85 107.32 110.00 3bil s GLY 69 Ca 0.37 -0.95 0.04 0.00 0.00 0.00 0.00 44.72 44.18 3bil s GLY 69 CO 0.21 -0.65 -0.14 0.54 0.00 0.00 0.00 173.10 173.06 3bil s VAL 70 N -0.55 1.17 -0.08 1.40 0.11 0.47 -1.33 120.40 121.59 3bil s VAL 70 Ca 0.08 -0.60 0.04 0.00 -2.93 0.00 0.00 61.98 58.57 3bil s VAL 70 Cb -0.12 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.73 3bil s VAL 70 CO 0.01 0.34 -0.22 -0.63 -3.33 0.00 0.00 175.10 171.28 3bil s ILE 71 N -0.06 1.86 0.01 7.04 1.01 -0.90 0.13 121.20 130.29 3bil s ILE 71 Ca -0.00 -0.92 -0.01 0.00 0.00 0.00 0.00 60.65 59.72 3bil s ILE 71 Cb -0.09 -1.61 -0.01 0.00 0.01 0.00 0.00 42.46 40.76 3bil s ILE 71 CO 0.01 0.52 -0.01 0.54 0.00 0.00 0.00 174.94 175.99 3bil s VAL 72 N 0.26 0.09 -0.24 2.92 0.11 0.39 -2.04 120.40 121.88 3bil s VAL 72 Ca -0.14 -0.71 0.28 0.00 -2.93 0.00 0.00 61.98 58.49 3bil s VAL 72 Cb -0.16 -0.22 0.34 0.00 -1.53 0.00 0.00 36.38 34.80 3bil s VAL 72 CO 0.06 -0.39 1.82 1.55 -3.33 0.00 0.00 175.10 174.82 3bil h PRO 73 N 4.93 0.00 -1.94 1.54 0.13 -1.85 0.29 132.00 135.10 3bil h PRO 73 Ca -0.30 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.84 3bil h PRO 73 Cb 1.21 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.14 3bil h PRO 73 CO 0.43 0.00 0.35 0.45 -0.23 0.00 0.00 178.00 179.00 3bil s SER 74 N -5.37 -0.52 -0.01 1.44 0.15 -1.26 -2.06 113.70 106.08 3bil s SER 74 Ca 0.04 0.48 0.02 0.00 0.70 0.00 0.00 55.95 57.19 3bil s SER 74 Cb 0.09 0.44 -0.03 0.00 -1.71 0.00 0.00 66.02 64.81 3bil s SER 74 CO 0.55 -0.54 0.03 0.18 1.20 0.00 0.00 173.24 174.65 3bil n LEU 75 N 0.63 0.00 0.26 3.45 4.77 -1.26 -4.48 117.00 120.37 3bil n LEU 75 Ca -0.15 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.00 3bil n LEU 75 Cb 0.58 0.03 0.66 0.00 -2.33 0.00 0.00 43.42 42.36 3bil n LEU 75 CO 0.19 0.03 0.98 0.16 -1.33 0.00 0.00 177.39 177.41 3bil h ILE 76 N 0.00 0.00 -2.56 -0.08 3.07 -1.99 -3.40 117.51 112.55 3bil h ILE 76 Ca -0.03 -0.48 -0.55 0.00 1.55 0.00 0.00 64.86 65.35 3bil h ILE 76 Cb 0.66 1.45 -0.01 0.00 -0.27 0.00 0.00 36.82 38.65 3bil h ILE 76 CO 0.00 0.00 1.15 0.21 -1.05 0.00 0.00 178.15 178.46 3bil s ASN 77 N -5.52 6.50 0.40 2.16 3.84 -1.26 -4.86 114.94 116.20 3bil s ASN 77 Ca 0.02 2.17 0.17 0.00 0.21 0.00 0.00 52.86 55.43 3bil s ASN 77 Cb 0.09 -2.53 0.84 0.00 -0.55 0.00 0.00 41.25 39.10 3bil s ASN 77 CO 0.53 -1.07 1.85 -0.74 -2.79 0.00 0.00 177.10 174.87 3bil h HIS 78 N 10.29 0.00 -0.15 0.43 -0.00 -1.94 -1.07 115.15 122.71 3bil h HIS 78 Ca -0.40 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 59.94 3bil h HIS 78 Cb 1.19 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.59 3bil h HIS 78 CO 0.91 0.33 -0.01 -0.92 -0.00 0.00 0.00 177.93 178.23 3bil h TYR 79 N 0.00 0.30 0.00 5.26 3.20 -1.93 0.95 116.97 124.75 3bil h TYR 79 Ca -0.00 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.76 3bil h TYR 79 Cb 0.65 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 3bil h TYR 79 CO 0.00 0.52 -0.25 0.74 -1.64 0.00 0.00 178.16 177.53 3bil h PHE 80 N -0.00 0.00 0.05 -3.82 0.04 -1.77 0.01 116.94 111.44 3bil h PHE 80 Ca 0.04 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.57 3bil h PHE 80 Cb 0.41 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.56 3bil h PHE 80 CO 0.04 0.25 -1.05 0.00 -0.60 0.00 0.00 178.31 176.96 3bil h ALA 81 N 1.75 0.26 -0.21 2.45 0.00 -1.04 -2.74 119.26 119.73 3bil h ALA 81 Ca -0.00 -0.76 -0.00 0.00 0.00 0.00 0.00 54.91 54.14 3bil h ALA 81 Cb 0.76 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 3bil h ALA 81 CO 0.03 0.85 0.12 0.00 0.00 0.00 0.00 179.25 180.25 3bil h ALA 82 N 0.66 0.27 -0.76 0.00 0.00 -0.56 -1.63 119.26 117.24 3bil h ALA 82 Ca -0.10 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 54.82 3bil h ALA 82 Cb 1.71 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 19.36 3bil h ALA 82 CO 0.18 -0.21 0.45 1.98 0.00 0.00 0.00 179.25 181.65 3bil h MET 83 N 0.24 0.79 -0.00 0.00 -1.53 -1.02 -1.43 114.93 111.98 3bil h MET 83 Ca 0.07 -0.05 -0.22 0.00 -3.44 0.00 0.00 59.70 56.07 3bil h MET 83 Cb 0.05 -0.18 0.00 0.00 -0.55 0.00 0.00 31.60 30.92 3bil h MET 83 CO -0.01 0.52 -0.92 -0.39 0.14 0.00 0.00 176.91 176.25 3bil h VAL 84 N 0.82 1.41 -0.26 -5.77 -1.51 -1.40 0.72 116.25 110.27 3bil h VAL 84 Ca 0.34 -2.46 0.04 0.00 -1.23 0.00 0.00 66.70 63.39 3bil h VAL 84 Cb 0.18 2.41 -0.04 0.00 -2.13 0.00 0.00 31.29 31.72 3bil h VAL 84 CO -0.18 0.73 0.03 0.74 -1.23 0.00 0.00 177.57 177.66 3bil h THR 85 N 0.22 0.85 0.00 7.19 2.02 -1.02 0.47 112.91 122.63 3bil h THR 85 Ca -0.07 -0.04 -0.10 0.00 0.77 0.00 0.00 66.41 66.96 3bil h THR 85 Cb 1.55 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 3bil h THR 85 CO 0.16 0.02 -0.50 -0.33 0.37 0.00 0.00 175.52 175.24 3bil h GLU 86 N 0.12 0.00 -0.16 6.66 3.07 -1.11 -2.04 114.58 121.12 3bil h GLU 86 Ca 0.12 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.82 3bil h GLU 86 Cb 0.14 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 3bil h GLU 86 CO -0.18 0.50 -0.56 0.82 -1.40 0.00 0.00 179.01 178.19 3bil h ILE 87 N 0.00 1.33 -0.33 3.13 2.04 -0.63 -2.58 117.51 120.47 3bil h ILE 87 Ca -0.00 -1.82 -0.16 0.00 1.00 0.00 0.00 64.86 63.87 3bil h ILE 87 Cb 0.93 1.81 -0.00 0.00 -0.74 0.00 0.00 36.82 38.82 3bil h ILE 87 CO 0.06 0.56 -0.41 -0.61 0.00 0.00 0.00 178.15 177.76 3bil h GLN 88 N 0.37 0.86 -0.15 2.37 4.15 -0.69 -2.24 115.11 119.79 3bil h GLN 88 Ca 0.01 -0.48 -0.04 0.00 0.77 0.00 0.00 58.65 58.90 3bil h GLN 88 Cb 1.09 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.80 3bil h GLN 88 CO 0.10 1.12 -0.06 1.03 -1.93 0.00 0.00 178.83 179.09 3bil h SER 89 N 0.65 0.31 -0.50 -0.69 0.87 -1.39 -2.27 113.55 110.52 3bil h SER 89 Ca 0.04 -0.40 0.02 0.00 -1.23 0.00 0.00 61.79 60.22 3bil h SER 89 Cb 1.01 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.85 3bil h SER 89 CO 0.10 0.64 0.30 0.74 -0.53 0.00 0.00 176.83 178.08 3bil h THR 90 N -0.03 1.06 -0.95 2.23 2.02 -1.55 -2.50 112.91 113.19 3bil h THR 90 Ca 0.03 -0.21 0.07 0.00 0.77 0.00 0.00 66.41 67.08 3bil h THR 90 Cb 0.52 0.40 -0.06 0.00 -1.74 0.00 0.00 68.15 67.27 3bil h THR 90 CO 0.02 0.11 0.62 0.00 0.37 0.00 0.00 175.52 176.64 3bil h ALA 91 N 1.22 1.48 -0.04 6.16 0.00 -1.34 -2.67 119.26 124.07 3bil h ALA 91 Ca 0.20 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.92 3bil h ALA 91 Cb 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3bil h ALA 91 CO -0.09 0.37 -0.75 0.66 0.00 0.00 0.00 179.25 179.43 3bil h SER 92 N 1.07 0.30 0.04 0.00 4.64 -1.17 0.67 113.55 119.11 3bil h SER 92 Ca 0.42 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3bil h SER 92 Cb 0.23 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 3bil h SER 92 CO -0.17 0.95 -0.02 0.11 -0.87 0.00 0.00 176.83 176.83 3bil h LYS 93 N 0.16 0.00 -0.87 4.77 1.57 -1.12 -0.74 116.57 120.34 3bil h LYS 93 Ca -0.03 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.28 3bil h LYS 93 Cb 1.33 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 33.37 3bil h LYS 93 CO 0.12 0.02 0.51 0.00 -0.57 0.00 0.00 179.45 179.52 3bil n ALA 94 N -2.36 5.43 -3.63 3.86 0.00 -0.91 -4.97 120.51 117.92 3bil n ALA 94 Ca -0.03 -3.03 -0.26 0.00 0.00 0.00 0.00 53.44 50.12 3bil n ALA 94 Cb 0.10 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 18.27 3bil n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bil n GLY 95 N -1.11 -0.83 2.97 0.00 0.00 -0.28 -5.03 105.19 100.91 3bil n GLY 95 Ca 0.55 0.39 -0.12 0.00 0.00 0.00 0.00 46.02 46.84 3bil n GLY 95 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bil s LEU 96 N -6.37 1.72 0.75 0.99 1.43 0.18 -4.68 118.68 112.70 3bil s LEU 96 Ca 0.35 0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 53.49 3bil s LEU 96 Cb -0.11 0.30 0.13 0.00 0.03 0.00 0.00 46.19 46.55 3bil s LEU 96 CO 0.83 -0.08 1.04 0.00 0.23 0.00 0.00 176.35 178.37 3bil s ALA 97 N -0.21 3.47 -0.13 4.21 0.00 -1.26 -3.19 121.76 124.64 3bil s ALA 97 Ca -0.03 -1.61 -0.05 0.00 0.00 0.00 0.00 51.96 50.27 3bil s ALA 97 Cb -0.02 -2.15 0.07 0.00 0.00 0.00 0.00 23.12 21.02 3bil s ALA 97 CO 0.00 -1.59 0.27 0.99 0.00 0.00 0.00 175.76 175.44 3bil s THR 98 N -3.25 -0.43 -0.19 0.00 2.01 -1.26 -0.49 115.64 112.03 3bil s THR 98 Ca 0.67 0.27 -0.05 0.00 0.31 0.00 0.00 61.69 62.89 3bil s THR 98 Cb -0.05 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.97 3bil s THR 98 CO 0.45 0.11 0.00 -0.63 -0.69 0.00 0.00 174.62 173.87 3bil s ILE 99 N 2.43 4.06 -0.04 1.82 -1.09 -0.77 -4.99 121.20 122.62 3bil s ILE 99 Ca 0.01 -0.28 -0.01 0.00 -2.23 0.00 0.00 60.65 58.14 3bil s ILE 99 Cb -0.12 -2.83 -0.04 0.00 -1.58 0.00 0.00 42.46 37.89 3bil s ILE 99 CO -0.09 0.44 0.06 -0.63 -1.23 0.00 0.00 174.94 173.49 3bil s ILE 100 N 0.83 4.63 0.15 2.92 1.09 -1.26 -0.40 121.20 129.17 3bil s ILE 100 Ca 0.01 -0.31 0.05 0.00 -1.10 