#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ml3 n PRO 2 N 0.00 0.31 0.00 0.03 -0.02 -1.19 -4.82 135.00 129.31 1ml3 n PRO 2 Ca 0.00 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1ml3 n PRO 2 Cb 0.00 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1ml3 n PRO 2 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1ml3 n ILE 3 N 2.45 0.00 -3.24 4.25 2.08 -0.06 -4.86 119.36 119.99 1ml3 n ILE 3 Ca 0.22 0.00 -0.02 0.00 0.56 0.00 0.00 62.75 63.52 1ml3 n ILE 3 Cb 0.08 0.00 -0.04 0.00 -0.75 0.00 0.00 39.64 38.93 1ml3 n ILE 3 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1ml3 s LYS 4 N 0.14 0.48 0.13 0.38 -0.14 -1.26 -4.33 119.74 115.13 1ml3 s LYS 4 Ca 0.00 0.76 0.08 0.00 -1.36 0.00 0.00 55.97 55.45 1ml3 s LYS 4 Cb 0.00 0.10 -0.04 0.00 -1.68 0.00 0.00 37.83 36.21 1ml3 s LYS 4 CO 0.00 -0.67 -0.19 0.08 -0.76 0.00 0.00 175.35 173.82 1ml3 s VAL 5 N 2.72 1.69 -0.10 3.17 1.01 -1.18 -2.06 120.40 125.65 1ml3 s VAL 5 Ca 0.17 -1.73 -0.03 0.00 0.00 0.00 0.00 61.98 60.38 1ml3 s VAL 5 Cb -0.15 -1.67 0.05 0.00 0.00 0.00 0.00 36.38 34.61 1ml3 s VAL 5 CO -0.20 -0.23 0.16 -0.83 0.00 0.00 0.00 175.10 174.00 1ml3 s GLY 6 N -2.33 0.07 -0.21 4.51 0.00 0.49 -1.70 107.32 108.15 1ml3 s GLY 6 Ca 0.11 0.46 -0.19 0.00 0.00 0.00 0.00 44.72 45.10 1ml3 s GLY 6 CO 0.05 1.72 0.55 -0.42 0.00 0.00 0.00 173.10 175.00 1ml3 s ILE 7 N 2.28 5.08 -0.29 0.90 1.01 -1.14 0.35 121.20 129.39 1ml3 s ILE 7 Ca 0.04 1.01 -0.07 0.00 0.00 0.00 0.00 60.65 61.62 1ml3 s ILE 7 Cb -0.13 -3.87 0.01 0.00 0.01 0.00 0.00 42.46 38.48 1ml3 s ILE 7 CO -0.07 0.14 0.08 0.21 0.00 0.00 0.00 174.94 175.31 1ml3 s ASN 8 N 1.23 5.13 0.00 3.58 3.04 0.35 -0.10 114.94 128.17 1ml3 s ASN 8 Ca 0.25 -0.69 0.00 0.00 0.04 0.00 0.00 52.86 52.46 1ml3 s ASN 8 Cb -0.16 -1.88 0.00 0.00 -1.54 0.00 0.00 41.25 37.67 1ml3 s ASN 8 CO 0.10 -0.19 0.00 0.61 -3.04 0.00 0.00 177.10 174.58 1ml3 n GLY 9 N 4.87 0.83 2.90 1.21 0.00 0.19 -0.56 105.19 114.63 1ml3 n GLY 9 Ca -0.15 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1ml3 n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1ml3 n PHE 10 N -0.02 2.74 -1.37 1.61 7.35 -1.22 -3.85 117.46 122.70 1ml3 n PHE 10 Ca 0.00 -2.42 0.00 0.00 -0.76 0.00 0.00 57.45 54.27 1ml3 n PHE 10 Cb 0.01 -2.15 0.00 0.00 0.35 0.00 0.00 39.48 37.69 1ml3 n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1ml3 n GLY 11 N 4.30 3.86 0.35 7.13 0.00 -1.26 -4.69 105.19 114.88 1ml3 n GLY 11 Ca 0.51 -1.82 -0.12 0.00 0.00 0.00 0.00 46.02 44.59 1ml3 n GLY 11 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ml3 h ARG 12 N 0.00 -0.48 -0.32 1.61 2.47 -1.95 0.31 114.38 116.02 1ml3 h ARG 12 Ca 0.00 0.03 -0.15 0.00 -1.26 0.00 0.00 59.98 58.60 1ml3 h ARG 12 Cb 0.00 0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 1ml3 h ARG 12 CO 0.00 -0.32 -0.40 0.82 0.56 0.00 0.00 179.97 180.63 1ml3 h ILE 13 N -0.50 1.28 0.16 2.04 1.08 -1.90 0.36 117.51 120.04 1ml3 h ILE 13 Ca 0.06 -1.58 0.01 0.00 -0.39 0.00 0.00 64.86 62.96 1ml3 h ILE 13 Cb 0.58 1.46 -0.02 0.00 -3.07 0.00 0.00 36.82 35.77 1ml3 h ILE 13 CO -0.27 0.52 -0.19 1.23 -0.69 0.00 0.00 178.15 178.75 1ml3 h GLY 14 N 0.89 -0.39 1.45 5.37 0.00 -1.60 0.35 103.07 109.14 1ml3 h GLY 14 Ca 0.05 0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.50 1ml3 h GLY 14 CO 0.09 -0.18 -0.21 3.21 0.00 0.00 0.00 176.54 179.45 1ml3 h ARG 15 N -0.40 0.64 -0.27 4.80 3.08 -0.94 -0.69 114.38 120.60 1ml3 h ARG 15 Ca 0.01 -0.24 -0.09 0.00 0.07 0.00 0.00 59.98 59.74 1ml3 h ARG 15 Cb 0.39 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1ml3 h ARG 15 CO -0.07 0.80 -0.20 0.52 -1.07 0.00 0.00 179.97 179.95 1ml3 h MET 16 N 0.56 0.49 0.00 0.04 2.86 -0.57 0.42 114.93 118.74 1ml3 h MET 16 Ca 0.08 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 1ml3 h MET 16 Cb 0.67 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.29 1ml3 h MET 16 CO 0.05 0.67 -0.00 0.28 1.06 0.00 0.00 176.91 178.96 1ml3 h VAL 17 N 0.44 1.37 -0.84 -2.22 2.07 0.08 0.20 116.25 117.35 1ml3 h VAL 17 Ca 0.07 -1.12 0.05 0.00 0.82 0.00 0.00 66.70 66.53 1ml3 h VAL 17 Cb 0.60 2.13 -0.06 0.00 -1.52 0.00 0.00 31.29 32.44 1ml3 h VAL 17 CO 0.04 0.29 0.53 0.15 0.02 0.00 0.00 177.57 178.60 1ml3 h PHE 18 N -0.48 0.98 -0.36 1.57 3.04 -0.91 0.19 116.94 120.96 1ml3 h PHE 18 Ca -0.00 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.88 1ml3 h PHE 18 Cb 0.48 -0.32 -0.02 0.00 2.56 0.00 0.00 35.95 38.66 1ml3 h PHE 18 CO 0.09 0.51 -0.19 0.37 -2.02 0.00 0.00 178.31 177.07 1ml3 h GLN 19 N 0.97 0.68 -0.50 1.11 4.15 -0.05 -2.13 115.11 119.35 1ml3 h GLN 19 Ca 0.36 -0.25 -0.04 0.00 0.77 0.00 0.00 58.65 59.50 1ml3 h GLN 19 Cb 0.13 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.76 1ml3 h GLN 19 CO -0.16 0.83 0.17 0.00 -1.93 0.00 0.00 178.83 177.74 1ml3 h ALA 20 N 1.18 0.65 -0.84 3.38 0.00 0.72 0.28 119.26 124.64 1ml3 h ALA 20 Ca 0.09 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ml3 h ALA 20 Cb 0.66 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ml3 h ALA 20 CO 0.05 0.29 0.55 1.25 0.00 0.00 0.00 179.25 181.38 1ml3 h LEU 21 N 0.67 0.98 -0.06 0.00 6.46 -0.39 -2.49 115.31 120.49 1ml3 h LEU 21 Ca 0.16 -0.03 -0.15 0.00 -0.12 0.00 0.00 57.88 57.74 1ml3 h LEU 21 Cb 0.24 -0.25 0.01 0.00 -0.73 0.00 0.00 40.66 39.94 1ml3 h LEU 21 CO -0.01 0.72 -0.56 0.00 -0.62 0.00 0.00 178.44 177.97 1ml3 h GLU 23 N 0.04 0.54 -0.10 0.00 4.81 -0.66 0.87 114.58 120.08 1ml3 h GLU 23 Ca -0.05 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1ml3 h GLU 23 Cb 1.23 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1ml3 h GLU 23 CO 0.11 0.36 0.00 -0.25 -0.73 0.00 0.00 179.01 178.50 1ml3 n ASP 24 N -4.61 0.91 -3.47 1.04 8.00 -0.96 -4.93 116.55 112.54 1ml3 n ASP 24 Ca 0.21 -1.64 -0.18 0.00 0.71 0.00 0.00 54.79 53.90 1ml3 n ASP 24 Cb 0.66 -0.07 0.08 0.00 -0.02 0.00 0.00 41.12 41.77 1ml3 n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ml3 n GLY 25 N 0.95 -0.40 0.30 0.44 0.00 0.30 -4.93 105.19 101.85 1ml3 n GLY 25 Ca 0.14 0.14 0.05 0.00 0.00 0.00 0.00 46.02 46.34 1ml3 n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ml3 n LEU 26 N -4.10 1.48 -4.56 0.99 4.77 -0.85 -4.71 117.00 110.03 1ml3 n LEU 26 Ca -0.28 -0.88 -0.35 0.00 -0.03 0.00 0.00 56.01 54.47 1ml3 n LEU 26 Cb 0.67 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.72 1ml3 n LEU 26 CO 0.62 0.29 1.41 -0.22 -1.33 0.00 0.00 177.39 178.16 1ml3 s LEU 27 N -1.19 3.32 0.00 2.23 2.96 -1.26 -0.19 118.68 124.54 1ml3 s LEU 27 Ca 0.10 -0.89 0.00 0.00 -0.22 0.00 0.00 54.13 53.12 1ml3 s LEU 27 Cb 0.08 -2.56 0.00 0.00 0.50 0.00 0.00 46.19 44.21 1ml3 s LEU 27 CO 0.18 -2.12 0.00 0.61 -1.32 0.00 0.00 176.35 173.70 1ml3 n GLY 28 N 6.63 3.37 0.12 7.98 0.00 0.18 -4.94 105.19 118.53 1ml3 n GLY 28 Ca 0.32 -1.01 -0.04 0.00 0.00 0.00 0.00 46.02 45.29 1ml3 n GLY 28 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ml3 h THR 29 N 0.00 0.00 0.00 2.61 1.35 -1.84 -3.40 112.91 111.63 1ml3 h THR 29 Ca 0.00 -0.13 -0.31 0.00 -0.55 0.00 0.00 66.41 65.42 1ml3 h THR 29 Cb 0.00 0.00 -0.05 0.00 -1.73 0.00 0.00 68.15 66.37 1ml3 h THR 29 CO 0.00 0.00 -2.16 -0.62 -0.25 0.00 0.00 175.52 172.49 1ml3 n GLU 30 N -3.13 0.50 -4.20 4.72 1.02 -1.20 -3.19 120.64 115.15 1ml3 n GLU 30 Ca -0.04 0.13 -0.30 0.00 -0.02 0.00 0.00 57.16 56.93 1ml3 n GLU 30 Cb 0.11 -1.38 -0.09 0.00 -0.02 0.00 0.00 31.44 30.06 1ml3 n GLU 30 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ml3 s ILE 31 N -2.40 3.74 -0.34 -3.67 1.01 0.73 -0.88 121.20 119.40 1ml3 s ILE 31 Ca -0.28 -1.07 -0.01 0.00 0.00 0.00 0.00 60.65 59.30 1ml3 s ILE 31 Cb 0.08 -2.76 0.13 0.00 0.01 0.00 0.00 42.46 39.92 1ml3 s ILE 31 CO 0.45 0.15 0.20 -0.62 0.00 0.00 0.00 174.94 175.11 1ml3 s ASP 32 N -2.18 3.10 -0.68 3.58 -1.08 -1.26 0.51 116.67 118.67 1ml3 s ASP 32 Ca 0.23 -2.02 -0.26 0.00 -0.52 0.00 0.00 52.55 49.98 1ml3 s ASP 32 Cb -0.11 -0.41 -0.08 0.00 -1.46 0.00 0.00 42.92 40.86 1ml3 s ASP 32 CO 0.15 -0.33 2.22 -0.69 0.52 0.00 0.00 175.17 177.04 1ml3 s VAL 33 N 1.25 3.15 0.10 1.11 1.01 -1.26 -3.11 120.40 122.65 1ml3 s VAL 33 Ca 0.16 -0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 1ml3 s VAL 33 Cb -0.22 -3.37 -0.12 0.00 0.00 0.00 0.00 36.38 32.67 1ml3 s VAL 33 CO -0.06 -0.35 1.62 0.58 0.00 0.00 0.00 175.10 176.88 1ml3 h VAL 34 N 7.46 0.31 -3.27 2.92 2.07 -1.64 -3.41 116.25 120.70 1ml3 h VAL 34 Ca -0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1ml3 h VAL 34 Cb 1.12 0.31 -0.11 0.00 -1.52 0.00 0.00 31.29 31.10 1ml3 h VAL 34 CO 1.13 0.00 0.05 0.00 0.02 0.00 0.00 177.57 178.77 1ml3 s ALA 35 N -6.01 -1.03 -0.02 1.67 0.00 -1.25 -2.89 121.76 112.24 1ml3 s ALA 35 Ca -0.16 -0.12 0.03 0.00 0.00 0.00 0.00 51.96 51.71 1ml3 s ALA 35 Cb 0.06 0.84 -0.00 0.00 0.00 0.00 0.00 23.12 24.02 1ml3 s ALA 35 CO 0.64 -0.79 -0.11 0.14 0.00 0.00 0.00 175.76 175.64 1ml3 s VAL 36 N -3.85 0.93 -0.11 0.00 -7.23 0.05 -2.87 120.40 107.32 1ml3 s VAL 36 Ca 0.07 -0.46 0.03 0.00 -1.81 0.00 0.00 61.98 59.81 1ml3 s VAL 36 Cb -0.01 -0.80 -0.00 0.00 0.56 0.00 0.00 36.38 36.13 1ml3 s VAL 36 CO -0.05 0.28 -0.21 0.54 -0.31 0.00 0.00 175.10 175.35 1ml3 s VAL 37 N 0.00 2.33 0.00 1.32 0.11 0.86 -2.96 120.40 122.06 1ml3 s VAL 37 Ca -0.00 -0.92 0.00 0.00 -2.93 0.00 0.00 61.98 58.12 1ml3 s VAL 37 Cb -0.08 -1.92 0.00 0.00 -1.53 0.00 0.00 36.38 32.86 1ml3 s VAL 37 CO 0.00 0.55 0.00 -0.67 -3.33 0.00 0.00 175.10 171.65 1ml3 n ASP 38 N 3.56 0.00 0.00 3.54 2.03 -1.26 0.53 116.55 124.95 1ml3 n ASP 38 Ca -0.19 -0.98 0.00 0.00 0.52 0.00 0.00 54.79 54.14 1ml3 n ASP 38 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1ml3 n ASP 38 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 1ml3 n MET 39 N 0.00 0.00 -1.31 -0.67 2.81 -1.26 -3.11 117.12 113.57 1ml3 n MET 39 Ca 0.00 0.27 -0.14 0.00 -1.81 0.00 0.00 57.70 56.03 1ml3 n MET 39 Cb 0.00 -0.95 0.09 0.00 -0.71 0.00 0.00 33.22 31.65 1ml3 n MET 39 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1ml3 n ASN 40 N -0.72 0.38 -0.01 7.83 0.23 -1.26 -4.23 115.26 117.48 1ml3 n ASN 40 Ca 0.00 -1.42 0.01 0.00 -0.53 0.00 0.00 54.58 52.63 1ml3 n ASN 40 Cb 0.00 -0.44 0.01 0.00 -2.08 0.00 0.00 39.78 37.27 1ml3 n ASN 40 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1ml3 n THR 41 N -2.57 0.85 -2.03 5.53 -2.24 -1.26 -4.85 114.28 107.70 1ml3 n THR 41 Ca 0.09 -0.87 -0.26 0.00 -2.27 0.00 0.00 64.05 60.74 1ml3 n THR 41 Cb 0.31 0.55 -0.05 0.00 -2.10 0.00 0.00 70.33 69.04 1ml3 n THR 41 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ml3 s ASP 42 N -0.91 5.08 0.50 3.42 -1.08 -1.26 -4.42 116.67 118.01 1ml3 s ASP 42 Ca 0.02 -0.74 0.27 0.00 -0.52 0.00 0.00 52.55 51.58 1ml3 s ASP 42 Cb 0.02 -2.56 1.36 0.00 -1.46 0.00 0.00 42.92 40.27 1ml3 s ASP 42 CO 0.00 -2.82 1.89 0.00 0.52 0.00 0.00 175.17 174.76 1ml3 h ALA 43 N 11.20 2.62 -0.50 3.66 0.00 -1.90 -0.08 119.26 134.26 1ml3 h ALA 43 Ca 0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1ml3 h ALA 43 Cb 1.00 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1ml3 h ALA 43 CO 1.20 -0.87 0.17 0.93 0.00 0.00 0.00 179.25 180.68 1ml3 h GLU 44 N 0.12 0.76 -0.52 0.00 5.08 -1.87 -2.41 114.58 115.75 1ml3 h GLU 44 Ca 0.42 -0.15 -0.09 0.00 -1.00 0.00 0.00 59.36 58.54 1ml3 h GLU 44 Cb 1.47 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.59 1ml3 h GLU 44 CO -0.06 0.70 -0.03 -0.92 -1.00 0.00 0.00 179.01 177.70 1ml3 h TYR 45 N 0.67 0.98 0.20 4.33 3.20 -1.42 -2.65 116.97 122.28 1ml3 h TYR 45 Ca 0.16 -0.16 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1ml3 h TYR 45 Cb 0.24 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.26 1ml3 h TYR 45 CO 0.01 0.89 -0.10 0.74 -1.64 0.00 0.00 178.16 178.07 1ml3 h PHE 46 N 0.83 -0.25 -0.64 -3.82 -1.00 -1.27 -2.12 116.94 108.67 1ml3 h PHE 46 Ca 0.15 -0.01 0.10 0.00 2.81 0.00 0.00 57.97 61.02 1ml3 h PHE 46 Cb 0.53 0.08 -0.07 0.00 3.61 0.00 0.00 35.95 40.10 1ml3 h PHE 46 CO 0.03 -0.14 0.26 0.00 -1.61 0.00 0.00 178.31 176.85 1ml3 h ALA 47 N 0.51 0.85 -0.83 2.45 0.00 -1.35 -0.70 119.26 120.18 1ml3 h ALA 47 Ca -0.03 0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ml3 h ALA 47 Cb 0.22 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1ml3 h ALA 47 CO 0.05 -0.16 0.54 -0.92 0.00 0.00 0.00 179.25 178.76 1ml3 h TYR 48 N 0.45 1.03 0.00 0.00 3.20 -1.29 0.39 116.97 120.75 1ml3 h TYR 48 Ca 0.33 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.20 1ml3 h TYR 48 Cb 0.40 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 1ml3 h TYR 48 CO -0.15 0.62 -0.09 1.96 -1.64 0.00 0.00 178.16 178.86 1ml3 h GLN 49 N 1.09 0.00 0.05 1.82 4.20 -0.49 -2.76 115.11 119.02 1ml3 h GLN 49 Ca 0.32 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.71 1ml3 h GLN 49 Cb -0.07 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.68 1ml3 h GLN 49 CO -0.09 0.09 -1.83 -1.33 -0.67 0.00 0.00 178.83 175.00 1ml3 n MET 50 N -3.40 0.68 -0.13 1.46 2.81 -0.24 -4.25 117.12 114.05 1ml3 n MET 50 Ca -0.01 0.28 -0.09 0.00 -1.81 0.00 0.00 57.70 56.07 1ml3 n MET 50 Cb 0.25 -1.76 -0.01 0.00 -0.71 0.00 0.00 33.22 30.99 1ml3 n MET 50 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ml3 h ARG 51 N 0.03 0.57 -6.47 0.03 3.08 -0.03 -3.34 114.38 108.25 1ml3 h ARG 51 Ca -0.34 -0.11 -0.70 0.00 0.07 0.00 0.00 59.98 58.91 1ml3 h ARG 51 Cb 2.02 -0.09 -0.27 0.00 0.08 0.00 0.00 29.97 31.72 1ml3 h ARG 51 CO 0.08 0.55 -0.83 0.71 -1.07 0.00 0.00 179.97 179.41 1ml3 s TYR 52 N -5.53 2.51 -0.04 3.04 2.02 -1.07 -1.59 117.35 116.69 1ml3 s TYR 52 Ca -0.13 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.27 1ml3 s TYR 52 Cb 0.10 -1.56 0.02 0.00 -0.40 0.00 0.00 41.96 40.12 1ml3 s TYR 52 CO 0.75 0.07 -0.02 0.34 -1.57 0.00 0.00 175.55 175.12 1ml3 s ASP 53 N -0.67 0.69 0.29 2.29 -1.08 -1.04 -4.76 116.67 112.39 1ml3 s ASP 53 Ca 0.11 -0.06 -0.01 0.00 -0.52 0.00 0.00 52.55 52.06 1ml3 s ASP 53 Cb -0.10 -0.31 0.48 0.00 -1.46 0.00 0.00 42.92 41.52 1ml3 s ASP 53 CO -0.00 -0.09 1.92 0.74 0.52 0.00 0.00 175.17 178.26 1ml3 h THR 54 N 6.21 1.12 0.00 1.71 2.02 -1.98 -3.07 112.91 118.91 1ml3 h THR 54 Ca -0.39 -0.37 -0.17 0.00 0.77 0.00 0.00 66.41 66.24 1ml3 h THR 54 Cb 1.14 -0.