#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gnd s LYS 11 N 0.00 1.74 -0.33 1.61 1.02 -1.26 -5.11 119.74 117.40 3gnd s LYS 11 Ca 0.00 -1.14 0.03 0.00 0.02 0.00 0.00 55.97 54.88 3gnd s LYS 11 Cb 0.00 -1.96 0.10 0.00 -0.52 0.00 0.00 37.83 35.45 3gnd s LYS 11 CO 0.00 0.50 0.05 0.34 -0.92 0.00 0.00 175.35 175.32 3gnd s ASP 12 N -1.35 4.66 0.00 2.83 2.15 -1.26 -4.95 116.67 118.74 3gnd s ASP 12 Ca 0.12 -2.06 0.19 0.00 0.43 0.00 0.00 52.55 51.23 3gnd s ASP 12 Cb -0.10 -1.52 0.81 0.00 -0.30 0.00 0.00 42.92 41.80 3gnd s ASP 12 CO 0.03 -0.38 1.56 0.49 -0.17 0.00 0.00 175.17 176.70 3gnd n PHE 13 N 4.34 0.16 -3.89 -5.34 3.72 -1.26 -4.95 117.46 110.25 3gnd n PHE 13 Ca 0.03 -0.08 -0.27 0.00 -0.05 0.00 0.00 57.45 57.07 3gnd n PHE 13 Cb 0.42 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.97 3gnd n PHE 13 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3gnd n ARG 14 N 0.03 -0.58 0.00 -1.08 0.63 -1.26 -4.78 116.66 109.62 3gnd n ARG 14 Ca 0.15 -0.13 0.11 0.00 -0.92 0.00 0.00 57.85 57.06 3gnd n ARG 14 Cb 0.25 -1.06 0.61 0.00 0.45 0.00 0.00 32.46 32.72 3gnd n ARG 14 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 3gnd n THR 15 N -3.24 0.18 1.44 5.15 -2.24 -1.26 -2.41 114.28 111.90 3gnd n THR 15 Ca -0.08 0.05 0.14 0.00 -2.27 0.00 0.00 64.05 61.89 3gnd n THR 15 Cb 0.34 -0.68 0.58 0.00 -2.10 0.00 0.00 70.33 68.46 3gnd n THR 15 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3gnd n ASP 16 N -1.17 0.72 -3.69 3.42 5.68 -1.26 -4.69 116.55 115.57 3gnd n ASP 16 Ca 0.13 -0.84 -0.30 0.00 -0.50 0.00 0.00 54.79 53.29 3gnd n ASP 16 Cb 0.14 -0.01 -0.14 0.00 -1.14 0.00 0.00 41.12 39.96 3gnd n ASP 16 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 3gnd s GLN 17 N -2.36 0.87 0.50 0.11 0.74 -1.01 -5.12 119.66 113.39 3gnd s GLN 17 Ca 0.31 -1.41 -0.22 0.00 0.05 0.00 0.00 55.36 54.09 3gnd s GLN 17 Cb 0.20 -2.01 -0.06 0.00 1.10 0.00 0.00 33.01 32.24 3gnd s GLN 17 CO 0.45 -1.07 1.21 -2.14 -0.55 0.00 0.00 175.29 173.19 3gnd s PRO 18 N 1.14 3.53 0.23 1.67 0.02 -1.26 -4.96 135.00 135.36 3gnd s PRO 18 Ca 0.13 1.87 -0.30 0.00 0.02 0.00 0.00 61.00 62.72 3gnd s PRO 18 Cb -0.20 -2.31 -0.09 0.00 0.02 0.00 0.00 34.50 31.92 3gnd s PRO 18 CO -0.14 -0.77 1.35 -1.14 -0.33 0.00 0.00 177.00 175.97 3gnd s GLN 19 N -2.84 4.35 -0.02 5.54 0.74 -1.26 -5.04 119.66 121.14 3gnd s GLN 19 Ca 0.67 2.14 0.05 0.00 0.05 0.00 0.00 55.36 58.28 3gnd s GLN 19 Cb -0.31 -3.16 -0.01 0.00 1.10 0.00 0.00 33.01 30.63 3gnd s GLN 19 CO 0.37 -0.29 -0.17 0.15 -0.55 0.00 0.00 175.29 174.80 3gnd s LYS 20 N -0.39 1.46 0.18 1.67 1.02 -1.26 -5.13 119.74 117.29 3gnd s LYS 20 Ca 0.56 -0.62 -0.30 0.00 0.02 0.00 0.00 55.97 55.63 3gnd s LYS 20 Cb -0.38 -1.39 -0.08 0.00 -0.52 0.00 0.00 37.83 35.45 3gnd s LYS 20 CO 0.41 0.36 1.22 -0.80 -0.92 0.00 0.00 175.35 175.63 3gnd s ASN 21 N -0.36 7.04 -0.26 2.83 0.01 -1.26 -5.01 114.94 117.93 3gnd s ASN 21 Ca 0.06 2.26 -0.23 0.00 -0.71 0.00 0.00 52.86 54.23 3gnd s ASN 21 Cb -0.07 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 38.97 3gnd s ASN 21 CO -0.00 -0.41 0.77 -0.63 -1.51 0.00 0.00 177.10 175.32 3gnd s ILE 22 N 0.06 4.86 0.52 0.60 1.01 -1.26 -5.02 121.20 121.96 3gnd s ILE 22 Ca 0.54 1.39 -0.22 0.00 0.00 0.00 0.00 60.65 62.36 3gnd s ILE 22 Cb -0.33 -4.08 -0.06 0.00 0.01 0.00 0.00 42.46 38.00 3gnd s ILE 22 CO 0.36 -0.08 1.27 -2.84 0.00 0.00 0.00 174.94 173.65 3gnd s PRO 23 N 2.78 3.36 -0.36 2.79 0.02 -1.26 -5.00 135.00 137.33 3gnd s PRO 23 Ca 0.32 2.02 -0.13 0.00 0.02 0.00 0.00 61.00 63.24 3gnd s PRO 23 Cb -0.15 -2.29 0.00 0.00 0.02 0.00 0.00 34.50 32.08 3gnd s PRO 23 CO 0.09 -0.95 0.24 0.12 -0.33 0.00 0.00 177.00 176.17 3gnd s PHE 24 N -1.42 3.23 -1.24 6.54 5.36 -1.26 -4.99 117.98 124.19 3gnd s PHE 24 Ca 0.69 -0.47 0.23 0.00 -0.96 0.00 0.00 56.93 56.41 3gnd s PHE 24 Cb -0.35 -2.49 0.09 0.00 -0.34 0.00 0.00 43.02 39.92 3gnd s PHE 24 CO 0.41 -0.48 1.12 0.25 -1.46 0.00 0.00 175.22 175.07 3gnd n THR 25 N 5.09 0.00 -1.66 0.12 -2.24 -1.26 -4.46 114.28 109.87 3gnd n THR 25 Ca -0.12 -0.05 -0.51 0.00 -2.27 0.00 0.00 64.05 61.10 3gnd n THR 25 Cb 0.48 0.79 -0.05 0.00 -2.10 0.00 0.00 70.33 69.45 3gnd n THR 25 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3gnd n LEU 26 N -1.18 2.64 -4.64 3.22 7.94 -1.26 -4.72 117.00 118.99 3gnd n LEU 26 Ca 0.06 1.06 -0.62 0.00 -1.11 0.00 0.00 56.01 55.40 3gnd n LEU 26 Cb 0.36 -1.29 -0.09 0.00 0.53 0.00 0.00 43.42 42.93 3gnd n LEU 26 CO 0.37 -0.47 1.34 1.17 -1.11 0.00 0.00 177.39 178.69 3gnd n LYS 27 N 4.38 0.45 -1.25 1.96 4.81 -1.26 -1.44 118.16 125.81 3gnd n LYS 27 Ca 0.21 0.16 -0.09 0.00 -0.87 0.00 0.00 58.31 57.72 3gnd n LYS 27 Cb 0.23 -1.76 -0.04 0.00 0.02 0.00 0.00 35.03 33.48 3gnd n LYS 27 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gnd n GLY 28 N 4.76 1.01 0.40 3.14 0.00 -1.25 -3.93 105.19 109.33 3gnd n GLY 28 Ca 0.34 -0.40 0.07 0.00 0.00 0.00 0.00 46.02 46.03 3gnd n GLY 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnd n GLY 30 N -1.06 -0.27 2.65 0.00 0.00 -1.26 -3.92 105.19 101.33 3gnd n GLY 30 Ca 0.15 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.93 3gnd n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnd n ALA 31 N -0.08 2.99 -2.66 4.61 0.00 -1.26 -4.95 120.51 119.16 3gnd n ALA 31 Ca 0.08 -2.92 -0.25 0.00 0.00 0.00 0.00 53.44 50.36 3gnd n ALA 31 Cb 0.15 -0.78 -0.07 0.00 0.00 0.00 0.00 19.45 18.75 3gnd n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gnd s LEU 32 N -3.67 3.29 1.01 0.00 1.43 -1.25 -5.13 118.68 114.35 3gnd s LEU 32 Ca 0.31 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.81 3gnd s LEU 32 Cb 0.34 -1.88 0.19 0.00 0.03 0.00 0.00 46.19 44.87 3gnd s LEU 32 CO -0.03 0.05 1.08 -0.62 0.23 0.00 0.00 176.35 177.06 3gnd s ASP 33 N -3.29 2.32 0.12 2.29 2.15 -1.26 -4.76 116.67 114.23 3gnd s ASP 33 Ca 0.29 1.74 -0.20 0.00 0.43 0.00 0.00 52.55 54.81 3gnd s ASP 33 Cb -0.08 -2.36 -0.06 0.00 -0.30 0.00 0.00 42.92 40.12 3gnd s ASP 33 CO 0.19 -3.40 1.76 -0.25 -0.17 0.00 0.00 175.17 173.31 3gnd h TRP 34 N -2.07 0.19 -0.71 -5.34 7.01 -2.00 -1.86 115.95 111.17 3gnd h TRP 34 Ca -0.52 0.01 0.01 0.00 2.11 0.00 0.00 58.89 60.50 3gnd h TRP 34 Cb 1.30 -0.06 -0.04 0.00 -2.10 0.00 0.00 29.16 28.26 3gnd h TRP 34 CO 0.39 0.11 0.46 0.78 -2.79 0.00 0.00 178.44 177.39 3gnd h GLY 35 N 0.21 1.01 1.13 2.65 0.00 -1.92 0.18 103.07 106.33 3gnd h GLY 35 Ca 0.07 -0.36 -0.09 0.00 0.00 0.00 0.00 47.33 46.95 3gnd h GLY 35 CO -0.04 0.34 0.03 1.98 0.00 0.00 0.00 176.54 178.85 3gnd h MET 36 N 0.94 1.04 -0.23 4.80 1.85 -1.58 -0.55 114.93 121.20 3gnd h MET 36 Ca 0.27 -0.31 -0.08 0.00 -0.61 0.00 0.00 59.70 58.97 3gnd h MET 36 Cb -0.07 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 31.84 3gnd h MET 36 CO -0.07 1.00 -0.20 1.96 -0.40 0.00 0.00 176.91 179.20 3gnd h GLN 37 N 0.96 0.41 -0.07 0.39 4.20 -0.70 -0.73 115.11 119.56 3gnd h GLN 37 Ca 0.18 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 3gnd h GLN 37 Cb 0.52 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 3gnd h GLN 37 CO 0.03 0.59 0.02 1.03 -0.67 0.00 0.00 178.83 179.83 3gnd h SER 38 N 0.37 0.11 -0.39 1.46 0.87 0.01 -0.51 113.55 115.48 3gnd h SER 38 Ca 0.06 -0.21 0.03 0.00 -1.23 0.00 0.00 61.79 60.45 3gnd h SER 38 Cb 0.56 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.46 3gnd h SER 38 CO 0.04 0.29 0.18 0.03 -0.53 0.00 0.00 176.83 176.84 3gnd h ARG 39 N -0.07 0.37 -0.38 2.24 3.08 -0.90 -2.14 114.38 116.58 3gnd h ARG 39 Ca 0.02 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3gnd h ARG 39 Cb 0.22 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 3gnd h ARG 39 CO -0.00 0.24 0.23 -0.07 -1.07 0.00 0.00 179.97 179.30 3gnd h LEU 40 N 0.38 0.44 -0.77 3.04 3.38 -0.97 -0.22 115.31 120.59 3gnd h LEU 40 Ca 0.17 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3gnd h LEU 40 Cb 0.09 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3gnd h LEU 40 CO -0.13 0.34 0.00 0.28 0.09 0.00 0.00 178.44 179.03 3gnd h SER 41 N 0.52 0.00 0.68 -0.43 0.02 -0.55 0.11 113.55 113.89 3gnd h SER 41 Ca 0.14 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.94 3gnd h SER 41 Cb -0.02 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 3gnd h SER 41 CO -0.03 0.00 -0.70 0.03 -1.14 0.00 0.00 176.83 174.99 3gnd h ARG 42 N 0.00 0.02 0.00 3.45 3.08 -0.41 -3.36 114.38 117.16 3gnd h ARG 42 Ca 0.00 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 3gnd h ARG 42 Cb 0.62 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 3gnd h ARG 42 CO 0.00 0.72 -0.56 0.82 -1.07 0.00 0.00 179.97 179.87 3gnd h ILE 43 N 0.01 0.67 -3.42 2.04 2.04 -1.22 -3.45 117.51 114.19 3gnd h ILE 43 Ca -0.01 -1.66 -0.71 0.00 1.00 0.00 0.00 64.86 63.47 3gnd h ILE 43 Cb 1.25 1.42 -0.21 0.00 -0.74 0.00 0.00 36.82 38.55 3gnd h ILE 43 CO 0.09 0.23 -0.28 -0.36 0.00 0.00 0.00 178.15 177.83 3gnd s PHE 44 N -2.15 3.20 -0.46 1.37 0.08 0.32 -4.51 117.98 115.83 3gnd s PHE 44 Ca -0.18 -0.63 -0.43 0.00 0.12 0.00 0.00 56.93 55.81 3gnd s PHE 44 Cb 0.02 -2.97 -0.18 0.00 -0.57 0.00 0.00 43.02 39.32 3gnd s PHE 44 CO 0.40 -0.74 1.96 -1.71 -0.10 0.00 0.00 175.22 175.03 3gnd n ASN 45 N 5.41 1.19 -0.29 1.36 2.85 -0.61 -4.48 115.26 120.69 3gnd n ASN 45 Ca -0.10 0.83 0.18 0.00 -0.11 0.00 0.00 54.58 55.37 3gnd n ASN 45 Cb 0.46 -0.96 0.45 0.00 1.24 0.00 0.00 39.78 40.97 3gnd n ASN 45 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3gnd h PRO 46 N 8.12 0.51 0.70 1.20 0.11 -1.91 1.97 132.00 142.70 