0.00 0.00 60.65 59.29 3bil s ILE 100 Cb -0.14 -3.05 -0.04 0.00 -1.06 0.00 0.00 42.46 38.16 3bil s ILE 100 CO 0.02 0.46 -0.10 0.42 -0.10 0.00 0.00 174.94 175.64 3bil s THR 101 N -1.07 1.20 -0.16 2.92 -4.23 0.35 -4.93 115.64 109.72 3bil s THR 101 Ca 0.19 -2.07 -0.01 0.00 -1.18 0.00 0.00 61.69 58.62 3bil s THR 101 Cb -0.12 -1.87 0.04 0.00 1.34 0.00 0.00 72.50 71.90 3bil s THR 101 CO 0.09 -0.73 -0.05 0.21 -0.54 0.00 0.00 174.62 173.59 3bil s ASN 102 N -3.18 2.74 0.00 3.99 3.84 -1.25 -0.46 114.94 120.61 3bil s ASN 102 Ca 0.17 -0.62 0.26 0.00 0.21 0.00 0.00 52.86 52.89 3bil s ASN 102 Cb 0.02 -0.89 0.73 0.00 -0.55 0.00 0.00 41.25 40.57 3bil s ASN 102 CO 0.01 -0.18 1.55 -1.54 -2.79 0.00 0.00 177.10 174.16 3bil n SER 103 N 4.89 0.87 -2.43 -4.21 3.41 0.09 -4.94 113.62 111.31 3bil n SER 103 Ca -0.12 -0.72 -0.07 0.00 -0.26 0.00 0.00 58.87 57.70 3bil n SER 103 Cb 0.48 0.14 -0.00 0.00 -0.26 0.00 0.00 64.21 64.57 3bil n SER 103 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3bil n ASN 104 N -0.86 -2.68 -2.32 4.04 4.13 -0.87 -0.71 115.26 115.99 3bil n ASN 104 Ca 0.11 0.32 -0.19 0.00 1.68 0.00 0.00 54.58 56.50 3bil n ASN 104 Cb 0.34 -2.35 0.01 0.00 -1.54 0.00 0.00 39.78 36.24 3bil n ASN 104 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3bil n GLU 105 N -2.64 -2.77 -4.04 3.52 -0.58 -1.17 -4.98 120.64 107.98 3bil n GLU 105 Ca -0.09 0.83 -0.31 0.00 -0.42 0.00 0.00 57.16 57.17 3bil n GLU 105 Cb 0.56 -5.37 -0.16 0.00 -0.57 0.00 0.00 31.44 25.90 3bil n GLU 105 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3bil s ASP 106 N -2.46 3.65 0.14 1.62 -1.08 0.11 -5.02 116.67 113.63 3bil s ASP 106 Ca 0.13 -1.00 -0.18 0.00 -0.52 0.00 0.00 52.55 50.97 3bil s ASP 106 Cb -0.06 -1.36 -0.00 0.00 -1.46 0.00 0.00 42.92 40.04 3bil s ASP 106 CO 0.15 -0.13 1.74 0.00 0.52 0.00 0.00 175.17 177.45 3bil h ALA 107 N 7.91 0.27 -0.80 3.66 0.00 -1.94 -2.46 119.26 125.90 3bil h ALA 107 Ca -0.28 0.04 0.10 0.00 0.00 0.00 0.00 54.91 54.77 3bil h ALA 107 Cb 1.09 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 3bil h ALA 107 CO 0.50 -0.35 0.44 1.15 0.00 0.00 0.00 179.25 180.98 3bil h THR 108 N 0.16 0.86 -0.28 0.00 2.02 -1.93 0.15 112.91 113.89 3bil h THR 108 Ca 0.12 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 3bil h THR 108 Cb 0.11 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 3bil h THR 108 CO -0.14 0.13 0.15 0.74 0.37 0.00 0.00 175.52 176.77 3bil h THR 109 N 0.72 1.13 -0.55 3.16 2.02 -1.73 -0.68 112.91 116.98 3bil h THR 109 Ca 0.40 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 67.12 3bil h THR 109 Cb 0.41 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 3bil h THR 109 CO -0.27 0.13 -0.05 -0.03 0.37 0.00 0.00 175.52 175.67 3bil h MET 110 N 0.33 0.98 -0.14 6.66 -1.53 -1.02 -0.99 114.93 119.22 3bil h MET 110 Ca 0.10 -0.32 0.04 0.00 -3.44 0.00 0.00 59.70 56.08 3bil h MET 110 Cb 0.08 -0.08 -0.07 0.00 -0.55 0.00 0.00 31.60 30.98 3bil h MET 110 CO -0.01 0.99 -0.43 1.03 0.14 0.00 0.00 176.91 178.63 3bil h SER 111 N 0.89 -1.34 -0.81 1.39 0.87 -0.56 -0.90 113.55 113.09 3bil h SER 111 Ca 0.15 0.18 0.19 0.00 -1.23 0.00 0.00 61.79 61.08 3bil h SER 111 Cb 0.58 0.54 -0.12 0.00 -0.44 0.00 0.00 62.40 62.97 3bil h SER 111 CO 0.04 -0.43 0.27 1.23 -0.53 0.00 0.00 176.83 177.40 3bil h GLY 112 N -0.49 1.25 0.67 5.77 0.00 -0.26 -2.69 103.07 107.32 3bil h GLY 112 Ca 0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 3bil h GLY 112 CO -0.40 -0.23 -0.05 1.76 0.00 0.00 0.00 176.54 177.61 3bil h SER 113 N 0.32 -0.12 0.39 0.19 0.02 -0.49 -2.23 113.55 111.64 3bil h SER 113 Ca 0.48 -0.28 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 3bil h SER 113 Cb 0.87 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.43 3bil h SER 113 CO -0.53 0.23 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.05 3bil h LEU 114 N -0.47 -0.70 -0.87 5.07 3.38 -1.10 1.05 115.31 121.68 3bil h LEU 114 Ca -0.01 0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.16 3bil h LEU 114 Cb 0.39 0.22 -0.16 0.00 0.09 0.00 0.00 40.66 41.20 3bil h LEU 114 CO 0.02 -0.42 -0.28 -0.08 0.09 0.00 0.00 178.44 177.77 3bil h GLU 115 N -0.65 -0.02 -0.18 1.13 4.81 -1.57 -1.73 114.58 116.37 3bil h GLU 115 Ca -0.04 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.13 3bil h GLU 115 Cb 0.55 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 3bil h GLU 115 CO 0.02 -0.02 -0.14 0.35 -0.73 0.00 0.00 179.01 178.49 3bil h PHE 116 N -0.03 0.49 -0.76 0.92 3.57 -0.59 -2.59 116.94 117.95 3bil h PHE 116 Ca 0.38 -0.14 0.02 0.00 3.53 0.00 0.00 57.97 61.76 3bil h PHE 116 Cb 0.62 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.21 3bil h PHE 116 CO -0.73 0.76 0.49 -0.07 -2.23 0.00 0.00 178.31 176.54 3bil h LEU 117 N 0.08 0.84 -0.20 0.59 3.38 0.19 -2.22 115.31 117.97 3bil h LEU 117 Ca 0.03 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 3bil h LEU 117 Cb 0.66 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3bil h LEU 117 CO 0.04 0.59 -0.69 0.71 0.09 0.00 0.00 178.44 179.18 3bil h THR 118 N 0.99 1.25 0.00 0.22 1.35 -1.43 -2.98 112.91 112.30 3bil h THR 118 Ca 0.29 -2.58 -0.00 0.00 -0.55 0.00 0.00 66.41 63.57 3bil h THR 118 Cb -0.06 2.49 -0.00 0.00 -1.73 0.00 0.00 68.15 68.86 3bil h THR 118 CO -0.08 0.67 -0.00 0.28 -0.25 0.00 0.00 175.52 176.14 3bil h SER 119 N 0.00 0.00 -0.03 5.36 0.02 -0.98 -3.16 113.55 114.76 3bil h SER 119 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3bil h SER 119 Cb 1.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.98 3bil h SER 119 CO 0.09 0.00 0.00 1.41 -1.14 0.00 0.00 176.83 177.19 3bil n HIS 120 N -3.14 0.10 -2.98 3.45 8.25 -1.11 -5.01 115.22 114.78 3bil n HIS 120 Ca -0.03 -0.91 -0.12 0.00 -0.26 0.00 0.00 57.72 56.40 3bil n HIS 120 Cb 0.07 -0.15 0.05 0.00 1.12 0.00 0.00 29.99 31.08 3bil n HIS 120 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3bil n GLY 121 N -1.19 0.08 3.74 -1.41 0.00 -1.19 -5.03 105.19 100.19 3bil n GLY 121 Ca 0.14 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 3bil n GLY 121 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bil s VAL 122 N -3.18 4.06 0.27 1.61 -7.23 -1.23 -4.98 120.40 109.71 3bil s VAL 122 Ca 0.20 1.92 -0.03 0.00 -1.81 0.00 0.00 61.98 62.25 3bil s VAL 122 Cb -0.09 -4.22 0.18 0.00 0.56 0.00 0.00 36.38 32.81 3bil s VAL 122 CO 0.40 0.39 1.85 0.44 -0.31 0.00 0.00 175.10 177.87 3bil h ASP 123 N 4.64 0.91 -5.11 4.85 5.19 -1.53 -3.47 116.42 121.90 3bil h ASP 123 Ca -0.45 -0.12 -0.07 0.00 -0.62 0.00 0.00 57.03 55.77 3bil h ASP 123 Cb 1.21 -0.23 -0.14 0.00 0.18 0.00 0.00 39.33 40.35 3bil h ASP 123 CO 0.70 0.80 -0.21 -0.83 -3.12 0.00 0.00 179.24 176.58 3bil s GLY 124 N -3.48 -0.11 -0.13 2.75 0.00 -1.26 -4.40 107.32 100.68 3bil s GLY 124 Ca -0.11 -0.29 0.01 0.00 0.00 0.00 0.00 44.72 44.33 3bil s GLY 124 CO 0.81 -0.52 -0.14 -0.42 0.00 0.00 0.00 173.10 172.83 3bil s ILE 125 N -3.76 1.51 -0.15 0.90 1.01 -0.16 -0.33 121.20 120.21 3bil s ILE 125 Ca 0.03 -0.61 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 3bil s ILE 125 Cb 0.03 -1.42 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 3bil s ILE 125 CO -0.11 0.45 -0.01 -0.63 0.00 0.00 0.00 174.94 174.64 3bil s ILE 126 N 1.36 4.18 -0.07 2.92 1.01 -0.44 -0.92 121.20 129.24 3bil s ILE 126 Ca 0.02 -0.26 -0.17 0.00 0.00 0.00 0.00 60.65 60.24 3bil s ILE 126 Cb -0.13 -2.84 0.04 0.00 0.01 0.00 0.00 42.46 39.53 3bil s ILE 126 CO -0.08 0.50 0.40 0.00 0.00 0.00 0.00 174.94 175.76 3bil s VAL 128 N -0.73 4.86 0.16 0.00 1.01 -0.87 -0.59 120.40 124.24 3bil s VAL 128 Ca -0.08 -1.81 -0.31 0.00 0.00 0.00 0.00 61.98 59.78 3bil s VAL 128 Cb -0.04 -4.12 -0.09 0.00 0.00 0.00 0.00 36.38 32.13 3bil s VAL 128 CO 0.04 -0.86 1.46 -2.16 0.00 0.00 0.00 175.10 173.58 3bil s PRO 129 N 1.23 4.27 0.24 2.72 0.04 -1.26 -4.72 135.00 137.53 3bil s PRO 129 Ca 0.07 2.22 -0.30 0.00 0.04 0.00 0.00 61.00 63.03 3bil s PRO 129 Cb -0.25 -3.19 -0.09 0.00 0.04 0.00 0.00 34.50 31.01 3bil s PRO 129 CO -0.00 -0.49 1.06 1.21 0.04 0.00 0.00 177.00 178.81 3bil s ASN 130 N 0.99 7.37 0.35 6.66 3.84 -1.26 -4.87 114.94 128.03 3bil s ASN 130 Ca 0.66 2.14 0.06 0.00 0.21 0.00 0.00 52.86 55.92 3bil s ASN 130 Cb -0.40 -2.62 0.65 0.00 -0.55 0.00 0.00 41.25 38.33 3bil s ASN 130 CO 0.33 -0.08 1.89 -0.33 -2.79 0.00 0.00 177.10 176.11 3bil h GLU 131 N 4.21 0.46 -0.29 0.43 5.08 -1.94 -2.53 114.58 120.00 3bil h GLU 131 Ca -0.46 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 3bil h GLU 131 Cb 1.21 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.39 3bil h GLU 131 CO 0.68 0.51 0.00 0.39 -1.00 0.00 0.00 179.01 179.59 3bil n GLU 132 N -4.28 0.44 -0.05 2.33 1.02 -1.26 -1.89 120.64 116.94 3bil n GLU 132 Ca 0.01 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.16 3bil n GLU 132 Cb 0.25 -1.14 0.01 0.00 -0.02 0.00 0.00 31.44 30.53 3bil n GLU 132 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3bil h ALA 134 N 0.00 1.57 0.47 0.00 0.00 -1.51 -2.41 119.26 117.38 3bil h ALA 134 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3bil h ALA 134 Cb 0.88 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3bil h ALA 134 CO 0.00 0.15 -0.23 -0.91 0.00 0.00 0.00 179.25 178.26 3bil h ASN 135 N 0.93 -0.54 -0.35 0.00 2.35 -1.89 -2.74 115.58 113.35 3bil h ASN 135 Ca 0.52 -0.08 0.02 0.00 -0.55 0.00 0.00 56.30 56.21 3bil h ASN 135 Cb 0.61 0.14 -0.02 0.00 0.05 0.00 0.00 38.32 39.10 3bil h ASN 135 CO -0.30 -0.18 0.23 1.56 -1.65 0.00 0.00 177.43 177.09 3bil h GLN 136 N -0.93 0.37 0.00 0.81 4.20 -1.92 -1.24 115.11 116.40 3bil h GLN 136 Ca -0.06 -0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.55 3bil h GLN 136 Cb 0.59 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.27 3bil h GLN 136 CO 0.11 0.25 -0.35 -0.07 -0.67 0.00 0.00 178.83 178.09 3bil h LEU 137 N 0.38 0.00 0.02 1.46 3.38 -1.41 -2.67 115.31 116.47 3bil h LEU 137 Ca 0.14 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 3bil h LEU 137 Cb 0.08 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.84 3bil h LEU 137 CO -0.03 0.35 -0.25 -0.08 0.09 0.00 0.00 178.44 178.52 3bil h GLU 138 N 0.00 0.13 -0.73 1.13 4.57 -0.92 -3.27 114.58 115.49 3bil h GLU 138 Ca -0.00 -0.17 0.16 0.00 -1.18 0.00 0.00 59.36 58.17 3bil h GLU 138 Cb 0.83 0.06 -0.12 0.00 -0.16 0.00 0.00 28.75 29.36 3bil h GLU 138 CO 0.05 0.98 0.11 -0.44 -1.18 0.00 0.00 179.01 178.53 3bil h ASP 139 N -0.65 -0.12 -0.45 1.04 5.19 -1.41 -0.96 116.42 119.06 3bil h ASP 139 Ca -0.04 0.16 -0.02 0.00 -0.62 0.00 0.00 57.03 56.52 3bil h ASP 139 Cb 1.09 0.25 -0.02 0.00 0.18 0.00 0.00 39.33 40.82 3bil h ASP 139 CO 0.05 -0.09 0.24 -0.07 -3.12 0.00 0.00 179.24 176.24 3bil h LEU 140 N 0.20 0.60 -0.78 1.55 3.38 -1.59 0.59 115.31 119.26 3bil h LEU 140 Ca 0.41 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.32 3bil h LEU 140 Cb 0.71 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 3bil h LEU 140 CO -0.56 0.51 0.45 -0.61 0.09 0.00 0.00 178.44 178.32 3bil h GLN 141 N 0.68 1.08 0.00 1.13 4.15 -1.26 -0.46 115.11 120.43 3bil h GLN 141 Ca 0.17 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3bil h GLN 141 Cb 0.07 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 27.54 3bil h GLN 141 CO -0.02 0.78 0.00 0.87 -1.93 0.00 0.00 178.83 178.53 3bil h LYS 142 N 1.08 0.00 0.00 1.69 1.57 0.06 -3.39 116.57 117.58 3bil h LYS 142 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 3bil h LYS 142 Cb -0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3bil h LYS 142 CO -0.05 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.87 3bil n GLN 143 N -2.54 0.00 -3.61 3.15 6.02 -0.90 -5.09 117.38 114.41 3bil n GLN 143 Ca 0.01 0.12 -0.39 0.00 -0.01 0.00 0.00 57.00 56.73 3bil n GLN 143 Cb 0.21 -0.55 -0.11 0.00 1.02 0.00 0.00 30.24 30.81 3bil n GLN 143 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 3bil s MET 145 N -0.32 3.56 -0.25 -1.09 1.75 -0.19 -5.01 119.30 117.75 3bil s MET 145 Ca 0.00 -0.58 -0.28 0.00 -1.25 0.00 0.00 55.69 53.58 3bil s MET 145 Cb 0.00 -3.63 -0.04 0.00 2.84 0.00 0.00 34.83 34.00 3bil s MET 145 CO 0.00 -0.34 2.13 -2.14 -0.65 0.00 0.00 175.02 174.01 3bil s PRO 146 N 1.68 3.15 0.04 4.11 0.02 -1.26 -4.13 135.00 138.60 3bil s PRO 146 Ca 0.06 1.87 0.04 0.00 0.02 0.00 0.00 61.00 62.99 3bil s PRO 146 Cb -0.17 -4.34 -0.04 0.00 0.02 0.00 0.00 34.50 29.98 3bil s PRO 146 CO 0.08 -2.09 -0.06 0.14 -0.33 0.00 0.00 177.00 174.75 3bil s VAL 147 N 8.10 3.69 -0.02 3.83 -7.23 -1.26 -0.99 120.40 126.51 3bil s VAL 147 Ca 0.96 -0.90 0.00 0.00 -1.81 0.00 0.00 61.98 60.23 3bil s VAL 147 Cb -0.30 -2.66 0.02 0.00 0.56 0.00 0.00 36.38 34.01 3bil s VAL 147 CO 0.34 0.29 0.01 -0.69 -0.31 0.00 0.00 175.10 174.75 3bil s VAL 148 N -1.10 0.05 -0.06 1.32 1.01 -0.09 -4.44 120.40 117.09 3bil s VAL 148 Ca 0.20 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.26 3bil s VAL 148 Cb -0.11 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 3bil s VAL 148 CO 0.11 0.10 0.14 -0.76 0.00 0.00 0.00 175.10 174.68 3bil s LEU 149 N 0.85 4.26 0.05 3.92 1.43 -0.84 -0.40 118.68 127.95 3bil s LEU 149 Ca -0.08 0.35 0.05 0.00 -1.03 0.00 0.00 54.13 53.42 3bil s LEU 149 Cb -0.11 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.78 3bil s LEU 149 CO -0.02 0.33 -0.13 0.68 0.23 0.00 0.00 176.35 177.43 3bil s VAL 150 N -1.16 1.04 0.00 -1.59 -7.23 0.25 -1.28 120.40 110.42 3bil s VAL 150 Ca 0.21 -1.11 0.00 0.00 -1.81 0.00 0.00 61.98 59.27 3bil s VAL 150 Cb -0.12 -0.98 0.00 0.00 0.56 0.00 0.00 36.38 35.84 3bil s VAL 150 CO 0.11 -0.12 0.00 -0.67 -0.31 0.00 0.00 175.10 174.11 3bil n ASP 151 N 1.63 0.00 -4.61 4.85 4.64 -0.88 -4.37 116.55 117.81 3bil n ASP 151 Ca -0.20 0.00 -0.32 0.00 -1.38 0.00 0.00 54.79 52.90 3bil n ASP 151 Cb 0.55 0.00 -0.10 0.00 -1.04 0.00 0.00 41.12 40.53 3bil n ASP 151 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 3bil s ARG 152 N 0.00 2.51 -0.05 -0.67 0.52 -1.26 -4.63 118.95 115.36 3bil s ARG 152 Ca 0.00 -0.77 0.01 0.00 -0.52 0.00 0.00 55.73 54.45 3bil s ARG 152 Cb 0.00 -2.49 -0.03 0.00 0.52 0.00 0.00 34.95 32.95 3bil s ARG 152 CO 0.00 0.58 -0.07 -1.21 0.02 0.00 0.00 175.30 174.63 3bil s GLU 153 N -1.65 2.71 0.24 3.54 2.02 -1.26 -4.55 118.70 119.75 3bil s GLU 153 Ca 0.19 -0.59 -0.30 0.00 0.02 0.00 0.00 54.97 54.29 3bil s GLU 153 Cb -0.11 -2.57 -0.10 0.00 0.10 0.00 0.00 34.13 31.45 3bil s GLU 153 CO 0.10 0.65 1.46 -0.51 0.02 0.00 0.00 175.26 176.98 3bil s LEU 154 N -0.95 4.38 0.00 1.80 1.43 -1.26 -4.59 118.68 119.49 3bil s LEU 154 Ca 0.13 2.67 0.11 0.00 -1.03 0.00 0.00 54.13 56.02 3bil s LEU 154 Cb -0.11 -3.62 0.54 0.00 0.03 0.00 0.00 46.19 43.03 3bil s LEU 154 CO 0.03 -0.73 1.30 -0.81 0.23 0.00 0.00 176.35 176.37 3bil n PRO 155 N 2.55 0.10 0.00 1.29 -0.04 -1.26 -4.82 135.00 132.83 3bil n PRO 155 Ca 0.08 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.76 3bil n PRO 155 Cb 0.40 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 3bil n PRO 155 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3bil n GLY 156 N -0.34 3.42 0.00 0.55 0.00 -1.26 -5.21 105.19 102.36 3bil n GLY 156 Ca 0.04 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3bil n GLY 156 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3bil n ASP 157 N 0.00 0.00 0.00 1.61 9.92 -1.26 -5.14 116.55 121.68 3bil n ASP 157 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 3bil n ASP 157 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 3bil n ASP 157 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 3bil n THR 159 N 0.00 0.00 -1.85 -3.53 -2.24 -1.26 -5.16 114.28 100.24 3bil n THR 159 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 3bil n THR 159 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 3bil n THR 159 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3bil s ILE 160 N -0.47 2.91 0.22 2.28 1.01 -1.26 -4.90 121.20 120.99 3bil s ILE 160 Ca 0.00 0.33 -0.32 0.00 0.00 0.00 0.00 60.65 60.66 3bil s ILE 160 Cb 0.00 -3.21 -0.13 0.00 0.01 0.00 0.00 42.46 39.13 3bil s ILE 160 CO 0.00 -0.00 1.64 -2.65 0.00 0.00 0.00 174.94 173.93 3bil n PRO 161 N 5.83 2.56 -4.90 2.79 -0.02 -1.26 -4.80 135.00 135.20 3bil n PRO 161 Ca 0.17 0.92 -0.26 0.00 -2.02 0.00 0.00 63.50 62.31 3bil n PRO 161 Cb 0.40 -2.72 -0.15 0.00 -0.02 0.00 0.00 33.50 31.00 3bil n PRO 161 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3bil s THR 162 N 0.79 1.55 -0.22 3.45 -4.23 -1.26 -1.99 115.64 113.73 3bil s THR 162 Ca 0.73 -0.88 0.01 0.00 -1.18 0.00 0.00 61.69 60.37 3bil s THR 162 Cb -0.56 -1.30 0.03 0.00 1.34 0.00 0.00 72.50 72.02 3bil s THR 162 CO 0.38 0.40 -0.15 0.00 -0.54 0.00 0.00 174.62 174.71 3bil s ALA 163 N -0.51 2.47 0.19 3.99 0.00 -0.40 -1.47 121.76 126.04 3bil s ALA 163 Ca 0.07 -1.44 0.03 0.00 0.00 0.00 0.00 51.96 50.62 3bil s ALA 163 Cb -0.08 -1.40 -0.05 0.00 0.00 0.00 0.00 23.12 21.59 3bil s ALA 163 CO -0.00 -0.71 -0.02 0.95 0.00 0.00 0.00 175.76 175.98 3bil s THR 164 N 1.23 0.93 0.06 0.00 -4.23 -0.72 -2.07 115.64 110.84 3bil s THR 164 Ca -0.00 -2.02 -0.18 0.00 -1.18 0.00 0.00 61.69 58.31 3bil s THR 164 Cb -0.16 -2.15 -0.06 0.00 1.34 0.00 0.00 72.50 71.47 3bil s THR 164 CO -0.09 -0.48 0.52 -0.94 -0.54 0.00 0.00 174.62 173.09 3bil s SER 165 N -3.22 6.98 -0.40 3.99 1.04 -1.26 -1.46 113.70 119.37 3bil s SER 165 Ca 0.24 1.17 -0.22 0.00 0.48 0.00 0.00 55.95 57.62 3bil s SER 165 Cb 0.05 -2.32 0.01 0.00 0.10 0.00 0.00 66.02 63.86 3bil s SER 165 CO 0.05 0.28 0.72 0.21 0.98 0.00 0.00 173.24 175.48 3bil s ASN 166 N -1.13 6.44 0.04 7.02 2.47 0.23 -4.84 114.94 125.17 3bil s ASN 166 Ca 0.28 0.07 0.27 0.00 0.42 0.00 0.00 52.86 53.90 3bil s ASN 166 Cb -0.18 -2.36 0.91 