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.45 1ml3 h THR 54 CO 0.46 0.20 -1.80 1.33 0.37 0.00 0.00 175.52 176.07 1ml3 n VAL 55 N -4.46 0.65 -0.21 3.16 0.24 -1.26 -4.65 118.33 111.80 1ml3 n VAL 55 Ca 0.13 -0.48 0.11 0.00 -2.04 0.00 0.00 64.34 62.05 1ml3 n VAL 55 Cb 0.14 -0.46 0.31 0.00 -1.47 0.00 0.00 33.84 32.36 1ml3 n VAL 55 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1ml3 n HIS 56 N -2.34 0.99 -4.17 6.34 8.25 -1.25 -4.95 115.22 118.09 1ml3 n HIS 56 Ca -0.16 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 56.83 1ml3 n HIS 56 Cb 0.77 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.85 1ml3 n HIS 56 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ml3 n GLY 57 N 1.50 -1.81 3.79 -1.41 0.00 -1.16 -4.84 105.19 101.26 1ml3 n GLY 57 Ca 0.23 -1.34 -0.38 0.00 0.00 0.00 0.00 46.02 44.53 1ml3 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ml3 s LYS 58 N 0.00 4.18 0.40 1.61 1.02 -1.26 -2.50 119.74 123.18 1ml3 s LYS 58 Ca 0.00 0.56 -0.23 0.00 0.02 0.00 0.00 55.97 56.32 1ml3 s LYS 58 Cb 0.00 -3.31 -0.14 0.00 -0.52 0.00 0.00 37.83 33.87 1ml3 s LYS 58 CO 0.00 0.47 0.47 0.34 -0.92 0.00 0.00 175.35 175.72 1ml3 n PHE 59 N 2.47 -0.74 0.00 3.18 7.35 -0.62 -4.93 117.46 124.16 1ml3 n PHE 59 Ca -0.10 0.64 -0.13 0.00 -0.76 0.00 0.00 57.45 57.10 1ml3 n PHE 59 Cb 0.51 -1.96 -0.10 0.00 0.35 0.00 0.00 39.48 38.29 1ml3 n PHE 59 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1ml3 h LYS 60 N 0.76 -0.04 -6.94 -4.13 1.79 -1.93 -3.46 116.57 102.63 1ml3 h LYS 60 Ca -0.39 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 57.60 1ml3 h LYS 60 Cb 1.41 0.01 0.04 0.00 -1.58 0.00 0.00 32.23 32.11 1ml3 h LYS 60 CO 0.51 0.43 0.09 0.71 -1.08 0.00 0.00 179.45 180.12 1ml3 s TYR 61 N -4.21 3.46 0.20 -1.35 1.51 -1.26 -5.07 117.35 110.63 1ml3 s TYR 61 Ca -0.16 0.70 -0.24 0.00 -1.01 0.00 0.00 57.07 56.36 1ml3 s TYR 61 Cb 0.02 -2.39 -0.08 0.00 -0.11 0.00 0.00 41.96 39.39 1ml3 s TYR 61 CO 0.65 -0.40 0.79 -2.00 -1.11 0.00 0.00 175.55 173.49 1ml3 s GLU 62 N -4.77 4.52 0.03 -0.62 2.12 -1.26 -4.93 118.70 113.78 1ml3 s GLU 62 Ca 0.49 1.13 0.07 0.00 0.36 0.00 0.00 54.97 57.02 1ml3 s GLU 62 Cb -0.10 -3.12 -0.02 0.00 0.26 0.00 0.00 34.13 31.14 1ml3 s GLU 62 CO 0.44 0.49 -0.19 0.08 -0.54 0.00 0.00 175.26 175.54 1ml3 s VAL 63 N -1.29 1.53 0.28 3.70 1.01 -1.26 -1.94 120.40 122.42 1ml3 s VAL 63 Ca 0.39 -1.07 -0.11 0.00 0.00 0.00 0.00 61.98 61.20 1ml3 s VAL 63 Cb -0.21 -1.33 0.00 0.00 0.00 0.00 0.00 36.38 34.84 1ml3 s VAL 63 CO 0.25 0.23 0.49 0.28 0.00 0.00 0.00 175.10 176.35 1ml3 s THR 64 N -0.72 0.00 0.21 3.92 -1.32 -1.22 -4.98 115.64 111.54 1ml3 s THR 64 Ca 0.06 -1.43 0.05 0.00 -1.21 0.00 0.00 61.69 59.16 1ml3 s THR 64 Cb -0.08 -2.35 -0.05 0.00 -1.51 0.00 0.00 72.50 68.51 1ml3 s THR 64 CO 0.01 0.00 -0.05 0.42 -2.21 0.00 0.00 174.62 172.79 1ml3 s THR 65 N -3.71 1.24 0.00 5.08 -4.23 -1.26 -0.00 115.64 112.77 1ml3 s THR 65 Ca 0.24 -2.08 0.00 0.00 -1.18 0.00 0.00 61.69 58.67 1ml3 s THR 65 Cb -0.01 -2.20 0.00 0.00 1.34 0.00 0.00 72.50 71.64 1ml3 s THR 65 CO 0.11 -0.46 0.00 0.35 -0.54 0.00 0.00 174.62 174.08 1ml3 n THR 66 N -0.38 0.00 -5.21 3.99 -2.24 -0.94 -4.95 114.28 104.55 1ml3 n THR 66 Ca -0.07 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.40 1ml3 n THR 66 Cb 0.63 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.69 1ml3 n THR 66 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ml3 s LYS 67 N -0.91 2.62 0.35 -0.78 1.02 -1.26 -2.57 119.74 118.21 1ml3 s LYS 67 Ca 0.00 -0.87 0.03 0.00 0.02 0.00 0.00 55.97 55.15 1ml3 s LYS 67 Cb 0.00 -2.14 0.64 0.00 -0.52 0.00 0.00 37.83 35.81 1ml3 s LYS 67 CO 0.00 0.31 1.97 0.66 -0.92 0.00 0.00 175.35 177.37 1ml3 h SER 68 N 6.28 0.66 -3.39 2.83 4.64 -1.94 -3.43 113.55 119.19 1ml3 h SER 68 Ca -0.28 -0.05 0.01 0.00 -0.47 0.00 0.00 61.79 61.00 1ml3 h SER 68 Cb 1.19 -0.17 -0.22 0.00 -0.31 0.00 0.00 62.40 62.89 1ml3 h SER 68 CO 0.47 0.53 0.17 -0.44 -0.87 0.00 0.00 176.83 176.70 1ml3 s SER 69 N -6.56 -0.74 0.59 4.97 0.01 -1.26 -5.02 113.70 105.68 1ml3 s SER 69 Ca -0.09 1.31 0.30 0.00 1.31 0.00 0.00 55.95 58.78 1ml3 s SER 69 Cb 0.17 1.32 1.22 0.00 0.21 0.00 0.00 66.02 68.94 1ml3 s SER 69 CO 0.76 -0.22 1.56 -0.65 0.41 0.00 0.00 173.24 175.11 1ml3 h PRO 70 N 5.64 0.00 0.00 12.44 0.11 -1.99 -0.08 132.00 148.12 1ml3 h PRO 70 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1ml3 h PRO 70 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ml3 h PRO 70 CO 0.11 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.77 1ml3 n SER 71 N -3.51 0.01 -4.66 -2.05 3.41 -1.26 -4.65 113.62 100.92 1ml3 n SER 71 Ca 0.20 0.50 -0.35 0.00 -0.26 0.00 0.00 58.87 58.97 1ml3 n SER 71 Cb 1.25 -0.50 -0.10 0.00 -0.26 0.00 0.00 64.21 64.60 1ml3 n SER 71 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ml3 s VAL 72 N -3.01 4.19 0.00 -3.33 1.01 -0.05 -5.09 120.40 114.13 1ml3 s VAL 72 Ca 0.01 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.70 1ml3 s VAL 72 Cb 0.01 -2.76 0.00 0.00 0.00 0.00 0.00 36.38 33.63 1ml3 s VAL 72 CO 0.03 0.60 0.00 0.00 0.00 0.00 0.00 175.10 175.73 1ml3 n ALA 73 N 2.23 0.00 -1.20 5.51 0.00 -1.26 -4.80 120.51 120.99 1ml3 n ALA 73 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.94 1ml3 n ALA 73 Cb 0.53 0.00 0.10 0.00 0.00 0.00 0.00 19.45 20.08 1ml3 n ALA 73 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ml3 s LYS 74 N 0.00 2.10 1.16 0.00 1.02 -1.26 -4.99 119.74 117.77 1ml3 s LYS 74 Ca 0.00 1.35 -0.17 0.00 0.02 0.00 0.00 55.97 57.17 1ml3 s LYS 74 Cb 0.00 -1.87 0.18 0.00 -0.52 0.00 0.00 37.83 35.62 1ml3 s LYS 74 CO 0.00 -1.79 0.32 -0.25 -0.92 0.00 0.00 175.35 172.71 1ml3 n ASP 75 N -3.37 -2.38 -0.76 2.83 9.92 -1.26 -4.95 116.55 116.57 1ml3 n ASP 75 Ca 0.10 -0.21 -0.04 0.00 -0.53 0.00 0.00 54.79 54.11 1ml3 n ASP 75 Cb 0.52 -1.02 -0.04 0.00 -0.64 0.00 0.00 41.12 39.95 1ml3 n ASP 75 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1ml3 n ASP 76 N -2.74 -0.58 -3.73 -2.24 5.68 -1.06 -3.65 116.55 108.23 1ml3 n ASP 76 Ca 0.02 -1.28 -0.13 0.00 -0.50 0.00 0.00 54.79 52.90 1ml3 n ASP 76 Cb 0.59 0.17 -0.14 0.00 -1.14 0.00 0.00 41.12 40.60 1ml3 n ASP 76 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1ml3 s THR 77 N 0.00 -0.08 0.16 2.12 2.01 -1.20 -1.46 115.64 117.19 1ml3 s THR 77 Ca 0.00 0.19 -0.12 0.00 0.31 0.00 0.00 61.69 62.07 1ml3 s THR 77 Cb 0.00 -0.31 -0.07 0.00 0.01 0.00 0.00 72.50 72.13 1ml3 s THR 77 CO 0.00 0.08 0.52 -0.76 -0.69 0.00 0.00 174.62 173.76 1ml3 s LEU 78 N 1.37 4.29 -0.56 4.42 2.01 -0.52 -2.20 118.68 127.48 1ml3 s LEU 78 Ca -0.08 0.96 0.07 0.00 0.01 0.00 0.00 54.13 55.09 1ml3 s LEU 78 Cb -0.11 -3.33 0.25 0.00 0.01 0.00 0.00 46.19 43.01 1ml3 s LEU 78 CO -0.07 0.07 0.67 0.52 1.01 0.00 0.00 176.35 178.55 1ml3 n VAL 79 N 0.54 1.40 -2.34 -1.59 0.31 1.00 -1.87 118.33 115.78 1ml3 n VAL 79 Ca -0.04 -4.84 -0.43 0.00 -0.01 0.00 0.00 64.34 59.02 1ml3 n VAL 79 Cb 0.52 -2.06 -0.02 0.00 -0.91 0.00 0.00 33.84 31.37 1ml3 n VAL 79 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1ml3 s VAL 80 N -2.06 3.93 -1.14 2.52 1.01 -1.15 -3.41 120.40 120.11 1ml3 s VAL 80 Ca 0.38 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.35 1ml3 s VAL 80 Cb 0.15 -4.15 0.00 0.00 0.00 0.00 0.00 36.38 32.39 1ml3 s VAL 80 CO -0.04 -0.65 0.00 -3.20 0.00 0.00 0.00 175.10 171.20 1ml3 n ASN 81 N 8.55 -2.85 0.00 3.32 5.15 -0.82 -1.62 115.26 126.99 1ml3 n ASN 81 Ca 0.16 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.41 1ml3 n ASN 81 Cb 0.47 -2.76 0.00 0.00 -0.53 0.00 0.00 39.78 36.97 1ml3 n ASN 81 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ml3 n GLY 82 N -0.21 3.15 3.64 8.20 0.00 -1.25 -5.08 105.19 113.65 1ml3 n GLY 82 Ca -0.11 -1.11 -0.34 0.00 0.00 0.00 0.00 46.02 44.46 1ml3 n GLY 82 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ml3 n HIS 83 N 0.00 0.84 -4.03 1.61 -0.00 -0.64 -4.96 115.22 108.05 1ml3 n HIS 83 Ca 0.00 0.39 -0.31 0.00 -0.00 0.00 0.00 57.72 57.80 1ml3 n HIS 83 Cb 0.00 -2.07 -0.16 0.00 -0.00 0.00 0.00 29.99 27.76 1ml3 n HIS 83 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1ml3 s ARG 84 N -3.83 2.21 -0.03 1.57 0.52 -1.26 -2.93 118.95 115.20 1ml3 s ARG 84 Ca 0.72 -0.97 0.01 0.00 -0.52 0.00 0.00 55.73 54.97 1ml3 s ARG 84 Cb -0.30 -2.56 -0.03 0.00 0.52 0.00 0.00 34.95 32.58 1ml3 s ARG 84 CO 0.52 -0.44 -0.02 0.42 0.02 0.00 0.00 175.30 175.81 1ml3 s ILE 85 N 1.31 4.05 -0.13 1.52 1.09 -0.78 -4.79 121.20 123.47 1ml3 s ILE 85 Ca -0.02 -0.53 -0.05 0.00 -1.10 0.00 0.00 60.65 58.94 1ml3 s ILE 85 Cb -0.17 -2.76 -0.04 0.00 -1.06 0.00 0.00 42.46 38.44 1ml3 s ILE 85 CO -0.08 0.46 0.05 -0.22 -0.10 0.00 0.00 174.94 175.05 1ml3 s LEU 86 N -1.29 3.84 -1.20 2.97 2.96 -1.14 -1.43 118.68 123.39 1ml3 s LEU 86 Ca 0.17 0.19 -0.08 0.00 -0.22 0.00 0.00 54.13 54.19 1ml3 s LEU 86 Cb -0.11 -1.93 0.22 0.00 0.50 0.00 0.00 46.19 44.87 1ml3 s LEU 86 CO 0.07 0.31 1.66 0.00 -1.32 0.00 0.00 176.35 177.07 1ml3 s VAL 88 N -0.52 2.46 0.69 0.00 -7.23 -1.16 -4.76 120.40 109.89 1ml3 s VAL 88 Ca 0.37 0.30 -0.14 0.00 -1.81 0.00 0.00 61.98 60.70 1ml3 s VAL 88 Cb 0.05 -3.13 0.02 0.00 0.56 0.00 0.00 36.38 33.89 1ml3 s VAL 88 CO 0.03 -0.05 1.11 -0.75 -0.31 0.00 0.00 175.10 175.13 1ml3 s LYS 89 N -3.26 2.62 -0.07 4.82 2.20 -1.26 -3.98 119.74 120.81 1ml3 s LYS 89 Ca 0.77 1.36 -0.05 0.00 -0.36 0.00 0.00 55.97 57.69 1ml3 s LYS 89 Cb -0.33 -1.93 -0.04 0.00 -1.51 0.00 0.00 37.83 34.02 1ml3 s LYS 89 CO 0.36 -1.39 0.15 0.00 -0.36 0.00 0.00 175.35 174.11 1ml3 s ALA 90 N -2.46 3.86 0.14 3.13 0.00 -1.18 -4.80 121.76 120.45 1ml3 s ALA 90 Ca 0.66 -0.70 0.05 0.00 0.00 0.00 0.00 51.96 51.97 1ml3 s ALA 90 Cb -0.20 -1.