3gnd h PRO 46 Ca -0.25 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.80 3gnd h PRO 46 Cb 1.39 -0.11 0.01 0.00 0.11 0.00 0.00 31.00 32.39 3gnd h PRO 46 CO 1.04 0.34 -0.34 0.87 -0.21 0.00 0.00 178.00 179.70 3gnd h LYS 47 N 0.52 -0.90 0.00 1.05 1.79 -1.98 -3.35 116.57 113.70 3gnd h LYS 47 Ca 0.52 0.06 -0.12 0.00 -2.18 0.00 0.00 60.65 58.93 3gnd h LYS 47 Cb 1.12 0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 31.96 3gnd h LYS 47 CO -0.25 -0.60 -0.98 1.79 -1.08 0.00 0.00 179.45 178.33 3gnd h THR 48 N -1.21 0.54 -0.17 -0.16 1.35 -1.84 -3.48 112.91 107.95 3gnd h THR 48 Ca -0.10 -1.90 -0.07 0.00 -0.55 0.00 0.00 66.41 63.79 3gnd h THR 48 Cb 0.72 2.10 -0.03 0.00 -1.73 0.00 0.00 68.15 69.21 3gnd h THR 48 CO 0.16 0.31 -0.07 0.61 -0.25 0.00 0.00 175.52 176.28 3gnd n GLY 49 N 1.29 0.66 3.60 5.82 0.00 0.66 -5.01 105.19 112.21 3gnd n GLY 49 Ca -0.04 -0.55 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 3gnd n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gnd s LYS 50 N -1.82 2.01 -0.14 1.61 1.02 -1.25 -4.80 119.74 116.38 3gnd s LYS 50 Ca 0.00 -2.24 -0.17 0.00 0.02 0.00 0.00 55.97 53.58 3gnd s LYS 50 Cb 0.00 -0.94 0.04 0.00 -0.52 0.00 0.00 37.83 36.41 3gnd s LYS 50 CO 0.00 -0.42 0.46 -0.08 -0.92 0.00 0.00 175.35 174.38 3gnd s THR 51 N -3.09 0.01 -0.32 2.17 -1.32 -0.70 -1.58 115.64 110.81 3gnd s THR 51 Ca 0.19 -0.09 -0.06 0.00 -1.21 0.00 0.00 61.69 60.52 3gnd s THR 51 Cb 0.03 -0.67 0.03 0.00 -1.51 0.00 0.00 72.50 70.38 3gnd s THR 51 CO 0.11 -0.05 0.07 -0.69 -2.21 0.00 0.00 174.62 171.86 3gnd s VAL 52 N -0.16 3.64 -0.20 5.08 1.01 -1.26 -2.12 120.40 126.38 3gnd s VAL 52 Ca -0.03 -1.08 -0.04 0.00 0.00 0.00 0.00 61.98 60.82 3gnd s VAL 52 Cb -0.03 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 3gnd s VAL 52 CO 0.02 -0.10 -0.02 -0.32 0.00 0.00 0.00 175.10 174.68 3gnd s MET 53 N 1.39 3.53 -0.44 2.72 1.75 -0.30 -1.78 119.30 126.17 3gnd s MET 53 Ca -0.01 -0.56 -0.21 0.00 -1.25 0.00 0.00 55.69 53.65 3gnd s MET 53 Cb -0.19 -3.04 0.02 0.00 2.84 0.00 0.00 34.83 34.46 3gnd s MET 53 CO 0.02 -0.05 0.68 -1.17 -0.65 0.00 0.00 175.02 173.84 3gnd s LEU 54 N 1.14 4.44 -0.25 4.11 2.96 -0.40 -1.40 118.68 129.27 3gnd s LEU 54 Ca 0.02 -0.28 -0.11 0.00 -0.22 0.00 0.00 54.13 53.54 3gnd s LEU 54 Cb -0.14 -2.79 -0.05 0.00 0.50 0.00 0.00 46.19 43.71 3gnd s LEU 54 CO 0.01 -0.81 0.20 0.00 -1.32 0.00 0.00 176.35 174.43 3gnd s ALA 55 N 2.94 3.58 -0.29 5.97 0.00 0.12 -1.29 121.76 132.78 3gnd s ALA 55 Ca 0.24 -0.93 0.19 0.00 0.00 0.00 0.00 51.96 51.47 3gnd s ALA 55 Cb -0.14 -2.43 0.48 0.00 0.00 0.00 0.00 23.12 21.04 3gnd s ALA 55 CO 0.20 -0.36 1.05 1.97 0.00 0.00 0.00 175.76 178.62 3gnd n PHE 56 N 4.64 1.40 1.14 0.00 1.16 -0.43 -4.23 117.46 121.14 3gnd n PHE 56 Ca -0.14 -2.44 0.12 0.00 -1.87 0.00 0.00 57.45 53.12 3gnd n PHE 56 Cb 0.52 -0.29 0.21 0.00 -1.61 0.00 0.00 39.48 38.31 3gnd n PHE 56 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 3gnd n ASP 57 N -0.39 2.52 -0.31 5.98 5.75 -1.23 -4.56 116.55 124.30 3gnd n ASP 57 Ca 0.11 -1.82 0.28 0.00 -0.01 0.00 0.00 54.79 53.35 3gnd n ASP 57 Cb 0.81 0.03 0.61 0.00 -1.03 0.00 0.00 41.12 41.54 3gnd n ASP 57 CO 0.00 0.00 0.00 0.45 -0.11 0.00 0.00 177.20 177.54 3gnd h HIS 58 N 3.91 0.39 0.00 2.11 -0.00 -1.93 0.07 115.15 119.69 3gnd h HIS 58 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 3gnd h HIS 58 Cb 0.85 -0.11 0.00 0.00 -0.00 0.00 0.00 27.41 28.15 3gnd h HIS 58 CO 0.00 0.03 0.00 0.78 -0.00 0.00 0.00 177.93 178.74 3gnd h GLY 59 N 0.23 0.00 1.86 2.45 0.00 -1.80 -2.68 103.07 103.12 3gnd h GLY 59 Ca 0.57 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.91 3gnd h GLY 59 CO -0.18 0.00 0.06 0.10 0.00 0.00 0.00 176.54 176.52 3gnd h TYR 60 N 0.00 0.00 0.00 5.60 -0.00 -1.28 -2.37 116.97 118.93 3gnd h TYR 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 3gnd h TYR 60 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.77 3gnd h TYR 60 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 178.16 180.13 3gnd n PHE 61 N -3.57 0.00 0.54 0.10 1.16 -1.17 -4.73 117.46 109.78 3gnd n PHE 61 Ca -0.02 0.00 0.06 0.00 -1.87 0.00 0.00 57.45 55.62 3gnd n PHE 61 Cb 0.14 0.00 0.02 0.00 -1.61 0.00 0.00 39.48 38.03 3gnd n PHE 61 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 3gnd n GLN 62 N -0.10 1.49 0.00 3.97 6.02 -1.02 -2.23 117.38 125.51 3gnd n GLN 62 Ca 0.00 -0.91 0.00 0.00 -0.01 0.00 0.00 57.00 56.08 3gnd n GLN 62 Cb 0.10 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.17 3gnd n GLN 62 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3gnd n GLY 63 N 0.89 -0.04 3.57 1.08 0.00 -0.90 -4.35 105.19 105.44 3gnd n GLY 63 Ca 0.06 -1.01 -0.25 0.00 0.00 0.00 0.00 46.02 44.82 3gnd n GLY 63 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gnd s PRO 64 N 0.00 2.28 0.60 1.61 0.02 -1.26 -4.12 135.00 134.13 3gnd s PRO 64 Ca 0.00 -0.78 -0.17 0.00 0.02 0.00 0.00 61.00 60.07 3gnd s PRO 64 Cb 0.00 -5.14 -0.03 0.00 0.02 0.00 0.00 34.50 29.35 3gnd s PRO 64 CO 0.00 -4.08 1.12 -0.08 -0.33 0.00 0.00 177.00 173.63 3gnd s THR 65 N 11.84 3.19 0.07 0.99 -1.32 -1.26 -4.76 115.64 124.38 3gnd s THR 65 Ca 0.72 0.64 -0.34 0.00 -1.21 0.00 0.00 61.69 61.50 3gnd s THR 65 Cb -0.03 -3.19 -0.13 0.00 -1.51 0.00 0.00 72.50 67.63 3gnd s THR 65 CO 0.10 -0.26 1.67 0.41 -2.21 0.00 0.00 174.62 174.33 3gnd n THR 66 N -1.88 0.20 0.00 5.08 -1.04 -1.26 -1.24 114.28 114.14 3gnd n THR 66 Ca 0.11 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 3gnd n THR 66 Cb 0.51 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.41 3gnd n THR 66 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3gnd n GLY 67 N 3.71 3.39 0.63 3.41 0.00 -1.26 -4.86 105.19 110.22 3gnd n GLY 67 Ca 0.19 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.30 3gnd n GLY 67 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gnd n LEU 68 N 0.00 3.39 -0.04 0.99 4.77 -0.37 -4.64 117.00 121.10 3gnd n LEU 68 Ca 0.00 -3.07 -0.10 0.00 -0.03 0.00 0.00 56.01 52.81 3gnd n LEU 68 Cb 0.00 -0.51 -0.04 0.00 -2.33 0.00 0.00 43.42 40.54 3gnd n LEU 68 CO 0.00 0.70 0.92 -0.33 -1.33 0.00 0.00 177.39 177.35 3gnd h GLU 69 N 1.20 0.26 -2.80 3.23 3.07 -1.85 -3.36 114.58 114.32 3gnd h GLU 69 Ca 0.01 -0.03 -0.61 0.00 -0.50 0.00 0.00 59.36 58.23 3gnd h GLU 69 Cb 1.31 -0.05 -0.42 0.00 -0.84 0.00 0.00 28.75 28.75 3gnd h GLU 69 CO 0.15 0.22 -0.63 0.54 -1.40 0.00 0.00 179.01 177.90 3gnd n ARG 70 N -4.92 1.79 -0.34 2.33 5.12 -1.26 -4.92 116.66 114.46 3gnd n ARG 70 Ca -0.04 -4.37 0.21 0.00 -1.93 0.00 0.00 57.85 51.72 3gnd n ARG 70 Cb 0.06 -2.19 0.44 0.00 -1.16 0.00 0.00 32.46 29.60 3gnd n ARG 70 CO 0.00 0.00 0.00 0.82 -1.93 0.00 0.00 177.63 176.52 3gnd h ILE 71 N 4.09 0.48 0.00 0.55 1.08 -1.88 0.20 117.51 122.03 3gnd h ILE 71 Ca 0.17 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 64.48 3gnd h ILE 71 Cb 0.75 -0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.46 3gnd h ILE 71 CO 0.70 0.09 0.00 -2.24 -0.69 0.00 0.00 178.15 176.01 3gnd h ASP 72 N 0.48 0.00 0.00 1.72 2.03 -1.91 -0.51 116.42 118.23 3gnd h ASP 72 Ca 0.66 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 56.83 3gnd h ASP 72 Cb 1.42 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.90 3gnd h ASP 72 CO -0.45 0.00 -1.21 -0.38 -1.03 0.00 0.00 179.24 176.17 3gnd n ILE 73 N -2.98 0.94 0.12 4.15 5.41 0.48 -4.41 119.36 123.06 3gnd n ILE 73 Ca -0.01 0.01 -0.23 0.00 1.00 0.00 0.00 62.75 63.52 3gnd n ILE 73 Cb 0.21 -1.77 -0.14 0.00 -0.71 0.00 0.00 39.64 37.23 3gnd n ILE 73 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 3gnd h ASN 74 N -0.44 0.88 0.64 4.38 4.21 -1.07 -3.36 115.58 120.82 3gnd h ASN 74 Ca -0.19 -0.86 -0.27 0.00 1.21 0.00 0.00 56.30 56.19 3gnd h ASN 74 Cb 0.95 -0.28 -0.04 0.00 -1.12 0.00 0.00 38.32 37.83 3gnd h ASN 74 CO -0.12 1.66 -1.50 0.40 -1.29 0.00 0.00 177.43 176.58 3gnd h ILE 75 N 0.23 1.07 -0.59 2.81 1.08 -1.53 -3.39 117.51 117.19 3gnd h ILE 75 Ca -0.22 -2.88 0.12 0.00 -0.39 0.00 0.00 64.86 61.49 3gnd h ILE 75 Cb 2.03 2.52 -0.11 0.00 -3.07 0.00 0.00 36.82 38.19 3gnd h ILE 75 CO 0.26 0.61 -0.15 0.00 -0.69 0.00 0.00 178.15 178.17 3gnd h ALA 76 N 1.01 0.38 0.00 1.87 0.00 -1.27 0.16 119.26 121.42 3gnd h ALA 76 Ca -0.21 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3gnd h ALA 76 Cb 1.93 0.46 0.00 0.00 0.00 0.00 0.00 17.79 20.18 3gnd h ALA 76 CO 0.09 -0.44 0.00 -2.30 0.00 0.00 0.00 179.25 176.60 3gnd n PRO 77 N -5.41 0.06 0.07 0.00 -0.02 -1.26 -2.60 135.00 125.84 3gnd n PRO 77 Ca 0.07 0.28 0.08 0.00 -2.02 0.00 0.00 63.50 61.90 3gnd n PRO 77 Cb 0.31 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.25 3gnd n PRO 77 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3gnd n LEU 78 N -1.42 0.77 -0.08 2.45 4.77 0.57 -4.50 117.00 119.56 3gnd n LEU 78 Ca 0.03 0.31 -0.08 0.00 -0.03 0.00 0.00 56.01 56.25 3gnd n LEU 78 Cb 0.10 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 3gnd n LEU 78 CO 0.08 -0.07 0.68 -0.26 -1.33 0.00 0.00 177.39 176.49 3gnd h PHE 79 N 0.00 -0.71 -0.47 -1.77 0.04 -1.50 -1.49 116.94 111.05 3gnd h PHE 79 Ca -0.06 0.05 0.10 0.00 2.80 0.00 0.00 57.97 60.86 3gnd h PHE 79 Cb 1.19 0.36 -0.02 0.00 2.20 0.00 0.00 35.95 39.67 3gnd h PHE 79 CO 0.00 -0.34 0.32 1.05 -0.60 0.00 0.00 178.31 178.74 3gnd h GLU 80 N -0.24 0.18 -0.07 1.51 4.11 -1.81 0.68 114.58 118.94 3gnd h GLU 80 Ca 0.16 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.58 3gnd h GLU 80 Cb 0.49 