0.00 -1.45 0.00 0.00 41.25 38.16 3bil s ASN 166 CO 0.17 -0.75 1.72 -0.81 -3.72 0.00 0.00 177.10 173.72 3bil n PRO 167 N 6.38 0.07 -0.09 0.43 -0.04 -1.26 -2.40 135.00 138.08 3bil n PRO 167 Ca 0.01 0.04 -0.10 0.00 -0.04 0.00 0.00 63.50 63.41 3bil n PRO 167 Cb 0.48 -1.56 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 3bil n PRO 167 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 3bil h GLN 168 N 0.00 0.45 -0.52 0.54 -0.00 -1.94 -2.07 115.11 111.57 3bil h GLN 168 Ca 0.00 -0.09 0.02 0.00 -0.00 0.00 0.00 58.65 58.58 3bil h GLN 168 Cb 0.56 -0.07 -0.03 0.00 0.00 0.00 0.00 27.48 27.94 3bil h GLN 168 CO 0.00 0.49 0.31 -1.35 0.00 0.00 0.00 178.83 178.28 3bil h PRO 169 N 0.31 0.60 -0.29 -2.39 0.11 -1.83 0.15 132.00 128.67 3bil h PRO 169 Ca 0.10 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 3bil h PRO 169 Cb 0.23 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.19 3bil h PRO 169 CO -0.00 0.40 0.02 0.78 -0.21 0.00 0.00 178.00 178.98 3bil h GLY 170 N 0.62 0.53 0.92 -0.55 0.00 -1.55 -2.29 103.07 100.76 3bil h GLY 170 Ca 0.21 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 3bil h GLY 170 CO -0.09 0.35 0.09 -2.22 0.00 0.00 0.00 176.54 174.67 3bil h ILE 171 N 0.29 1.13 -0.82 2.60 2.04 -1.26 0.67 117.51 122.16 3bil h ILE 171 Ca 0.08 -0.36 0.06 0.00 1.00 0.00 0.00 64.86 65.64 3bil h ILE 171 Cb 0.40 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 3bil h ILE 171 CO 0.01 0.12 0.50 0.00 0.00 0.00 0.00 178.15 178.78 3bil h ALA 172 N 0.96 1.13 -0.26 1.87 0.00 -0.76 0.24 119.26 122.44 3bil h ALA 172 Ca 0.07 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 3bil h ALA 172 Cb 0.11 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3bil h ALA 172 CO -0.01 0.23 -0.52 0.00 0.00 0.00 0.00 179.25 178.94 3bil h ALA 173 N 1.40 0.57 -0.40 0.00 0.00 -1.05 -0.63 119.26 119.15 3bil h ALA 173 Ca 0.36 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3bil h ALA 173 Cb 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3bil h ALA 173 CO -0.18 0.68 0.24 0.00 0.00 0.00 0.00 179.25 180.00 3bil h ALA 174 N 0.81 0.51 -0.12 0.00 0.00 -0.45 -0.59 119.26 119.41 3bil h ALA 174 Ca 0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3bil h ALA 174 Cb 1.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3bil h ALA 174 CO 0.11 -0.00 0.08 0.28 0.00 0.00 0.00 179.25 179.71 3bil h VAL 175 N 0.53 1.06 -0.55 0.00 2.07 -0.40 -0.32 116.25 118.64 3bil h VAL 175 Ca 0.14 -0.15 0.11 0.00 0.82 0.00 0.00 66.70 67.62 3bil h VAL 175 Cb -0.01 0.94 -0.11 0.00 -1.52 0.00 0.00 31.29 30.59 3bil h VAL 175 CO -0.03 0.05 -0.24 -0.33 0.02 0.00 0.00 177.57 177.05 3bil h GLU 176 N 0.14 -0.10 -0.82 1.57 4.39 -1.03 0.16 114.58 118.88 3bil h GLU 176 Ca 0.04 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 3bil h GLU 176 Cb 0.02 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.66 3bil h GLU 176 CO -0.01 -0.07 0.50 1.25 -1.16 0.00 0.00 179.01 179.53 3bil h LEU 177 N -0.10 0.98 -0.69 1.33 5.85 -0.84 -0.68 115.31 121.16 3bil h LEU 177 Ca 0.25 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 3bil h LEU 177 Cb 0.50 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 3bil h LEU 177 CO -0.62 0.75 0.35 -0.07 -0.34 0.00 0.00 178.44 178.52 3bil h LEU 178 N 1.13 0.88 -0.12 2.25 3.38 0.16 -2.52 115.31 120.47 3bil h LEU 178 Ca 0.30 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 3bil h LEU 178 Cb -0.05 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3bil h LEU 178 CO -0.06 0.74 0.04 0.00 0.09 0.00 0.00 178.44 179.26 3bil h ALA 179 N 1.17 0.16 -0.02 1.53 0.00 -0.04 -1.46 119.26 120.59 3bil h ALA 179 Ca 0.24 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3bil h ALA 179 Cb 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3bil h ALA 179 CO -0.03 -0.24 -0.00 0.45 0.00 0.00 0.00 179.25 179.42 3bil h HIS 180 N 0.02 0.02 -0.15 0.00 3.86 -1.12 -1.84 115.15 115.93 3bil h HIS 180 Ca 0.04 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3bil h HIS 180 Cb 0.20 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.66 3bil h HIS 180 CO -0.01 0.03 0.00 0.09 0.86 0.00 0.00 177.93 178.90 3bil n ASN 181 N -4.52 1.26 -4.26 2.45 3.02 -0.95 -4.93 115.26 107.33 3bil n ASN 181 Ca -0.03 -1.72 -0.35 0.00 -0.03 0.00 0.00 54.58 52.46 3bil n ASN 181 Cb 0.10 -0.10 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 3bil n ASN 181 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3bil n ASN 182 N 0.08 -1.71 -3.26 6.41 5.15 -0.69 -2.49 115.26 118.75 3bil n ASN 182 Ca 0.14 -1.11 -0.39 0.00 -0.60 0.00 0.00 54.58 52.62 3bil n ASN 182 Cb 0.25 -2.36 0.02 0.00 -0.53 0.00 0.00 39.78 37.16 3bil n ASN 182 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3bil n ALA 183 N -4.35 6.36 -2.51 5.20 0.00 -0.59 -4.69 120.51 119.93 3bil n ALA 183 Ca -0.05 -4.23 -0.25 0.00 0.00 0.00 0.00 53.44 48.90 3bil n ALA 183 Cb 0.55 -2.18 -0.10 0.00 0.00 0.00 0.00 19.45 17.72 3bil n ALA 183 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3bil s LEU 184 N -3.81 2.72 0.64 0.00 1.43 -1.26 -4.34 118.68 114.06 3bil s LEU 184 Ca 0.47 -0.83 -0.12 0.00 -1.03 0.00 0.00 54.13 52.62 3bil s LEU 184 Cb 0.30 -1.33 -0.02 0.00 0.03 0.00 0.00 46.19 45.16 3bil s LEU 184 CO -0.24 0.07 1.04 -2.16 0.23 0.00 0.00 176.35 175.29 3bil s PRO 185 N -3.18 3.35 -0.20 1.29 0.04 -1.26 -4.66 135.00 130.39 3bil s PRO 185 Ca 0.27 0.87 -0.11 0.00 0.04 0.00 0.00 61.00 62.06 3bil s PRO 185 Cb -0.07 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 3bil s PRO 185 CO 0.14 -0.77 0.19 0.42 0.04 0.00 0.00 177.00 177.03 3bil s ILE 186 N -3.05 5.36 -0.54 0.56 1.01 -1.26 -0.98 121.20 122.31 3bil s ILE 186 Ca 0.57 0.30 -0.18 0.00 0.00 0.00 0.00 60.65 61.35 3bil s ILE 186 Cb -0.12 -3.53 0.09 0.00 0.01 0.00 0.00 42.46 38.91 3bil s ILE 186 CO 0.52 0.40 0.59 -0.83 0.00 0.00 0.00 174.94 175.61 3bil s GLY 187 N 0.56 1.88 -0.09 6.18 0.00 0.88 -1.63 107.32 115.11 3bil s GLY 187 Ca 0.11 -2.13 -0.20 0.00 0.00 0.00 0.00 44.72 42.50 3bil s GLY 187 CO 0.01 1.38 0.55 -0.47 0.00 0.00 0.00 173.10 174.58 3bil s TYR 188 N 2.28 3.56 -0.49 1.90 5.04 -0.28 -1.18 117.35 128.16 3bil s TYR 188 Ca 0.10 1.03 -0.06 0.00 -2.44 0.00 0.00 57.07 55.69 3bil s TYR 188 Cb -0.24 -2.62 0.13 0.00 0.35 0.00 0.00 41.96 39.58 3bil s TYR 188 CO 0.07 0.18 0.34 -1.17 -1.34 0.00 0.00 175.55 173.63 3bil s LEU 189 N 0.53 5.55 1.01 6.97 2.96 0.87 -0.91 118.68 135.66 3bil s LEU 189 Ca 0.30 -2.14 -0.11 0.00 -0.22 0.00 0.00 54.13 51.95 3bil s LEU 189 Cb -0.16 -1.94 0.20 0.00 0.50 0.00 0.00 46.19 44.78 3bil s LEU 189 CO 0.13 -0.59 1.09 -0.55 -1.32 0.00 0.00 176.35 175.11 3bil s SER 190 N 2.08 2.28 0.50 3.68 0.15 0.92 -1.48 113.70 121.83 3bil s SER 190 Ca 0.09 1.76 0.07 0.00 0.70 0.00 0.00 55.95 58.56 3bil s SER 190 Cb -0.23 -2.37 0.03 0.00 -1.71 0.00 0.00 66.02 61.73 3bil s SER 190 CO -0.03 -3.43 0.46 -0.83 1.20 0.00 0.00 173.24 170.61 3bil s GLY 191 N -2.79 2.18 -0.08 9.45 0.00 -1.26 -2.74 107.32 112.08 3bil s GLY 191 Ca 0.67 -1.64 -0.40 0.00 0.00 0.00 0.00 44.72 43.35 3bil s GLY 191 CO 0.60 -1.81 1.32 -1.55 0.00 0.00 0.00 173.10 171.65 3bil n PRO 192 N -1.77 0.52 0.00 2.90 -0.04 -1.25 -4.43 135.00 130.93 3bil n PRO 192 Ca 0.03 0.19 0.15 0.00 -0.04 0.00 0.00 63.50 63.83 3bil n PRO 192 Cb 0.63 -1.76 0.81 0.00 -0.04 0.00 0.00 33.50 33.15 3bil n PRO 192 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3bil n MET 193 N 2.66 0.67 -0.09 0.54 2.81 -1.26 -2.74 117.12 119.70 3bil n MET 193 Ca 0.22 0.01 0.10 0.00 -1.81 0.00 0.00 57.70 56.21 3bil n MET 193 Cb 0.10 -1.50 0.34 0.00 -0.71 0.00 0.00 33.22 31.46 3bil n MET 193 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3bil n ASP 194 N -1.15 1.62 -4.58 7.83 5.68 -1.26 -4.69 116.55 119.99 3bil n ASP 194 Ca 0.18 -1.74 -0.32 0.00 -0.50 0.00 0.00 54.79 52.41 3bil n ASP 194 Cb 0.17 -0.12 -0.11 0.00 -1.14 0.00 0.00 41.12 39.92 3bil n ASP 194 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 3bil s THR 195 N -1.76 3.58 0.31 2.12 -4.23 -1.11 -4.78 115.64 109.78 3bil s THR 195 Ca 0.30 -0.80 0.01 0.00 -1.18 0.00 0.00 61.69 60.03 3bil s THR 195 Cb 0.16 -2.55 0.28 0.00 1.34 0.00 0.00 72.50 71.73 3bil s THR 195 CO 0.24 0.40 1.93 0.77 -0.54 0.00 0.00 174.62 177.42 3bil h SER 196 N 4.55 0.87 0.25 3.99 4.64 -1.89 -2.16 113.55 123.80 3bil h SER 196 Ca -0.48 -0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.84 3bil h SER 196 Cb 1.17 -0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 63.03 3bil h SER 196 CO 0.53 0.58 -0.48 0.74 -0.87 0.00 0.00 176.83 177.33 3bil h THR 197 N 1.00 0.06 -0.75 2.95 2.02 -1.91 0.17 112.91 116.45 3bil h THR 197 Ca 0.35 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.63 3bil h THR 197 Cb 0.13 0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 66.55 3bil h THR 197 CO -0.12 0.00 0.49 