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 1ml3 s ALA 90 CO 0.45 0.67 0.09 -0.65 0.00 0.00 0.00 175.76 176.32 1ml3 s GLN 91 N -1.38 2.78 0.41 0.00 -1.52 -1.26 -4.99 119.66 113.70 1ml3 s GLN 91 Ca 0.20 -0.88 0.29 0.00 -1.95 0.00 0.00 55.36 53.02 1ml3 s GLN 91 Cb -0.12 -2.60 1.14 0.00 -0.22 0.00 0.00 33.01 31.21 1ml3 s GLN 91 CO 0.10 0.50 1.85 -0.09 -0.25 0.00 0.00 175.29 177.39 1ml3 h ARG 92 N 2.71 0.00 -4.44 2.91 2.43 -1.99 -3.40 114.38 112.60 1ml3 h ARG 92 Ca -0.47 0.00 -0.56 0.00 -0.81 0.00 0.00 59.98 58.13 1ml3 h ARG 92 Cb 1.19 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 30.38 1ml3 h ARG 92 CO 0.62 0.00 -0.82 1.21 -1.51 0.00 0.00 179.97 179.48 1ml3 s ASN 93 N -5.06 2.41 0.53 -3.80 3.84 -1.26 -5.03 114.94 106.56 1ml3 s ASN 93 Ca 0.03 -0.39 0.37 0.00 0.21 0.00 0.00 52.86 53.08 1ml3 s ASN 93 Cb 0.09 -1.00 1.54 0.00 -0.55 0.00 0.00 41.25 41.33 1ml3 s ASN 93 CO 0.49 -0.09 1.75 -0.65 -2.79 0.00 0.00 177.10 175.82 1ml3 h PRO 94 N 8.10 0.04 -0.43 0.43 0.11 -1.83 -0.38 132.00 138.04 1ml3 h PRO 94 Ca -0.34 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.70 1ml3 h PRO 94 Cb 1.13 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1ml3 h PRO 94 CO 0.47 0.03 -0.02 0.00 -0.21 0.00 0.00 178.00 178.27 1ml3 h ALA 95 N 1.37 1.17 0.00 -0.75 0.00 -1.86 -3.04 119.26 116.16 1ml3 h ALA 95 Ca 0.65 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1ml3 h ALA 95 Cb 2.48 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 20.09 1ml3 h ALA 95 CO -0.06 0.54 0.00 -0.25 0.00 0.00 0.00 179.25 179.48 1ml3 n ASP 96 N -4.23 0.34 -4.71 0.00 10.43 -0.15 -4.38 116.55 113.86 1ml3 n ASP 96 Ca 0.02 -1.14 -0.35 0.00 2.57 0.00 0.00 54.79 55.89 1ml3 n ASP 96 Cb 0.29 -0.17 -0.09 0.00 1.84 0.00 0.00 41.12 43.00 1ml3 n ASP 96 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1ml3 s LEU 97 N -0.40 4.01 -1.49 0.64 2.01 -1.15 -4.84 118.68 117.47 1ml3 s LEU 97 Ca 0.00 0.20 -0.11 0.00 0.01 0.00 0.00 54.13 54.23 1ml3 s LEU 97 Cb 0.00 -2.01 -0.05 0.00 0.01 0.00 0.00 46.19 44.14 1ml3 s LEU 97 CO 0.00 0.24 2.64 -0.81 1.01 0.00 0.00 176.35 179.42 1ml3 n PRO 98 N 3.13 3.23 0.21 1.29 -0.04 -1.26 -4.60 135.00 136.96 1ml3 n PRO 98 Ca -0.17 -2.24 0.14 0.00 -0.04 0.00 0.00 63.50 61.18 1ml3 n PRO 98 Cb 0.53 -2.92 0.44 0.00 -0.04 0.00 0.00 33.50 31.51 1ml3 n PRO 98 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1ml3 h TRP 99 N 5.52 0.00 0.17 0.54 4.06 -1.79 -3.13 115.95 121.32 1ml3 h TRP 99 Ca 0.74 0.00 -0.30 0.00 2.06 0.00 0.00 58.89 61.39 1ml3 h TRP 99 Cb 0.39 0.00 0.02 0.00 -1.00 0.00 0.00 29.16 28.57 1ml3 h TRP 99 CO 1.74 0.00 -1.32 0.78 -3.56 0.00 0.00 178.44 176.08 1ml3 h GLY 100 N 3.12 0.49 0.98 1.49 0.00 -1.71 0.28 103.07 107.72 1ml3 h GLY 100 Ca 0.00 -1.19 0.00 0.00 0.00 0.00 0.00 47.33 46.14 1ml3 h GLY 100 CO 0.00 1.04 0.07 0.50 0.00 0.00 0.00 176.54 178.15 1ml3 h LYS 101 N 0.13 0.14 -0.00 4.80 1.57 -1.85 -2.01 116.57 119.35 1ml3 h LYS 101 Ca -0.19 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1ml3 h LYS 101 Cb 2.03 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.31 1ml3 h LYS 101 CO 0.24 0.11 -0.12 1.28 -0.57 0.00 0.00 179.45 180.39 1ml3 n LEU 102 N -5.01 0.27 -3.15 2.94 4.32 -1.22 -4.97 117.00 110.19 1ml3 n LEU 102 Ca -0.05 0.18 -0.04 0.00 -0.02 0.00 0.00 56.01 56.08 1ml3 n LEU 102 Cb 0.04 -0.29 0.00 0.00 -1.62 0.00 0.00 43.42 41.55 1ml3 n LEU 102 CO 0.33 0.05 0.24 0.61 -1.22 0.00 0.00 177.39 177.41 1ml3 n GLY 103 N 1.37 -1.24 3.14 -0.72 0.00 -0.36 -5.00 105.19 102.38 1ml3 n GLY 103 Ca 0.11 0.54 -0.34 0.00 0.00 0.00 0.00 46.02 46.34 1ml3 n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ml3 s VAL 104 N -2.96 2.56 -0.03 1.61 1.01 0.84 -4.98 120.40 118.45 1ml3 s VAL 104 Ca 0.02 -1.27 -0.00 0.00 0.00 0.00 0.00 61.98 60.72 1ml3 s VAL 104 Cb -0.00 -2.37 -0.00 0.00 0.00 0.00 0.00 36.38 34.00 1ml3 s VAL 104 CO 0.77 0.12 -0.01 1.05 0.00 0.00 0.00 175.10 177.03 1ml3 h GLU 105 N 7.92 0.00 -6.48 2.72 4.11 -1.87 -3.33 114.58 117.65 1ml3 h GLU 105 Ca -0.28 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.60 1ml3 h GLU 105 Cb 1.08 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.27 1ml3 h GLU 105 CO 0.54 0.00 1.07 0.71 0.07 0.00 0.00 179.01 181.40 1ml3 s TYR 106 N -1.20 2.38 -0.27 2.06 4.12 -0.87 -2.68 117.35 120.89 1ml3 s TYR 106 Ca -0.01 0.56 -0.02 0.00 0.02 0.00 0.00 57.07 57.62 1ml3 s TYR 106 Cb 0.00 -4.38 0.03 0.00 -1.52 0.00 0.00 41.96 36.09 1ml3 s TYR 106 CO 0.01 -1.90 -0.03 0.54 0.02 0.00 0.00 175.55 174.19 1ml3 s VAL 107 N 5.69 3.02 -0.37 0.71 0.11 -0.85 -0.38 120.40 128.33 1ml3 s VAL 107 Ca 0.55 -1.07 -0.29 0.00 -2.93 0.00 0.00 61.98 58.24 1ml3 s VAL 107 Cb -0.11 -2.59 0.00 0.00 -1.53 0.00 0.00 36.38 32.15 1ml3 s VAL 107 CO 0.28 0.11 1.48 -0.63 -3.33 0.00 0.00 175.10 173.02 1ml3 s ILE 108 N 1.33 3.84 -0.53 7.04 -1.09 0.15 -2.40 121.20 129.54 1ml3 s ILE 108 Ca -0.01 0.88 -0.22 0.00 -2.23 0.00 0.00 60.65 59.07 1ml3 s ILE 108 Cb -0.17 -4.07 0.05 0.00 -1.58 0.00 0.00 42.46 36.68 1ml3 s ILE 108 CO -0.03 -0.64 0.81 -0.70 -1.23 0.00 0.00 174.94 173.16 1ml3 s GLU 109 N 4.95 3.25 -0.04 2.79 2.56 0.13 -0.50 118.70 131.85 1ml3 s GLU 109 Ca 0.65 -0.51 0.05 0.00 0.00 0.00 0.00 54.97 55.15 1ml3 s GLU 109 Cb -0.16 -4.07 0.08 0.00 2.00 0.00 0.00 34.13 31.98 1ml3 s GLU 109 CO 0.32 -1.37 0.93 -1.13 -0.56 0.00 0.00 175.26 173.44 1ml3 n SER 110 N 6.93 1.26 -0.08 -1.70 3.41 0.28 -0.76 113.62 122.96 1ml3 n SER 110 Ca -0.02 -2.07 -0.01 0.00 -0.26 0.00 0.00 58.87 56.51 1ml3 n SER 110 Cb 0.47 -0.16 0.26 0.00 -0.26 0.00 0.00 64.21 64.52 1ml3 n SER 110 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1ml3 h THR 111 N 2.02 1.20 -0.06 6.66 1.35 -1.34 -3.44 112.91 119.30 1ml3 h THR 111 Ca 0.00 -0.68 -0.03 0.00 -0.55 0.00 0.00 66.41 65.16 1ml3 h THR 111 Cb 0.92 0.69 -0.01 0.00 -1.73 0.00 0.00 68.15 68.02 1ml3 h THR 111 CO 0.00 0.25 -0.02 0.61 -0.25 0.00 0.00 175.52 176.11 1ml3 n GLY 112 N -1.00 0.49 0.00 5.82 0.00 -1.26 -4.88 105.19 104.35 1ml3 n GLY 112 Ca 0.03 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1ml3 n GLY 112 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ml3 n LEU 113 N -0.14 0.91 -3.18 0.99 7.94 -1.26 -4.88 117.00 117.37 1ml3 n LEU 113 Ca -0.01 -0.91 -0.23 0.00 -1.11 0.00 0.00 56.01 53.75 1ml3 n LEU 113 Cb 0.05 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 43.93 1ml3 n LEU 113 CO 0.02 0.23 -0.27 0.49 -1.11 0.00 0.00 177.39 176.74 1ml3 n PHE 114 N -0.22 -0.57 0.01 1.96 3.72 -1.26 -4.96 117.46 116.13 1ml3 n PHE 114 Ca 0.00 -3.44 -0.18 0.00 -0.05 0.00 0.00 57.45 53.78 1ml3 n PHE 114 Cb 0.37 -0.21 -0.14 0.00 -0.94 0.00 0.00 39.48 38.56 1ml3 n PHE 114 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1ml3 h THR 115 N 2.21 1.59 -1.68 4.37 2.02 -1.90 -3.36 112.91 116.16 1ml3 h THR 115 Ca 0.07 -2.47 -0.68 0.00 0.77 0.00 0.00 66.41 64.10 1ml3 h THR 115 Cb 0.89 3.25 0.05 0.00 -1.74 0.00 0.00 68.15 70.60 1ml3 h THR 115 CO 0.45 0.68 0.51 0.00 0.37 0.00 0.00 175.52 177.53 1ml3 n ALA 116 N -2.67 -0.83 0.08 6.16 0.00 -1.26 -3.48 120.51 118.52 1ml3 n ALA 116 Ca -0.13 0.50 0.05 0.00 0.00 0.00 0.00 53.44 53.86 1ml3 n ALA 116 Cb 0.70 -2.10 0.27 0.00 0.00 0.00 0.00 19.45 18.32 1ml3 n ALA 116 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1ml3 n LYS 117 N 2.88 0.06 -0.07 0.00 4.81 -1.10 -1.13 118.16 123.61 1ml3 n LYS 117 Ca 0.19 0.56 -0.11 0.00 -0.87 0.00 0.00 58.31 58.09 1ml3 n LYS 117 Cb 0.19 -1.71 -0.07 0.00 0.02 0.00 0.00 35.03 33.46 1ml3 n LYS 117 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ml3 h ALA 118 N 2.01 0.07 -0.12 3.14 0.00 -1.87 -3.24 119.26 119.24 1ml3 h ALA 118 Ca 0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 54.91 54.34 1ml3 h ALA 118 Cb 0.01 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ml3 h ALA 118 CO 0.00 0.29 0.05 0.00 0.00 0.00 0.00 179.25 179.59 1ml3 h ALA 119 N -0.59 0.16 0.00 0.00 0.00 -1.80 -1.61 119.26 115.42 1ml3 h ALA 119 Ca -0.09 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ml3 h ALA 119 Cb 0.72 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1ml3 h ALA 119 CO -0.05 -0.25 0.00 0.00 0.00 0.00 0.00 179.25 178.94 1ml3 n ALA 120 N -2.21 2.09 0.36 0.00 0.00 -0.28 -1.53 120.51 118.95 1ml3 n ALA 120 Ca -0.05 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.44 1ml3 n ALA 120 Cb 0.12 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.49 1ml3 n ALA 120 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ml3 n GLU 121 N -0.11 2.41 0.26 0.00 2.13 -0.61 -4.40 120.64 120.33 1ml3 n GLU 121 Ca 0.00 -0.03 0.18 0.00 0.66 0.00 0.00 57.16 57.97 1ml3 n GLU 121 Cb 0.10 -1.10 0.91 0.00 0.27 0.00 0.00 31.44 31.62 1ml3 n GLU 121 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1ml3 h GLY 122 N 2.47 0.00 1.27 8.31 0.00 -1.26 0.17 103.07 114.03 1ml3 h GLY 122 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 1ml3 h GLY 122 CO 0.00 0.00 0.34 0.45 0.00 0.00 0.00 176.54 177.33 1ml3 h HIS 123 N 0.00 0.45 0.03 5.60 3.86 -1.77 0.91 115.15 124.22 1ml3 h HIS 123 Ca 0.05 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1ml3 h HIS 123 Cb 0.37 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.70 1ml3 h HIS 123 CO 0.00 0.24 -0.01 -0.07 0.86 0.00 0.00 177.93 178.95 1ml3 h LEU 124 N 0.45 -0.03 0.00 2.43 4.07 -0.70 0.46 115.31 121.98 1ml3 h LEU 124 Ca 0.22 -0.41 0.00 0.00 0.08 0.00 0.00 57.88 57.77 1ml3 h LEU 124 Cb 0.31 0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.05 1ml3 h LEU 124 CO -0.06 0.40 0.00 -2.11 -1.08 0.00 0.00 178.44 175.59 1ml3 n ARG 125 N -4.90 0.88 0.00 1.13 1.85 -0.92 -1.74 116.66 112.96 1ml3 n ARG 125 Ca -0.08 0.00 0.09 0.00 -1.00 0.00 0.00 57.85 56.86 1ml3 n ARG 125 Cb 0.23 -1.35 -0.01 0.00 -1.05 0.00 0.00 32.46 30.28 1ml3 n ARG 125 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ml3 n GLY 126 N 0.65 -0.05 0.00 2.89 0.00 0.27 -4.97 105.19 103.97 1ml3 n GLY 126 Ca 0.15 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1ml3 n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ml3 n GLY 127 N 1.25 2.32 3.77 -0.02 0.00 -0.71 -2.21 105.19 109.57 1ml3 n GLY 127 Ca 0.07 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 1ml3 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ml3 s ALA 128 N -0.26 2.00 -0.02 4.61 0.00 0.16 -4.45 121.76 123.80 1ml3 s ALA 128 Ca 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 51.96 51.86 1ml3 s ALA 128 Cb 0.00 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 19.94 1ml3 s ALA 128 CO 0.00 -1.94 -0.06 0.54 0.00 0.00 0.00 175.76 174.29 1ml3 n ARG 129 N -3.60 0.10 -3.64 0.00 1.74 -1.09 -3.60 116.66 106.56 1ml3 n ARG 129 Ca 0.07 0.04 -0.37 0.00 -0.77 0.00 0.00 57.85 56.82 1ml3 n ARG 129 Cb 0.55 -0.51 -0.06 0.00 -1.02 0.00 0.00 32.46 31.42 1ml3 n ARG 129 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1ml3 s LYS 130 N -1.49 3.78 -0.03 5.56 -0.14 -1.11 -4.73 119.74 121.58 1ml3 s LYS 130 Ca -0.05 0.18 0.03 0.00 -1.36 0.00 0.00 55.97 54.77 1ml3 s LYS 130 Cb 0.01 -3.23 -0.00 0.00 -1.68 0.00 0.00 37.83 32.92 1ml3 s LYS 130 CO 0.08 0.67 -0.12 0.08 -0.76 0.00 0.00 175.35 175.30 1ml3 s VAL 131 N -0.88 0.98 -0.18 3.17 1.01 0.22 -2.01 120.40 122.72 1ml3 s VAL 131 Ca 0.20 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.70 1ml3 s VAL 131 Cb -0.15 -0.86 0.01 0.00 0.00 0.00 0.00 36.38 35.39 1ml3 s VAL 131 CO 0.09 0.30 -0.18 -0.69 0.00 0.00 0.00 175.10 174.61 1ml3 s VAL 132 N 0.09 2.22 -0.41 2.92 1.01 -1.01 -1.30 120.40 123.92 1ml3 s VAL 132 Ca -0.02 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 60.84 1ml3 s VAL 132 Cb -0.09 -1.94 0.02 0.00 0.00 0.00 0.00 36.38 34.37 1ml3 s VAL 132 CO 0.01 0.53 0.74 -0.63 0.00 0.00 0.00 175.10 175.75 1ml3 s ILE 133 N 1.24 4.73 -0.09 2.22 1.01 0.15 0.22 121.20 130.67 1ml3 s ILE 133 Ca 0.03 0.50 -0.05 0.00 0.00 0.00 0.00 60.65 61.14 1ml3 s ILE 133 Cb -0.14 -4.24 -0.20 0.00 0.01 0.00 0.00 42.46 37.90 1ml3 s ILE 133 CO -0.10 -0.58 2.87 -1.54 0.00 0.00 0.00 174.94 175.59 1ml3 n SER 134 N 6.48 4.22 0.00 3.58 3.41 0.06 -1.93 113.62 129.44 1ml3 n SER 134 Ca 0.01 -2.27 0.00 0.00 -0.26 0.00 0.00 58.87 56.36 1ml3 n SER 134 Cb 0.48 -1.11 0.00 0.00 -0.26 0.00 0.00 64.21 63.33 1ml3 n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ml3 n ALA 135 N 2.71 0.00 -1.46 7.33 0.00 -1.19 -4.95 120.51 122.94 1ml3 n ALA 135 Ca 0.35 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 53.32 1ml3 n ALA 135 Cb 0.67 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.09 1ml3 n ALA 135 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ml3 n PRO 136 N -0.29 0.46 -4.35 0.00 -0.02 -1.09 -4.45 135.00 125.24 1ml3 n PRO 136 Ca 0.00 0.16 -0.25 0.00 -2.02 0.00 0.00 63.50 61.39 1ml3 n PRO 136 Cb 0.00 -1.29 -0.09 0.00 -0.02 0.00 0.00 33.50 32.10 1ml3 n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ml3 s ALA 137 N -1.01 3.23 0.00 3.55 0.00 -1.26 -4.89 121.76 121.38 1ml3 s ALA 137 Ca 0.62 -2.02 0.00 0.00 0.00 0.00 0.00 51.96 50.56 1ml3 s ALA 137 Cb -0.86 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 21.97 1ml3 s ALA 137 CO 0.57 0.02 0.00 -1.13 