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.70 3gnd h GLU 80 CO -0.45 0.12 0.00 0.72 0.07 0.00 0.00 179.01 179.47 3gnd n HIS 81 N -4.45 0.09 -4.24 2.06 8.25 -0.56 -4.84 115.22 111.53 3gnd n HIS 81 Ca 0.07 -0.05 -0.30 0.00 -0.26 0.00 0.00 57.72 57.19 3gnd n HIS 81 Cb 0.41 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.42 3gnd n HIS 81 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3gnd s ALA 82 N -1.91 2.98 0.00 -1.41 0.00 0.23 -4.87 121.76 116.78 3gnd s ALA 82 Ca 0.17 -1.22 -0.22 0.00 0.00 0.00 0.00 51.96 50.69 3gnd s ALA 82 Cb 0.08 -0.93 -0.19 0.00 0.00 0.00 0.00 23.12 22.09 3gnd s ALA 82 CO 0.13 0.64 1.21 -0.44 0.00 0.00 0.00 175.76 177.30 3gnd h ASP 83 N 3.67 0.32 -4.71 0.00 3.32 -1.64 -3.47 116.42 113.92 3gnd h ASP 83 Ca -0.49 -0.61 -0.17 0.00 0.02 0.00 0.00 57.03 55.78 3gnd h ASP 83 Cb 1.17 -0.09 -0.22 0.00 0.22 0.00 0.00 39.33 40.40 3gnd h ASP 83 CO 0.53 0.87 -0.62 0.54 -1.72 0.00 0.00 179.24 178.84 3gnd s VAL 84 N -3.79 0.08 -0.10 -1.35 0.11 -1.18 -4.22 120.40 109.95 3gnd s VAL 84 Ca -0.15 -0.64 -0.08 0.00 -2.93 0.00 0.00 61.98 58.19 3gnd s VAL 84 Cb 0.03 -0.28 -0.04 0.00 -1.53 0.00 0.00 36.38 34.56 3gnd s VAL 84 CO 0.75 -0.35 0.18 -0.76 -3.33 0.00 0.00 175.10 171.59 3gnd s LEU 85 N -1.10 4.40 -0.14 2.54 1.43 0.13 -1.28 118.68 124.66 3gnd s LEU 85 Ca -0.12 0.54 0.02 0.00 -1.03 0.00 0.00 54.13 53.54 3gnd s LEU 85 Cb -0.07 -2.16 0.01 0.00 0.03 0.00 0.00 46.19 44.00 3gnd s LEU 85 CO 0.00 0.39 -0.21 -0.32 0.23 0.00 0.00 176.35 176.44 3gnd s MET 86 N -1.07 2.93 0.17 1.70 -2.45 -0.41 -0.69 119.30 119.48 3gnd s MET 86 Ca 0.17 -0.82 -0.11 0.00 -1.25 0.00 0.00 55.69 53.67 3gnd s MET 86 Cb -0.13 -2.39 0.04 0.00 1.25 0.00 0.00 34.83 33.61 3gnd s MET 86 CO 0.06 -0.03 0.57 0.00 1.05 0.00 0.00 175.02 176.66 3gnd s THR 88 N -2.34 2.83 -0.01 0.00 -4.23 -1.26 -0.67 115.64 109.97 3gnd s THR 88 Ca 0.12 -0.31 0.26 0.00 -1.18 0.00 0.00 61.69 60.59 3gnd s THR 88 Cb -0.02 -3.15 0.29 0.00 1.34 0.00 0.00 72.50 70.96 3gnd s THR 88 CO 0.05 -0.14 1.81 0.08 -0.54 0.00 0.00 174.62 175.88 3gnd h ARG 89 N -0.27 0.00 0.19 3.99 0.11 -1.98 -1.34 114.38 115.08 3gnd h ARG 89 Ca -0.44 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.63 3gnd h ARG 89 Cb 1.29 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.37 3gnd h ARG 89 CO 0.58 0.13 -0.09 0.78 0.10 0.00 0.00 179.97 181.47 3gnd h GLY 90 N 2.54 -0.27 0.96 0.08 0.00 -1.97 -1.63 103.07 102.77 3gnd h GLY 90 Ca -0.00 0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.35 3gnd h GLY 90 CO 0.02 -0.10 -0.06 -2.22 0.00 0.00 0.00 176.54 174.17 3gnd h ILE 91 N -0.69 1.27 -0.01 2.60 1.08 -1.95 -2.24 117.51 117.57 3gnd h ILE 91 Ca -0.03 -1.13 0.03 0.00 -0.39 0.00 0.00 64.86 63.35 3gnd h ILE 91 Cb 0.49 1.21 -0.06 0.00 -3.07 0.00 0.00 36.82 35.39 3gnd h ILE 91 CO 0.04 0.38 -0.42 0.25 -0.69 0.00 0.00 178.15 177.71 3gnd h LEU 92 N 0.54 -1.27 -0.80 1.44 5.85 -1.21 -0.86 115.31 119.00 3gnd h LEU 92 Ca 0.10 0.16 -0.06 0.00 0.84 0.00 0.00 57.88 58.92 3gnd h LEU 92 Cb 0.57 0.50 -0.03 0.00 0.37 0.00 0.00 40.66 42.07 3gnd h LEU 92 CO 0.03 -0.45 0.19 0.03 -0.34 0.00 0.00 178.44 177.90 3gnd h ARG 93 N -0.57 1.09 0.06 1.25 3.08 -1.28 -2.97 114.38 115.04 3gnd h ARG 93 Ca 0.05 -0.24 -0.13 0.00 0.07 0.00 0.00 59.98 59.72 3gnd h ARG 93 Cb 0.65 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.56 3gnd h ARG 93 CO -0.32 0.95 -0.55 0.66 -1.07 0.00 0.00 179.97 179.63 3gnd h SER 94 N 1.04 0.39 0.00 7.04 4.64 -0.79 -3.42 113.55 122.44 3gnd h SER 94 Ca 0.22 -0.87 0.00 0.00 -0.47 0.00 0.00 61.79 60.67 3gnd h SER 94 Cb 0.33 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 3gnd h SER 94 CO -0.00 1.22 0.00 1.33 -0.87 0.00 0.00 176.83 178.51 3gnd n VAL 95 N -4.28 0.00 -2.92 0.95 0.24 -0.39 -4.96 118.33 106.98 3gnd n VAL 95 Ca -0.12 -0.27 -0.43 0.00 -2.04 0.00 0.00 64.34 61.49 3gnd n VAL 95 Cb 0.68 1.00 -0.05 0.00 -1.47 0.00 0.00 33.84 34.00 3gnd n VAL 95 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3gnd s VAL 96 N -0.54 4.64 0.16 3.34 1.01 -1.12 -4.79 120.40 123.09 3gnd s VAL 96 Ca 0.00 0.71 -0.31 0.00 0.00 0.00 0.00 61.98 62.38 3gnd s VAL 96 Cb 0.00 -4.31 -0.08 0.00 0.00 0.00 0.00 36.38 31.99 3gnd s VAL 96 CO 0.00 -0.63 1.36 -2.84 0.00 0.00 0.00 175.10 172.99 3gnd s PRO 97 N 3.33 4.34 0.52 2.72 0.02 -1.26 -4.71 135.00 139.97 3gnd s PRO 97 Ca 0.32 2.08 0.22 0.00 0.02 0.00 0.00 61.00 63.64 3gnd s PRO 97 Cb -0.12 -3.22 1.34 0.00 0.02 0.00 0.00 34.50 32.52 3gnd s PRO 97 CO 0.21 -0.37 2.05 -1.35 -0.33 0.00 0.00 177.00 177.21 3gnd h PRO 98 N 6.14 0.02 0.00 5.54 0.11 -1.96 -0.02 132.00 141.83 3gnd h PRO 98 Ca -0.43 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3gnd h PRO 98 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3gnd h PRO 98 CO 0.82 0.01 0.00 0.00 -0.21 0.00 0.00 178.00 178.62 3gnd n ALA 99 N -2.60 1.64 0.26 -0.75 0.00 -1.26 -2.21 120.51 115.58 3gnd n ALA 99 Ca 0.05 -0.05 0.17 0.00 0.00 0.00 0.00 53.44 53.62 3gnd n ALA 99 Cb 0.42 -1.20 0.82 0.00 0.00 0.00 0.00 19.45 19.49 3gnd n ALA 99 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3gnd h THR 100 N 0.00 0.15 -6.84 0.00 2.02 -1.37 -3.45 112.91 103.42 3gnd h THR 100 Ca 0.00 0.00 -0.57 0.00 0.77 0.00 0.00 66.41 66.61 3gnd h THR 100 Cb 0.17 0.69 -0.15 0.00 -1.74 0.00 0.00 68.15 67.13 3gnd h THR 100 CO 0.00 0.00 -0.93 -3.20 0.37 0.00 0.00 175.52 171.76 3gnd n ASN 101 N -3.21 0.26 -4.03 4.18 5.15 -0.94 -4.91 115.26 111.76 3gnd n ASN 101 Ca 0.01 -1.16 -0.21 0.00 -0.60 0.00 0.00 54.58 52.61 3gnd n ASN 101 Cb 0.43 -2.22 -0.16 0.00 -0.53 0.00 0.00 39.78 37.30 3gnd n ASN 101 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 3gnd s ARG 102 N -7.03 1.12 0.36 1.20 6.06 -1.26 -5.13 118.95 114.27 3gnd s ARG 102 Ca 0.04 -0.37 -0.28 0.00 -2.50 0.00 0.00 55.73 52.62 3gnd s ARG 102 Cb -0.02 -1.03 -0.12 0.00 0.06 0.00 0.00 34.95 33.84 3gnd s ARG 102 CO 0.95 0.15 1.45 -2.30 -2.50 0.00 0.00 175.30 173.05 3gnd n PRO 103 N 3.22 2.53 -4.63 5.12 -0.02 -1.26 -4.78 135.00 135.17 3gnd n PRO 103 Ca -0.18 0.89 -0.30 0.00 -2.02 0.00 0.00 63.50 61.89 3gnd n PRO 103 Cb 0.54 -2.59 -0.14 0.00 -0.02 0.00 0.00 33.50 31.30 3gnd n PRO 103 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3gnd s VAL 104 N -0.95 2.22 -0.24 -1.45 -7.23 -1.26 -0.70 120.40 110.79 3gnd s VAL 104 Ca 0.55 -1.57 0.00 0.00 -1.81 0.00 0.00 61.98 59.15 3gnd s VAL 104 Cb -0.51 -1.93 0.03 0.00 0.56 0.00 0.00 36.38 34.54 3gnd s VAL 104 CO 0.61 0.22 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.84 3gnd s VAL 105 N -0.94 2.55 0.01 1.32 1.01 0.13 -1.14 120.40 123.33 3gnd s VAL 105 Ca 0.13 -1.17 -0.25 0.00 0.00 0.00 0.00 61.98 60.69 3gnd s VAL 105 Cb -0.10 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 3gnd s VAL 105 CO 0.04 0.20 0.77 -0.76 0.00 0.00 0.00 175.10 175.36 3gnd s LEU 106 N 1.26 4.40 -0.12 3.92 1.43 -0.76 -2.61 118.68 126.20 3gnd s LEU 106 Ca -0.01 1.40 -0.29 0.00 -1.03 0.00 0.00 54.13 54.19 3gnd s LEU 106 Cb -0.17 -3.23 -0.05 0.00 0.03 0.00 0.00 46.19 42.77 3gnd s LEU 106 CO -0.06 -0.06 1.85 -0.60 0.23 0.00 0.00 176.35 177.72 3gnd s ARG 107 N 0.32 3.80 -0.21 1.70 6.06 0.16 -0.32 118.95 130.46 3gnd s ARG 107 Ca 0.40 2.09 0.14 0.00 -2.50 0.00 0.00 55.73 55.85 3gnd s ARG 107 Cb -0.20 -4.14 0.44 0.00 0.06 0.00 0.00 34.95 31.12 3gnd s ARG 107 CO 0.22 -1.31 1.33 0.00 -2.50 0.00 0.00 175.30 173.04 3gnd n ALA 108 N 8.71 3.38 -2.24 6.12 0.00 0.15 -4.60 120.51 132.03 3gnd n ALA 108 Ca 0.21 -2.85 -0.14 0.00 0.00 0.00 0.00 53.44 50.67 3gnd n ALA 108 Cb 0.44 -0.57 -0.10 0.00 0.00 0.00 0.00 19.45 19.21 3gnd n ALA 108 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3gnd s SER 109 N -2.61 1.29 0.00 0.00 1.04 -1.23 0.10 113.70 112.29 3gnd s SER 109 Ca 0.40 -1.15 0.00 0.00 0.48 0.00 0.00 55.95 55.67 3gnd s SER 109 Cb 0.35 0.10 0.00 0.00 0.10 0.00 0.00 66.02 66.57 3gnd s SER 109 CO 0.01 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.30 3gnd n GLY 110 N -0.24 -0.57 2.11 7.32 0.00 -0.51 -4.63 105.19 108.68 3gnd n GLY 110 Ca -0.07 -0.71 -0.00 0.00 0.00 0.00 0.00 46.02 45.24 3gnd n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnd n ALA 111 N 0.00 -0.01 -2.38 4.61 0.00 -1.26 0.32 120.51 121.79 3gnd n ALA 111 Ca 0.00 0.01 -0.24 0.00 0.00 0.00 0.00 53.44 53.21 3gnd n ALA 111 Cb 0.00 -0.25 -0.06 0.00 0.00 0.00 0.00 19.45 19.14 3gnd n ALA 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3gnd s ASN 112 N -2.15 4.59 0.22 0.00 4.22 -1.24 -4.82 114.94 115.76 3gnd s ASN 112 Ca 0.00 -1.02 -0.19 0.00 -2.14 0.00 0.00 52.86 49.51 3gnd s ASN 112 Cb 0.00 -0.42 0.03 0.00 1.28 0.00 0.00 41.25 42.14 3gnd s ASN 112 CO 0.00 -0.62 0.59 -0.94 -2.04 0.00 0.00 177.10 174.09 3gnd s SER 113 N -3.99 -0.31 0.00 3.54 1.04 -1.26 -4.57 113.70 108.16 3gnd s SER 113 Ca 0.42 -0.46 0.11 0.00 0.48 0.00 0.00 55.95 56.50 3gnd s SER 113 Cb 0.02 0.62 0.52 0.00 0.10 0.00 0.00 66.02 67.29 3gnd s SER 113 CO 0.23 -1.12 1.30 2.30 0.98 0.00 0.00 173.24 176.93 3gnd n ILE 114 N -0.38 0.96 1.31 -1.02 -5.35 -0.95 -1.79 119.36 112.14 3gnd n ILE 114 Ca -0.09 0.24 0.13 0.00 -0.27 0.00 0.00 62.75 62.76 3gnd n ILE 114 Cb 0.62 -1.05 0.45 0.00 -1.74 0.00 0.00 39.64 37.92 3gnd n ILE 114 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3gnd n LEU 115 N -1.38 0.95 0.00 7.28 4.77 -1.26 -4.98 117.00 122.38 3gnd n LEU 115 Ca 0.04 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 3gnd n LEU 115 Cb 0.11 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 