1.23 0.37 0.00 0.00 175.52 177.49 3bil h GLY 198 N -0.81 0.95 0.16 2.16 0.00 -1.50 -2.51 103.07 101.53 3bil h GLY 198 Ca -0.02 -0.28 -0.24 0.00 0.00 0.00 0.00 47.33 46.79 3bil h GLY 198 CO -0.20 0.17 -1.32 0.07 0.00 0.00 0.00 176.54 175.26 3bil h ARG 199 N 0.67 0.07 -0.89 4.80 0.11 -1.32 -3.05 114.38 114.77 3bil h ARG 199 Ca 0.34 -0.12 0.15 0.00 0.10 0.00 0.00 59.98 60.45 3bil h ARG 199 Cb 0.44 0.05 -0.15 0.00 1.11 0.00 0.00 29.97 31.42 3bil h ARG 199 CO -0.12 1.06 -0.31 0.39 0.10 0.00 0.00 179.97 181.09 3bil n GLU 200 N -4.23 -0.17 0.14 0.08 -0.58 0.58 -0.23 120.64 116.24 3bil n GLU 200 Ca -0.30 1.38 0.01 0.00 -0.42 0.00 0.00 57.16 57.83 3bil n GLU 200 Cb 0.75 -2.05 0.14 0.00 -0.57 0.00 0.00 31.44 29.72 3bil n GLU 200 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3bil h ARG 201 N 0.00 0.00 0.18 3.49 3.08 -1.59 -1.80 114.38 117.75 3bil h ARG 201 Ca 0.35 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 60.09 3bil h ARG 201 Cb 0.57 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.65 3bil h ARG 201 CO -0.90 0.56 -1.35 1.25 -1.07 0.00 0.00 179.97 178.47 3bil h LEU 202 N 0.00 0.81 -0.29 3.04 5.85 -1.03 -1.81 115.31 121.88 3bil h LEU 202 Ca -0.01 -0.81 0.06 0.00 0.84 0.00 0.00 57.88 57.97 3bil h LEU 202 Cb 1.22 -0.26 -0.08 0.00 0.37 0.00 0.00 40.66 41.91 3bil h LEU 202 CO 0.07 1.62 -0.36 -0.33 -0.34 0.00 0.00 178.44 179.11 3bil h GLU 203 N 0.20 -0.33 -0.86 1.25 5.08 -0.50 -1.45 114.58 117.97 3bil h GLU 203 Ca -0.21 0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.15 3bil h GLU 203 Cb 2.03 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 31.32 3bil h GLU 203 CO 0.25 -0.22 0.45 -0.44 -1.00 0.00 0.00 179.01 178.06 3bil h ASP 204 N -0.34 1.08 -0.27 1.42 3.45 -1.36 0.28 116.42 120.69 3bil h ASP 204 Ca 0.13 -0.10 -0.08 0.00 0.43 0.00 0.00 57.03 57.40 3bil h ASP 204 Cb 0.56 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.04 3bil h ASP 204 CO -0.48 0.88 -0.11 0.15 -1.57 0.00 0.00 179.24 178.12 3bil h PHE 205 N 1.21 0.74 0.19 4.55 3.57 -1.24 -1.14 116.94 124.82 3bil h PHE 205 Ca 0.30 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 3bil h PHE 205 Cb 0.05 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.60 3bil h PHE 205 CO 0.01 0.76 -0.09 0.87 -2.23 0.00 0.00 178.31 177.63 3bil h LYS 206 N 0.62 -0.24 -0.41 1.11 1.57 0.11 -2.30 116.57 117.02 3bil h LYS 206 Ca 0.11 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.96 3bil h LYS 206 Cb 0.55 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.86 3bil h LYS 206 CO 0.03 0.06 0.13 0.00 -0.57 0.00 0.00 179.45 179.10 3bil h ALA 207 N 0.19 0.48 -0.91 3.86 0.00 -1.13 -2.33 119.26 119.42 3bil h ALA 207 Ca -0.03 0.06 0.13 0.00 0.00 0.00 0.00 54.91 55.08 3bil h ALA 207 Cb 0.41 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.17 3bil h ALA 207 CO 0.04 -0.27 0.52 0.00 0.00 0.00 0.00 179.25 179.54 3bil h ALA 208 N 1.28 1.37 -0.60 0.00 0.00 -1.21 0.97 119.26 121.07 3bil h ALA 208 Ca 0.20 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 3bil h ALA 208 Cb 0.20 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3bil h ALA 208 CO -0.22 0.04 0.26 0.00 0.00 0.00 0.00 179.25 179.34 3bil h ALA 210 N 1.10 -0.30 -0.07 0.00 0.00 -0.83 -0.85 119.26 118.31 3bil h ALA 210 Ca 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3bil h ALA 210 Cb 0.16 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3bil h ALA 210 CO -0.02 -0.53 0.04 -0.97 0.00 0.00 0.00 179.25 177.77 3bil h ASN 211 N -0.58 0.09 0.25 0.00 -1.24 0.12 0.69 115.58 114.90 3bil h ASN 211 Ca -0.03 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.98 3bil h ASN 211 Cb 0.43 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.45 3bil h ASN 211 CO 0.05 0.07 -0.08 -1.20 -1.29 0.00 0.00 177.43 174.99 3bil n SER 212 N -4.52 0.54 -3.78 1.15 7.64 0.59 -4.96 113.62 110.29 3bil n SER 212 Ca -0.02 -0.77 -0.32 0.00 1.01 0.00 0.00 58.87 58.77 3bil n SER 212 Cb 0.09 -0.05 0.03 0.00 -1.01 0.00 0.00 64.21 63.27 3bil n SER 212 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3bil n LYS 213 N -0.80 -1.48 0.00 1.43 4.01 0.24 -4.92 118.16 116.63 3bil n LYS 213 Ca 0.17 0.40 0.05 0.00 -0.51 0.00 0.00 58.31 58.42 3bil n LYS 213 Cb 0.26 -4.00 0.02 0.00 -0.51 0.00 0.00 35.03 30.79 3bil n LYS 213 CO 0.00 0.00 0.00 0.44 -1.11 0.00 0.00 177.40 176.73 3bil n ILE 214 N -4.33 0.00 -0.00 -0.18 -5.35 -0.42 -5.03 119.36 104.04 3bil n ILE 214 Ca -0.13 -0.45 0.00 0.00 -0.27 0.00 0.00 62.75 61.90 3bil n ILE 214 Cb 0.60 1.16 -0.00 0.00 -1.74 0.00 0.00 39.64 39.66 3bil n ILE 214 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3bil n GLY 215 N 0.73 -1.81 3.76 3.28 0.00 -1.25 -4.90 105.19 105.01 3bil n GLY 215 Ca 0.05 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.15 3bil n GLY 215 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3bil s GLU 216 N -1.81 4.24 0.53 1.61 2.02 -1.26 -4.74 118.70 119.29 3bil s GLU 216 Ca 0.00 2.37 0.03 0.00 0.02 0.00 0.00 54.97 57.40 3bil s GLU 216 Cb 0.00 -3.05 0.03 0.00 0.10 0.00 0.00 34.13 31.22 3bil s GLU 216 CO 0.00 -0.38 0.29 1.04 0.02 0.00 0.00 175.26 176.23 3bil n GLN 217 N 1.19 0.72 -2.84 1.61 1.13 -1.26 -5.03 117.38 112.91 3bil n GLN 217 Ca 0.03 -3.43 -0.40 0.00 -1.94 0.00 0.00 57.00 51.26 3bil n GLN 217 Cb 0.40 0.53 -0.06 0.00 0.11 0.00 0.00 30.24 31.22 3bil n GLN 217 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3bil s LEU 218 N 0.00 4.59 -0.07 1.08 1.43 -0.64 -4.99 118.68 120.08 3bil s LEU 218 Ca 0.22 1.79 0.01 0.00 -1.03 0.00 0.00 54.13 55.12 3bil s LEU 218 Cb -0.02 -3.48 0.02 0.00 0.03 0.00 0.00 46.19 42.74 3bil s LEU 218 CO 0.14 0.13 -0.07 -0.69 0.23 0.00 0.00 176.35 176.08 3bil s VAL 219 N -0.89 0.84 -0.15 -1.59 1.01 -1.26 -1.13 120.40 117.23 3bil s VAL 219 Ca 0.40 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.08 3bil s VAL 219 Cb -0.24 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 3bil s VAL 219 CO 0.29 0.31 -0.02 0.12 0.00 0.00 0.00 175.10 175.80 3bil s PHE 220 N 1.13 3.06 -0.76 5.22 5.36 -0.08 -4.97 117.98 126.94 3bil s PHE 220 Ca -0.07 -0.20 -0.19 0.00 -0.96 0.00 0.00 56.93 55.52 3bil s PHE 220 Cb -0.14 -1.96 0.13 0.00 -0.34 0.00 0.00 43.02 40.71 3bil s PHE 220 CO -0.01 0.04 0.91 -0.51 -1.46 0.00 0.00 175.22 174.19 3bil s LEU 221 N 0.24 5.31 0.00 6.12 1.43 -1.26 -0.06 118.68 130.46 3bil s LEU 221 Ca -0.01 -1.77 0.00 0.00 -1.03 0.00 0.00 54.13 51.31 3bil s LEU 221 Cb -0.14 -2.34 0.00 0.00 0.03 0.00 0.00 46.19 43.74 3bil s LEU 221 CO 0.02 -1.07 0.00 0.61 0.23 0.00 0.00 176.35 176.15 3bil n GLY 222 N 5.17 0.78 0.00 -3.19 0.00 -1.11 -4.96 105.19 101.88 3bil n GLY 222 Ca 0.07 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3bil n GLY 222 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bil n GLY 223 N 5.00 0.51 0.93 -0.02 0.00 -1.26 -3.85 105.19 106.51 3bil n GLY 223 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.47 3bil n GLY 223 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3bil n TYR 224 N 0.00 0.00 -2.26 1.61 4.01 -1.26 -3.89 117.16 115.37 3bil n TYR 224 Ca 0.00 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.38 3bil n TYR 224 Cb 0.00 0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 39.04 3bil n TYR 224 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3bil s GLU 225 N -2.00 3.63 0.38 -0.72 8.01 -1.26 -4.92 118.70 121.81 3bil s GLU 225 Ca 0.00 1.72 0.11 0.00 0.01 0.00 0.00 54.97 56.82 3bil s GLU 225 Cb 0.00 -2.28 0.90 0.00 -4.31 0.00 0.00 34.13 28.44 3bil s GLU 225 CO 0.00 -0.65 1.88 0.37 0.01 0.00 0.00 175.26 176.87 3bil h GLN 226 N 1.77 0.58 -0.61 1.61 4.15 -1.98 -2.07 115.11 118.56 3bil h GLN 226 Ca -0.50 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 58.90 3bil h GLN 226 Cb 1.25 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 28.78 3bil h GLN 226 CO 0.59 0.38 0.40 1.03 -1.93 0.00 0.00 178.83 179.31 3bil h SER 227 N 0.60 0.69 -0.79 -0.69 0.87 -1.94 -1.49 113.55 110.80 3bil h SER 227 Ca 0.43 -0.02 0.06 0.00 -1.23 0.00 0.00 61.79 61.03 3bil h SER 227 Cb 0.78 -0.17 -0.05 0.00 -0.44 0.00 0.00 62.40 62.52 3bil h SER 227 CO -0.18 0.50 0.52 0.58 -0.53 0.00 0.00 176.83 177.72 3bil h VAL 228 N 0.82 1.05 0.07 2.23 2.07 -1.75 0.01 116.25 120.75 3bil h VAL 228 Ca 0.23 -0.30 -0.27 0.00 0.82 0.00 0.00 66.70 67.18 3bil h VAL 228 Cb -0.08 0.10 0.02 0.00 -1.52 0.00 0.00 31.29 29.81 3bil h VAL 228 CO -0.05 0.16 -1.08 1.23 0.02 0.00 0.00 177.57 177.84 3bil h GLY 229 N 0.88 0.69 0.65 2.17 0.00 -1.40 0.52 103.07 106.58 3bil h GLY 229 Ca 0.34 -1.34 0.07 0.00 0.00 0.00 0.00 47.33 46.40 3bil h GLY 229 CO -0.12 1.18 0.48 -2.75 0.00 0.00 0.00 176.54 175.34 3bil h PHE 230 N 0.24 0.89 0.05 5.60 3.57 -1.00 0.38 116.94 126.67 3bil h PHE 230 Ca -0.16 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.37 3bil