0.00 0.00 0.00 175.76 175.22 1ml3 n SER 138 N -0.98 1.38 -1.65 0.00 3.41 -1.23 -4.76 113.62 109.79 1ml3 n SER 138 Ca -0.04 -0.25 -0.19 0.00 -0.26 0.00 0.00 58.87 58.13 1ml3 n SER 138 Cb 0.63 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.51 1ml3 n SER 138 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ml3 n GLY 139 N 3.44 1.60 2.84 5.00 0.00 -1.26 -2.72 105.19 114.08 1ml3 n GLY 139 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1ml3 n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ml3 n GLY 140 N -0.42 -0.61 3.67 -0.02 0.00 -1.26 -4.70 105.19 101.85 1ml3 n GLY 140 Ca -0.20 0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1ml3 n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ml3 s ALA 141 N -3.29 3.47 0.04 4.61 0.00 -1.15 -5.04 121.76 120.40 1ml3 s ALA 141 Ca 0.30 -0.73 -0.36 0.00 0.00 0.00 0.00 51.96 51.17 1ml3 s ALA 141 Cb -0.04 -1.93 -0.16 0.00 0.00 0.00 0.00 23.12 20.99 1ml3 s ALA 141 CO 0.56 0.23 1.47 1.17 0.00 0.00 0.00 175.76 179.19 1ml3 n LYS 142 N 3.34 1.39 -4.06 0.00 3.00 -1.26 -4.62 118.16 115.96 1ml3 n LYS 142 Ca -0.17 0.50 -0.35 0.00 -0.00 0.00 0.00 58.31 58.30 1ml3 n LYS 142 Cb 0.52 -2.19 -0.09 0.00 0.00 0.00 0.00 35.03 33.27 1ml3 n LYS 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1ml3 s THR 143 N 1.14 4.79 0.05 3.15 2.01 -1.26 -0.68 115.64 124.84 1ml3 s THR 143 Ca 0.86 -0.04 0.05 0.00 0.31 0.00 0.00 61.69 62.86 1ml3 s THR 143 Cb -0.90 -3.12 -0.02 0.00 0.01 0.00 0.00 72.50 68.46 1ml3 s THR 143 CO 0.48 0.51 -0.15 -0.76 -0.69 0.00 0.00 174.62 174.00 1ml3 s LEU 144 N -0.01 2.21 -0.18 4.42 1.43 -0.35 -4.91 118.68 121.29 1ml3 s LEU 144 Ca 0.06 -0.53 -0.05 0.00 -1.03 0.00 0.00 54.13 52.59 1ml3 s LEU 144 Cb -0.12 -0.60 0.06 0.00 0.03 0.00 0.00 46.19 45.56 1ml3 s LEU 144 CO 0.01 0.00 0.09 -0.69 0.23 0.00 0.00 176.35 175.99 1ml3 s VAL 145 N -1.01 -0.02 0.23 -1.59 1.01 -1.26 -4.21 120.40 113.55 1ml3 s VAL 145 Ca 0.01 -0.25 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 1ml3 s VAL 145 Cb -0.09 -0.65 -0.15 0.00 0.00 0.00 0.00 36.38 35.49 1ml3 s VAL 145 CO 0.02 -0.31 1.01 0.23 0.00 0.00 0.00 175.10 176.06 1ml3 n MET 146 N 5.25 1.10 0.00 2.72 0.00 -1.26 -0.44 117.12 124.49 1ml3 n MET 146 Ca -0.07 0.39 0.00 0.00 0.00 0.00 0.00 57.70 58.02 1ml3 n MET 146 Cb 0.48 -1.77 0.00 0.00 0.00 0.00 0.00 33.22 31.94 1ml3 n MET 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ml3 n GLY 147 N 1.64 2.84 0.98 3.03 0.00 -1.26 -4.78 105.19 107.64 1ml3 n GLY 147 Ca 0.13 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.14 1ml3 n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ml3 n VAL 148 N -2.00 0.95 -1.86 1.61 0.31 0.42 -4.95 118.33 112.81 1ml3 n VAL 148 Ca 0.00 0.28 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1ml3 n VAL 148 Cb 0.00 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.32 1ml3 n VAL 148 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1ml3 n ASN 149 N -3.43 0.00 0.09 4.52 6.94 -0.66 -4.90 115.26 117.82 1ml3 n ASN 149 Ca -0.02 -1.49 0.08 0.00 -0.02 0.00 0.00 54.58 53.13 1ml3 n ASN 149 Cb 0.16 -0.10 0.38 0.00 -2.36 0.00 0.00 39.78 37.87 1ml3 n ASN 149 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ml3 n HIS 150 N 0.00 0.47 0.98 -2.53 1.44 -1.17 -1.68 115.22 112.73 1ml3 n HIS 150 Ca 0.00 0.22 0.14 0.00 -2.01 0.00 0.00 57.72 56.07 1ml3 n HIS 150 Cb 0.60 -0.85 0.61 0.00 0.12 0.00 0.00 29.99 30.46 1ml3 n HIS 150 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1ml3 n HIS 151 N -1.96 0.00 1.25 -1.40 8.25 -1.26 -3.14 115.22 116.96 1ml3 n HIS 151 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1ml3 n HIS 151 Cb 0.09 -0.50 0.00 0.00 1.12 0.00 0.00 29.99 30.70 1ml3 n HIS 151 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1ml3 n GLU 152 N -1.50 0.85 -2.51 -0.41 1.02 -0.68 -4.81 120.64 112.60 1ml3 n GLU 152 Ca 0.07 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.78 1ml3 n GLU 152 Cb 0.33 -1.22 -0.02 0.00 -0.02 0.00 0.00 31.44 30.51 1ml3 n GLU 152 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1ml3 s TYR 153 N -1.48 3.09 -0.44 -0.32 5.04 -1.19 -5.01 117.35 117.04 1ml3 s TYR 153 Ca 0.00 1.21 -0.10 0.00 -2.44 0.00 0.00 57.07 55.74 1ml3 s TYR 153 Cb 0.00 -3.41 0.09 0.00 0.35 0.00 0.00 41.96 39.00 1ml3 s TYR 153 CO 0.00 -1.21 0.30 1.21 -1.34 0.00 0.00 175.55 174.51 1ml3 s ASN 154 N 1.62 5.70 0.42 4.32 3.84 -1.26 -4.98 114.94 124.59 1ml3 s ASN 154 Ca 0.52 -1.66 0.25 0.00 0.21 0.00 0.00 52.86 52.19 1ml3 s ASN 154 Cb -0.20 -2.01 1.32 0.00 -0.55 0.00 0.00 41.25 39.80 1ml3 s ASN 154 CO 0.14 -0.61 1.66 -0.65 -2.79 0.00 0.00 177.10 174.85 1ml3 h PRO 155 N 8.45 0.17 -2.26 0.43 0.11 -1.84 -0.36 132.00 136.70 1ml3 h PRO 155 Ca -0.23 -0.01 -0.62 0.00 0.11 0.00 0.00 66.00 65.25 1ml3 h PRO 155 Cb 1.08 -0.04 -0.41 0.00 0.11 0.00 0.00 31.00 31.75 1ml3 h PRO 155 CO 0.81 0.11 -0.46 -1.13 -0.21 0.00 0.00 178.00 177.12 1ml3 n SER 156 N -4.75 4.12 0.00 -2.05 3.41 -1.26 -4.44 113.62 108.65 1ml3 n SER 156 Ca 0.34 -3.48 0.00 0.00 -0.26 0.00 0.00 58.87 55.48 1ml3 n SER 156 Cb 1.26 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 1ml3 n SER 156 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1ml3 n GLU 157 N 0.75 0.00 -3.68 4.33 4.07 -1.01 -5.08 120.64 120.02 1ml3 n GLU 157 Ca 0.30 0.00 -0.39 0.00 -0.06 0.00 0.00 57.16 57.01 1ml3 n GLU 157 Cb 0.40 0.00 -0.11 0.00 -0.06 0.00 0.00 31.44 31.67 1ml3 n GLU 157 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 1ml3 s HIS 158 N 0.00 3.31 0.00 4.31 3.76 -0.17 -4.86 115.29 121.63 1ml3 s HIS 158 Ca 0.00 -1.49 0.00 0.00 -0.15 0.00 0.00 55.06 53.42 1ml3 s HIS 158 Cb 0.00 -2.63 0.00 0.00 1.11 0.00 0.00 32.58 31.06 1ml3 s HIS 158 CO 0.00 -0.79 0.00 0.72 -0.85 0.00 0.00 174.74 173.82 1ml3 n HIS 159 N 4.86 0.00 -3.50 1.40 8.25 -1.26 -4.70 115.22 120.27 1ml3 n HIS 159 Ca -0.11 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.07 1ml3 n HIS 159 Cb 0.44 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.43 1ml3 n HIS 159 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ml3 s VAL 160 N -1.12 0.57 0.38 1.59 1.01 -1.26 -0.61 120.40 120.96 1ml3 s VAL 160 Ca 0.00 -2.36 0.05 0.00 0.00 0.00 0.00 61.98 59.67 1ml3 s VAL 160 Cb 0.00 -1.40 -0.00 0.00 0.00 0.00 0.00 36.38 34.97 1ml3 s VAL 160 CO 0.00 -1.08 0.54 0.68 0.00 0.00 0.00 175.10 175.24 1ml3 s VAL 161 N 0.41 3.81 0.09 2.92 -7.23 -0.42 -4.12 120.40 115.86 1ml3 s VAL 161 Ca 0.24 -0.89 0.10 0.00 -1.81 0.00 0.00 61.98 59.62 1ml3 s VAL 161 Cb -0.11 -3.33 -0.04 0.00 0.56 0.00 0.00 36.38 33.46 1ml3 s VAL 161 CO -0.09 -0.15 -0.25 -0.55 -0.31 0.00 0.00 175.10 173.75 1ml3 s SER 162 N -4.22 3.37 0.00 4.85 0.15 0.14 0.34 113.70 118.33 1ml3 s SER 162 Ca 0.48 -0.65 0.19 0.00 0.70 0.00 0.00 55.95 56.67 1ml3 s SER 162 Cb -0.10 -0.31 0.53 0.00 -1.71 0.00 0.00 66.02 64.43 1ml3 s SER 162 CO 0.33 0.21 1.44 -3.20 1.20 0.00 0.00 173.24 173.22 1ml3 n ASN 163 N 1.26 3.61 0.00 5.45 5.15 -0.81 -1.21 115.26 128.70 1ml3 n ASN 163 Ca -0.17 -1.99 0.00 0.00 -0.60 0.00 0.00 54.58 51.82 1ml3 n ASN 163 Cb 0.52 -0.39 0.00 0.00 -0.53 0.00 0.00 39.78 39.38 1ml3 n ASN 163 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ml3 n ALA 164 N 1.31 0.00 -2.61 5.20 0.00 -1.26 -4.79 120.51 118.36 1ml3 n ALA 164 Ca 0.20 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.37 1ml3 n ALA 164 Cb 0.56 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.91 1ml3 n ALA 164 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ml3 s SER 165 N -4.00 3.68 0.09 0.00 1.04 -1.26 -2.69 113.70 110.57 1ml3 s SER 165 Ca 0.00 -1.40 -0.23 0.00 0.48 0.00 0.00 55.95 54.80 1ml3 s SER 165 Cb 0.00 -0.27 -0.14 0.00 0.10 0.00 0.00 66.02 65.71 1ml3 s SER 165 CO 0.00 -0.51 1.73 0.00 0.98 0.00 0.00 173.24 175.44 1ml3 h THR 167 N -0.05 1.15 -0.86 0.00 2.02 -1.95 -1.54 112.91 111.69 1ml3 h THR 167 Ca 0.01 -0.38 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 1ml3 h THR 167 Cb 0.05 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.02 1ml3 h THR 167 CO -0.02 0.16 0.44 0.74 0.37 0.00 0.00 175.52 177.21 1ml3 h THR 168 N 0.59 1.26 0.00 3.16 2.02 -1.78 0.19 112.91 118.35 1ml3 h THR 168 Ca 0.16 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.66 1ml3 h THR 168 Cb 0.03 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 1ml3 h THR 168 CO -0.03 0.30 0.00 0.59 0.37 0.00 0.00 175.52 176.75 1ml3 n ASN 169 N -4.32 0.52 -0.10 4.18 3.02 -0.07 -0.59 115.26 117.90 1ml3 n ASN 169 Ca 0.09 0.64 -0.14 0.00 -0.03 0.00 0.00 54.58 55.14 1ml3 n ASN 169 Cb 0.12 -0.74 -0.14 0.00 -0.61 0.00 0.00 39.78 38.40 1ml3 n ASN 169 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ml3 h LEU 171 N 0.01 0.22 -0.68 0.00 6.46 -0.44 -3.38 115.31 117.49 1ml3 h LEU 171 Ca -0.53 -0.97 0.15 0.00 -0.12 0.00 0.00 57.88 56.41 1ml3 h LEU 171 Cb 2.09 -0.07 -0.12 0.00 -0.73 0.00 0.00 40.66 41.82 1ml3 h LEU 171 CO -0.00 1.17 -0.04 0.00 -0.62 0.00 0.00 178.44 178.95 1ml3 h ALA 172 N 0.05 0.63 -0.79 1.25 0.00 -1.07 -1.34 119.26 117.99 1ml3 h ALA 172 Ca -0.06 0.23 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1ml3 h ALA 172 Cb 1.29 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 19.44 1ml3 h ALA 172 CO 0.07 -0.41 0.52 -1.35 0.00 0.00 0.00 179.25 178.07 1ml3 h PRO 173 N 0.08 0.78 0.12 0.00 0.11 -1.79 0.38 132.00 131.67 1ml3 h PRO 173 Ca 0.36 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.41 1ml3 h PRO 173 Cb 0.59 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.53 1ml3 h PRO 173 CO -0.62 0.51 -0.06 0.82 -0.21 0.00 0.00 178.00 178.44 1ml3 h ILE 174 N 0.80 1.07 -0.60 4.15 1.08 -1.45 -1.57 117.51 120.98 1ml3 h ILE 174 Ca 0.35 -0.82 0.03 0.00 -0.39 0.00 0.00 64.86 64.04 1ml3 h ILE 174 Cb 0.32 1.57 -0.04 0.00 -3.07 0.00 0.00 36.82 35.60 1ml3 h ILE 174 CO -0.13 0.19 0.35 0.58 -0.69 0.00 0.00 178.15 178.46 1ml3 h VAL 175 N -0.55 1.04 0.00 1.67 2.07 -0.99 -0.26 116.25 119.23 1ml3 h VAL 175 Ca -0.02 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.30 1ml3 h VAL 175 Cb 0.44 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1ml3 h VAL 175 CO 0.03 0.13 -0.22 -0.74 0.02 0.00 0.00 177.57 176.78 1ml3 h HIS 176 N 0.69 -0.58 -0.14 1.57 -0.00 -0.21 0.15 115.15 116.64 1ml3 h HIS 176 Ca 0.25 0.02 0.03 0.00 -0.00 0.00 0.00 60.37 60.66 1ml3 h HIS 176 Cb 0.06 0.26 -0.02 0.00 -0.00 0.00 0.00 27.41 27.70 1ml3 h HIS 176 CO -0.06 -0.30 -0.01 0.28 -0.00 0.00 0.00 177.93 177.83 1ml3 h VAL 177 N -0.35 0.88 -0.46 5.26 2.07 -0.81 0.12 116.25 122.96 1ml3 h VAL 177 Ca 0.06 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.65 1ml3 h VAL 177 Cb 0.42 0.85 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 1ml3 h VAL 177 CO -0.20 0.01 0.08 -0.07 0.02 0.00 0.00 177.57 177.41 1ml3 h LEU 178 N 0.03 -0.01 0.50 2.57 3.38 -0.49 0.25 115.31 121.53 1ml3 h LEU 178 Ca 0.07 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1ml3 h LEU 178 Cb 0.09 0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1ml3 h LEU 178 CO -0.13 0.03 -0.24 0.58 0.09 0.00 0.00 178.44 178.77 1ml3 h VAL 179 N 0.22 0.00 -1.02 1.22 2.07 -0.41 -0.45 116.25 117.88 1ml3 h VAL 179 Ca 0.23 -0.21 0.25 0.00 0.82 0.00 0.00 66.70 67.79 1ml3 h VAL 179 Cb 0.30 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.98 1ml3 h VAL 179 CO -0.30 0.00 0.66 0.11 0.02 0.00 0.00 177.57 178.05 1ml3 h LYS 180 N -0.88 0.41 0.00 1.57 1.79 -0.69 0.10 116.57 118.88 1ml3 h LYS 180 Ca -0.07 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1ml3 h LYS 180 Cb 0.51 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1ml3 h LYS 180 CO 0.11 0.27 0.00 0.39 -1.08 0.00 0.00 179.45 179.14 1ml3 n GLU 181 N -4.62 0.07 0.00 3.15 -0.58 0.86 -4.89 120.64 114.63 1ml3 n GLU 181 Ca 0.24 0.13 0.00 0.00 -0.42 0.00 0.00 57.16 57.11 1ml3 n GLU 181 Cb 0.83 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.20 1ml3 n GLU 181 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ml3 n GLY 182 N 0.64 0.87 0.27 0.62 0.00 0.36 -4.91 105.19 103.03 1ml3 n GLY 182 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.00 1ml3 n GLY 182 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1ml3 h PHE 183 N 0.00 0.94 -2.65 1.61 0.04 -1.53 -3.45 116.94 111.90 1ml3 h PHE 183 Ca 0.00 -0.10 0.28 0.00 2.80 0.00 0.00 57.97 60.94 1ml3 h PHE 183 Cb 0.00 -0.27 -0.13 