3gnd n LEU 115 CO 0.09 0.17 0.00 0.00 -1.33 0.00 0.00 177.39 176.33 3gnd n ALA 116 N -0.62 0.00 -1.66 -1.18 0.00 -0.74 -5.10 120.51 111.21 3gnd n ALA 116 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.15 3gnd n ALA 116 Cb 0.33 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.75 3gnd n ALA 116 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3gnd n GLU 117 N 0.00 2.79 0.13 0.00 4.07 -1.26 -4.76 120.64 121.60 3gnd n GLU 117 Ca 0.00 1.02 0.02 0.00 -0.06 0.00 0.00 57.16 58.15 3gnd n GLU 117 Cb 0.00 -2.97 0.39 0.00 -0.06 0.00 0.00 31.44 28.80 3gnd n GLU 117 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 3gnd h LEU 118 N 10.44 0.20 -0.71 4.31 5.85 -1.97 -2.69 115.31 130.74 3gnd h LEU 118 Ca -0.50 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.18 3gnd h LEU 118 Cb 1.24 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.22 3gnd h LEU 118 CO 0.94 0.38 0.00 -1.54 -0.34 0.00 0.00 178.44 177.88 3gnd n SER 119 N -4.26 1.05 -4.13 1.25 3.41 -1.26 -4.55 113.62 105.13 3gnd n SER 119 Ca -0.01 -1.78 -0.43 0.00 -0.26 0.00 0.00 58.87 56.39 3gnd n SER 119 Cb 0.28 -0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 3gnd n SER 119 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3gnd n ASN 120 N -0.01 5.34 -4.64 4.04 5.15 -1.01 -4.36 115.26 119.75 3gnd n ASN 120 Ca 0.11 -3.10 -0.32 0.00 -0.60 0.00 0.00 54.58 50.67 3gnd n ASN 120 Cb 0.20 -1.48 -0.10 0.00 -0.53 0.00 0.00 39.78 37.88 3gnd n ASN 120 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3gnd s GLU 121 N 0.25 2.69 0.37 1.20 2.02 -1.26 -3.61 118.70 120.35 3gnd s GLU 121 Ca 0.39 -0.65 0.08 0.00 0.02 0.00 0.00 54.97 54.81 3gnd s GLU 121 Cb 0.03 -2.60 -0.06 0.00 0.10 0.00 0.00 34.13 31.61 3gnd s GLU 121 CO 0.01 0.62 0.06 0.00 0.02 0.00 0.00 175.26 175.96 3gnd s ALA 122 N -1.04 3.30 0.18 5.21 0.00 0.15 -4.71 121.76 124.86 3gnd s ALA 122 Ca 0.18 -2.04 -0.31 0.00 0.00 0.00 0.00 51.96 49.79 3gnd s ALA 122 Cb -0.11 -0.31 -0.09 0.00 0.00 0.00 0.00 23.12 22.60 3gnd s ALA 122 CO 0.09 -0.02 1.45 0.08 0.00 0.00 0.00 175.76 177.37 3gnd s VAL 123 N -2.56 2.87 -1.52 0.00 1.01 -1.26 -1.43 120.40 117.51 3gnd s VAL 123 Ca 0.36 0.66 0.15 0.00 0.00 0.00 0.00 61.98 63.16 3gnd s VAL 123 Cb 0.02 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 33.02 3gnd s VAL 123 CO 0.20 0.07 0.86 0.00 0.00 0.00 0.00 175.10 176.23 3gnd n ALA 124 N 3.31 2.87 -3.45 5.51 0.00 0.11 -4.81 120.51 124.05 3gnd n ALA 124 Ca 0.10 -0.55 -0.14 0.00 0.00 0.00 0.00 53.44 52.86 3gnd n ALA 124 Cb 0.40 -0.51 -0.08 0.00 0.00 0.00 0.00 19.45 19.26 3gnd n ALA 124 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 3gnd s LEU 125 N -1.69 -0.12 0.51 0.00 0.05 -1.25 -4.89 118.68 111.29 3gnd s LEU 125 Ca 0.14 1.04 -0.20 0.00 0.05 0.00 0.00 54.13 55.16 3gnd s LEU 125 Cb 0.12 1.93 -0.07 0.00 -2.05 0.00 0.00 46.19 46.11 3gnd s LEU 125 CO 0.30 -0.24 1.08 -0.94 -0.55 0.00 0.00 176.35 176.00 3gnd s SER 126 N 0.10 6.08 0.34 1.48 1.04 -1.26 -4.92 113.70 116.56 3gnd s SER 126 Ca -0.02 2.04 0.02 0.00 0.48 0.00 0.00 55.95 58.48 3gnd s SER 126 Cb -0.04 -2.57 0.62 0.00 0.10 0.00 0.00 66.02 64.14 3gnd s SER 126 CO 0.02 -0.97 1.98 -0.03 0.98 0.00 0.00 173.24 175.23 3gnd h MET 127 N 1.42 0.86 -0.86 4.02 4.05 -1.99 -0.55 114.93 121.89 3gnd h MET 127 Ca -0.50 -0.05 0.12 0.00 -0.28 0.00 0.00 59.70 58.99 3gnd h MET 127 Cb 1.24 -0.19 -0.14 0.00 -0.80 0.00 0.00 31.60 31.71 3gnd h MET 127 CO 0.58 0.57 -0.43 0.22 0.23 0.00 0.00 176.91 178.09 3gnd h ASP 128 N 0.89 -1.54 0.93 1.39 3.58 -1.98 -0.18 116.42 119.51 3gnd h ASP 128 Ca 0.28 0.29 -0.10 0.00 0.42 0.00 0.00 57.03 57.92 3gnd h ASP 128 Cb 0.00 0.75 -0.01 0.00 1.72 0.00 0.00 39.33 41.79 3gnd h ASP 128 CO -0.07 -0.29 -0.45 -0.78 -2.88 0.00 0.00 179.24 174.76 3gnd h ASP 129 N -0.07 0.00 -0.53 2.28 3.58 -1.50 -1.77 116.42 118.41 3gnd h ASP 129 Ca 0.27 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.67 3gnd h ASP 129 Cb 0.55 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.58 3gnd h ASP 129 CO -0.88 0.45 0.14 0.00 -2.88 0.00 0.00 179.24 176.07 3gnd h ALA 130 N 1.55 0.70 -0.37 -0.78 0.00 -0.34 -0.99 119.26 119.02 3gnd h ALA 130 Ca -0.00 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 3gnd h ALA 130 Cb 1.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3gnd h ALA 130 CO 0.06 0.38 -0.39 0.28 0.00 0.00 0.00 179.25 179.59 3gnd h VAL 131 N 0.74 1.27 -0.57 0.00 2.07 -0.87 -2.23 116.25 116.67 3gnd h VAL 131 Ca 0.17 -1.56 0.05 0.00 0.82 0.00 0.00 66.70 66.17 3gnd h VAL 131 Cb 0.32 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 3gnd h VAL 131 CO -0.00 0.52 0.38 -0.09 0.02 0.00 0.00 177.57 178.40 3gnd h ARG 132 N 0.74 0.58 -0.04 1.57 2.43 -1.05 -1.03 114.38 117.57 3gnd h ARG 132 Ca 0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3gnd h ARG 132 Cb 0.97 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 3gnd h ARG 132 CO 0.09 0.38 0.00 1.28 -1.51 0.00 0.00 179.97 180.22 3gnd n LEU 133 N -4.47 0.93 -3.44 3.80 4.77 -0.40 -4.94 117.00 113.25 3gnd n LEU 133 Ca 0.07 -0.34 -0.20 0.00 -0.03 0.00 0.00 56.01 55.51 3gnd n LEU 133 Cb 0.19 -0.02 0.08 0.00 -2.33 0.00 0.00 43.42 41.34 3gnd n LEU 133 CO 0.34 0.17 0.19 -3.20 -1.33 0.00 0.00 177.39 173.56 3gnd n ASN 134 N -0.24 -4.54 -4.78 -1.43 5.15 -0.39 -4.98 115.26 104.05 3gnd n ASN 134 Ca 0.19 -0.55 -0.33 0.00 -0.60 0.00 0.00 54.58 53.28 3gnd n ASN 134 Cb 0.24 -4.92 0.03 0.00 -0.53 0.00 0.00 39.78 34.60 3gnd n ASN 134 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 3gnd s SER 135 N -3.72 5.35 0.08 1.20 0.01 -0.95 -4.74 113.70 110.93 3gnd s SER 135 Ca 0.34 2.01 0.17 0.00 1.31 0.00 0.00 55.95 59.78 3gnd s SER 135 Cb -0.15 -2.56 -0.12 0.00 0.21 0.00 0.00 66.02 63.41 3gnd s SER 135 CO 0.71 -1.46 0.87 0.00 0.41 0.00 0.00 173.24 173.76 3gnd s ALA 137 N -2.95 -1.47 0.04 0.00 0.00 -1.23 -4.17 121.76 111.99 3gnd s ALA 137 Ca -0.02 -0.00 0.09 0.00 0.00 0.00 0.00 51.96 52.02 3gnd s ALA 137 Cb 0.09 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.92 3gnd s ALA 137 CO 0.81 -1.01 -0.25 0.14 0.00 0.00 0.00 175.76 175.45 3gnd s VAL 138 N -3.59 1.98 -0.01 0.00 -7.23 -0.67 -1.82 120.40 109.07 3gnd s VAL 138 Ca 0.11 -1.29 0.06 0.00 -1.81 0.00 0.00 61.98 59.05 3gnd s VAL 138 Cb -0.03 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 35.20 3gnd s VAL 138 CO 0.03 0.35 -0.20 0.00 -0.31 0.00 0.00 175.10 174.97 3gnd s ALA 139 N -0.77 1.69 0.05 1.32 0.00 0.56 0.53 121.76 125.14 3gnd s ALA 139 Ca 0.10 -0.90 -0.09 0.00 0.00 0.00 0.00 51.96 51.07 3gnd s ALA 139 Cb -0.10 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.61 3gnd s ALA 139 CO 0.02 0.41 0.19 0.00 0.00 0.00 0.00 175.76 176.38 3gnd s ALA 140 N -0.52 -0.34 0.18 0.00 0.00 -0.78 0.31 121.76 120.61 3gnd s ALA 140 Ca 0.08 -0.34 -0.17 0.00 0.00 0.00 0.00 51.96 51.53 3gnd s ALA 140 Cb -0.08 0.31 -0.07 0.00 0.00 0.00 0.00 23.12 23.28 3gnd s ALA 140 CO -0.00 -0.38 0.63 -0.65 0.00 0.00 0.00 175.76 175.35 3gnd s GLN 141 N -2.77 4.12 -0.07 0.00 -1.52 -1.26 -1.25 119.66 116.90 3gnd s GLN 141 Ca -0.04 0.68 0.03 0.00 -1.95 0.00 0.00 55.36 54.08 3gnd s GLN 141 Cb -0.00 -2.92 -0.02 0.00 -0.22 0.00 0.00 33.01 29.85 3gnd s GLN 141 CO -0.05 0.45 -0.17 0.54 -0.25 0.00 0.00 175.29 175.81 3gnd s VAL 142 N -1.47 2.79 -0.63 1.09 0.11 0.59 -4.75 120.40 118.14 3gnd s VAL 142 Ca 0.40 -0.80 0.06 0.00 -2.93 0.00 0.00 61.98 58.71 3gnd s VAL 142 Cb -0.16 -2.10 0.26 0.00 -1.53 0.00 0.00 36.38 32.85 3gnd s VAL 142 CO 0.20 0.57 0.76 -1.22 -3.33 0.00 0.00 175.10 172.07 3gnd n TYR 143 N 2.82 3.58 -1.83 1.54 4.01 -1.26 -0.87 117.16 125.15 3gnd n TYR 143 Ca -0.17 -4.13 -0.42 0.00 -0.16 0.00 0.00 57.90 53.01 3gnd n TYR 143 Cb 0.52 -0.55 -0.03 0.00 -0.31 0.00 0.00 39.34 38.97 3gnd n TYR 143 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 3gnd s ILE 144 N -2.59 2.50 0.00 -0.72 -1.09 -1.26 -2.02 121.20 116.02 3gnd s ILE 144 Ca 0.40 0.26 0.00 0.00 -2.23 0.00 0.00 60.65 59.08 3gnd s ILE 144 Cb 0.16 -3.16 0.00 0.00 -1.58 0.00 0.00 42.46 37.87 3gnd s ILE 144 CO -0.02 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.31 3gnd n GLY 145 N 3.95 1.34 4.01 6.18 0.00 -1.26 -4.98 105.19 114.44 3gnd n GLY 145 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 3gnd n GLY 145 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gnd s SER 146 N -3.02 4.66 0.15 1.61 0.01 -0.86 -5.00 113.70 111.26 3gnd s SER 146 Ca 0.00 -0.63 -0.14 0.00 1.31 0.00 0.00 55.95 56.49 3gnd s SER 146 Cb 0.00 0.20 0.03 0.00 0.21 0.00 0.00 66.02 66.45 3gnd s SER 146 CO 0.00 -1.65 1.69 -0.08 0.41 0.00 0.00 173.24 173.61 3gnd h GLU 147 N -0.21 0.72 -1.10 12.44 4.81 -1.93 -2.81 114.58 126.50 3gnd h GLU 147 Ca -0.33 -0.14 -0.61 0.00 -0.13 0.00 0.00 59.36 58.16 3gnd h GLU 147 Cb 1.28 -0.11 -0.26 0.00 0.63 0.00 0.00 28.75 30.28 3gnd h GLU 147 CO 0.40 0.66 0.78 0.66 -0.73 0.00 0.00 179.01 180.78 3gnd n TYR 148 N -4.56 2.90 0.09 0.92 4.01 -1.26 -4.66 117.16 114.60 3gnd n TYR 148 Ca 0.01 -2.81 -0.13 0.00 -0.16 0.00 0.00 57.90 54.82 3gnd n TYR 148 Cb 0.16 -1.35 -0.07 0.00 -0.31 0.00 0.00 39.34 37.77 3gnd n TYR 148 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 3gnd h GLU 149 N 1.88 -0.18 -0.50 -0.72 4.81 -1.63 -2.03 114.58 116.21 3gnd h GLU 149 Ca 0.55 0.01 0.09 0.00 -0.13 0.00 0.00 59.36 59.88 3gnd h GLU 149 Cb 0.86 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 30.21 3gnd h GLU 149 CO 1.43 -0.12 0.09 1.25 -0.73 0.00 