h PHE 230 Cb 1.76 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 40.22 3bil h PHE 230 CO 0.12 0.42 -0.02 1.49 -2.23 0.00 0.00 178.31 178.09 3bil h GLU 231 N 0.86 -0.06 -0.48 1.11 4.57 -0.95 -1.66 114.58 117.97 3bil h GLU 231 Ca 0.37 0.00 0.09 0.00 -1.18 0.00 0.00 59.36 58.64 3bil h GLU 231 Cb 0.23 0.01 -0.10 0.00 -0.16 0.00 0.00 28.75 28.73 3bil h GLU 231 CO -0.20 0.54 -0.31 0.78 -1.18 0.00 0.00 179.01 178.65 3bil h GLY 232 N -0.74 -0.13 1.57 1.92 0.00 -0.77 -1.09 103.07 103.84 3bil h GLY 232 Ca -0.01 0.39 -0.10 0.00 0.00 0.00 0.00 47.33 47.62 3bil h GLY 232 CO 0.01 -0.21 -0.27 0.00 0.00 0.00 0.00 176.54 176.07 3bil h ALA 233 N 0.93 1.06 -0.20 3.60 0.00 -0.23 -1.47 119.26 122.94 3bil h ALA 233 Ca 0.20 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.67 3bil h ALA 233 Cb 0.53 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3bil h ALA 233 CO -0.59 0.58 -0.22 1.15 0.00 0.00 0.00 179.25 180.17 3bil h THR 234 N 0.44 1.24 -0.12 0.00 2.02 -0.78 -2.43 112.91 113.28 3bil h THR 234 Ca 0.06 -1.12 -0.20 0.00 0.77 0.00 0.00 66.41 65.91 3bil h THR 234 Cb 0.71 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 3bil h THR 234 CO 0.05 0.35 -0.75 0.11 0.37 0.00 0.00 175.52 175.66 3bil h LYS 235 N 0.32 0.60 -0.75 6.66 1.57 -0.32 -2.21 116.57 122.45 3bil h LYS 235 Ca 0.05 -0.49 0.04 0.00 -1.87 0.00 0.00 60.65 58.39 3bil h LYS 235 Cb 0.57 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.93 3bil h LYS 235 CO 0.04 1.11 0.46 -0.07 -0.57 0.00 0.00 179.45 180.42 3bil h LEU 236 N 0.42 0.74 -0.89 2.94 3.38 -1.16 -0.59 115.31 120.14 3bil h LEU 236 Ca -0.04 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3bil h LEU 236 Cb 1.35 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.93 3bil h LEU 236 CO 0.14 0.50 0.01 -0.07 0.09 0.00 0.00 178.44 179.11 3bil h LEU 237 N 0.88 0.79 -0.31 1.67 3.38 -1.42 0.14 115.31 120.44 3bil h LEU 237 Ca 0.31 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.10 3bil h LEU 237 Cb 0.08 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3bil h LEU 237 CO -0.14 0.85 0.18 0.44 0.09 0.00 0.00 178.44 179.86 3bil h ASP 238 N 0.77 0.29 0.00 -0.43 3.32 -0.85 -2.82 116.42 116.69 3bil h ASP 238 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3bil h ASP 238 Cb 0.45 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3bil h ASP 238 CO 0.02 0.21 0.00 0.00 -1.72 0.00 0.00 179.24 177.75 3bil n GLN 239 N -4.92 0.70 0.00 3.56 6.02 -0.28 -4.83 117.38 117.64 3bil n GLN 239 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 3bil n GLN 239 Cb 0.05 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 30.10 3bil n GLN 239 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3bil n GLY 240 N 0.28 0.63 3.64 1.08 0.00 -0.81 -5.05 105.19 104.97 3bil n GLY 240 Ca 0.07 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.63 3bil n GLY 240 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bil n ALA 241 N -1.86 0.57 0.62 4.61 0.00 0.41 -4.58 120.51 120.28 3bil n ALA 241 Ca 0.00 0.43 0.07 0.00 0.00 0.00 0.00 53.44 53.94 3bil n ALA 241 Cb 0.00 -2.21 0.01 0.00 0.00 0.00 0.00 19.45 17.25 3bil n ALA 241 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3bil n LYS 242 N 2.10 1.72 -3.84 0.00 5.02 -0.15 -4.63 118.16 118.38 3bil n LYS 242 Ca 0.13 -0.82 -0.13 0.00 -2.02 0.00 0.00 58.31 55.48 3bil n LYS 242 Cb 0.29 -1.22 -0.14 0.00 -0.02 0.00 0.00 35.03 33.94 3bil n LYS 242 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3bil s THR 243 N -1.65 -0.01 -0.14 -0.18 2.01 -1.06 -1.36 115.64 113.25 3bil s THR 243 Ca 0.12 0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.18 3bil s THR 243 Cb 0.11 -0.06 -0.01 0.00 0.01 0.00 0.00 72.50 72.56 3bil s THR 243 CO 0.33 0.02 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.37 3bil s LEU 244 N 0.26 2.57 -0.33 4.42 1.43 0.23 -0.08 118.68 127.18 3bil s LEU 244 Ca -0.02 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.68 3bil s LEU 244 Cb -0.03 -1.58 0.10 0.00 0.03 0.00 0.00 46.19 44.72 3bil s LEU 244 CO -0.01 0.13 0.10 0.12 0.23 0.00 0.00 176.35 176.93 3bil s PHE 245 N 0.54 2.25 0.47 0.29 5.99 -0.32 -0.77 117.98 126.43 3bil s PHE 245 Ca -0.09 -2.13 -0.16 0.00 0.00 0.00 0.00 56.93 54.54 3bil s PHE 245 Cb -0.16 -2.04 -0.08 0.00 0.00 0.00 0.00 43.02 40.74 3bil s PHE 245 CO 0.04 -0.88 0.93 0.00 -0.00 0.00 0.00 175.22 175.30 3bil s ALA 246 N 1.29 3.12 -0.71 11.12 0.00 -0.55 -0.09 121.76 135.95 3bil s ALA 246 Ca 0.11 0.14 0.08 0.00 0.00 0.00 0.00 51.96 52.29 3bil s ALA 246 Cb -0.18 -3.04 0.23 0.00 0.00 0.00 0.00 23.12 20.13 3bil s ALA 246 CO -0.18 -0.11 1.18 0.41 0.00 0.00 0.00 175.76 177.06 3bil n GLY 247 N -1.32 2.72 3.19 0.00 0.00 -0.55 -4.32 105.19 104.91 3bil n GLY 247 Ca 0.06 -0.28 -0.09 0.00 0.00 0.00 0.00 46.02 45.70 3bil n GLY 247 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3bil s ASP 248 N -0.99 0.12 0.16 1.61 1.01 -1.26 -4.77 116.67 112.54 3bil s ASP 248 Ca 0.17 -0.60 -0.28 0.00 0.71 0.00 0.00 52.55 52.56 3bil s ASP 248 Cb 0.09 0.32 -0.02 0.00 1.01 0.00 0.00 42.92 44.32 3bil s ASP 248 CO 0.12 -0.67 1.56 0.28 0.21 0.00 0.00 175.17 176.66 3bil h SER 249 N 2.97 -1.68 -0.58 0.27 0.02 -1.95 -0.17 113.55 112.43 3bil h SER 249 Ca -0.33 0.26 -0.09 0.00 -0.84 0.00 0.00 61.79 60.78 3bil h SER 249 Cb 1.19 0.74 -0.02 0.00 0.14 0.00 0.00 62.40 64.45 3bil h SER 249 CO 0.55 -0.35 -0.01 0.24 -1.14 0.00 0.00 176.83 176.12 3bil h MET 250 N -0.25 1.02 -0.46 3.45 2.86 -1.93 -0.27 114.93 119.35 3bil h MET 250 Ca 0.15 -0.33 0.01 0.00 -2.06 0.00 0.00 59.70 57.47 3bil h MET 250 Cb 0.56 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 3bil h MET 250 CO -0.69 1.01 0.31 0.52 1.06 0.00 0.00 176.91 179.12 3bil h MET 251 N 0.91 0.60 -0.51 1.72 2.86 -1.88 -2.58 114.93 116.06 3bil h MET 251 Ca 0.16 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.67 3bil h MET 251 Cb 0.56 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 3bil h MET 251 CO 0.03 0.40 -0.06 1.15 1.06 0.00 0.00 176.91 179.49 3bil h THR 252 N 0.62 1.26 0.02 2.22 2.02 0.73 -0.40 112.91 119.39 3bil h THR 252 Ca 0.17 -1.16 0.02 0.00 0.77 0.00 0.00 66.41 66.21 3bil h THR 252 Cb -0.06 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 3bil h THR 252 CO -0.04 0.41 -0.11 0.40 0.37 0.00 0.00 175.52 176.55 3bil h ILE 253 N 0.82 0.74 -0.94 3.11 2.04 -1.10 -2.39 117.51 119.78 3bil h ILE 253 Ca 0.14 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.13 3bil h ILE 253 Cb 0.57 0.74 -0.08 0.00 -0.74 0.00 0.00 36.82 37.31 3bil h ILE 253 CO 0.03 0.00 0.60 1.23 0.00 0.00 0.00 178.15 180.01 3bil h GLY 254 N -0.20 1.42 0.96 5.37 0.00 -1.04 0.23 103.07 109.81 3bil h GLY 254 Ca 0.03 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 46.97 3bil h GLY 254 CO -0.09 0.12 0.17 -2.08 0.00 0.00 0.00 176.54 174.66 3bil h VAL 255 N 0.83 1.21 0.08 4.60 2.07 -1.03 0.16 116.25 124.19 3bil h VAL 255 Ca 0.47 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 3bil h VAL 255 Cb 0.61 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3bil h VAL 255 CO -0.24 0.25 -0.04 0.40 0.02 0.00 0.00 177.57 177.96 3bil h ILE 256 N 0.60 1.03 -0.45 4.57 2.04 -0.65 -0.89 117.51 123.76 3bil h ILE 256 Ca 0.15 -0.39 0.07 0.00 1.00 0.00 0.00 64.86 65.69 3bil h ILE 256 Cb 0.22 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 3bil h ILE 256 CO -0.01 0.10 0.11 -0.08 0.00 0.00 0.00 178.15 178.26 3bil h GLU 257 N -0.29 0.24 -0.73 2.37 4.81 -0.54 0.23 114.58 120.67 3bil h GLU 257 Ca -0.01 -0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.30 3bil h GLU 257 Cb 0.24 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.49 3bil h GLU 257 CO 0.02 0.16 0.36 0.00 -0.73 0.00 0.00 179.01 178.82 3bil h ALA 258 N 1.33 1.02 -0.08 2.92 0.00 -0.57 0.29 119.26 124.17 3bil h ALA 258 Ca 0.22 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.05 3bil h ALA 258 Cb 0.26 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3bil h ALA 258 CO -0.27 -0.05 -0.56 0.00 0.00 0.00 0.00 179.25 178.37 3bil h HIS 260 N 0.17 -0.53 -0.61 0.00 6.17 -0.59 0.88 115.15 120.65 3bil h HIS 260 Ca -0.00 -0.01 0.09 0.00 0.71 0.00 0.00 60.37 61.16 3bil h HIS 260 Cb 1.03 0.17 -0.07 0.00 2.52 0.00 0.00 27.41 31.07 3bil h HIS 260 CO 0.02 -0.23 0.24 0.87 0.71 0.00 0.00 177.93 179.54 3bil h LYS 261 N -1.05 0.41 0.00 5.26 1.57 -0.49 -1.42 116.57 120.86 3bil h LYS 261 Ca -0.06 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3bil h LYS 261 Cb 0.53 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3bil h LYS 261 CO 0.10 0.27 0.00 0.00 -0.57 0.00 0.00 179.45 179.25 3bil n ALA 262 N -2.46 1.82 -1.43 3.86 0.00 -0.66 -4.88 120.51 116.76 3bil n ALA 262 Ca 0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 53.44 53.42 3bil n ALA 262 Cb 0.27 -1.21 -0.01 0.00 0.00 0.00 0.00 19.45 