0.00 2.20 0.00 0.00 35.95 37.75 1ml3 h PHE 183 CO 0.00 0.80 -0.84 0.41 -0.60 0.00 0.00 178.31 178.07 1ml3 n GLY 184 N -0.67 -2.86 2.77 -1.45 0.00 -0.25 -0.82 105.19 101.91 1ml3 n GLY 184 Ca 0.03 -1.16 -0.26 0.00 0.00 0.00 0.00 46.02 44.62 1ml3 n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ml3 s VAL 185 N -3.49 0.56 -0.04 1.61 1.01 -1.26 -2.49 120.40 116.30 1ml3 s VAL 185 Ca 0.00 -0.35 -0.11 0.00 0.00 0.00 0.00 61.98 61.52 1ml3 s VAL 185 Cb 0.00 -0.91 -0.06 0.00 0.00 0.00 0.00 36.38 35.41 1ml3 s VAL 185 CO 0.00 -0.01 0.49 1.56 0.00 0.00 0.00 175.10 177.14 1ml3 h GLN 186 N 8.25 -0.37 -3.89 2.72 4.20 -1.40 -3.46 115.11 121.16 1ml3 h GLN 186 Ca -0.19 0.03 -0.14 0.00 0.06 0.00 0.00 58.65 58.41 1ml3 h GLN 186 Cb 1.12 0.08 -0.19 0.00 0.30 0.00 0.00 27.48 28.80 1ml3 h GLN 186 CO 0.32 -0.25 -0.61 0.95 -0.67 0.00 0.00 178.83 178.58 1ml3 s THR 187 N -2.81 0.13 -0.25 -0.54 -4.23 -1.25 -4.82 115.64 101.87 1ml3 s THR 187 Ca -0.06 -1.07 -0.23 0.00 -1.18 0.00 0.00 61.69 59.15 1ml3 s THR 187 Cb 0.01 -0.69 0.07 0.00 1.34 0.00 0.00 72.50 73.22 1ml3 s THR 187 CO 0.17 -0.59 0.67 -0.83 -0.54 0.00 0.00 174.62 173.50 1ml3 s GLY 188 N -1.90 -0.51 -0.05 3.99 0.00 -0.37 -1.60 107.32 106.90 1ml3 s GLY 188 Ca -0.09 1.90 0.05 0.00 0.00 0.00 0.00 44.72 46.59 1ml3 s GLY 188 CO -0.03 1.64 -0.20 1.08 0.00 0.00 0.00 173.10 175.59 1ml3 s LEU 189 N 0.38 1.98 0.07 0.66 1.43 0.51 -2.77 118.68 120.93 1ml3 s LEU 189 Ca -0.00 -0.42 0.08 0.00 -1.03 0.00 0.00 54.13 52.77 1ml3 s LEU 189 Cb -0.05 -1.13 -0.03 0.00 0.03 0.00 0.00 46.19 45.01 1ml3 s LEU 189 CO 0.01 0.20 -0.23 0.00 0.23 0.00 0.00 176.35 176.55 1ml3 s MET 190 N -0.08 1.45 -0.05 1.70 0.23 -0.66 -0.97 119.30 120.92 1ml3 s MET 190 Ca -0.03 -1.08 0.02 0.00 -1.03 0.00 0.00 55.69 53.57 1ml3 s MET 190 Cb -0.12 -1.66 0.01 0.00 -1.53 0.00 0.00 34.83 31.53 1ml3 s MET 190 CO 0.03 0.41 -0.11 0.99 -2.03 0.00 0.00 175.02 174.31 1ml3 s THR 191 N -0.90 1.03 -0.17 3.16 2.01 -0.43 -0.74 115.64 119.59 1ml3 s THR 191 Ca 0.09 -0.44 0.00 0.00 0.31 0.00 0.00 61.69 61.65 1ml3 s THR 191 Cb -0.09 -0.94 0.01 0.00 0.01 0.00 0.00 72.50 71.49 1ml3 s THR 191 CO 0.03 0.32 -0.16 0.28 -0.69 0.00 0.00 174.62 174.40 1ml3 s THR 192 N 0.51 2.49 -0.58 -0.82 -1.32 -0.67 -0.05 115.64 115.21 1ml3 s THR 192 Ca -0.11 -0.81 -0.24 0.00 -1.21 0.00 0.00 61.69 59.32 1ml3 s THR 192 Cb -0.14 -2.06 0.05 0.00 -1.51 0.00 0.00 72.50 68.84 1ml3 s THR 192 CO 0.02 0.51 0.97 -0.63 -2.21 0.00 0.00 174.62 173.28 1ml3 s ILE 193 N 1.06 4.34 0.02 5.08 1.09 -0.59 -1.06 121.20 131.14 1ml3 s ILE 193 Ca -0.01 0.19 0.04 0.00 -1.10 0.00 0.00 60.65 59.77 1ml3 s ILE 193 Cb -0.14 -4.59 -0.03 0.00 -1.06 0.00 0.00 42.46 36.64 1ml3 s ILE 193 CO -0.05 -1.21 -0.07 -2.28 -0.10 0.00 0.00 174.94 171.23 1ml3 s HIS 194 N 4.07 2.86 0.65 3.97 2.46 0.16 -1.89 115.29 127.57 1ml3 s HIS 194 Ca 0.29 -0.06 -0.14 0.00 0.47 0.00 0.00 55.06 55.63 1ml3 s HIS 194 Cb -0.13 -1.58 -0.01 0.00 -0.13 0.00 0.00 32.58 30.73 1ml3 s HIS 194 CO 0.18 0.37 1.07 -1.12 -2.47 0.00 0.00 174.74 172.77 1ml3 s SER 195 N -1.52 5.44 0.71 9.88 0.01 -1.26 0.16 113.70 127.11 1ml3 s SER 195 Ca 0.18 1.79 -0.12 0.00 1.31 0.00 0.00 55.95 59.10 1ml3 s SER 195 Cb -0.11 -2.52 0.02 0.00 0.21 0.00 0.00 66.02 63.62 1ml3 s SER 195 CO 0.08 -1.40 1.09 -0.72 0.41 0.00 0.00 173.24 172.70 1ml3 s TYR 196 N -2.64 2.69 0.38 2.43 -0.85 -0.90 -4.67 117.35 113.79 1ml3 s TYR 196 Ca 0.62 1.53 0.04 0.00 -0.52 0.00 0.00 57.07 58.74 1ml3 s TYR 196 Cb -0.16 -3.06 -0.03 0.00 0.38 0.00 0.00 41.96 39.08 1ml3 s TYR 196 CO 0.44 -1.63 0.13 0.95 -1.52 0.00 0.00 175.55 173.92 1ml3 s THR 197 N -2.69 0.60 0.55 -3.49 -4.23 -1.26 -4.75 115.64 100.37 1ml3 s THR 197 Ca 0.63 -2.00 0.28 0.00 -1.18 0.00 0.00 61.69 59.41 1ml3 s THR 197 Cb -0.18 -2.43 0.40 0.00 1.34 0.00 0.00 72.50 71.64 1ml3 s THR 197 CO 0.49 0.00 1.96 0.00 -0.54 0.00 0.00 174.62 176.54 1ml3 h ALA 198 N 1.90 2.41 0.00 3.99 0.00 -1.98 -0.51 119.26 125.07 1ml3 h ALA 198 Ca -0.35 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1ml3 h ALA 198 Cb 1.27 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ml3 h ALA 198 CO 0.57 -0.71 0.00 1.79 0.00 0.00 0.00 179.25 180.90 1ml3 h THR 199 N 0.00 0.00 -3.70 0.00 1.35 -1.99 -3.45 112.91 105.12 1ml3 h THR 199 Ca 0.26 -0.37 -0.45 0.00 -0.55 0.00 0.00 66.41 65.30 1ml3 h THR 199 Cb 1.12 1.22 0.14 0.00 -1.73 0.00 0.00 68.15 68.90 1ml3 h THR 199 CO -0.00 0.00 0.35 -1.10 -0.25 0.00 0.00 175.52 174.51 1ml3 s GLN 200 N -3.45 1.09 -0.01 4.72 -0.21 -0.20 -5.00 119.66 116.59 1ml3 s GLN 200 Ca 0.03 -0.48 0.07 0.00 0.02 0.00 0.00 55.36 55.00 1ml3 s GLN 200 Cb 0.09 -1.98 -0.02 0.00 1.00 0.00 0.00 33.01 32.10 1ml3 s GLN 200 CO 0.46 -2.06 -0.22 0.15 -2.12 0.00 0.00 175.29 171.51 1ml3 s LYS 201 N -5.67 2.17 0.26 2.91 3.01 -1.26 -4.99 119.74 116.17 1ml3 s LYS 201 Ca 0.70 -0.90 -0.03 0.00 -1.01 0.00 0.00 55.97 54.73 1ml3 s LYS 201 Cb -0.05 -2.14 0.32 0.00 -1.01 0.00 0.00 37.83 34.94 1ml3 s LYS 201 CO 0.50 0.57 1.81 1.79 0.51 0.00 0.00 175.35 180.53 1ml3 h THR 202 N 4.34 1.24 -3.53 2.17 1.35 -1.93 -1.26 112.91 115.30 1ml3 h THR 202 Ca -0.45 -0.82 -0.29 0.00 -0.55 0.00 0.00 66.41 64.30 1ml3 h THR 202 Cb 1.14 0.55 -0.15 0.00 -1.73 0.00 0.00 68.15 67.96 1ml3 h THR 202 CO 0.47 0.32 -0.71 0.68 -0.25 0.00 0.00 175.52 176.03 1ml3 s VAL 203 N -5.32 1.01 -0.37 6.82 -7.23 -1.26 -4.08 120.40 109.97 1ml3 s VAL 203 Ca -0.11 -2.02 -0.42 0.00 -1.81 0.00 0.00 61.98 57.62 1ml3 s VAL 203 Cb 0.16 -1.81 -0.17 0.00 0.56 0.00 0.00 36.38 35.11 1ml3 s VAL 203 CO 0.81 -0.77 1.81 0.47 -0.31 0.00 0.00 175.10 177.11 1ml3 n ASP 204 N -0.16 1.88 -4.07 4.85 8.00 -1.26 -4.34 116.55 121.45 1ml3 n ASP 204 Ca -0.11 0.98 -0.11 0.00 0.71 0.00 0.00 54.79 56.27 1ml3 n ASP 204 Cb 0.61 -1.06 -0.08 0.00 -0.02 0.00 0.00 41.12 40.57 1ml3 n ASP 204 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1ml3 s GLY 205 N 4.14 1.04 0.26 0.44 0.00 0.87 -4.92 107.32 109.15 1ml3 s GLY 205 Ca 1.04 -1.32 -0.31 0.00 0.00 0.00 0.00 44.72 44.13 1ml3 s GLY 205 CO 0.68 -1.04 1.47 -0.62 0.00 0.00 0.00 173.10 173.60 1ml3 n VAL 206 N -0.33 0.99 -2.71 1.40 0.31 -1.26 -4.50 118.33 112.22 1ml3 n VAL 206 Ca 0.00 -0.25 -0.06 0.00 -0.01 0.00 0.00 64.34 64.03 1ml3 n VAL 206 Cb 0.64 -1.64 0.05 0.00 -0.91 0.00 0.00 33.84 31.98 1ml3 n VAL 206 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ml3 n SER 207 N 2.15 -2.21 -0.35 4.52 2.88 -1.26 -4.92 113.62 114.43 1ml3 n SER 207 Ca 0.10 -2.42 0.14 0.00 -1.33 0.00 0.00 58.87 55.36 1ml3 n SER 207 Cb 0.33 1.28 0.33 0.00 -0.75 0.00 0.00 64.21 65.41 1ml3 n SER 207 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1ml3 h VAL 208 N 2.58 0.69 0.00 2.46 2.07 -1.97 -1.21 116.25 120.87 1ml3 h VAL 208 Ca -0.14 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1ml3 h VAL 208 Cb 1.12 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1ml3 h VAL 208 CO 0.05 0.14 0.00 0.29 0.02 0.00 0.00 177.57 178.06 1ml3 n LYS 209 N -4.77 0.13 -3.08 1.57 4.76 -1.26 -4.52 118.16 111.00 1ml3 n LYS 209 Ca 0.24 0.26 0.02 0.00 -2.87 0.00 0.00 58.31 55.95 1ml3 n LYS 209 Cb 0.59 -1.71 -0.00 0.00 -1.84 0.00 0.00 35.03 32.07 1ml3 n LYS 209 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1ml3 s ASP 210 N -3.82 -1.16 0.16 4.39 2.15 -0.47 -5.06 116.67 112.87 1ml3 s ASP 210 Ca 0.08 -0.50 -0.21 0.00 0.43 0.00 0.00 52.55 52.35 1ml3 s ASP 210 Cb 0.12 1.50 0.05 0.00 -0.30 0.00 0.00 42.92 44.29 1ml3 s ASP 210 CO 0.44 -0.14 1.63 -0.50 -0.17 0.00 0.00 175.17 176.43 1ml3 h TRP 211 N 6.63 -0.60 -0.66 -5.34 4.06 -1.75 -1.79 115.95 116.50 1ml3 h TRP 211 Ca 0.02 0.04 0.08 0.00 2.06 0.00 0.00 58.89 61.08 1ml3 h TRP 211 Cb 1.20 0.31 -0.06 0.00 -1.00 0.00 0.00 29.16 29.60 1ml3 h TRP 211 CO 0.07 -0.31 0.33 0.00 -3.56 0.00 0.00 178.44 174.98 1ml3 h ARG 212 N -0.20 0.57 0.00 0.49 3.08 -1.90 0.22 114.38 116.65 1ml3 h ARG 212 Ca 0.16 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1ml3 h ARG 212 Cb 0.45 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1ml3 h ARG 212 CO -0.42 0.38 0.00 0.41 -1.07 0.00 0.00 179.97 179.27 1ml3 n GLY 213 N -1.29 -0.33 0.03 0.04 0.00 -0.70 -1.84 105.19 101.09 1ml3 n GLY 213 Ca 0.09 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1ml3 n GLY 213 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ml3 n GLY 214 N -0.34 -1.13 3.81 -0.02 0.00 0.79 -4.30 105.19 104.00 1ml3 n GLY 214 Ca 0.07 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 1ml3 n GLY 214 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ml3 s ARG 215 N -3.28 3.29 -0.40 1.61 1.81 -0.77 -0.09 118.95 121.12 1ml3 s ARG 215 Ca 0.00 1.09 -0.41 0.00 -1.72 0.00 0.00 55.73 54.70 1ml3 s ARG 215 Cb 0.14 -2.03 -0.16 0.00 -0.45 0.00 0.00 34.95 32.45 1ml3 s ARG 215 CO 0.85 -0.82 2.00 0.00 -0.68 0.00 0.00 175.30 176.64 1ml3 n ALA 216 N -2.30 0.20 -0.06 2.13 0.00 -1.26 -4.51 120.51 114.71 1ml3 n ALA 216 Ca 0.08 0.20 -0.13 0.00 0.00 0.00 0.00 53.44 53.59 1ml3 n ALA 216 Cb 0.53 -2.24 -0.07 0.00 0.00 0.00 0.00 19.45 17.68 1ml3 n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ml3 h ALA 217 N 9.15 0.23 0.00 0.00 0.00 -1.37 -3.14 119.26 124.14 1ml3 h ALA 217 Ca -0.28 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1ml3 h ALA 217 Cb 1.36 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ml3 h ALA 217 CO 1.03 0.10 0.00 0.00 0.00 0.00 0.00 179.25 180.38 1ml3 n ALA 218 N -2.41 2.56 -0.36 0.00 0.00 -1.26 -3.57 120.51 115.47 1ml3 n ALA 218 Ca -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1ml3 n ALA 218 Cb 0.35 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1ml3 n ALA 218 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1ml3 n VAL 219 N -0.92 0.05 -4.39 0.00 0.24 -1.24 -4.69 118.33 107.38 1ml3 n VAL 219 Ca 0.18 -0.35 -0.20 0.00 -2.04 0.00 0.00 64.34 61.94 1ml3 n VAL 219 Cb 0.08 1.30 -0.10 0.00 -1.47 0.00 0.00 33.84 33.65 1ml3 n VAL 219 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1ml3 s ASN 220 N -0.05 2.57 -0.29 -1.34 0.01 -1.19 -5.05 114.94 109.60 1ml3 s ASN 220 Ca 0.00 -1.15 -0.07 0.00 -0.71 0.00 0.00 52.86 50.93 1ml3 s ASN 220 Cb 0.00 -0.13 0.00 0.00 0.41 0.00 0.00 41.25 41.53 1ml3 s ASN 220 CO 0.00 -0.33 0.08 -0.63 -1.51 0.00 0.00 177.10 174.71 1ml3 s ILE 221 N -3.07 4.02 -0.20 0.60 1.01 -1.26 -4.00 121.20 118.30 1ml3 s ILE 221 Ca 0.27 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.28 1ml3 s ILE 221 Cb 0.03 -3.06 0.01 0.00 0.01 0.00 0.00 42.46 39.45 1ml3 s ILE 221 CO 0.10 0.10 -0.13 -0.63 0.00 0.00 0.00 174.94 174.38 1ml3 s ILE 222 N 1.52 2.62 0.51 2.92 1.01 0.07 -4.93 121.20 124.91 1ml3 s ILE 222 Ca 0.03 -0.78 -0.20 0.00 0.00 0.00 0.00 60.65 59.69 1ml3 s ILE 222 Cb -0.17 -2.17 -0.07 0.00 0.01 0.00 0.00 42.46 40.07 1ml3 s ILE 222 CO 0.03 0.46 1.12 -2.84 0.00 0.00 0.00 174.94 173.71 1ml3 s PRO 223 N 1.36 3.56 0.07 2.79 0.02 -1.26 0.21 135.00 141.75 1ml3 s PRO 223 Ca 0.05 1.59 -0.25 0.00 0.02 0.00 0.00 61.00 62.41 1ml3 s PRO 223 Cb -0.14 -2.13 0.07 0.00 0.02 0.00 0.00 34.50 32.32 1ml3 s PRO 223 CO -0.09 -0.68 0.61 0.45 -0.33 0.00 0.00 177.00 176.96 1ml3 s SER 224 N -1.72 -0.57 0.35 2.53 0.15 -0.63 -4.71 113.70 109.10 1ml3 s SER 224 Ca 0.69 0.27 -0.07 0.00 0.70 0.00 0.00 55.95 57.54 1ml3 s SER 224 Cb -0.23 0.56 -0.06 0.00 -1.71 0.00 0.00 66.02 64.58 1ml3 s SER 224 CO 0.27 -0.80 0.66 0.42 1.20 0.00 0.00 173.24 174.99 1ml3 s THR 225 N -2.64 4.92 -0.00 6.45 -4.23 -1.26 -0.67 115.64 118.20 1ml3 s THR 225 Ca -0.04 0.29 -0.12 0.00 -1.18 0.00 0.00 61.69 60.64 1ml3 s THR 225 Cb -0.01 -3.75 0.01 0.00 1.34 0.00 0.00 72.50 70.10 1ml3 s THR 225 CO -0.03 -0.45 0.24 0.28 -0.54 0.00 0.00 174.62 174.12 1ml3 s THR 226 N -2.26 0.07 -0.30 3.99 -1.32 -1.25 -4.77 115.64 109.80 1ml3 s THR 226 Ca 0.47 -0.58 0.22 0.00 -1.21 0.00 0.00 61.69 60.60 1ml3 s THR 226 Cb -0.10 -0.56 -0.14 0.00 -1.51 0.00 0.00 72.50 70.19 1ml3 s THR 226 CO 0.32 -0.32 0.87 0.61 -2.21 0.00 0.00 174.62 173.89 1ml3 n GLY 227 N 1.30 -1.24 0.21 6.08 0.00 -1.26 -4.57 105.19 105.71 1ml3 n GLY 227 Ca -0.22 -0.38 -0.02 0.00 0.00 0.00 0.00 46.02 45.41 1ml3 n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ml3 n ALA 228 N -2.08 -0.13 0.00 4.61 0.00 -1.26 -0.21 120.51 121.44 1ml3 n ALA 228 Ca -0.01 0.50 -0.11 0.00 0.00 0.00 0.00 53.44 53.83 1ml3 n ALA 228 Cb 0.52 -0.19 -0.06 