0.00 179.01 180.93 3gnd h HIS 150 N -0.18 0.15 -0.45 0.92 2.76 -1.87 -2.03 115.15 114.43 3gnd h HIS 150 Ca -0.00 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.16 3gnd h HIS 150 Cb 0.16 0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.11 3gnd h HIS 150 CO -0.09 -0.01 0.15 0.37 -1.30 0.00 0.00 177.93 177.04 3gnd h GLN 151 N 0.23 0.70 -0.86 5.26 5.75 -1.89 -1.92 115.11 122.38 3gnd h GLN 151 Ca 0.25 -0.15 0.03 0.00 -0.15 0.00 0.00 58.65 58.64 3gnd h GLN 151 Cb 0.34 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.74 3gnd h GLN 151 CO -0.34 0.67 0.57 0.66 -2.65 0.00 0.00 178.83 177.74 3gnd h SER 152 N 0.59 0.94 0.06 -0.69 4.64 -0.84 0.26 113.55 118.51 3gnd h SER 152 Ca 0.15 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.33 3gnd h SER 152 Cb 0.26 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3gnd h SER 152 CO -0.01 0.65 -0.42 0.40 -0.87 0.00 0.00 176.83 176.59 3gnd h ILE 153 N 1.09 1.31 -0.53 0.95 2.04 -1.09 -2.32 117.51 118.95 3gnd h ILE 153 Ca 0.34 -1.57 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 3gnd h ILE 153 Cb -0.00 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 3gnd h ILE 153 CO -0.10 0.49 0.20 0.11 0.00 0.00 0.00 178.15 178.86 3gnd h LYS 154 N 0.37 0.77 -0.59 2.37 1.57 -0.40 -0.44 116.57 120.22 3gnd h LYS 154 Ca 0.03 -0.12 0.05 0.00 -1.87 0.00 0.00 60.65 58.74 3gnd h LYS 154 Cb 0.89 -0.14 -0.05 0.00 0.08 0.00 0.00 32.23 33.01 3gnd h LYS 154 CO 0.07 0.64 0.33 -0.91 -0.57 0.00 0.00 179.45 179.02 3gnd h ASN 155 N 0.77 0.49 -0.07 0.86 2.35 -0.46 0.11 115.58 119.63 3gnd h ASN 155 Ca 0.18 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3gnd h ASN 155 Cb 0.17 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 3gnd h ASN 155 CO -0.02 0.33 0.03 0.40 -1.65 0.00 0.00 177.43 176.53 3gnd h ILE 156 N 0.62 1.00 -0.55 2.81 1.08 -1.12 -1.37 117.51 119.98 3gnd h ILE 156 Ca 0.26 -0.03 0.08 0.00 -0.39 0.00 0.00 64.86 64.79 3gnd h ILE 156 Cb 0.13 0.92 -0.07 0.00 -3.07 0.00 0.00 36.82 34.74 3gnd h ILE 156 CO -0.16 0.01 0.19 0.40 -0.69 0.00 0.00 178.15 177.90 3gnd h ILE 157 N 0.07 0.78 -0.37 -0.67 2.04 -0.41 -0.63 117.51 118.32 3gnd h ILE 157 Ca 0.03 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 3gnd h ILE 157 Cb 0.00 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 3gnd h ILE 157 CO -0.02 0.06 0.09 -0.61 0.00 0.00 0.00 178.15 177.68 3gnd h GLN 158 N 0.36 0.59 -0.69 2.37 4.15 -0.66 -1.34 115.11 119.88 3gnd h GLN 158 Ca 0.28 -0.14 -0.03 0.00 0.77 0.00 0.00 58.65 59.52 3gnd h GLN 158 Cb 0.33 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.92 3gnd h GLN 158 CO -0.29 0.63 0.30 -0.07 -1.93 0.00 0.00 178.83 177.47 3gnd h LEU 159 N 0.45 0.94 0.33 -2.39 3.38 -0.77 -2.00 115.31 115.25 3gnd h LEU 159 Ca 0.12 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3gnd h LEU 159 Cb 0.31 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3gnd h LEU 159 CO 0.00 0.83 -0.16 0.58 0.09 0.00 0.00 178.44 179.79 3gnd h VAL 160 N 0.98 0.69 -0.98 1.22 2.07 -0.99 0.37 116.25 119.61 3gnd h VAL 160 Ca 0.23 -0.40 0.17 0.00 0.82 0.00 0.00 66.70 67.53 3gnd h VAL 160 Cb 0.17 0.90 -0.17 0.00 -1.52 0.00 0.00 31.29 30.67 3gnd h VAL 160 CO -0.02 0.08 -0.32 0.44 0.02 0.00 0.00 177.57 177.76 3gnd h ASP 161 N -0.66 -1.19 -0.18 0.57 3.32 -1.23 0.15 116.42 117.20 3gnd h ASP 161 Ca -0.04 0.30 -0.12 0.00 0.02 0.00 0.00 57.03 57.19 3gnd h ASP 161 Cb 0.47 0.68 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3gnd h ASP 161 CO 0.07 -0.31 -0.36 0.00 -1.72 0.00 0.00 179.24 176.93 3gnd h ALA 162 N 1.65 0.29 -0.01 3.45 0.00 -1.11 -3.19 119.26 120.34 3gnd h ALA 162 Ca 0.40 -0.44 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3gnd h ALA 162 Cb 0.65 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3gnd h ALA 162 CO -0.99 0.35 -0.29 0.78 0.00 0.00 0.00 179.25 179.11 3gnd h GLY 163 N 0.22 0.01 2.00 0.00 0.00 0.50 -2.75 103.07 103.05 3gnd h GLY 163 Ca 0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 47.33 47.28 3gnd h GLY 163 CO 0.08 0.01 -0.20 -0.33 0.00 0.00 0.00 176.54 176.10 3gnd h MET 164 N 0.01 0.00 0.00 4.80 2.07 -0.71 0.19 114.93 121.28 3gnd h MET 164 Ca -0.00 0.00 -0.00 0.00 -2.07 0.00 0.00 59.70 57.63 3gnd h MET 164 Cb 0.52 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.25 3gnd h MET 164 CO 0.04 0.20 -0.01 0.87 1.07 0.00 0.00 176.91 179.07 3gnd h LYS 165 N 0.00 0.00 0.00 1.72 1.57 -1.57 -3.31 116.57 114.98 3gnd h LYS 165 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3gnd h LYS 165 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 3gnd h LYS 165 CO 0.03 0.01 0.00 0.28 -0.57 0.00 0.00 179.45 179.20 3gnd n VAL 166 N -3.11 0.00 -1.37 0.50 0.31 -0.89 -5.01 118.33 108.76 3gnd n VAL 166 Ca 0.01 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 3gnd n VAL 166 Cb 0.33 1.05 0.00 0.00 -0.91 0.00 0.00 33.84 34.31 3gnd n VAL 166 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gnd n GLY 167 N 0.52 0.47 3.57 2.92 0.00 0.46 -4.94 105.19 108.19 3gnd n GLY 167 Ca 0.00 -0.91 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 3gnd n GLY 167 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3gnd s MET 168 N -2.78 3.83 0.53 1.61 0.00 -0.05 -3.81 119.30 118.63 3gnd s MET 168 Ca 0.00 -0.41 -0.21 0.00 0.00 0.00 0.00 55.69 55.07 3gnd s MET 168 Cb 0.00 -3.69 -0.05 0.00 0.00 0.00 0.00 34.83 31.09 3gnd s MET 168 CO 0.00 -0.25 1.20 -2.14 0.00 0.00 0.00 175.02 173.84 3gnd s PRO 169 N 1.75 3.34 -0.08 4.11 0.02 -1.26 -4.36 135.00 138.51 3gnd s PRO 169 Ca 0.07 1.84 0.02 0.00 0.02 0.00 0.00 61.00 62.94 3gnd s PRO 169 Cb -0.16 -2.16 -0.02 0.00 0.02 0.00 0.00 34.50 32.18 3gnd s PRO 169 CO 0.11 -0.92 -0.13 0.99 -0.33 0.00 0.00 177.00 176.72 3gnd s THR 170 N -1.56 3.16 -0.20 0.99 2.01 -1.26 -1.67 115.64 117.12 3gnd s THR 170 Ca 0.71 -0.66 -0.04 0.00 0.31 0.00 0.00 61.69 62.01 3gnd s THR 170 Cb -0.30 -2.28 -0.02 0.00 0.01 0.00 0.00 72.50 69.91 3gnd s THR 170 CO 0.35 0.57 -0.03 -0.32 -0.69 0.00 0.00 174.62 174.49 3gnd s MET 171 N -0.34 3.49 -0.20 4.92 1.75 0.19 -1.78 119.30 127.33 3gnd s MET 171 Ca 0.03 -0.58 -0.09 0.00 -1.25 0.00 0.00 55.69 53.80 3gnd s MET 171 Cb -0.13 -2.99 -0.05 0.00 2.84 0.00 0.00 34.83 34.50 3gnd s MET 171 CO 0.02 -0.04 0.12 0.00 -0.65 0.00 0.00 175.02 174.47 3gnd s ALA 172 N 1.10 3.61 -0.19 4.11 0.00 -0.28 -1.87 121.76 128.24 3gnd s ALA 172 Ca 0.02 -0.73 -0.03 0.00 0.00 0.00 0.00 51.96 51.22 3gnd s ALA 172 Cb -0.15 -2.13 -0.01 0.00 0.00 0.00 0.00 23.12 20.83 3gnd s ALA 172 CO 0.00 0.12 -0.06 0.08 0.00 0.00 0.00 175.76 175.91 3gnd s VAL 173 N 0.44 3.39 -0.86 0.00 1.01 -0.38 -1.42 120.40 122.58 3gnd s VAL 173 Ca 0.07 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.29 3gnd s VAL 173 Cb -0.12 -2.51 0.03 0.00 0.00 0.00 0.00 36.38 33.78 3gnd s VAL 173 CO -0.01 0.45 1.41 0.42 0.00 0.00 0.00 175.10 177.38 3gnd s THR 174 N 1.09 3.77 0.22 3.92 -4.23 -0.44 -0.30 115.64 119.68 3gnd s THR 174 Ca 0.01 -0.13 -0.16 0.00 -1.18 0.00 0.00 61.69 60.24 3gnd s THR 174 Cb -0.15 -4.88 -0.08 0.00 1.34 0.00 0.00 72.50 68.73 3gnd s THR 174 CO -0.01 -1.80 0.65 -0.83 -0.54 0.00 0.00 174.62 172.09 3gnd s GLY 175 N 4.70 2.46 0.00 3.99 0.00 -0.05 -4.79 107.32 113.62 3gnd s GLY 175 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.14 3gnd s GLY 175 CO 0.04 0.25 0.00 -0.62 0.00 0.00 0.00 173.10 172.77 3gnd n VAL 176 N 0.38 0.00 -0.87 1.40 0.31 -1.26 -4.36 118.33 113.93 3gnd n VAL 176 Ca -0.02 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.98 3gnd n VAL 176 Cb 0.52 -0.45 -0.05 0.00 -0.91 0.00 0.00 33.84 32.95 3gnd n VAL 176 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 3gnd n VAL 181 N -0.17 0.00 -3.60 2.52 3.14 -1.26 -5.07 118.33 113.89 3gnd n VAL 181 Ca 0.00 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.01 3gnd n VAL 181 Cb 0.00 -0.10 -0.06 0.00 -1.06 0.00 0.00 33.84 32.62 3gnd n VAL 181 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 3gnd n ARG 182 N 1.32 2.76 -3.71 1.45 1.74 -1.26 -4.92 116.66 114.04 3gnd n ARG 182 Ca 0.13 -4.48 -0.24 0.00 -0.77 0.00 0.00 57.85 52.48 3gnd n ARG 182 Cb 0.01 -2.42 0.00 0.00 -1.02 0.00 0.00 32.46 29.03 3gnd n ARG 182 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 3gnd s ASP 183 N -0.13 4.75 0.13 0.55 -4.77 -1.26 -4.93 116.67 111.01 3gnd s ASP 183 Ca 0.28 -1.12 -0.19 0.00 -3.30 0.00 0.00 52.55 48.23 3gnd s ASP 183 Cb -0.06 0.25 -0.04 0.00 -1.09 0.00 0.00 42.92 41.98 3gnd s ASP 183 CO -0.12 -1.07 1.78 -0.61 0.70 0.00 0.00 175.17 175.84 3gnd h GLN 184 N 0.71 0.28 -0.41 2.11 -0.00 -1.93 -2.58 115.11 113.29 3gnd h GLN 184 Ca -0.36 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.26 3gnd h GLN 184 Cb 1.29 -0.06 -0.02 0.00 0.00 0.00 0.00 27.48 28.69 3gnd h GLN 184 CO 0.55 0.19 0.20 0.07 0.00 0.00 0.00 178.83 179.84 3gnd h ARG 185 N 0.29 0.57 0.49 1.69 0.11 -1.96 -0.35 114.38 115.23 3gnd h ARG 185 Ca 0.09 -0.06 -0.02 0.00 0.10 0.00 0.00 59.98 60.09 3gnd h ARG 185 Cb -0.01 -0.12 0.00 0.00 1.11 0.00 0.00 29.97 30.96 3gnd h ARG 185 CO -0.04 0.44 -0.24 -0.92 0.10 0.00 0.00 179.97 179.31 3gnd h TYR 186 N 0.58 -0.61 -0.06 4.08 3.20 -1.85 -2.74 116.97 119.56 3gnd h TYR 186 Ca 0.15 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 3gnd h TYR 186 Cb 0.05 0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.52 3gnd h TYR 186 CO 0.00 -0.29 0.02 0.74 -1.64 0.00 0.00 178.16 177.00 3gnd h PHE 187 N -0.99 0.07 -0.36 -3.82 0.04 -1.27 -0.70 116.94 