18.49 3bil n ALA 262 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3bil n GLY 263 N -0.17 0.54 3.75 0.00 0.00 -0.53 -5.05 105.19 103.73 3bil n GLY 263 Ca 0.07 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.91 3bil n GLY 263 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bil s LEU 264 N -1.04 4.06 -0.46 0.99 1.43 0.30 -5.01 118.68 118.96 3bil s LEU 264 Ca 0.00 0.26 -0.28 0.00 -1.03 0.00 0.00 54.13 53.08 3bil s LEU 264 Cb 0.00 -2.00 0.03 0.00 0.03 0.00 0.00 46.19 44.24 3bil s LEU 264 CO 0.00 0.29 1.09 -0.69 0.23 0.00 0.00 176.35 177.28 3bil s VAL 265 N -0.34 4.28 0.47 -1.59 1.01 -1.26 -4.45 120.40 118.52 3bil s VAL 265 Ca 0.10 1.20 -0.23 0.00 0.00 0.00 0.00 61.98 63.05 3bil s VAL 265 Cb -0.12 -4.56 -0.08 0.00 0.00 0.00 0.00 36.38 31.62 3bil s VAL 265 CO 0.01 -0.92 1.12 -0.38 0.00 0.00 0.00 175.10 174.93 3bil n ILE 266 N 6.67 2.90 -0.67 2.22 5.41 -1.26 0.87 119.36 135.50 3bil n ILE 266 Ca 0.11 -0.50 0.00 0.00 1.00 0.00 0.00 62.75 63.36 3bil n ILE 266 Cb 0.49 -1.34 0.00 0.00 -0.71 0.00 0.00 39.64 38.08 3bil n ILE 266 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3bil n GLY 267 N 1.05 0.30 1.39 7.39 0.00 -0.68 -4.67 105.19 109.96 3bil n GLY 267 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3bil n GLY 267 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3bil n LYS 268 N -1.92 0.00 -0.00 1.61 3.00 -0.43 -4.56 118.16 115.86 3bil n LYS 268 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 58.31 58.39 3bil n LYS 268 Cb 0.02 -0.31 -0.11 0.00 0.00 0.00 0.00 35.03 34.63 3bil n LYS 268 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3bil n ASP 269 N -2.92 1.01 -3.59 3.14 8.00 0.25 -4.97 116.55 117.47 3bil n ASP 269 Ca 0.00 -0.40 -0.14 0.00 0.71 0.00 0.00 54.79 54.96 3bil n ASP 269 Cb 0.26 1.41 -0.06 0.00 -0.02 0.00 0.00 41.12 42.71 3bil n ASP 269 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3bil s VAL 270 N -2.86 0.03 -0.03 2.53 0.11 -1.21 -4.96 120.40 114.02 3bil s VAL 270 Ca -0.01 -0.25 -0.05 0.00 -2.93 0.00 0.00 61.98 58.74 3bil s VAL 270 Cb 0.11 -0.94 -0.04 0.00 -1.53 0.00 0.00 36.38 33.98 3bil s VAL 270 CO 0.67 -0.14 0.20 -0.44 -3.33 0.00 0.00 175.10 172.06 3bil s SER 271 N -1.81 6.42 -0.03 3.54 0.01 -0.46 -1.68 113.70 119.69 3bil s SER 271 Ca -0.07 0.45 0.05 0.00 1.31 0.00 0.00 55.95 57.70 3bil s SER 271 Cb -0.01 -2.05 -0.01 0.00 0.21 0.00 0.00 66.02 64.16 3bil s SER 271 CO 0.00 0.30 -0.18 -0.69 0.41 0.00 0.00 173.24 173.08 3bil s VAL 272 N -1.24 1.47 -0.17 3.43 1.01 0.11 -0.61 120.40 124.41 3bil s VAL 272 Ca 0.24 -0.77 -0.00 0.00 0.00 0.00 0.00 61.98 61.45 3bil s VAL 272 Cb -0.13 -1.24 0.00 0.00 0.00 0.00 0.00 36.38 35.02 3bil s VAL 272 CO 0.14 0.42 -0.15 -0.63 0.00 0.00 0.00 175.10 174.88 3bil s ILE 273 N -0.24 2.63 0.42 2.22 -1.09 0.05 -4.37 121.20 120.82 3bil s ILE 273 Ca 0.03 -0.77 0.08 0.00 -2.23 0.00 0.00 60.65 57.75 3bil s ILE 273 Cb -0.09 -2.12 -0.00 0.00 -1.58 0.00 0.00 42.46 38.66 3bil s ILE 273 CO 0.01 0.51 0.48 -0.83 -1.23 0.00 0.00 174.94 173.87 3bil s GLY 274 N 0.96 2.04 -0.06 6.18 0.00 -0.39 -1.48 107.32 114.57 3bil s GLY 274 Ca -0.03 -1.78 0.04 0.00 0.00 0.00 0.00 44.72 42.96 3bil s GLY 274 CO -0.02 -1.59 -0.19 -0.12 0.00 0.00 0.00 173.10 171.17 3bil s PHE 275 N -2.41 1.99 0.19 1.90 5.36 -1.26 -1.82 117.98 121.92 3bil s PHE 275 Ca 0.52 -0.66 0.00 0.00 -0.96 0.00 0.00 56.93 55.82 3bil s PHE 275 Cb -0.07 -1.34 0.00 0.00 -0.34 0.00 0.00 43.02 41.27 3bil s PHE 275 CO 0.30 -0.25 0.00 -0.25 -1.46 0.00 0.00 175.22 173.57 3bil n ASP 276 N 3.30 -2.78 -0.76 6.13 8.00 -0.46 -3.49 116.55 126.49 3bil n ASP 276 Ca -0.19 0.43 0.12 0.00 0.71 0.00 0.00 54.79 55.86 3bil n ASP 276 Cb 0.53 -1.63 0.31 0.00 -0.02 0.00 0.00 41.12 40.30 3bil n ASP 276 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3bil n THR 277 N -2.95 0.10 -0.23 -3.53 -2.24 -1.26 -4.78 114.28 99.40 3bil n THR 277 Ca -0.02 -0.42 -0.09 0.00 -2.27 0.00 0.00 64.05 61.25 3bil n THR 277 Cb 0.23 0.91 -0.01 0.00 -2.10 0.00 0.00 70.33 69.36 3bil n THR 277 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3bil n HIS 278 N 0.80 0.13 -0.33 4.78 -0.00 -1.26 -4.74 115.22 114.60 3bil n HIS 278 Ca 0.17 0.16 0.17 0.00 0.46 0.00 0.00 57.72 58.68 3bil n HIS 278 Cb 0.48 -0.31 0.37 0.00 -0.12 0.00 0.00 29.99 30.41 3bil n HIS 278 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3bil h PRO 279 N 0.50 0.47 0.00 1.57 0.13 -2.02 -1.16 132.00 131.50 3bil h PRO 279 Ca -0.07 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 3bil h PRO 279 Cb 0.21 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.23 3bil h PRO 279 CO 0.10 0.31 0.00 -0.07 -0.23 0.00 0.00 178.00 178.12 3bil h LEU 280 N 0.49 0.00 -1.01 1.56 3.38 -1.99 -2.65 115.31 115.09 3bil h LEU 280 Ca 0.63 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.54 3bil h LEU 280 Cb 1.23 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 3bil h LEU 280 CO -0.51 0.00 0.02 -0.26 0.09 0.00 0.00 178.44 177.78 3bil h PHE 281 N 0.00 0.77 0.00 1.13 0.05 -1.50 -3.00 116.94 114.40 3bil h PHE 281 Ca 0.00 -0.09 0.00 0.00 3.82 0.00 0.00 57.97 61.70 3bil h PHE 281 Cb 0.46 -0.22 0.00 0.00 2.00 0.00 0.00 35.95 38.20 3bil h PHE 281 CO 0.00 0.71 0.00 0.00 -0.18 0.00 0.00 178.31 178.84 3bil n ALA 282 N -2.47 2.01 -0.11 2.45 0.00 -1.00 -2.64 120.51 118.76 3bil n ALA 282 Ca 0.03 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3bil n ALA 282 Cb 0.27 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.39 3bil n ALA 282 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3bil n LEU 283 N -1.38 1.70 -4.53 0.00 4.77 -1.13 -4.64 117.00 111.78 3bil n LEU 283 Ca 0.08 -1.70 -0.33 0.00 -0.03 0.00 0.00 56.01 54.02 3bil n LEU 283 Cb 0.20 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.41 3bil n LEU 283 CO 0.17 0.43 0.26 0.00 -1.33 0.00 0.00 177.39 176.92 3bil n GLN 284 N -0.40 -0.09 -0.15 3.23 1.13 -1.22 -4.92 117.38 114.96 3bil n GLN 284 Ca 0.00 0.03 0.20 0.00 -1.94 0.00 0.00 57.00 55.29 3bil n GLN 284 Cb 0.25 -2.07 0.58 0.00 0.11 0.00 0.00 30.24 29.12 3bil n GLN 284 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 3bil h PRO 285 N -1.23 0.25 -4.56 -1.09 0.13 -1.95 -3.21 132.00 120.34 3bil h PRO 285 Ca -0.44 -0.01 -0.64 0.00 -0.87 0.00 0.00 66.00 64.03 3bil h PRO 285 Cb 1.30 -0.06 -0.38 0.00 0.13 0.00 0.00 31.00 31.99 3bil h PRO 285 CO 0.40 0.16 -0.77 -1.01 -0.23 0.00 0.00 178.00 176.55 3bil s HIS 286 N -5.26 3.05 0.82 1.56 3.76 -1.26 -5.11 115.29 112.85 3bil s HIS 286 Ca -0.07 -2.33 -0.14 0.00 -0.15 0.00 0.00 55.06 52.37 3bil s HIS 286 Cb 0.21 -2.12 0.03 0.00 1.11 0.00 0.00 32.58 31.82 3bil s HIS 286 CO 0.76 -0.87 0.78 -2.30 -0.85 0.00 0.00 174.74 172.26 3bil n PRO 287 N 4.48 0.09 -3.31 8.40 -0.02 -1.22 -4.60 135.00 138.82 3bil n PRO 287 Ca -0.07 0.09 -0.39 0.00 -2.02 0.00 0.00 63.50 61.11 3bil n PRO 287 Cb 0.43 -2.09 -0.07 0.00 -0.02 0.00 0.00 33.50 31.74 3bil n PRO 287 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3bil s LEU 288 N -2.74 4.14 0.19 2.45 1.02 -1.08 -1.41 118.68 121.26 3bil s LEU 288 Ca 0.66 0.59 -0.32 0.00 0.02 0.00 0.00 54.13 55.08 3bil s LEU 288 Cb -0.29 -2.62 -0.12 0.00 0.02 0.00 0.00 46.19 43.18 3bil s LEU 288 CO 0.58 -0.14 1.71 0.41 0.02 0.00 0.00 176.35 178.92 3bil n THR 289 N 4.50 0.04 -4.07 5.49 -1.04 -1.26 -4.58 114.28 113.37 3bil n THR 289 Ca -0.06 -0.01 -0.09 0.00 -2.04 0.00 0.00 64.05 61.85 3bil n THR 289 Cb 0.51 -1.90 -0.09 0.00 -1.82 0.00 0.00 70.33 67.02 3bil n THR 289 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 3bil s VAL 290 N 1.30 0.12 -0.32 12.58 -7.23 -1.10 -1.27 120.40 124.49 3bil s VAL 290 Ca 0.77 -1.70 -0.12 0.00 -1.81 0.00 0.00 61.98 59.11 3bil s VAL 290 Cb -0.54 -1.82 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 3bil s VAL 290 CO 0.34 -0.56 0.23 -0.63 -0.31 0.00 0.00 175.10 174.17 3bil s ILE 291 N -3.98 5.29 -0.01 -0.62 1.01 -0.76 -1.45 121.20 120.67 3bil s ILE 291 Ca 0.17 -0.06 -0.15 0.00 0.00 0.00 0.00 60.65 60.62 3bil s ILE 291 Cb 0.06 -3.66 -0.06 0.00 0.01 0.00 0.00 42.46 38.82 3bil s ILE 291 CO -0.02 0.08 0.40 -0.62 0.00 0.00 0.00 174.94 174.77 3bil s ASP 292 N 1.73 6.78 0.00 3.58 2.15 0.12 -1.35 116.67 129.68 3bil s ASP 292 Ca 0.07 0.93 0.16 0.00 0.43 0.00 0.00 52.55 54.14 3bil s ASP 292 Cb -0.17 -2.25 0.08 0.00 -0.30 0.00 0.00 42.92 40.28 3bil s ASP 292 CO 0.11 0.30 0.94 0.00 -0.17 0.00 0.00 175.17 176.35 3bil n GLN 293 N 1.99 1.43 -3.26 4.34 6.02 -1.26 -0.97 117.38 125.67 3bil n GLN 293 Ca -0.14 -1.21 -0.15 0.00 -0.01 0.00 0.00 57.00 55.49 3bil n GLN 293 Cb 0.52 -1.29 0.07 0.00 1.02 0.00 0.00 30.24 30.56 3bil n GLN 293 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3bil n ASN 294 N 0.52 -6.65 -0.28 1.08 2.85 -1.26 -4.83 115.26 106.68 3bil n ASN 294 Ca 0.08 -0.69 0.12 0.00 -0.11 0.00 0.00 54.58 53.98 