0.00 0.00 0.00 0.00 19.45 19.72 1ml3 n ALA 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ml3 h ALA 229 N 0.61 0.11 -0.62 0.00 0.00 -1.89 -2.22 119.26 115.24 1ml3 h ALA 229 Ca 0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1ml3 h ALA 229 Cb 0.29 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1ml3 h ALA 229 CO -0.51 -0.39 0.19 0.87 0.00 0.00 0.00 179.25 179.40 1ml3 h LYS 230 N 0.10 0.94 -0.74 0.00 1.57 -0.66 -2.23 116.57 115.55 1ml3 h LYS 230 Ca 0.03 -0.19 0.12 0.00 -1.87 0.00 0.00 60.65 58.74 1ml3 h LYS 230 Cb 0.01 -0.15 -0.05 0.00 0.08 0.00 0.00 32.23 32.12 1ml3 h LYS 230 CO -0.01 0.82 0.49 0.00 -0.57 0.00 0.00 179.45 180.18 1ml3 h ALA 231 N 1.29 1.95 -0.83 3.86 0.00 -0.39 0.16 119.26 125.29 1ml3 h ALA 231 Ca 0.20 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.16 1ml3 h ALA 231 Cb 0.27 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1ml3 h ALA 231 CO -0.01 -0.12 0.52 0.28 0.00 0.00 0.00 179.25 179.92 1ml3 h VAL 232 N 0.54 1.06 -0.29 0.00 2.07 -0.80 -0.27 116.25 118.57 1ml3 h VAL 232 Ca 0.35 -0.33 0.08 0.00 0.82 0.00 0.00 66.70 67.63 1ml3 h VAL 232 Cb 0.63 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1ml3 h VAL 232 CO -0.12 0.18 0.34 1.23 0.02 0.00 0.00 177.57 179.21 1ml3 h GLY 233 N 0.96 0.00 1.74 2.17 0.00 -0.71 0.63 103.07 107.87 1ml3 h GLY 233 Ca 0.35 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.43 1ml3 h GLY 233 CO -0.16 0.00 -1.15 -0.33 0.00 0.00 0.00 176.54 174.91 1ml3 h MET 234 N 0.00 0.20 0.00 4.80 2.86 -1.04 -2.60 114.93 119.14 1ml3 h MET 234 Ca 0.14 -0.32 -0.20 0.00 -2.06 0.00 0.00 59.70 57.26 1ml3 h MET 234 Cb 0.81 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.55 1ml3 h MET 234 CO -0.00 1.14 -1.23 0.28 1.06 0.00 0.00 176.91 178.15 1ml3 h VAL 235 N 0.06 0.90 -2.26 -2.22 2.07 -0.36 -3.39 116.25 111.05 1ml3 h VAL 235 Ca -0.09 -2.50 -0.58 0.00 0.82 0.00 0.00 66.70 64.34 1ml3 h VAL 235 Cb 1.88 2.37 -0.40 0.00 -1.52 0.00 0.00 31.29 33.62 1ml3 h VAL 235 CO 0.18 0.51 -0.90 -0.38 0.02 0.00 0.00 177.57 177.00 1ml3 n ILE 236 N -3.08 0.17 -0.09 4.57 5.41 0.19 -4.79 119.36 121.73 1ml3 n ILE 236 Ca -0.07 -4.26 0.22 0.00 1.00 0.00 0.00 62.75 59.63 1ml3 n ILE 236 Cb 0.89 -1.95 0.33 0.00 -0.71 0.00 0.00 39.64 38.21 1ml3 n ILE 236 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1ml3 h PRO 237 N 4.58 0.00 -0.00 0.38 0.11 -1.66 0.49 132.00 135.89 1ml3 h PRO 237 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1ml3 h PRO 237 Cb 0.82 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.93 1ml3 h PRO 237 CO 0.56 0.00 0.02 0.77 -0.21 0.00 0.00 178.00 179.13 1ml3 h SER 238 N 0.00 0.00 -0.24 -2.05 0.02 -1.94 -2.36 113.55 106.99 1ml3 h SER 238 Ca 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 1ml3 h SER 238 Cb 2.72 0.00 0.00 0.00 0.14 0.00 0.00 62.40 65.26 1ml3 h SER 238 CO -0.00 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.04 1ml3 n THR 239 N -3.31 0.54 -1.65 -2.27 -2.24 0.17 -4.97 114.28 100.55 1ml3 n THR 239 Ca -0.03 -0.77 -0.51 0.00 -2.27 0.00 0.00 64.05 60.47 1ml3 n THR 239 Cb 0.09 0.86 -0.06 0.00 -2.10 0.00 0.00 70.33 69.12 1ml3 n THR 239 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1ml3 n GLN 240 N 0.75 1.56 -1.01 -0.78 -0.06 -0.89 -0.27 117.38 116.67 1ml3 n GLN 240 Ca 0.11 0.56 -0.00 0.00 -2.00 0.00 0.00 57.00 55.67 1ml3 n GLN 240 Cb 0.41 -2.28 -0.00 0.00 -4.06 0.00 0.00 30.24 24.31 1ml3 n GLN 240 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1ml3 n GLY 241 N 3.33 0.31 0.14 1.69 0.00 -1.26 -4.83 105.19 104.56 1ml3 n GLY 241 Ca 0.20 -0.03 0.05 0.00 0.00 0.00 0.00 46.02 46.24 1ml3 n GLY 241 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ml3 n LYS 242 N -1.26 2.74 -3.86 1.61 5.02 0.62 -5.00 118.16 118.03 1ml3 n LYS 242 Ca -0.00 -0.35 -0.12 0.00 -2.02 0.00 0.00 58.31 55.81 1ml3 n LYS 242 Cb 0.23 -1.05 -0.14 0.00 -0.02 0.00 0.00 35.03 34.05 1ml3 n LYS 242 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ml3 s LEU 243 N -2.04 1.85 0.29 -0.35 1.43 -1.24 -1.24 118.68 117.39 1ml3 s LEU 243 Ca 0.07 0.04 -0.11 0.00 -1.03 0.00 0.00 54.13 53.10 1ml3 s LEU 243 Cb 0.08 0.05 0.00 0.00 0.03 0.00 0.00 46.19 46.36 1ml3 s LEU 243 CO 0.34 -0.02 0.52 0.28 0.23 0.00 0.00 176.35 177.70 1ml3 s THR 244 N 0.11 0.00 -0.07 5.49 -1.32 -1.11 -3.69 115.64 115.05 1ml3 s THR 244 Ca -0.01 -1.39 -0.29 0.00 -1.21 0.00 0.00 61.69 58.79 1ml3 s THR 244 Cb -0.01 -2.37 0.09 0.00 -1.51 0.00 0.00 72.50 68.70 1ml3 s THR 244 CO -0.00 0.00 1.30 0.61 -2.21 0.00 0.00 174.62 174.32 1ml3 n GLY 245 N -0.44 0.14 3.31 6.08 0.00 -1.26 -1.65 105.19 111.36 1ml3 n GLY 245 Ca -0.02 -1.02 -0.19 0.00 0.00 0.00 0.00 46.02 44.79 1ml3 n GLY 245 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1ml3 s MET 246 N -2.01 1.71 0.23 1.61 0.23 0.08 -3.96 119.30 117.20 1ml3 s MET 246 Ca 0.31 -2.00 0.06 0.00 -1.03 0.00 0.00 55.69 53.03 1ml3 s MET 246 Cb -0.00 0.19 -0.05 0.00 -1.53 0.00 0.00 34.83 33.44 1ml3 s MET 246 CO -0.02 -0.60 -0.08 0.45 -2.03 0.00 0.00 175.02 172.75 1ml3 s SER 247 N -3.38 2.38 -0.28 -1.18 0.15 0.15 -1.66 113.70 109.88 1ml3 s SER 247 Ca 0.38 -1.12 -0.03 0.00 0.70 0.00 0.00 55.95 55.88 1ml3 s SER 247 Cb 0.03 -0.10 0.11 0.00 -1.71 0.00 0.00 66.02 64.34 1ml3 s SER 247 CO 0.24 -0.32 0.17 -0.36 1.20 0.00 0.00 173.24 174.17 1ml3 s PHE 248 N -3.13 0.10 -0.06 3.44 0.08 -0.22 -1.61 117.98 116.58 1ml3 s PHE 248 Ca 0.25 -0.62 -0.30 0.00 0.12 0.00 0.00 56.93 56.38 1ml3 s PHE 248 Cb 0.03 -0.76 -0.03 0.00 -0.57 0.00 0.00 43.02 41.68 1ml3 s PHE 248 CO 0.08 -0.82 1.26 1.03 -0.10 0.00 0.00 175.22 176.67 1ml3 s ARG 249 N 2.17 4.32 0.36 0.44 1.81 0.13 -0.66 118.95 127.52 1ml3 s ARG 249 Ca 0.08 1.74 0.09 0.00 -1.72 0.00 0.00 55.73 55.92 1ml3 s ARG 249 Cb -0.15 -3.59 -0.07 0.00 -0.45 0.00 0.00 34.95 30.68 1ml3 s ARG 249 CO -0.33 -0.51 -0.04 0.14 -0.68 0.00 0.00 175.30 173.88 1ml3 s VAL 250 N 2.45 2.26 -0.56 3.52 -7.23 0.41 -0.75 120.40 120.50 1ml3 s VAL 250 Ca 0.58 -2.10 -0.07 0.00 -1.81 0.00 0.00 61.98 58.58 1ml3 s VAL 250 Cb -0.26 -2.77 -0.06 0.00 0.56 0.00 0.00 36.38 33.85 1ml3 s VAL 250 CO 0.22 -0.15 1.70 -2.65 -0.31 0.00 0.00 175.10 173.92 1ml3 n PRO 251 N -0.88 1.25 -4.05 4.82 -0.02 -1.26 -2.88 135.00 131.98 1ml3 n PRO 251 Ca -0.05 -1.16 -0.13 0.00 -2.02 0.00 0.00 63.50 60.14 1ml3 n PRO 251 Cb 0.64 -2.35 -0.13 0.00 -0.02 0.00 0.00 33.50 31.64 1ml3 n PRO 251 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ml3 s THR 252 N 4.25 0.31 0.21 3.45 -4.23 -1.26 -5.01 115.64 113.36 1ml3 s THR 252 Ca 0.30 -0.45 0.15 0.00 -1.18 0.00 0.00 61.69 60.51 1ml3 s THR 252 Cb 0.07 -0.32 0.07 0.00 1.34 0.00 0.00 72.50 73.67 1ml3 s THR 252 CO 0.01 -0.10 1.69 1.55 -0.54 0.00 0.00 174.62 177.23 1ml3 h PRO 253 N 5.53 0.00 -2.84 3.99 0.13 -1.87 -2.39 132.00 134.55 1ml3 h PRO 253 Ca -0.29 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.91 1ml3 h PRO 253 Cb 1.20 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.26 1ml3 h PRO 253 CO 0.47 0.47 0.29 0.34 -0.23 0.00 0.00 178.00 179.34 1ml3 s ASP 254 N -6.61 -0.31 0.00 1.44 2.15 -1.26 -4.71 116.67 107.37 1ml3 s ASP 254 Ca -0.01 -0.43 0.00 0.00 0.43 0.00 0.00 52.55 52.55 1ml3 s ASP 254 Cb 0.12 0.64 0.00 0.00 -0.30 0.00 0.00 42.92 43.38 1ml3 s ASP 254 CO 0.72 -1.16 0.00 0.52 -0.17 0.00 0.00 175.17 175.08 1ml3 n VAL 255 N -0.44 -1.43 -4.49 1.11 0.31 -1.26 -4.86 118.33 107.28 1ml3 n VAL 255 Ca -0.07 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 64.02 1ml3 n VAL 255 Cb 0.61 -1.43 -0.09 0.00 -0.91 0.00 0.00 33.84 32.02 1ml3 n VAL 255 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1ml3 s SER 256 N -0.45 2.62 -0.10 4.52 0.01 0.31 -4.11 113.70 116.50 1ml3 s SER 256 Ca 0.00 -1.62 -0.08 0.00 1.31 0.00 0.00 55.95 55.56 1ml3 s SER 256 Cb 0.00 0.40 0.03 0.00 0.21 0.00 0.00 66.02 66.66 1ml3 s SER 256 CO 0.00 -0.88 0.25 0.54 0.41 0.00 0.00 173.24 173.57 1ml3 s VAL 257 N -3.26 -0.00 -0.15 3.43 0.11 -0.79 -1.60 120.40 118.13 1ml3 s VAL 257 Ca 0.27 0.01 -0.08 0.00 -2.93 0.00 0.00 61.98 59.25 1ml3 s VAL 257 Cb 0.04 -0.36 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 1ml3 s VAL 257 CO 0.15 0.01 0.13 -0.69 -3.33 0.00 0.00 175.10 171.36 1ml3 s VAL 258 N 0.25 5.41 -0.42 2.04 1.01 0.16 -1.55 120.40 127.29 1ml3 s VAL 258 Ca -0.01 0.18 0.03 0.00 0.00 0.00 0.00 61.98 62.18 1ml3 s VAL 258 Cb -0.03 -3.40 0.12 0.00 0.00 0.00 0.00 36.38 33.07 1ml3 s VAL 258 CO -0.01 0.54 0.17 -0.62 0.00 0.00 0.00 175.10 175.18 1ml3 s ASP 259 N -0.41 4.27 -0.21 3.32 2.15 0.93 -1.75 116.67 124.98 1ml3 s ASP 259 Ca 0.12 -2.49 -0.12 0.00 0.43 0.00 0.00 52.55 50.49 1ml3 s ASP 259 Cb -0.12 -1.40 -0.05 0.00 -0.30 0.00 0.00 42.92 41.06 1ml3 s ASP 259 CO 0.01 -0.31 0.24 -0.22 -0.17 0.00 0.00 175.17 174.72 1ml3 s LEU 260 N 0.47 4.15 -0.15 -1.34 2.96 -0.50 -1.32 118.68 122.96 1ml3 s LEU 260 Ca 0.14 0.29 -0.00 0.00 -0.22 0.00 0.00 54.13 54.34 1ml3 s LEU 260 Cb -0.22 -2.25 -0.01 0.00 0.50 0.00 0.00 46.19 44.21 1ml3 s LEU 260 CO -0.06 0.05 -0.14 -0.89 -1.32 0.00 0.00 176.35 173.99 1ml3 s THR 261 N 0.96 2.79 0.20 3.68 2.01 -0.14 -0.31 115.64 124.83 1ml3 s THR 261 Ca 0.12 -0.73 -0.11 0.00 0.31 0.00 0.00 61.69 61.28 1ml3 s THR 261 Cb -0.13 -2.18 -0.01 0.00 0.01 0.00 0.00 72.50 70.19 1ml3 s THR 261 CO 0.04 0.51 0.37 0.72 -0.69 0.00 0.00 174.62 175.57 1ml3 s PHE 262 N 0.74 0.39 -0.16 4.92 -0.71 -0.04 -0.37 117.98 122.75 1ml3 s PHE 262 Ca -0.06 -0.74 -0.01 0.00 -1.04 0.00 0.00 56.93 55.08 1ml3 s PHE 262 Cb -0.15 0.04 -0.01 0.00 -1.21 0.00 0.00 43.02 41.69 1ml3 s PHE 262 CO 0.01 -0.83 -0.12 0.95 -1.34 0.00 0.00 175.22 173.89 1ml3 s THR 263 N -3.99 2.94 0.73 -4.49 -4.23 -0.62 0.22 115.64 106.20 1ml3 s THR 263 Ca 0.20 -0.67 -0.12 0.00 -1.18 0.00 0.00 61.69 59.91 1ml3 s THR 263 Cb 0.02 -2.27 0.04 0.00 1.34 0.00 0.00 72.50 71.63 1ml3 s THR 263 CO 0.04 0.50 1.11 0.00 -0.54 0.00 0.00 174.62 175.72 1ml3 s ALA 264 N 0.84 2.29 -1.95 3.99 0.00 0.42 -1.25 121.76 126.10 1ml3 s ALA 264 Ca -0.04 0.43 0.31 0.00 0.00 0.00 0.00 51.96 52.66 1ml3 s ALA 264 Cb -0.15 -3.31 1.81 0.00 0.00 0.00 0.00 23.12 21.47 1ml3 s ALA 264 CO 0.00 -1.63 2.15 0.00 0.00 0.00 0.00 175.76 176.28 1ml3 n ALA 265 N -3.08 2.63 -3.33 0.00 0.00 -0.00 -4.50 120.51 112.22 1ml3 n ALA 265 Ca 0.10 -0.19 -0.12 0.00 0.00 0.00 0.00 53.44 53.23 1ml3 n ALA 265 Cb 0.52 -1.50 -0.01 0.00 0.00 0.00 0.00 19.45 18.47 1ml3 n ALA 265 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1ml3 s ARG 266 N -2.05 2.10 -0.07 0.00 1.70 -1.23 -5.01 118.95 114.39 1ml3 s ARG 266 Ca 0.45 -1.63 -0.28 0.00 -0.47 0.00 0.00 55.73 53.80 1ml3 s ARG 266 Cb 0.21 0.53 -0.02 0.00 -0.57 0.00 0.00 34.95 35.10 1ml3 s ARG 266 CO 0.36 -0.93 0.92 -0.51 -1.08 0.00 0.00 175.30 174.06 1ml3 s ASP 267 N -3.17 7.20 0.00 -2.89 1.11 -1.26 -4.64 116.67 113.03 1ml3 s ASP 267 Ca 0.23 1.46 0.00 0.00 0.18 0.00 0.00 52.55 54.43 1ml3 s ASP 267 Cb -0.03 -2.52 0.00 0.00 1.07 0.00 0.00 42.92 41.44 1ml3 s ASP 267 CO 0.17 -0.31 0.00 0.35 1.18 0.00 0.00 175.17 176.55 1ml3 n THR 268 N 4.20 0.00 -3.51 -1.27 -2.24 -0.89 -5.06 114.28 105.52 1ml3 n THR 268 Ca 0.05 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.68 1ml3 n THR 268 Cb 0.50 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.68 1ml3 n THR 268 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ml3 s SER 269 N 1.36 -0.58 0.54 3.42 1.04 -1.26 -4.22 113.70 114.01 1ml3 s SER 269 Ca 0.00 0.39 0.26 0.00 0.48 0.00 0.00 55.95 57.08 1ml3 s SER 269 Cb 0.00 0.54 1.53 0.00 0.10 0.00 0.00 66.02 68.19 1ml3 s SER 269 CO 0.00 -0.73 2.14 -0.29 0.98 0.00 0.00 173.24 175.35 1ml3 h ILE 270 N 2.70 0.66 -0.19 -1.02 6.09 -1.93 -1.59 117.51 122.23 1ml3 h ILE 270 Ca -0.30 -0.29 -0.20 0.00 -1.37 0.00 0.00 64.86 62.70 1ml3 h ILE 270 Cb 1.20 1.18 0.01 0.00 0.47 0.00 0.00 36.82 39.67 1ml3 h ILE 270 CO 0.39 0.07 -0.67 1.56 -3.07 0.00 0.00 178.15 176.43 1ml3 h GLN 271 N 0.00 0.79 0.00 2.19 7.50 -1.96 0.60 115.11 124.23 1ml3 h GLN 271 Ca -0.00 -0.60 -0.07 0.00 0.50 0.00 0.00 58.65 58.48 1ml3 h GLN 271 Cb 0.17 0.11 -0.01 0.00 0.05 0.00 0.00 27.48 27.80 1ml3 h GLN 271 CO 0.01 1.21 -0.34 1.49 -1.50 0.00 0.00 178.83 179.70 1ml3 h GLU 272 N 0.53 0.00 0.17 1.46 4.81 -1.71 -0.98 114.58 118.87 1ml3 h GLU 272 Ca -0.03 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.92 1ml3 h GLU 272 