109.92 3gnd h PHE 187 Ca -0.07 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.71 3gnd h PHE 187 Cb 0.60 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.71 3gnd h PHE 187 CO 0.01 0.06 0.23 0.77 -0.60 0.00 0.00 178.31 178.78 3gnd h SER 188 N 0.08 0.39 0.29 2.17 0.02 -1.05 0.26 113.55 115.70 3gnd h SER 188 Ca 0.02 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3gnd h SER 188 Cb 0.02 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.47 3gnd h SER 188 CO -0.00 0.28 -0.14 0.25 -1.14 0.00 0.00 176.83 176.08 3gnd h LEU 189 N 0.47 -0.33 -0.05 5.07 5.85 -0.86 -1.74 115.31 123.72 3gnd h LEU 189 Ca 0.13 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 3gnd h LEU 189 Cb -0.04 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 3gnd h LEU 189 CO -0.04 -0.23 0.02 0.00 -0.34 0.00 0.00 178.44 177.85 3gnd h ALA 190 N 0.32 0.06 -0.26 1.25 0.00 -1.05 -2.14 119.26 117.44 3gnd h ALA 190 Ca -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3gnd h ALA 190 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3gnd h ALA 190 CO 0.07 -0.36 0.12 1.79 0.00 0.00 0.00 179.25 180.87 3gnd h THR 191 N -0.06 1.15 -0.38 0.00 1.35 -0.53 -2.71 112.91 111.72 3gnd h THR 191 Ca 0.02 -0.43 -0.01 0.00 -0.55 0.00 0.00 66.41 65.43 3gnd h THR 191 Cb 0.15 0.95 -0.02 0.00 -1.73 0.00 0.00 68.15 67.50 3gnd h THR 191 CO -0.00 0.15 0.19 -0.09 -0.25 0.00 0.00 175.52 175.52 3gnd h ARG 192 N 0.29 0.55 -0.53 4.72 9.65 -1.28 -0.75 114.38 127.03 3gnd h ARG 192 Ca 0.09 -0.08 0.04 0.00 -1.10 0.00 0.00 59.98 58.93 3gnd h ARG 192 Cb 0.13 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.57 3gnd h ARG 192 CO -0.01 0.47 0.29 0.82 2.80 0.00 0.00 179.97 184.34 3gnd h ILE 193 N 0.48 1.00 -0.30 1.20 2.04 -1.40 0.14 117.51 120.68 3gnd h ILE 193 Ca 0.13 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 3gnd h ILE 193 Cb 0.10 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3gnd h ILE 193 CO -0.02 0.10 0.17 0.00 0.00 0.00 0.00 178.15 178.41 3gnd h ALA 194 N 1.26 0.38 -0.71 1.87 0.00 -1.12 -0.32 119.26 120.62 3gnd h ALA 194 Ca 0.22 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 3gnd h ALA 194 Cb 0.09 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3gnd h ALA 194 CO -0.13 -0.11 0.27 0.00 0.00 0.00 0.00 179.25 179.28 3gnd h ALA 195 N 1.06 1.15 -0.43 0.00 0.00 -0.85 -2.02 119.26 118.17 3gnd h ALA 195 Ca 0.11 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3gnd h ALA 195 Cb 0.03 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3gnd h ALA 195 CO -0.02 0.61 0.00 1.49 0.00 0.00 0.00 179.25 181.33 3gnd h GLU 196 N 1.02 0.70 0.00 0.00 4.57 -0.17 -1.84 114.58 118.85 3gnd h GLU 196 Ca 0.24 -0.17 -0.07 0.00 -1.18 0.00 0.00 59.36 58.17 3gnd h GLU 196 Cb 0.21 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3gnd h GLU 196 CO -0.02 0.71 -0.34 0.52 -1.18 0.00 0.00 179.01 178.70 3gnd h MET 197 N 0.66 0.00 0.00 1.92 2.86 -0.35 -3.46 114.93 116.56 3gnd h MET 197 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3gnd h MET 197 Cb 0.41 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.07 3gnd h MET 197 CO 0.02 0.34 0.00 0.41 1.06 0.00 0.00 176.91 178.74 3gnd n GLY 198 N -0.03 0.49 3.72 8.32 0.00 -0.69 -4.92 105.19 112.09 3gnd n GLY 198 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3gnd n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnd n ALA 199 N 0.00 2.34 0.08 4.61 0.00 -1.07 -4.89 120.51 121.58 3gnd n ALA 199 Ca 0.00 0.39 0.05 0.00 0.00 0.00 0.00 53.44 53.88 3gnd n ALA 199 Cb 0.00 -2.44 -0.03 0.00 0.00 0.00 0.00 19.45 16.98 3gnd n ALA 199 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3gnd h GLN 200 N 5.18 0.00 -5.73 0.00 7.50 -1.71 -3.42 115.11 116.94 3gnd h GLN 200 Ca -0.46 0.00 -0.57 0.00 0.50 0.00 0.00 58.65 58.13 3gnd h GLN 200 Cb 1.23 0.00 -0.30 0.00 0.05 0.00 0.00 27.48 28.46 3gnd h GLN 200 CO 0.83 0.20 -0.84 0.42 -1.50 0.00 0.00 178.83 177.94 3gnd s ILE 201 N -3.09 1.46 -0.06 2.54 1.01 -1.04 -4.08 121.20 117.94 3gnd s ILE 201 Ca -0.01 -0.79 0.05 0.00 0.00 0.00 0.00 60.65 59.91 3gnd s ILE 201 Cb 0.09 -1.22 -0.00 0.00 0.01 0.00 0.00 42.46 41.33 3gnd s ILE 201 CO 0.79 0.41 -0.21 -0.63 0.00 0.00 0.00 174.94 175.30 3gnd s ILE 202 N -0.38 1.78 -0.12 2.92 -1.09 -0.74 -1.13 121.20 122.44 3gnd s ILE 202 Ca 0.06 -0.90 0.03 0.00 -2.23 0.00 0.00 60.65 57.60 3gnd s ILE 202 Cb -0.08 -1.52 0.01 0.00 -1.58 0.00 0.00 42.46 39.29 3gnd s ILE 202 CO -0.00 0.50 -0.20 -0.75 -1.23 0.00 0.00 174.94 173.25 3gnd s LYS 203 N 0.03 2.79 0.10 2.79 2.20 -0.51 -0.48 119.74 126.66 3gnd s LYS 203 Ca -0.07 -0.77 0.02 0.00 -0.36 0.00 0.00 55.97 54.79 3gnd s LYS 203 Cb -0.14 -2.24 -0.01 0.00 -1.51 0.00 0.00 37.83 33.93 3gnd s LYS 203 CO 0.04 0.01 0.08 -2.37 -0.36 0.00 0.00 175.35 172.75 3gnd n THR 204 N 3.99 0.00 -3.93 3.43 5.66 -0.02 -1.33 114.28 122.08 3gnd n THR 204 Ca -0.20 -0.70 -0.30 0.00 -3.05 0.00 0.00 64.05 59.81 3gnd n THR 204 Cb 0.52 0.34 -0.04 0.00 -1.55 0.00 0.00 70.33 69.59 3gnd n THR 204 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 3gnd s TYR 205 N -2.34 3.49 0.33 1.09 2.02 -1.26 -1.01 117.35 119.66 3gnd s TYR 205 Ca 0.11 0.21 -0.27 0.00 -0.37 0.00 0.00 57.07 56.75 3gnd s TYR 205 Cb 0.01 -1.73 -0.09 0.00 -0.40 0.00 0.00 41.96 39.74 3gnd s TYR 205 CO 0.08 0.57 1.04 -0.47 -1.57 0.00 0.00 175.55 175.19 3gnd s TYR 206 N -1.55 3.53 0.02 2.71 5.04 -1.26 -4.96 117.35 120.88 3gnd s TYR 206 Ca 0.35 1.72 0.08 0.00 -2.44 0.00 0.00 57.07 56.78 3gnd s TYR 206 Cb -0.13 -3.13 -0.02 0.00 0.35 0.00 0.00 41.96 39.03 3gnd s TYR 206 CO 0.28 -0.33 -0.24 0.08 -1.34 0.00 0.00 175.55 174.00 3gnd s VAL 207 N -1.43 1.95 0.22 3.14 1.01 -1.26 -5.03 120.40 119.00 3gnd s VAL 207 Ca 0.50 -1.23 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 3gnd s VAL 207 Cb -0.25 -1.65 0.19 0.00 0.00 0.00 0.00 36.38 34.66 3gnd s VAL 207 CO 0.32 0.38 1.70 -0.33 0.00 0.00 0.00 175.10 177.18 3gnd h GLU 208 N 5.06 0.28 -3.66 2.72 4.39 -1.96 -3.39 114.58 118.01 3gnd h GLU 208 Ca -0.44 -0.02 -0.24 0.00 0.34 0.00 0.00 59.36 59.00 3gnd h GLU 208 Cb 1.14 -0.06 -0.29 0.00 -0.10 0.00 0.00 28.75 29.44 3gnd h GLU 208 CO 0.45 0.18 -0.71 -1.59 -1.16 0.00 0.00 179.01 176.18 3gnd s LYS 209 N -6.08 0.00 0.00 2.33 -2.85 -1.26 -4.86 119.74 107.02 3gnd s LYS 209 Ca -0.13 0.06 0.00 0.00 -1.00 0.00 0.00 55.97 54.90 3gnd s LYS 209 Cb 0.19 -0.05 0.00 0.00 -2.06 0.00 0.00 37.83 35.91 3gnd s LYS 209 CO 0.75 -0.04 0.00 0.41 0.10 0.00 0.00 175.35 176.57 3gnd n GLY 210 N 3.33 0.71 0.37 0.59 0.00 -1.26 -4.41 105.19 104.52 3gnd n GLY 210 Ca -0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.94 3gnd n GLY 210 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3gnd h PHE 211 N 0.00 1.00 -0.92 1.61 3.57 -1.89 0.17 116.94 120.47 3gnd h PHE 211 Ca 0.00 0.03 0.18 0.00 3.53 0.00 0.00 57.97 61.71 3gnd h PHE 211 Cb 0.00 -0.32 -0.08 0.00 2.79 0.00 0.00 35.95 38.34 3gnd h PHE 211 CO 0.00 0.43 0.60 0.93 -2.23 0.00 0.00 178.31 178.03 3gnd h GLU 212 N 0.90 0.54 -0.00 1.11 5.08 -1.94 -0.41 114.58 119.86 3gnd h GLU 212 Ca 0.45 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.65 3gnd h GLU 212 Cb 0.48 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 3gnd h GLU 212 CO -0.21 0.36 -0.57 0.00 -1.00 0.00 0.00 179.01 177.59 3gnd h ARG 213 N 0.56 0.01 -0.10 2.33 3.08 -1.02 -1.49 114.38 117.76 3gnd h ARG 213 Ca 0.49 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.52 3gnd h ARG 213 Cb 0.99 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.04 3gnd h ARG 213 CO -0.23 0.58 0.02 0.82 -1.07 0.00 0.00 179.97 180.09 3gnd h ILE 214 N 0.01 1.21 -0.20 2.04 2.04 -1.02 -1.66 117.51 119.94 3gnd h ILE 214 Ca -0.01 -0.66 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 3gnd h ILE 214 Cb 1.01 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 3gnd h ILE 214 CO 0.08 0.19 0.06 0.58 0.00 0.00 0.00 178.15 179.06 3gnd h VAL 215 N -0.07 1.18 -0.26 1.67 2.07 -1.34 -2.79 116.25 116.72 3gnd h VAL 215 Ca 0.03 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 3gnd h VAL 215 Cb 0.28 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3gnd h VAL 215 CO 0.00 0.18 -0.01 0.00 0.02 0.00 0.00 177.57 177.76 3gnd h ALA 216 N 0.89 1.49 -0.00 1.67 0.00 -1.27 -2.43 119.26 119.61 3gnd h ALA 216 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3gnd h ALA 216 Cb 0.22 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3gnd h ALA 216 CO -0.00 0.36 -0.07 0.41 0.00 0.00 0.00 179.25 179.95 3gnd n GLY 217 N -0.99 -1.03 3.50 0.00 0.00 -0.63 -4.77 105.19 101.28 3gnd n GLY 217 Ca 0.01 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 3gnd n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnd n PRO 219 N 4.10 0.03 -4.62 0.00 -0.02 -1.26 -4.85 135.00 128.37 3gnd n PRO 219 Ca -0.17 0.07 -0.28 0.00 -2.02 0.00 0.00 63.50 61.10 3gnd n PRO 219 Cb 0.52 -1.54 -0.10 0.00 -0.02 0.00 0.00 33.50 32.36 3gnd n PRO 219 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3gnd s VAL 220 N -3.02 1.46 0.34 -1.45 -7.23 -1.26 -3.75 120.40 105.49 3gnd s VAL 220 Ca 0.12 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.01 3gnd s VAL 220 Cb 0.17 -2.64 -0.11 0.00 0.56 0.00 0.00 36.38 34.35 3gnd s VAL 220 CO 0.49 0.00 1.51 -2.65 -0.31 0.00 0.00 175.10 174.14 3gnd n PRO 221 N -1.01 2.62 -4.96 4.82 -0.02 -1.25 -4.85 135.00 130.35 3gnd n PRO 221 Ca -0.09 0.92 -0.32 0.00 -2.02 0.00 0.00 63.50 61.99 3gnd n PRO 221 Cb 0.67 -2.66 -0.14 0.00 -0.02 