3bil n ASN 294 Cb 0.37 -5.13 0.37 0.00 1.24 0.00 0.00 39.78 36.64 3bil n ASN 294 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 3bil h VAL 295 N -1.04 0.82 -0.54 3.44 2.07 -1.97 -2.38 116.25 116.66 3bil h VAL 295 Ca -0.58 -0.24 0.01 0.00 0.82 0.00 0.00 66.70 66.71 3bil h VAL 295 Cb 1.30 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.10 3bil h VAL 295 CO 0.43 0.13 0.35 -0.08 0.02 0.00 0.00 177.57 178.42 3bil h GLU 296 N 0.70 0.69 -0.16 1.57 4.81 -1.93 -1.75 114.58 118.50 3bil h GLU 296 Ca 0.46 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.50 3bil h GLU 296 Cb 0.74 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 3bil h GLU 296 CO -0.22 0.45 -0.53 0.37 -0.73 0.00 0.00 179.01 178.35 3bil h GLN 297 N 0.71 0.47 -0.33 1.92 4.15 -1.80 -0.11 115.11 120.11 3bil h GLN 297 Ca 0.20 -0.29 -0.06 0.00 0.77 0.00 0.00 58.65 59.27 3bil h GLN 297 Cb -0.06 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 3bil h GLN 297 CO -0.06 0.88 -0.04 -0.07 -1.93 0.00 0.00 178.83 177.62 3bil h LEU 298 N 0.36 0.61 -0.32 -2.39 3.38 -1.34 0.70 115.31 116.31 3bil h LEU 298 Ca 0.01 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.63 3bil h LEU 298 Cb 1.05 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 3bil h LEU 298 CO 0.10 0.80 0.13 0.00 0.09 0.00 0.00 178.44 179.56 3bil h ALA 299 N 0.83 0.41 0.13 1.53 0.00 -1.28 0.15 119.26 121.04 3bil h ALA 299 Ca 0.09 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3bil h ALA 299 Cb 0.51 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3bil h ALA 299 CO 0.02 0.01 -0.38 1.96 0.00 0.00 0.00 179.25 180.86 3bil h GLN 300 N 0.37 -0.56 -0.75 0.00 7.50 -0.95 -1.74 115.11 118.98 3bil h GLN 300 Ca 0.11 0.04 0.13 0.00 0.50 0.00 0.00 58.65 59.42 3bil h GLN 300 Cb 0.17 0.13 -0.09 0.00 0.05 0.00 0.00 27.48 27.74 3bil h GLN 300 CO -0.01 -0.37 0.32 0.00 -1.50 0.00 0.00 178.83 177.27 3bil h ARG 301 N -0.58 0.48 -0.31 1.46 2.47 -0.85 -1.53 114.38 115.52 3bil h ARG 301 Ca -0.01 -0.03 -0.06 0.00 -1.26 0.00 0.00 59.98 58.62 3bil h ARG 301 Cb 0.56 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 28.76 3bil h ARG 301 CO -0.18 0.31 -0.07 0.00 0.56 0.00 0.00 179.97 180.59 3bil h ALA 302 N 1.52 1.31 0.16 0.04 0.00 -0.52 -2.04 119.26 119.73 3bil h ALA 302 Ca 0.40 -0.24 -0.30 0.00 0.00 0.00 0.00 54.91 54.77 3bil h ALA 302 Cb 0.56 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.23 3bil h ALA 302 CO -0.37 0.46 -1.37 -0.24 0.00 0.00 0.00 179.25 177.73 3bil h VAL 303 N 0.47 1.36 -0.69 0.00 3.04 -0.84 -2.57 116.25 117.02 3bil h VAL 303 Ca 0.09 -2.91 0.14 0.00 -1.01 0.00 0.00 66.70 63.01 3bil h VAL 303 Cb 0.41 2.93 -0.13 0.00 -2.01 0.00 0.00 31.29 32.50 3bil h VAL 303 CO 0.02 0.86 -0.18 0.28 -1.01 0.00 0.00 177.57 177.54 3bil h SER 304 N 0.09 -0.67 0.74 3.17 0.02 -1.12 -0.36 113.55 115.42 3bil h SER 304 Ca -0.19 0.21 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 3bil h SER 304 Cb 2.04 0.44 -0.01 0.00 0.14 0.00 0.00 62.40 65.01 3bil h SER 304 CO 0.21 -0.23 -0.28 0.40 -1.14 0.00 0.00 176.83 175.79 3bil h ILE 305 N -0.01 0.75 0.10 3.27 2.04 -1.39 -2.43 117.51 119.85 3bil h ILE 305 Ca 0.33 -1.19 -0.26 0.00 1.00 0.00 0.00 64.86 64.74 3bil h ILE 305 Cb 0.51 1.75 -0.00 0.00 -0.74 0.00 0.00 36.82 38.34 3bil h ILE 305 CO -0.71 0.27 -1.18 0.25 0.00 0.00 0.00 178.15 176.78 3bil h LEU 306 N 0.00 0.36 0.45 1.44 5.85 -0.79 -3.35 115.31 119.26 3bil h LEU 306 Ca -0.00 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.32 3bil h LEU 306 Cb 0.72 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3bil h LEU 306 CO 0.04 1.28 -0.22 0.71 -0.34 0.00 0.00 178.44 179.91 3bil h THR 307 N 0.07 0.44 0.00 1.05 1.35 -0.94 -3.06 112.91 111.82 3bil h THR 307 Ca -0.11 -0.47 -0.09 0.00 -0.55 0.00 0.00 66.41 65.19 3bil h THR 307 Cb 1.91 0.62 -0.00 0.00 -1.73 0.00 0.00 68.15 68.95 3bil h THR 307 CO 0.19 0.07 1.01 -0.62 -0.25 0.00 0.00 175.52 175.92 3bil n GLU 308 N -5.23 0.61 0.00 4.72 1.02 -0.93 -5.12 120.64 115.70 3bil n GLU 308 Ca -0.10 -0.56 0.00 0.00 -0.02 0.00 0.00 57.16 56.48 3bil n GLU 308 Cb 0.30 -1.91 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 3bil n GLU 308 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3bil n LEU 309 N 3.88 0.00 0.00 -4.62 7.94 -1.16 -4.91 117.00 118.13 3bil n LEU 309 Ca 0.13 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.03 3bil n LEU 309 Cb 0.11 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.06 3bil n LEU 309 CO 0.41 0.00 0.00 1.07 -1.11 0.00 0.00 177.39 177.76 3bil n THR 320 N 0.00 0.00 -5.07 1.96 5.66 -0.54 -4.96 114.28 111.33 3bil n THR 320 Ca 0.00 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.72 3bil n THR 320 Cb 0.00 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 68.62 3bil n THR 320 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3bil s THR 321 N -0.97 1.72 -0.14 1.09 -4.23 -1.26 -1.75 115.64 110.09 3bil s THR 321 Ca 0.00 -0.93 -0.07 0.00 -1.18 0.00 0.00 61.69 59.50 3bil s THR 321 Cb 0.00 -1.43 -0.04 0.00 1.34 0.00 0.00 72.50 72.37 3bil s THR 321 CO 0.00 0.48 0.12 -0.63 -0.54 0.00 0.00 174.62 174.05 3bil s ILE 322 N -0.51 5.31 0.95 2.99 -1.09 -0.54 -4.86 121.20 123.44 3bil s ILE 322 Ca 0.08 0.14 -0.15 0.00 -2.23 0.00 0.00 60.65 58.50 3bil s ILE 322 Cb -0.08 -3.34 0.17 0.00 -1.58 0.00 0.00 42.46 37.63 3bil s ILE 322 CO -0.01 0.56 1.22 -2.16 -1.23 0.00 0.00 174.94 173.32 3bil s PRO 323 N -0.52 0.78 0.17 2.79 0.04 -1.26 0.74 135.00 137.72 3bil s PRO 323 Ca 0.12 -0.10 0.10 0.00 0.04 0.00 0.00 61.00 61.16 3bil s PRO 323 Cb -0.12 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 3bil s PRO 323 CO 0.02 -2.37 -0.21 -0.08 0.04 0.00 0.00 177.00 174.40 3bil s THR 324 N -3.57 2.59 0.04 1.26 -1.32 -1.01 -4.66 115.64 108.97 3bil s THR 324 Ca 0.69 -1.82 0.02 0.00 -1.21 0.00 0.00 61.69 59.36 3bil s THR 324 Cb -0.09 -2.23 -0.02 0.00 -1.51 0.00 0.00 72.50 68.66 3bil s THR 324 CO 0.53 -0.04 -0.07 0.00 -2.21 0.00 0.00 174.62 172.82 3bil s ALA 325 N -1.49 0.50 -0.35 11.08 0.00 -0.15 -3.29 121.76 128.07 3bil s ALA 325 Ca 0.20 -0.72 -0.19 0.00 0.00 0.00 0.00 51.96 51.25 3bil s ALA 325 Cb -0.09 0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.08 3bil s ALA 325 CO 0.10 -0.03 0.56 -1.17 0.00 0.00 0.00 175.76 175.22 3bil s LEU 326 N -1.51 4.31 -0.53 0.00 2.96 -1.26 0.12 118.68 122.78 3bil s LEU 326 Ca -0.10 0.05 -0.24 0.00 -0.22 0.00 0.00 54.13 53.62 3bil s LEU 326 Cb -0.10 -2.66 0.04 0.00 0.50 0.00 0.00 46.19 43.97 3bil s LEU 326 CO 0.00 -0.52 0.92 -0.63 -1.32 0.00 0.00 176.35 174.81 3bil s ILE 327 N 2.51 4.43 -0.31 6.68 -1.09 -0.53 -4.99 121.20 127.90 3bil s ILE 327 Ca 0.21 0.36 -0.29 0.00 -2.23 0.00 0.00 60.65 58.70 3bil s ILE 327 Cb -0.15 -4.50 -0.00 0.00 -1.58 0.00 0.00 42.46 36.22 3bil s ILE 327 CO 0.14 -1.03 1.44 -1.00 -1.23 0.00 0.00 174.94 173.25 3bil s HIS 328 N 3.85 2.42 0.00 3.97 3.76 -1.26 -2.72 115.29 125.31 3bil s HIS 328 Ca 0.31 0.72 0.00 0.00 -0.15 0.00 0.00 55.06 55.95 3bil s HIS 328 Cb -0.12 -4.05 0.00 0.00 1.11 0.00 0.00 32.58 29.52 3bil s HIS 328 CO 0.21 -2.15 0.00 0.54 -0.85 0.00 0.00 174.74 172.48 3bil n ARG 329 N 7.66 0.00 -0.99 1.40 1.74 -1.26 -4.96 116.66 120.25 3bil n ARG 329 Ca 0.17 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.29 3bil n ARG 329 Cb 0.47 0.00 0.13 0.00 -1.02 0.00 0.00 32.46 32.04 3bil n ARG 329 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3bil n GLU 330 N 0.00 0.99 -0.73 5.56 4.71 -0.50 -4.80 120.64 125.88 3bil n GLU 330 Ca 0.00 -2.81 0.08 0.00 -0.01 0.00 0.00 57.16 54.42 3bil n GLU 330 Cb 0.00 -0.99 0.36 0.00 -1.01 0.00 0.00 31.44 29.80 3bil n GLU 330 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 3bil n SER 331 N -0.47 5.08 -4.20 1.62 3.41 -1.05 -4.47 113.62 113.53 3bil n SER 331 Ca 0.14 -2.86 -0.34 0.00 -0.26 0.00 0.00 58.87 55.55 3bil n SER 331 Cb 0.88 -0.62 -0.15 0.00 -0.26 0.00 0.00 64.21 64.05 3bil n SER 331 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3bil s ILE 332 N -2.60 2.64 0.42 -1.33 -1.09 -1.26 -0.71 121.20 117.26 3bil s ILE 332 Ca 0.50 -0.79 -0.25 0.00 -2.23 0.00 0.00 60.65 57.89 3bil s ILE 332 Cb 0.38 -2.18 -0.08 0.00 -1.58 0.00 0.00 42.46 39.00 3bil s ILE 332 CO 0.16 0.45 1.20 -0.63 -1.23 0.00 0.00 174.94 174.89 3bil s ILE 333 N 1.36 2.98 -0.39 2.92 1.09 -1.26 -4.97 121.20 122.94 3bil s ILE 333 Ca 0.05 0.81 -0.17 0.00 -1.10 0.00 0.00 60.65 60.23 3bil s ILE 333 Cb -0.14 -3.45 0.01 0.00 -1.06 0.00 0.00 42.46 37.82 3bil s ILE 333 CO -0.08 0.06 0.47 0.21 -0.10 0.00 0.00 174.94 175.50 3bil s ASN 334 N -1.09 6.24 0.00 3.58 3.04 -1.26 -4.75 114.94 120.70 3bil s ASN 334 Ca 0.59 -0.36 0.26 0.00 0.04 0.00 0.00 52.86 53.39 3bil s ASN 334 Cb -0.32 -2.24 0.70 0.00 -1.54 0.00 0.00 41.25 37.84 3bil s ASN 334 CO 0.40 -0.53 1.55 -1.20 -3.04 0.00 0.00 177.10 174.28