Cb 1.30 0.00 0.03 0.00 0.63 0.00 0.00 28.75 30.71 1ml3 h GLU 272 CO 0.14 0.34 -1.18 0.82 -0.73 0.00 0.00 179.01 178.40 1ml3 h ILE 273 N 0.00 1.35 -0.63 2.32 2.04 -1.30 -2.94 117.51 118.35 1ml3 h ILE 273 Ca -0.00 -2.55 0.05 0.00 1.00 0.00 0.00 64.86 63.36 1ml3 h ILE 273 Cb 0.62 2.97 -0.05 0.00 -0.74 0.00 0.00 36.82 39.62 1ml3 h ILE 273 CO 0.04 0.76 0.35 -0.78 0.00 0.00 0.00 178.15 178.52 1ml3 h ASP 274 N 0.03 0.53 -0.63 1.72 3.58 -0.51 -1.54 116.42 119.59 1ml3 h ASP 274 Ca -0.20 0.03 -0.05 0.00 0.42 0.00 0.00 57.03 57.22 1ml3 h ASP 274 Cb 1.91 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 42.85 1ml3 h ASP 274 CO 0.22 0.35 0.20 0.00 -2.88 0.00 0.00 179.24 177.13 1ml3 h ALA 275 N 1.32 1.10 -0.36 -0.78 0.00 -1.24 -2.59 119.26 116.72 1ml3 h ALA 275 Ca 0.28 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1ml3 h ALA 275 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1ml3 h ALA 275 CO -0.17 0.61 -0.34 0.00 0.00 0.00 0.00 179.25 179.35 1ml3 h ALA 276 N 1.24 0.53 -0.80 0.00 0.00 -1.23 -1.11 119.26 117.87 1ml3 h ALA 276 Ca 0.21 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1ml3 h ALA 276 Cb 0.29 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1ml3 h ALA 276 CO -0.01 0.60 0.37 -0.07 0.00 0.00 0.00 179.25 180.14 1ml3 h LEU 277 N 0.67 1.07 -0.24 0.00 3.38 -1.21 0.29 115.31 119.27 1ml3 h LEU 277 Ca 0.06 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1ml3 h LEU 277 Cb 0.93 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1ml3 h LEU 277 CO 0.09 0.91 0.02 0.11 0.09 0.00 0.00 178.44 179.66 1ml3 h LYS 278 N 1.15 0.40 -0.15 1.13 1.57 -1.36 -1.41 116.57 117.92 1ml3 h LYS 278 Ca 0.27 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1ml3 h LYS 278 Cb 0.15 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1ml3 h LYS 278 CO -0.03 0.55 0.09 -0.09 -0.57 0.00 0.00 179.45 179.40 1ml3 h ARG 279 N 0.19 0.20 -0.23 3.15 2.43 -0.79 -2.16 114.38 117.17 1ml3 h ARG 279 Ca 0.07 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1ml3 h ARG 279 Cb 0.36 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1ml3 h ARG 279 CO 0.01 0.16 0.11 0.00 -1.51 0.00 0.00 179.97 178.74 1ml3 h ALA 280 N 1.02 1.76 -0.20 2.80 0.00 -0.38 -1.90 119.26 122.36 1ml3 h ALA 280 Ca 0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ml3 h ALA 280 Cb 0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ml3 h ALA 280 CO -0.01 0.20 0.02 0.66 0.00 0.00 0.00 179.25 180.13 1ml3 h SER 281 N 0.32 0.33 1.01 0.00 4.64 -0.64 0.44 113.55 119.65 1ml3 h SER 281 Ca 0.08 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 1ml3 h SER 281 Cb 0.04 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1ml3 h SER 281 CO -0.01 0.52 0.00 0.11 -0.87 0.00 0.00 176.83 176.58 1ml3 h LYS 282 N 0.13 0.00 0.00 4.77 1.57 -1.05 -2.66 116.57 119.33 1ml3 h LYS 282 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1ml3 h LYS 282 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1ml3 h LYS 282 CO 0.01 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.14 1ml3 n THR 283 N -2.76 0.00 0.48 -0.16 -2.24 -0.75 -4.80 114.28 104.05 1ml3 n THR 283 Ca 0.02 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.85 1ml3 n THR 283 Cb 0.30 0.00 0.26 0.00 -2.10 0.00 0.00 70.33 68.79 1ml3 n THR 283 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ml3 n TYR 284 N 0.00 0.00 -0.01 4.78 4.11 -1.22 -2.49 117.16 122.34 1ml3 n TYR 284 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1ml3 n TYR 284 Cb 0.00 -0.34 0.01 0.00 -0.00 0.00 0.00 39.34 39.01 1ml3 n TYR 284 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.86 175.53 1ml3 n MET 285 N -1.34 2.84 -1.70 -3.48 2.81 0.13 -4.98 117.12 111.40 1ml3 n MET 285 Ca 0.05 -1.49 -0.43 0.00 -1.81 0.00 0.00 57.70 54.02 1ml3 n MET 285 Cb 0.10 -1.01 -0.03 0.00 -0.71 0.00 0.00 33.22 31.56 1ml3 n MET 285 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1ml3 n LYS 286 N -0.44 2.56 0.00 0.03 4.81 -1.00 0.25 118.16 124.37 1ml3 n LYS 286 Ca 0.01 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 1ml3 n LYS 286 Cb 0.25 -2.74 0.00 0.00 0.02 0.00 0.00 35.03 32.55 1ml3 n LYS 286 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ml3 n GLY 287 N 3.78 3.27 0.29 3.14 0.00 -1.26 -4.75 105.19 109.67 1ml3 n GLY 287 Ca 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 1ml3 n GLY 287 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ml3 n ILE 288 N -2.00 0.70 -4.21 -0.61 2.08 -0.42 -4.37 119.36 110.53 1ml3 n ILE 288 Ca 0.00 -0.23 -0.33 0.00 0.56 0.00 0.00 62.75 62.75 1ml3 n ILE 288 Cb 0.00 -1.25 -0.16 0.00 -0.75 0.00 0.00 39.64 37.48 1ml3 n ILE 288 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1ml3 s LEU 289 N -6.13 2.16 0.00 1.39 2.96 0.14 -0.55 118.68 118.64 1ml3 s LEU 289 Ca -0.17 -0.63 0.00 0.00 -0.22 0.00 0.00 54.13 53.11 1ml3 s LEU 289 Cb 0.05 -1.48 0.00 0.00 0.50 0.00 0.00 46.19 45.26 1ml3 s LEU 289 CO 0.26 0.01 0.00 0.61 -1.32 0.00 0.00 176.35 175.91 1ml3 n GLY 290 N 4.52 4.06 3.49 7.98 0.00 -0.29 -4.39 105.19 120.57 1ml3 n GLY 290 Ca -0.21 -2.24 -0.10 0.00 0.00 0.00 0.00 46.02 43.47 1ml3 n GLY 290 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ml3 s TYR 291 N -1.29 -0.42 0.24 1.61 1.13 -1.26 -1.23 117.35 116.13 1ml3 s TYR 291 Ca 0.00 0.36 0.03 0.00 -1.41 0.00 0.00 57.07 56.05 1ml3 s TYR 291 Cb -0.00 0.52 -0.05 0.00 -1.10 0.00 0.00 41.96 41.33 1ml3 s TYR 291 CO 0.00 -0.59 0.01 -0.08 -2.51 0.00 0.00 175.55 172.38 1ml3 s THR 292 N -2.87 1.00 0.00 -3.49 -1.32 -0.20 -4.88 115.64 103.89 1ml3 s THR 292 Ca 0.02 -2.03 0.09 0.00 -1.21 0.00 0.00 61.69 58.56 1ml3 s THR 292 Cb -0.01 -2.41 0.15 0.00 -1.51 0.00 0.00 72.50 68.72 1ml3 s THR 292 CO -0.07 -0.27 0.99 -0.90 -2.21 0.00 0.00 174.62 172.16 1ml3 n ASP 293 N -0.45 0.21 -4.76 8.08 3.85 -1.26 -1.89 116.55 120.33 1ml3 n ASP 293 Ca -0.04 -1.85 -0.23 0.00 -0.71 0.00 0.00 54.79 51.95 1ml3 n ASP 293 Cb 0.64 -0.14 -0.06 0.00 -1.35 0.00 0.00 41.12 40.21 1ml3 n ASP 293 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1ml3 s GLU 294 N 0.00 2.42 -1.25 0.11 2.02 -1.26 -4.82 118.70 115.91 1ml3 s GLU 294 Ca 0.12 -1.54 -0.16 0.00 0.02 0.00 0.00 54.97 53.40 1ml3 s GLU 294 Cb 0.13 -2.21 -0.02 0.00 0.10 0.00 0.00 34.13 32.13 1ml3 s GLU 294 CO -0.06 0.07 2.13 0.39 0.02 0.00 0.00 175.26 177.82 1ml3 n GLU 295 N -1.21 2.45 -3.24 1.61 -0.58 -1.26 -4.89 120.64 113.52 1ml3 n GLU 295 Ca -0.02 -2.38 -0.27 0.00 -0.42 0.00 0.00 57.16 54.07 1ml3 n GLU 295 Cb 0.61 -3.18 -0.02 0.00 -0.57 0.00 0.00 31.44 28.28 1ml3 n GLU 295 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1ml3 s LEU 296 N 1.95 3.97 0.16 -4.62 1.43 -1.26 -5.11 118.68 115.20 1ml3 s LEU 296 Ca 0.50 0.65 0.03 0.00 -1.03 0.00 0.00 54.13 54.29 1ml3 s LEU 296 Cb 0.14 -3.51 -0.05 0.00 0.03 0.00 0.00 46.19 42.81 1ml3 s LEU 296 CO -0.03 -0.30 -0.06 0.68 0.23 0.00 0.00 176.35 176.88 1ml3 s VAL 297 N -2.28 0.96 0.13 -1.59 -7.23 -1.26 -5.03 120.40 104.10 1ml3 s VAL 297 Ca 0.43 -2.02 -0.07 0.00 -1.81 0.00 0.00 61.98 58.51 1ml3 s VAL 297 Cb -0.10 -1.97 0.18 0.00 0.56 0.00 0.00 36.38 35.05 1ml3 s VAL 297 CO 0.35 -0.63 0.82 -1.54 -0.31 0.00 0.00 175.10 173.79 1ml3 n SER 298 N -0.22 -0.27 0.09 4.85 3.41 -1.26 0.19 113.62 120.41 1ml3 n SER 298 Ca -0.09 0.92 0.18 0.00 -0.26 0.00 0.00 58.87 59.63 1ml3 n SER 298 Cb 0.62 -0.24 0.73 0.00 -0.26 0.00 0.00 64.21 65.06 1ml3 n SER 298 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ml3 h ALA 299 N 0.89 2.22 0.00 7.33 0.00 -1.97 -1.51 119.26 126.23 1ml3 h ALA 299 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ml3 h ALA 299 Cb 0.35 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ml3 h ALA 299 CO -0.54 -0.51 0.00 -0.25 0.00 0.00 0.00 179.25 177.95 1ml3 n ASP 300 N -4.14 0.36 -0.96 0.00 8.00 0.13 -2.58 116.55 117.36 1ml3 n ASP 300 Ca 0.06 0.58 0.11 0.00 0.71 0.00 0.00 54.79 56.25 1ml3 n ASP 300 Cb 0.50 -0.66 0.14 0.00 -0.02 0.00 0.00 41.12 41.07 1ml3 n ASP 300 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1ml3 n PHE 301 N -1.89 0.19 -1.87 1.24 3.01 -0.57 -4.91 117.46 112.67 1ml3 n PHE 301 Ca 0.03 -0.10 -0.42 0.00 1.01 0.00 0.00 57.45 57.96 1ml3 n PHE 301 Cb 0.22 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.66 1ml3 n PHE 301 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1ml3 s ILE 302 N -1.66 3.35 0.00 4.37 1.01 -1.07 -1.78 121.20 125.42 1ml3 s ILE 302 Ca 0.30 0.41 0.00 0.00 0.00 0.00 0.00 60.65 61.35 1ml3 s ILE 302 Cb 0.19 -3.32 0.00 0.00 0.01 0.00 0.00 42.46 39.35 1ml3 s ILE 302 CO 0.28 -0.10 0.00 0.59 0.00 0.00 0.00 174.94 175.72 1ml3 n ASN 303 N 8.32 -1.74 -4.64 3.58 3.02 -1.26 -5.05 115.26 117.49 1ml3 n ASN 303 Ca 0.20 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.36 1ml3 n ASN 303 Cb 0.43 -0.34 -0.07 0.00 -0.61 0.00 0.00 39.78 39.20 1ml3 n ASN 303 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ml3 s ASP 304 N -2.67 6.51 -0.05 6.41 -1.08 -0.74 -4.95 116.67 120.11 1ml3 s ASP 304 Ca 0.00 0.62 0.09 0.00 -0.52 0.00 0.00 52.55 52.74 1ml3 s ASP 304 Cb 0.00 -2.29 0.35 0.00 -1.46 0.00 0.00 42.92 39.52 1ml3 s ASP 304 CO 0.00 -0.24 1.21 -0.46 0.52 0.00 0.00 175.17 176.19 1ml3 n ASN 305 N 5.19 2.47 -4.85 -0.34 2.04 -1.26 -3.93 115.26 114.58 1ml3 n ASN 305 Ca -0.04 -2.18 -0.32 0.00 -0.44 0.00 0.00 54.58 51.60 1ml3 n ASN 305 Cb 0.50 -0.38 -0.02 0.00 -2.53 0.00 0.00 39.78 37.35 1ml3 n ASN 305 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1ml3 s ARG 306 N -1.65 3.79 0.38 -3.83 3.00 -1.26 -4.71 118.95 114.66 1ml3 s ARG 306 Ca 0.25 0.92 0.20 0.00 0.00 0.00 0.00 55.73 57.10 1ml3 s ARG 306 Cb 0.16 -2.11 0.23 0.00 0.00 0.00 0.00 34.95 33.23 1ml3 s ARG 306 CO 0.13 -0.41 1.54 0.77 0.00 0.00 0.00 175.30 177.33 1ml3 h SER 307 N 0.52 0.00 -2.25 0.23 0.02 -1.03 -3.41 113.55 107.63 1ml3 h SER 307 Ca -0.46 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 60.56 1ml3 h SER 307 Cb 1.19 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.52 1ml3 h SER 307 CO 0.61 0.18 -0.06 -0.55 -1.14 0.00 0.00 176.83 175.87 1ml3 s SER 308 N -6.28 -1.05 -0.36 3.07 0.15 -0.92 -3.56 113.70 104.75 1ml3 s SER 308 Ca 0.06 1.51 -0.04 0.00 0.70 0.00 0.00 55.95 58.17 1ml3 s SER 308 Cb 0.06 1.99 0.07 0.00 -1.71 0.00 0.00 66.02 66.43 1ml3 s SER 308 CO 0.70 -0.22 0.13 -0.63 1.20 0.00 0.00 173.24 174.42 1ml3 s ILE 309 N 2.48 3.42 0.13 6.45 1.09 0.00 -1.14 121.20 133.63 1ml3 s ILE 309 Ca -0.07 -1.58 -0.31 0.00 -1.10 0.00 0.00 60.65 57.59 1ml3 s ILE 309 Cb -0.10 -3.11 -0.10 0.00 -1.06 0.00 0.00 42.46 38.09 1ml3 s ILE 309 CO -0.19 -0.39 1.64 -0.47 -0.10 0.00 0.00 174.94 175.43 1ml3 s TYR 310 N 1.27 2.72 -0.78 3.97 5.04 -0.36 0.09 117.35 129.30 1ml3 s TYR 310 Ca 0.01 0.43 -0.17 0.00 -2.44 0.00 0.00 57.07 54.90 1ml3 s TYR 310 Cb -0.21 -3.98 0.16 0.00 0.35 0.00 0.00 41.96 38.27 1ml3 s TYR 310 CO -0.01 -3.79 0.84 0.34 -1.34 0.00 0.00 175.55 171.59 1ml3 s ASP 311 N 1.77 6.53 0.18 4.32 -1.08 0.42 -1.03 116.67 127.78 1ml3 s ASP 311 Ca 0.73 -2.09 -0.13 0.00 -0.52 0.00 0.00 52.55 50.54 1ml3 s ASP 311 Cb -0.43 -2.29 0.13 0.00 -1.46 0.00 0.00 42.92 38.87 1ml3 s ASP 311 CO 0.32 -0.89 1.79 -1.28 0.52 0.00 0.00 175.17 175.63 1ml3 h SER 312 N 8.56 0.40 -0.06 -0.34 0.87 -1.66 -2.33 113.55 119.00 1ml3 h SER 312 Ca -0.02 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 1ml3 h SER 312 Cb 1.05 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.96 1ml3 h SER 312 CO 0.97 0.28 -0.05 0.11 -0.53 0.00 0.00 176.83 177.61 1ml3 h LYS 313 N 0.53 0.14 -0.58 2.24 1.57 -1.88 0.59 116.57 119.19 1ml3 h LYS 313 Ca 0.22 -0.07 0.12 0.00 -1.87 0.00 0.00 60.65 59.04 1ml3 h LYS 313 Cb 0.11 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1ml3 h LYS 313 CO -0.14 0.58 0.40 0.00 -0.57 0.00 0.00 179.45 179.71 1ml3 h ALA 314 N 0.56 2.14 0.02 3.86 0.00 -1.93 -0.51 119.26 123.41 1ml3 h ALA 314 Ca 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ml3 h ALA 314 Cb 0.55 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1ml3 h ALA 314 CO 0.01 -0.29 -0.01 1.15 0.00 0.00 0.00 179.25 180.12 1ml3 h THR 315 N 0.30 1.14 0.00 0.00 2.02 -1.24 -3.08 112.91 112.04 1ml3 h THR 315 Ca 0.28 -1.76 -0.02 0.00 0.77 0.00 0.00 66.41 65.67 1ml3 h THR 315 Cb 0.68 2.11 -0.00 0.00 -1.74 0.00 0.00 68.15 69.19 1ml3 h THR 315 CO -0.06 0.37 -0.11 -0.07 0.37 0.00 0.00 