0.00 0.00 33.50 31.35 3gnd n PRO 221 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3gnd s ILE 222 N -0.73 2.88 0.00 4.25 1.01 -1.26 -1.78 121.20 125.58 3gnd s ILE 222 Ca 0.57 -0.80 0.06 0.00 0.00 0.00 0.00 60.65 60.49 3gnd s ILE 222 Cb -0.49 -2.11 -0.02 0.00 0.01 0.00 0.00 42.46 39.85 3gnd s ILE 222 CO 0.58 0.59 -0.19 -0.69 0.00 0.00 0.00 174.94 175.23 3gnd s VAL 223 N -0.71 1.53 -0.02 2.92 1.01 0.37 -0.10 120.40 125.39 3gnd s VAL 223 Ca 0.11 -0.92 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 3gnd s VAL 223 Cb -0.10 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 3gnd s VAL 223 CO 0.00 0.35 0.16 0.27 0.00 0.00 0.00 175.10 175.88 3gnd s ILE 224 N -0.56 5.32 0.39 2.22 -4.36 -0.87 -0.84 121.20 122.50 3gnd s ILE 224 Ca 0.07 -0.16 -0.24 0.00 -0.26 0.00 0.00 60.65 60.07 3gnd s ILE 224 Cb -0.08 -3.45 -0.10 0.00 1.25 0.00 0.00 42.46 40.08 3gnd s ILE 224 CO 0.00 0.37 0.98 0.00 0.24 0.00 0.00 174.94 176.53 3gnd s ALA 225 N -1.26 3.10 0.18 2.27 0.00 -0.18 0.41 121.76 126.28 3gnd s ALA 225 Ca 0.25 0.53 -0.13 0.00 0.00 0.00 0.00 51.96 52.61 3gnd s ALA 225 Cb -0.12 -3.20 0.09 0.00 0.00 0.00 0.00 23.12 19.89 3gnd s ALA 225 CO 0.16 0.03 1.84 0.78 0.00 0.00 0.00 175.76 178.57 3gnd h GLY 226 N 2.50 0.79 0.00 0.00 0.00 -1.89 -3.43 103.07 101.04 3gnd h GLY 226 Ca -0.48 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.57 3gnd h GLY 226 CO 0.63 0.26 0.00 0.61 0.00 0.00 0.00 176.54 178.04 3gnd n GLY 227 N -1.25 -2.27 3.67 4.60 0.00 -1.26 -4.89 105.19 103.78 3gnd n GLY 227 Ca 0.04 -1.54 -0.32 0.00 0.00 0.00 0.00 46.02 44.20 3gnd n GLY 227 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3gnd n LYS 228 N -0.50 -0.23 -1.69 1.61 2.85 -1.26 -4.45 118.16 114.49 3gnd n LYS 228 Ca 0.00 0.01 -0.44 0.00 -1.05 0.00 0.00 58.31 56.82 3gnd n LYS 228 Cb 0.00 -2.39 -0.02 0.00 -0.65 0.00 0.00 35.03 31.97 3gnd n LYS 228 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 3gnd n LYS 229 N -3.85 2.16 -4.31 -1.58 3.00 -1.26 -4.80 118.16 107.51 3gnd n LYS 229 Ca 0.12 0.77 -0.16 0.00 -0.00 0.00 0.00 58.31 59.04 3gnd n LYS 229 Cb 0.51 -2.45 -0.10 0.00 0.00 0.00 0.00 35.03 33.00 3gnd n LYS 229 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 3gnd s LEU 230 N -0.05 2.33 0.26 3.14 1.43 -1.26 -5.06 118.68 119.47 3gnd s LEU 230 Ca 0.67 -1.14 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 3gnd s LEU 230 Cb -0.62 -0.33 -0.13 0.00 0.03 0.00 0.00 46.19 45.14 3gnd s LEU 230 CO 0.50 -0.43 1.40 -2.65 0.23 0.00 0.00 176.35 175.39 3gnd n PRO 231 N -0.35 2.10 -0.32 1.29 -0.02 -1.26 -4.74 135.00 131.69 3gnd n PRO 231 Ca -0.07 0.74 0.21 0.00 -2.02 0.00 0.00 63.50 62.36 3gnd n PRO 231 Cb 0.63 -2.39 0.41 0.00 -0.02 0.00 0.00 33.50 32.12 3gnd n PRO 231 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3gnd h GLU 232 N 3.93 0.15 -0.35 -0.52 3.07 -1.99 0.20 114.58 119.07 3gnd h GLU 232 Ca -0.45 -0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 58.31 3gnd h GLU 232 Cb 1.27 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.13 3gnd h GLU 232 CO 0.73 0.10 -0.13 -0.09 -1.40 0.00 0.00 179.01 178.22 3gnd h ARG 233 N 0.15 0.61 -0.06 2.33 2.43 -1.98 -2.03 114.38 115.84 3gnd h ARG 233 Ca 0.68 -0.19 -0.21 0.00 -0.81 0.00 0.00 59.98 59.44 3gnd h ARG 233 Cb 1.55 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 31.05 3gnd h ARG 233 CO -0.72 0.73 -0.84 0.93 -1.51 0.00 0.00 179.97 178.56 3gnd h GLU 234 N 0.56 0.52 -0.60 0.20 5.08 -0.98 -2.48 114.58 116.88 3gnd h GLU 234 Ca 0.10 -0.48 -0.02 0.00 -1.00 0.00 0.00 59.36 57.97 3gnd h GLU 234 Cb 0.55 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.89 3gnd h GLU 234 CO 0.03 1.11 0.32 0.00 -1.00 0.00 0.00 179.01 179.47 3gnd h ALA 235 N 0.74 0.77 -0.37 3.43 0.00 -1.08 -1.42 119.26 121.34 3gnd h ALA 235 Ca -0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 3gnd h ALA 235 Cb 1.45 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3gnd h ALA 235 CO 0.15 0.31 -0.04 -0.07 0.00 0.00 0.00 179.25 179.60 3gnd h LEU 236 N 0.82 0.57 -0.60 0.00 3.38 -1.35 -2.16 115.31 115.98 3gnd h LEU 236 Ca 0.21 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3gnd h LEU 236 Cb 0.07 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3gnd h LEU 236 CO -0.03 0.67 0.27 -0.33 0.09 0.00 0.00 178.44 179.11 3gnd h GLU 237 N 0.57 0.87 -0.19 1.13 4.39 -0.95 -0.77 114.58 119.64 3gnd h GLU 237 Ca 0.11 -0.14 0.03 0.00 0.34 0.00 0.00 59.36 59.70 3gnd h GLU 237 Cb 0.42 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.89 3gnd h GLU 237 CO 0.02 0.72 0.02 1.98 -1.16 0.00 0.00 179.01 180.59 3gnd h MET 238 N 0.82 0.09 -0.26 2.33 4.05 -0.95 -0.60 114.93 120.42 3gnd h MET 238 Ca 0.20 -0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.66 3gnd h MET 238 Cb 0.15 -0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 30.89 3gnd h MET 238 CO -0.02 0.06 0.02 0.00 0.23 0.00 0.00 176.91 177.20 3gnd h TRP 240 N 0.10 0.32 0.04 0.00 7.01 -0.70 0.08 115.95 122.81 3gnd h TRP 240 Ca 0.12 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.15 3gnd h TRP 240 Cb 0.14 -0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 27.08 3gnd h TRP 240 CO -0.19 0.18 -0.15 1.96 -2.79 0.00 0.00 178.44 177.45 3gnd h GLN 241 N 0.36 -0.26 -0.02 2.65 1.08 -0.82 0.16 115.11 118.25 3gnd h GLN 241 Ca 0.13 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.39 3gnd h GLN 241 Cb 0.03 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.47 3gnd h GLN 241 CO -0.08 -0.18 -0.29 0.00 -0.95 0.00 0.00 178.83 177.33 3gnd h ALA 242 N 0.63 -0.39 -0.39 3.87 0.00 -0.30 0.49 119.26 123.16 3gnd h ALA 242 Ca 0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3gnd h ALA 242 Cb 0.31 0.51 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3gnd h ALA 242 CO -0.11 -0.79 0.21 0.82 0.00 0.00 0.00 179.25 179.38 3gnd h ILE 243 N -0.42 1.15 -0.49 0.00 1.08 -0.89 -1.29 117.51 116.65 3gnd h ILE 243 Ca 0.07 -0.39 0.05 0.00 -0.39 0.00 0.00 64.86 64.20 3gnd h ILE 243 Cb 0.52 0.69 -0.03 0.00 -3.07 0.00 0.00 36.82 34.93 3gnd h ILE 243 CO -0.26 0.16 0.33 -0.78 -0.69 0.00 0.00 178.15 176.90 3gnd h ASP 244 N 0.50 0.39 -0.31 1.72 3.58 -0.27 -1.70 116.42 120.34 3gnd h ASP 244 Ca 0.14 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.59 3gnd h ASP 244 Cb 0.06 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.03 3gnd h ASP 244 CO -0.02 0.26 0.00 0.00 -2.88 0.00 0.00 179.24 176.60 3gnd n GLN 245 N -4.48 1.92 0.00 0.28 6.02 0.13 -4.92 117.38 116.34 3gnd n GLN 245 Ca 0.06 -1.41 0.00 0.00 -0.01 0.00 0.00 57.00 55.64 3gnd n GLN 245 Cb 0.23 -1.37 0.00 0.00 1.02 0.00 0.00 30.24 30.11 3gnd n GLN 245 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3gnd n GLY 246 N 1.18 1.13 3.75 1.08 0.00 -0.64 -4.54 105.19 107.16 3gnd n GLY 246 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 3gnd n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnd s ALA 247 N -2.00 2.61 -1.69 4.61 0.00 -0.56 -4.82 121.76 119.90 3gnd s ALA 247 Ca 0.00 1.04 0.15 0.00 0.00 0.00 0.00 51.96 53.15 3gnd s ALA 247 Cb 0.00 -3.46 0.49 0.00 0.00 0.00 0.00 23.12 20.15 3gnd s ALA 247 CO 0.00 -1.14 1.39 0.43 0.00 0.00 0.00 175.76 176.43 3gnd n SER 248 N -1.44 3.12 0.00 0.00 7.64 0.86 -4.63 113.62 119.16 3gnd n SER 248 Ca 0.13 -2.13 0.00 0.00 1.01 0.00 0.00 58.87 57.88 3gnd n SER 248 Cb 0.49 -0.41 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 3gnd n SER 248 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gnd n GLY 249 N 1.16 0.64 3.37 0.23 0.00 -1.24 -1.72 105.19 107.62 3gnd n GLY 249 Ca 0.18 -1.72 -0.23 0.00 0.00 0.00 0.00 46.02 44.26 3gnd n GLY 249 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gnd s VAL 250 N -1.41 1.98 -0.67 1.61 -7.23 -0.90 -2.05 120.40 111.73 3gnd s VAL 250 Ca 0.00 -2.02 0.06 0.00 -1.81 0.00 0.00 61.98 58.20 3gnd s VAL 250 Cb 0.00 -1.97 0.22 0.00 0.56 0.00 0.00 36.38 35.20 3gnd s VAL 250 CO 0.00 -0.32 0.67 -0.67 -0.31 0.00 0.00 175.10 174.47 3gnd n ASP 251 N 0.11 3.55 -4.77 4.85 2.03 0.17 -1.15 116.55 121.34 3gnd n ASP 251 Ca -0.12 -3.37 -0.38 0.00 0.52 0.00 0.00 54.79 51.45 3gnd n ASP 251 Cb 0.58 -0.71 -0.03 0.00 -0.72 0.00 0.00 41.12 40.23 3gnd n ASP 251 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 3gnd s MET 252 N -2.14 4.24 0.00 -0.67 -1.94 -0.50 -3.00 119.30 115.29 3gnd s MET 252 Ca 0.35 1.68 0.00 0.00 -1.71 0.00 0.00 55.69 56.01 3gnd s MET 252 Cb 0.08 -2.73 0.00 0.00 2.01 0.00 0.00 34.83 34.19 3gnd s MET 252 CO -0.06 -0.12 0.00 0.41 -0.01 0.00 0.00 175.02 175.24 3gnd n GLY 253 N 0.63 0.09 0.23 -0.03 0.00 -1.26 0.12 105.19 104.97 3gnd n GLY 253 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.98 3gnd n GLY 253 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gnd h ARG 254 N 0.00 0.72 0.00 1.61 3.08 -1.84 -0.78 114.38 117.17 3gnd h ARG 254 Ca 0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3gnd h ARG 254 Cb 0.00 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 29.90 3gnd h ARG 254 CO 0.00 0.54 0.00 0.09 -1.07 0.00 0.00 179.97 179.53 3gnd n ASN 255 N -4.66 0.00 -0.01 7.04 3.02 -1.26 -0.90 115.26 118.49 3gnd n ASN 255 Ca 0.03 0.06 -0.04 0.00 -0.03 0.00 0.00 54.58 54.59 3gnd n ASN 255 Cb 0.06 -0.18 -0.01 0.00 -0.61 0.00 0.00 39.78 39.04 3gnd n ASN 255 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3gnd n ILE 256 N -1.18 1.17 0.63 2.41 5.41 -0.78 -4.54 119.36 122.48 3gnd n ILE 256 Ca 0.03 0.23 0.11 0.00 1.00 0.00 0.00 62.75 64.12 3gnd n ILE 256 