175.52 176.02 1ml3 h LEU 316 N -0.97 0.00 0.00 2.58 3.38 -0.66 -2.40 115.31 117.25 1ml3 h LEU 316 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ml3 h LEU 316 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1ml3 h LEU 316 CO 0.01 0.11 -0.57 0.00 0.09 0.00 0.00 178.44 178.08 1ml3 n GLN 317 N -3.76 0.24 -0.27 1.13 6.02 -0.22 -4.33 117.38 116.18 1ml3 n GLN 317 Ca -0.02 0.07 0.09 0.00 -0.01 0.00 0.00 57.00 57.13 1ml3 n GLN 317 Cb 0.22 -1.65 0.19 0.00 1.02 0.00 0.00 30.24 30.02 1ml3 n GLN 317 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1ml3 n ASN 318 N -2.00 2.94 -4.77 1.08 3.02 -0.91 -5.02 115.26 109.60 1ml3 n ASN 318 Ca 0.04 -3.13 -0.22 0.00 -0.03 0.00 0.00 54.58 51.24 1ml3 n ASN 318 Cb 0.42 -0.49 -0.05 0.00 -0.61 0.00 0.00 39.78 39.05 1ml3 n ASN 318 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1ml3 s ASN 319 N -2.51 5.07 0.15 6.41 0.01 -1.20 -4.89 114.94 117.98 1ml3 s ASN 319 Ca 0.37 -0.51 -0.31 0.00 -0.71 0.00 0.00 52.86 51.70 1ml3 s ASN 319 Cb 0.31 -1.03 -0.08 0.00 0.41 0.00 0.00 41.25 40.87 1ml3 s ASN 319 CO 0.05 -0.16 1.31 -0.76 -1.51 0.00 0.00 177.10 176.03 1ml3 s LEU 320 N -3.84 4.40 0.34 0.60 1.43 -1.26 -4.98 118.68 115.36 1ml3 s LEU 320 Ca 0.36 2.31 -0.28 0.00 -1.03 0.00 0.00 54.13 55.49 1ml3 s LEU 320 Cb -0.06 -3.60 -0.10 0.00 0.03 0.00 0.00 46.19 42.47 1ml3 s LEU 320 CO 0.24 -0.55 1.22 -2.16 0.23 0.00 0.00 176.35 175.33 1ml3 s PRO 321 N 0.46 4.32 -0.44 1.29 0.04 -1.26 -2.77 135.00 136.65 1ml3 s PRO 321 Ca 0.59 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.65 1ml3 s PRO 321 Cb -0.35 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1ml3 s PRO 321 CO 0.34 -0.14 0.00 1.63 0.04 0.00 0.00 177.00 178.87 1ml3 n LYS 322 N 0.67 -1.14 -2.26 4.56 5.02 -1.26 -4.99 118.16 118.77 1ml3 n LYS 322 Ca 0.01 0.52 -0.32 0.00 -2.02 0.00 0.00 58.31 56.49 1ml3 n LYS 322 Cb 0.44 -4.49 -0.02 0.00 -0.02 0.00 0.00 35.03 30.94 1ml3 n LYS 322 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1ml3 s GLU 323 N -1.83 3.72 0.00 1.97 2.56 -1.11 -4.98 118.70 119.03 1ml3 s GLU 323 Ca 0.00 1.03 0.00 0.00 0.00 0.00 0.00 54.97 56.00 1ml3 s GLU 323 Cb 0.00 -2.10 0.00 0.00 2.00 0.00 0.00 34.13 34.03 1ml3 s GLU 323 CO 0.00 -0.46 0.47 0.54 -0.56 0.00 0.00 175.26 175.25 1ml3 n ARG 324 N -1.79 0.30 0.07 4.30 1.74 -1.26 -4.41 116.66 115.62 1ml3 n ARG 324 Ca 0.07 -0.52 0.00 0.00 -0.77 0.00 0.00 57.85 56.63 1ml3 n ARG 324 Cb 0.54 -0.57 0.00 0.00 -1.02 0.00 0.00 32.46 31.41 1ml3 n ARG 324 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1ml3 n ARG 325 N -0.05 0.00 -2.70 5.56 5.12 -1.26 -2.09 116.66 121.23 1ml3 n ARG 325 Ca 0.00 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.49 1ml3 n ARG 325 Cb 0.42 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.69 1ml3 n ARG 325 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1ml3 s PHE 326 N -2.00 3.03 0.07 -1.55 5.36 -1.26 -0.44 117.98 121.20 1ml3 s PHE 326 Ca 0.00 0.87 0.02 0.00 -0.96 0.00 0.00 56.93 56.85 1ml3 s PHE 326 Cb 0.00 -3.87 -0.04 0.00 -0.34 0.00 0.00 43.02 38.77 1ml3 s PHE 326 CO 0.00 -0.93 -0.06 -0.06 -1.46 0.00 0.00 175.22 172.70 1ml3 s PHE 327 N 3.79 0.76 -0.14 10.12 0.08 0.13 -4.76 117.98 127.95 1ml3 s PHE 327 Ca 0.43 -0.79 0.02 0.00 0.12 0.00 0.00 56.93 56.71 1ml3 s PHE 327 Cb -0.11 -0.45 0.01 0.00 -0.57 0.00 0.00 43.02 41.90 1ml3 s PHE 327 CO 0.21 -0.15 -0.20 0.21 -0.10 0.00 0.00 175.22 175.19 1ml3 s LYS 328 N -3.04 3.09 -0.10 0.44 2.20 -1.26 -0.86 119.74 120.20 1ml3 s LYS 328 Ca 0.03 -0.82 0.04 0.00 -0.36 0.00 0.00 55.97 54.86 1ml3 s LYS 328 Cb 0.00 -2.49 -0.00 0.00 -1.51 0.00 0.00 37.83 33.83 1ml3 s LYS 328 CO -0.04 0.01 -0.23 0.42 -0.36 0.00 0.00 175.35 175.15 1ml3 s ILE 329 N 0.79 2.12 -0.16 5.43 1.01 0.58 -4.86 121.20 126.12 1ml3 s ILE 329 Ca -0.07 -0.99 -0.04 0.00 0.00 0.00 0.00 60.65 59.55 1ml3 s ILE 329 Cb -0.16 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.47 1ml3 s ILE 329 CO -0.01 0.56 -0.03 -0.69 0.00 0.00 0.00 174.94 174.77 1ml3 s VAL 330 N 0.37 3.90 -0.09 2.92 1.01 -1.26 -1.40 120.40 125.85 1ml3 s VAL 330 Ca -0.18 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 1ml3 s VAL 330 Cb -0.18 -2.71 0.03 0.00 0.00 0.00 0.00 36.38 33.52 1ml3 s VAL 330 CO 0.08 0.49 0.22 -0.55 0.00 0.00 0.00 175.10 175.34 1ml3 s SER 331 N 0.41 -0.23 0.63 3.32 0.15 -0.72 -0.43 113.70 116.83 1ml3 s SER 331 Ca -0.04 0.46 0.03 0.00 0.70 0.00 0.00 55.95 57.10 1ml3 s SER 331 Cb -0.14 0.40 0.09 0.00 -1.71 0.00 0.00 66.02 64.66 1ml3 s SER 331 CO 0.03 -0.12 0.86 0.26 1.20 0.00 0.00 173.24 175.47 1ml3 s TRP 332 N 0.67 1.84 -0.30 3.44 0.52 0.11 0.36 118.94 125.58 1ml3 s TRP 332 Ca -0.05 -0.38 -0.18 0.00 0.02 0.00 0.00 56.10 55.52 1ml3 s TRP 332 Cb -0.06 -2.67 0.21 0.00 -1.15 0.00 0.00 33.47 29.80 1ml3 s TRP 332 CO -0.04 -1.31 1.33 1.52 0.02 0.00 0.00 176.95 178.48 1ml3 s TYR 333 N -2.88 -0.03 -0.83 -1.98 1.13 -0.63 -0.82 117.35 111.32 1ml3 s TYR 333 Ca 0.63 0.05 -0.25 0.00 -1.41 0.00 0.00 57.07 56.09 1ml3 s TYR 333 Cb -0.07 0.13 0.05 0.00 -1.10 0.00 0.00 41.96 40.97 1ml3 s TYR 333 CO 0.41 -0.01 1.29 0.34 -2.51 0.00 0.00 175.55 175.07 1ml3 s ASP 334 N 0.78 6.29 0.40 -0.18 -1.08 -1.26 -0.53 116.67 121.09 1ml3 s ASP 334 Ca -0.04 -0.91 0.19 0.00 -0.52 0.00 0.00 52.55 51.27 1ml3 s ASP 334 Cb -0.03 -2.54 1.11 0.00 -1.46 0.00 0.00 42.92 40.00 1ml3 s ASP 334 CO -0.11 -1.65 1.78 -0.55 0.52 0.00 0.00 175.17 175.16 1ml3 h ASN 335 N 9.85 0.43 0.00 -0.34 -1.07 -1.90 -0.09 115.58 122.47 1ml3 h ASN 335 Ca -0.11 0.08 -0.01 0.00 0.07 0.00 0.00 56.30 56.33 1ml3 h ASN 335 Cb 1.04 0.01 -0.00 0.00 -2.07 0.00 0.00 38.32 37.29 1ml3 h ASN 335 CO 1.31 0.10 -0.03 -0.33 0.07 0.00 0.00 177.43 178.54 1ml3 h GLU 336 N 0.39 0.00 -0.12 4.14 5.08 -1.98 -3.35 114.58 118.74 1ml3 h GLU 336 Ca 0.58 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.90 1ml3 h GLU 336 Cb 1.48 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.73 1ml3 h GLU 336 CO -0.27 0.98 -0.07 2.35 -1.00 0.00 0.00 179.01 180.99 1ml3 h TRP 337 N -1.00 0.30 0.32 4.33 2.91 -1.78 -2.87 115.95 118.15 1ml3 h TRP 337 Ca -0.01 -0.08 -0.02 0.00 1.13 0.00 0.00 58.89 59.92 1ml3 h TRP 337 Cb 0.98 -0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.57 1ml3 h TRP 337 CO 0.27 0.61 -0.15 0.78 -1.03 0.00 0.00 178.44 178.92 1ml3 h GLY 338 N -0.10 -0.45 0.48 2.65 0.00 -1.14 -2.57 103.07 101.93 1ml3 h GLY 338 Ca 0.03 0.17 0.11 0.00 0.00 0.00 0.00 47.33 47.63 1ml3 h GLY 338 CO 0.02 -0.16 0.51 -1.82 0.00 0.00 0.00 176.54 175.08 1ml3 h TYR 339 N -0.59 0.92 -0.32 5.60 5.03 -1.70 -1.65 116.97 124.25 1ml3 h TYR 339 Ca -0.04 0.03 0.05 0.00 2.58 0.00 0.00 58.73 61.34 1ml3 h TYR 339 Cb 0.43 -0.28 -0.04 0.00 1.55 0.00 0.00 36.73 38.39 1ml3 h TYR 339 CO -0.01 0.36 0.07 0.77 -1.32 0.00 0.00 178.16 178.02 1ml3 h SER 340 N 0.82 0.02 -0.32 -2.11 0.02 -1.37 -0.52 113.55 110.09 1ml3 h SER 340 Ca 0.43 0.05 -0.06 0.00 -0.84 0.00 0.00 61.79 61.37 1ml3 h SER 340 Cb 0.42 0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1ml3 h SER 340 CO -0.26 0.05 -0.00 0.45 -1.14 0.00 0.00 176.83 175.92 1ml3 h HIS 341 N 0.18 0.70 -0.56 3.45 3.86 -0.97 -2.49 115.15 119.32 1ml3 h HIS 341 Ca 0.15 -0.09 -0.05 0.00 -1.16 0.00 0.00 60.37 59.22 1ml3 h HIS 341 Cb 0.16 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.41 1ml3 h HIS 341 CO -0.18 0.67 0.13 0.00 0.86 0.00 0.00 177.93 179.41 1ml3 h ARG 342 N 0.63 0.87 -0.87 2.45 2.47 -0.59 0.14 114.38 119.48 1ml3 h ARG 342 Ca 0.13 -0.19 0.01 0.00 -1.26 0.00 0.00 59.98 58.67 1ml3 h ARG 342 Cb 0.40 -0.13 -0.04 0.00 -1.65 0.00 0.00 29.97 28.55 1ml3 h ARG 342 CO 0.02 0.79 0.57 0.28 0.56 0.00 0.00 179.97 182.18 1ml3 h VAL 343 N 0.84 1.23 -0.03 2.04 2.07 -0.66 0.18 116.25 121.92 1ml3 h VAL 343 Ca 0.18 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 1ml3 h VAL 343 Cb 0.31 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1ml3 h VAL 343 CO -0.00 0.22 -0.24 0.58 0.02 0.00 0.00 177.57 178.15 1ml3 h VAL 344 N 1.19 1.49 -0.70 2.57 2.07 -1.27 -1.59 116.25 120.01 1ml3 h VAL 344 Ca 0.32 -1.79 0.15 0.00 0.82 0.00 0.00 66.70 66.19 1ml3 h VAL 344 Cb -0.12 2.56 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 1ml3 h VAL 344 CO -0.07 0.50 0.48 0.44 0.02 0.00 0.00 177.57 178.94 1ml3 h ASP 345 N -0.38 0.30 0.14 0.57 3.32 -0.31 -0.68 116.42 119.38 1ml3 h ASP 345 Ca -0.02 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1ml3 h ASP 345 Cb 0.94 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.45 1ml3 h ASP 345 CO 0.05 0.16 -0.07 0.25 -1.72 0.00 0.00 179.24 177.91 1ml3 h LEU 346 N 0.32 -0.16 -1.56 1.55 5.85 -0.60 -2.63 115.31 118.08 1ml3 h LEU 346 Ca 0.34 -0.32 0.27 0.00 0.84 0.00 0.00 57.88 59.02 1ml3 h LEU 346 Cb 0.88 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.88 1ml3 h LEU 346 CO -0.09 0.43 0.70 0.58 -0.34 0.00 0.00 178.44 179.71 1ml3 h VAL 347 N -0.95 0.52 -0.02 1.05 2.07 -0.82 0.71 116.25 118.81 1ml3 h VAL 347 Ca -0.02 -0.10 -0.17 0.00 0.82 0.00 0.00 66.70 67.23 1ml3 h VAL 347 Cb 0.46 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1ml3 h VAL 347 CO 0.03 0.05 -0.76 0.03 0.02 0.00 0.00 177.57 176.95 1ml3 h ARG 348 N 0.28 0.15 -0.23 1.57 3.08 -1.17 -3.14 114.38 114.93 1ml3 h ARG 348 Ca 0.56 -0.14 -0.10 0.00 0.07 0.00 0.00 59.98 60.37 1ml3 h ARG 348 Cb 1.64 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.72 1ml3 h ARG 348 CO -0.20 0.84 -0.27 1.25 -1.07 0.00 0.00 179.97 180.52 1ml3 h HIS 349 N 0.10 0.70 0.00 3.04 2.76 0.69 -2.01 115.15 120.43 1ml3 h HIS 349 Ca -0.02 -0.22 0.00 0.00 -2.20 0.00 0.00 60.37 57.93 1ml3 h HIS 349 Cb 1.33 -0.14 0.00 0.00 1.55 0.00 0.00 27.41 30.14 1ml3 h HIS 349 CO 0.02 0.93 0.00 -1.33 -1.30 0.00 0.00 177.93 176.25 1ml3 n MET 350 N -4.35 0.24 -0.04 5.26 2.81 0.32 -2.09 117.12 119.27 1ml3 n MET 350 Ca -0.05 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.79 1ml3 n MET 350 Cb 0.45 -1.41 -0.05 0.00 -0.71 0.00 0.00 33.22 31.50 1ml3 n MET 350 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ml3 n ALA 351 N -0.91 1.81 0.24 3.04 0.00 -0.96 -4.54 120.51 119.20 1ml3 n ALA 351 Ca 0.05 -0.42 0.13 0.00 0.00 0.00 0.00 53.44 53.19 1ml3 n ALA 351 Cb 0.02 0.22 0.53 0.00 0.00 0.00 0.00 19.45 20.23 1ml3 n ALA 351 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ml3 h SER 352 N 0.00 0.00 -0.88 0.00 4.64 -0.81 -2.15 113.55 114.35 1ml3 h SER 352 Ca -0.20 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.66 1ml3 h SER 352 Cb 1.36 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.18 1ml3 h SER 352 CO -0.02 0.13 0.58 0.29 -0.87 0.00 0.00 176.83 176.95 1ml3 n LYS 353 N -3.27 2.11 0.01 4.77 4.76 -0.89 -3.37 118.16 122.27 1ml3 n LYS 353 Ca 0.00 -2.65 0.00 0.00 -2.87 0.00 0.00 58.31 52.79 1ml3 n LYS 353 Cb 0.39 -2.04 0.00 0.00 -1.84 0.00 0.00 35.03 31.54 1ml3 n LYS 353 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1ml3 n ASP 354 N -0.94 0.00 0.12 4.39 9.92 -0.89 -4.56 116.55 124.59 1ml3 n ASP 354 Ca 0.53 0.03 0.13 0.00 -0.53 0.00 0.00 54.79 54.94 1ml3 n ASP 354 Cb 1.51 0.02 0.33 0.00 -0.64 0.00 0.00 41.12 42.35 1ml3 n ASP 354 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 1ml3 h ARG 355 N 0.00 0.00 -0.00 -1.24 2.47 -1.58 -1.74 114.38 112.28 1ml3 h ARG 355 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1ml3 h ARG 355 Cb 0.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1ml3 h ARG 355 CO 0.00 0.00 -0.28 0.43 0.56 0.00 0.00 179.97 180.68 1ml3 n SER 356 N -2.38 0.77 -0.00 7.04 7.64 -1.22 -3.77 113.62 121.70 1ml3 n SER 356 Ca 0.05 -0.89 0.02 0.00 1.01 0.00 0.00 58.87 59.06 1ml3 n SER 356 Cb 0.45 0.73 -0.02 0.00 -1.01 0.00 0.00 64.21 64.35 1ml3 n SER 356 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ml3 n ALA 357 N -0.72 2.59 -1.66 -0.43 0.00 -1.22 -4.76 120.51 114.31 1ml3 n ALA 357 Ca 0.03 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1ml3 n ALA 357 Cb 0.16 -0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1ml3 n ALA 357 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ml3 n ARG 358 N -1.08 0.00 0.00 0.00 1.74 -0.67 -4.97 116.66 111.69 1ml3 n ARG 358 Ca 0.01 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 1ml3 n ARG 358 Cb 0.07 -0.18 0.00 0.00 -1.02 0.00 0.00 32.46 31.33 1ml3 n ARG 358 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39