Cb 0.04 -1.80 0.44 0.00 -0.71 0.00 0.00 39.64 37.60 3gnd n ILE 256 CO 0.00 0.00 0.00 2.22 0.00 0.00 0.00 176.55 178.77 3gnd n PHE 257 N -3.74 0.26 -0.44 1.39 1.16 -0.37 -2.05 117.46 113.66 3gnd n PHE 257 Ca -0.07 0.09 0.10 0.00 -1.87 0.00 0.00 57.45 55.70 3gnd n PHE 257 Cb 0.26 -0.65 0.31 0.00 -1.61 0.00 0.00 39.48 37.80 3gnd n PHE 257 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 3gnd n GLN 258 N -1.73 3.08 -2.90 3.97 6.02 -0.08 -4.85 117.38 120.90 3gnd n GLN 258 Ca 0.04 -2.67 -0.26 0.00 -0.01 0.00 0.00 57.00 54.10 3gnd n GLN 258 Cb 0.26 -1.64 -0.00 0.00 1.02 0.00 0.00 30.24 29.87 3gnd n GLN 258 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3gnd s SER 259 N -1.00 6.26 0.31 1.08 0.15 -0.87 -4.97 113.70 114.66 3gnd s SER 259 Ca 0.46 0.75 0.25 0.00 0.70 0.00 0.00 55.95 58.12 3gnd s SER 259 Cb 0.26 -2.15 0.74 0.00 -1.71 0.00 0.00 66.02 63.16 3gnd s SER 259 CO 0.28 -0.49 1.74 0.44 1.20 0.00 0.00 173.24 176.41 3gnd h ASP 260 N 0.40 0.00 -2.12 5.45 3.32 -1.92 -3.37 116.42 118.19 3gnd h ASP 260 Ca -0.48 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.00 3gnd h ASP 260 Cb 1.21 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.37 3gnd h ASP 260 CO 0.61 0.00 -0.97 1.41 -1.72 0.00 0.00 179.24 178.57 3gnd n HIS 261 N -2.55 0.48 0.11 4.55 8.25 -1.26 -5.00 115.22 119.79 3gnd n HIS 261 Ca 0.04 -3.67 -0.12 0.00 -0.26 0.00 0.00 57.72 53.71 3gnd n HIS 261 Cb 0.42 -0.33 -0.06 0.00 1.12 0.00 0.00 29.99 31.15 3gnd n HIS 261 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3gnd h PRO 262 N 4.27 -0.41 -0.25 -0.41 0.11 -1.74 -0.60 132.00 132.98 3gnd h PRO 262 Ca 0.12 0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.28 3gnd h PRO 262 Cb 0.84 0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 3gnd h PRO 262 CO 0.53 -0.27 0.12 0.28 -0.21 0.00 0.00 178.00 178.45 3gnd h VAL 263 N -0.42 0.99 -0.40 3.15 2.07 -1.94 -0.45 116.25 119.24 3gnd h VAL 263 Ca 0.03 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.53 3gnd h VAL 263 Cb 0.45 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.87 3gnd h VAL 263 CO -0.14 0.05 0.05 0.00 0.02 0.00 0.00 177.57 177.55 3gnd h ALA 264 N 1.13 0.41 -0.84 1.67 0.00 -1.89 -1.72 119.26 118.02 3gnd h ALA 264 Ca 0.10 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.17 3gnd h ALA 264 Cb 0.03 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 3gnd h ALA 264 CO -0.07 -0.35 0.51 1.98 0.00 0.00 0.00 179.25 181.31 3gnd h MET 265 N 0.17 0.89 -0.31 0.00 -1.53 -0.09 -1.78 114.93 112.28 3gnd h MET 265 Ca 0.20 -0.05 -0.03 0.00 -3.44 0.00 0.00 59.70 56.37 3gnd h MET 265 Cb 0.26 -0.20 -0.01 0.00 -0.55 0.00 0.00 31.60 31.09 3gnd h MET 265 CO -0.28 0.59 0.08 0.52 0.14 0.00 0.00 176.91 177.95 3gnd h MET 266 N 0.91 0.50 -0.98 0.39 2.86 -0.59 0.19 114.93 118.21 3gnd h MET 266 Ca 0.37 -0.12 0.07 0.00 -2.06 0.00 0.00 59.70 57.96 3gnd h MET 266 Cb 0.21 -0.07 -0.07 0.00 0.06 0.00 0.00 31.60 31.74 3gnd h MET 266 CO -0.19 0.56 0.63 0.87 1.06 0.00 0.00 176.91 179.85 3gnd h LYS 267 N 0.35 1.10 0.35 1.72 1.57 -0.83 0.18 116.57 121.00 3gnd h LYS 267 Ca 0.10 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 3gnd h LYS 267 Cb 0.29 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3gnd h LYS 267 CO 0.00 0.73 -0.17 0.00 -0.57 0.00 0.00 179.45 179.44 3gnd h ALA 268 N 1.47 -0.47 -1.01 3.86 0.00 -0.96 -1.19 119.26 120.97 3gnd h ALA 268 Ca 0.43 -0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.31 3gnd h ALA 268 Cb 0.20 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 3gnd h ALA 268 CO -0.17 -0.74 0.64 0.28 0.00 0.00 0.00 179.25 179.26 3gnd h VAL 269 N -0.51 1.01 -0.52 0.00 2.07 -0.34 -1.08 116.25 116.88 3gnd h VAL 269 Ca -0.05 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.10 3gnd h VAL 269 Cb 0.39 -0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 29.95 3gnd h VAL 269 CO 0.08 0.20 0.32 1.56 0.02 0.00 0.00 177.57 179.75 3gnd h GLN 270 N 1.09 0.70 -0.51 1.57 1.08 -0.45 -1.09 115.11 117.51 3gnd h GLN 270 Ca 0.47 -0.06 0.05 0.00 -1.45 0.00 0.00 58.65 57.65 3gnd h GLN 270 Cb 0.33 -0.15 -0.05 0.00 -0.05 0.00 0.00 27.48 27.56 3gnd h GLN 270 CO -0.22 0.51 0.25 0.00 -0.95 0.00 0.00 178.83 178.42 3gnd h ALA 271 N 1.16 0.65 -0.33 3.87 0.00 -0.03 -0.75 119.26 123.84 3gnd h ALA 271 Ca 0.19 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 3gnd h ALA 271 Cb -0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3gnd h ALA 271 CO -0.04 -0.10 -0.13 0.28 0.00 0.00 0.00 179.25 179.26 3gnd h VAL 272 N 0.49 1.29 0.01 0.00 2.07 -1.04 -2.38 116.25 116.69 3gnd h VAL 272 Ca 0.23 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.52 3gnd h VAL 272 Cb 0.15 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.31 3gnd h VAL 272 CO -0.17 0.40 -0.00 0.58 0.02 0.00 0.00 177.57 178.40 3gnd h VAL 273 N 0.44 1.52 0.00 2.57 2.07 -0.94 -3.24 116.25 118.68 3gnd h VAL 273 Ca 0.08 -1.67 -0.26 0.00 0.82 0.00 0.00 66.70 65.67 3gnd h VAL 273 Cb 0.66 2.64 -0.04 0.00 -1.52 0.00 0.00 31.29 33.02 3gnd h VAL 273 CO 0.04 0.43 -1.62 1.41 0.02 0.00 0.00 177.57 177.85 3gnd n HIS 274 N -4.75 1.00 -0.49 1.57 -0.00 -0.31 -4.48 115.22 107.76 3gnd n HIS 274 Ca -0.09 0.35 0.06 0.00 -0.00 0.00 0.00 57.72 58.04 3gnd n HIS 274 Cb 0.35 -1.16 0.13 0.00 -0.00 0.00 0.00 29.99 29.31 3gnd n HIS 274 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 3gnd n HIS 275 N -3.00 0.35 -1.97 4.41 8.25 -0.92 -4.94 115.22 117.40 3gnd n HIS 275 Ca -0.15 -0.69 -0.15 0.00 -0.26 0.00 0.00 57.72 56.48 3gnd n HIS 275 Cb 0.99 -0.12 -0.03 0.00 1.12 0.00 0.00 29.99 31.94 3gnd n HIS 275 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3gnd n ASN 276 N -0.39 -4.18 -4.65 0.41 3.02 -1.19 -4.94 115.26 103.35 3gnd n ASN 276 Ca 0.12 0.24 -0.34 0.00 -0.03 0.00 0.00 54.58 54.57 3gnd n ASN 276 Cb 0.53 -3.66 0.13 0.00 -0.61 0.00 0.00 39.78 36.16 3gnd n ASN 276 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3gnd n GLU 277 N -2.45 0.11 -2.84 3.52 -0.58 -1.04 -5.00 120.64 112.36 3gnd n GLU 277 Ca -0.16 0.11 -0.27 0.00 -0.42 0.00 0.00 57.16 56.42 3gnd n GLU 277 Cb 0.56 -2.33 -0.01 0.00 -0.57 0.00 0.00 31.44 29.10 3gnd n GLU 277 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3gnd s THR 278 N -2.16 4.96 0.20 2.62 -4.23 -1.26 -4.61 115.64 111.15 3gnd s THR 278 Ca 0.71 0.05 -0.10 0.00 -1.18 0.00 0.00 61.69 61.16 3gnd s THR 278 Cb -0.29 -3.86 0.13 0.00 1.34 0.00 0.00 72.50 69.82 3gnd s THR 278 CO 0.53 -0.76 1.75 0.00 -0.54 0.00 0.00 174.62 175.61 3gnd h ALA 279 N 0.42 0.74 0.32 3.99 0.00 -1.95 -1.13 119.26 121.63 3gnd h ALA 279 Ca -0.48 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 3gnd h ALA 279 Cb 1.21 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3gnd h ALA 279 CO 0.62 -0.18 -0.15 -0.44 0.00 0.00 0.00 179.25 179.09 3gnd h ASP 280 N 0.41 -0.36 -0.60 0.00 3.32 -1.95 -0.57 116.42 116.67 3gnd h ASP 280 Ca 0.28 -0.15 0.12 0.00 0.02 0.00 0.00 57.03 57.30 3gnd h ASP 280 Cb 0.32 0.09 -0.09 0.00 0.22 0.00 0.00 39.33 39.88 3gnd h ASP 280 CO -0.28 -0.02 0.08 0.03 -1.72 0.00 0.00 179.24 177.33 3gnd h ARG 281 N -0.73 0.20 -0.47 3.56 2.47 -1.94 -0.68 114.38 116.79 3gnd h ARG 281 Ca -0.04 -0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.67 3gnd h ARG 281 Cb 0.49 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.75 3gnd h ARG 281 CO 0.07 0.13 0.30 0.00 0.56 0.00 0.00 179.97 181.03 3gnd h ALA 282 N 1.51 0.59 -0.50 0.04 0.00 -1.14 -1.78 119.26 117.98 3gnd h ALA 282 Ca 0.32 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.25 3gnd h ALA 282 Cb 0.49 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3gnd h ALA 282 CO -0.45 0.02 0.34 -0.92 0.00 0.00 0.00 179.25 178.24 3gnd h TYR 283 N 0.61 0.48 -0.07 0.00 3.20 0.33 0.20 116.97 121.72 3gnd h TYR 283 Ca 0.18 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.91 3gnd h TYR 283 Cb -0.04 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 3gnd h TYR 283 CO -0.05 0.26 -0.61 0.93 -1.64 0.00 0.00 178.16 177.05 3gnd h GLU 284 N 0.48 0.23 -0.30 1.82 5.08 -0.56 -0.21 114.58 121.12 3gnd h GLU 284 Ca 0.21 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3gnd h GLU 284 Cb 0.24 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3gnd h GLU 284 CO -0.06 0.77 0.17 1.25 -1.00 0.00 0.00 179.01 180.14 3gnd h LEU 285 N 0.17 0.35 -0.24 1.33 7.12 -0.20 -2.08 115.31 121.75 3gnd h LEU 285 Ca -0.01 -0.02 -0.21 0.00 0.13 0.00 0.00 57.88 57.77 3gnd h LEU 285 Cb 1.12 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 41.16 3gnd h LEU 285 CO 0.09 0.28 -0.85 0.22 -0.13 0.00 0.00 178.44 178.05 3gnd h TYR 286 N 0.40 0.69 0.00 1.25 3.20 -0.22 -3.21 116.97 119.08 3gnd h TYR 286 Ca 0.11 -0.34 -0.04 0.00 3.14 0.00 0.00 58.73 61.60 3gnd h TYR 286 Cb -0.00 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 3gnd h TYR 286 CO 0.00 1.14 -0.18 -0.07 -1.64 0.00 0.00 178.16 177.41 3gnd h LEU 287 N 0.31 0.00 -0.32 2.82 3.38 -0.69 -2.94 115.31 117.87 3gnd h LEU 287 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3gnd h LEU 287 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3gnd h LEU 287 CO 0.15 0.18 0.00 0.77 0.09 0.00 0.00 178.44 179.63 3gnd h SER 288 N 0.00 0.00 -0.01 -0.43 4.64 -1.39 -3.51 113.55 112.84 3gnd h SER 288 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gnd h SER 288 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 3gnd h SER 288 CO 0.02 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.36