#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 1.65 -0.32 1.61 1.02 -1.26 -5.11 119.74 117.33 3gnd s LYS 11 Ca 0.00 -1.05 0.03 0.00 0.02 0.00 0.00 55.97 54.97 3gnd s LYS 11 Cb 0.00 -1.81 0.09 0.00 -0.52 0.00 0.00 37.83 35.59 3gnd s LYS 11 CO 0.00 0.47 0.03 0.34 -0.92 0.00 0.00 175.35 175.26 3gnd s ASP 12 N -1.22 4.63 0.00 2.83 2.15 -1.26 -4.95 116.67 118.85 3gnd s ASP 12 Ca 0.10 -1.96 0.14 0.00 0.43 0.00 0.00 52.55 51.26 3gnd s ASP 12 Cb -0.10 -1.54 0.54 0.00 -0.30 0.00 0.00 42.92 41.53 3gnd s ASP 12 CO 0.02 -0.35 1.39 0.49 -0.17 0.00 0.00 175.17 176.55 3gnd n PHE 13 N 4.34 0.24 -3.79 -5.34 3.72 -1.26 -4.94 117.46 110.43 3gnd n PHE 13 Ca 0.00 -0.12 -0.23 0.00 -0.05 0.00 0.00 57.45 57.05 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 0.10 -0.64 0.00 -1.08 0.63 -1.26 -4.76 116.66 109.65 3gnd n ARG 14 Ca 0.12 -0.11 0.12 0.00 -0.92 0.00 0.00 57.85 57.06 3gnd n ARG 14 Cb 0.23 -0.90 0.67 0.00 0.45 0.00 0.00 32.46 32.91 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 -2.87 0.11 1.31 5.15 -2.24 -1.26 -2.29 114.28 112.19 3gnd n THR 15 Ca -0.08 0.03 0.14 0.00 -2.27 0.00 0.00 64.05 61.86 3gnd n THR 15 Cb 0.31 -0.65 0.50 0.00 -2.10 0.00 0.00 70.33 68.40 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 -1.11 0.67 -3.78 3.42 5.68 -1.26 -4.68 116.55 115.49 3gnd n ASP 16 Ca 0.15 -0.64 -0.30 0.00 -0.50 0.00 0.00 54.79 53.50 3gnd n ASP 16 Cb 0.12 0.01 -0.14 0.00 -1.14 0.00 0.00 41.12 39.97 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 -2.53 1.04 0.54 0.11 0.74 -0.97 -5.11 119.66 113.48 3gnd s GLN 17 Ca 0.26 -1.53 -0.20 0.00 0.05 0.00 0.00 55.36 53.94 3gnd s GLN 17 Cb 0.20 -2.32 -0.05 0.00 1.10 0.00 0.00 33.01 31.93 3gnd s GLN 17 CO 0.50 -1.04 1.20 -2.14 -0.55 0.00 0.00 175.29 173.27 3gnd s PRO 18 N 1.07 3.27 0.24 1.67 0.02 -1.26 -4.97 135.00 135.04 3gnd s PRO 18 Ca 0.13 1.84 -0.30 0.00 0.02 0.00 0.00 61.00 62.68 3gnd s PRO 18 Cb -0.20 -2.12 -0.09 0.00 0.02 0.00 0.00 34.50 32.11 3gnd s PRO 18 CO -0.14 -0.97 1.31 -1.14 -0.33 0.00 0.00 177.00 175.74 3gnd s GLN 19 N -3.09 4.38 0.00 5.54 0.74 -1.26 -5.05 119.66 120.92 3gnd s GLN 19 Ca 0.72 2.10 0.05 0.00 0.05 0.00 0.00 55.36 58.28 3gnd s GLN 19 Cb -0.30 -3.16 -0.01 0.00 1.10 0.00 0.00 33.01 30.64 3gnd s GLN 19 CO 0.34 -0.23 -0.15 0.15 -0.55 0.00 0.00 175.29 174.85 3gnd s LYS 20 N -0.56 1.17 0.15 1.67 1.02 -1.26 -5.12 119.74 116.80 3gnd s LYS 20 Ca 0.55 -0.61 -0.30 0.00 0.02 0.00 0.00 55.97 55.63 3gnd s LYS 20 Cb -0.38 -1.15 -0.07 0.00 -0.52 0.00 0.00 37.83 35.71 3gnd s LYS 20 CO 0.42 0.31 1.16 -0.80 -0.92 0.00 0.00 175.35 175.52 3gnd s ASN 21 N -0.57 7.15 -0.24 2.83 0.01 -1.26 -5.02 114.94 117.85 3gnd s ASN 21 Ca 0.05 2.12 -0.28 0.00 -0.71 0.00 0.00 52.86 54.04 3gnd s ASN 21 Cb -0.06 -2.60 0.01 0.00 0.41 0.00 0.00 41.25 39.00 3gnd s ASN 21 CO -0.00 -0.34 0.98 -0.63 -1.51 0.00 0.00 177.10 175.60 3gnd s ILE 22 N 0.16 4.71 0.58 0.60 1.01 -1.26 -5.02 121.20 121.99 3gnd s ILE 22 Ca 0.53 1.87 -0.20 0.00 0.00 0.00 0.00 60.65 62.85 3gnd s ILE 22 Cb -0.30 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 37.86 3gnd s ILE 22 CO 0.34 -0.18 1.27 -2.84 0.00 0.00 0.00 174.94 173.53 3gnd s PRO 23 N 3.13 3.00 -0.30 2.79 0.02 -1.26 -5.01 135.00 137.37 3gnd s PRO 23 Ca 0.41 1.99 -0.09 0.00 0.02 0.00 0.00 61.00 63.34 3gnd s PRO 23 Cb -0.15 -2.05 -0.00 0.00 0.02 0.00 0.00 34.50 32.32 3gnd s PRO 23 CO 0.07 -1.23 0.13 0.12 -0.33 0.00 0.00 177.00 175.76 3gnd s PHE 24 N -1.46 3.16 -0.95 6.54 5.36 -1.26 -5.00 117.98 124.38 3gnd s PHE 24 Ca 0.76 -0.68 0.22 0.00 -0.96 0.00 0.00 56.93 56.27 3gnd s PHE 24 Cb -0.35 -2.32 -0.02 0.00 -0.34 0.00 0.00 43.02 39.99 3gnd s PHE 24 CO 0.39 -0.48 1.03 0.25 -1.46 0.00 0.00 175.22 174.95 3gnd n THR 25 N 4.95 0.01 -1.66 0.12 -2.24 -1.26 -4.51 114.28 109.68 3gnd n THR 25 Ca -0.14 -0.03 -0.49 0.00 -2.27 0.00 0.00 64.05 61.12 3gnd n THR 25 Cb 0.49 0.72 -0.05 0.00 -2.10 0.00 0.00 70.33 69.39 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 -1.55 2.85 -4.65 3.22 7.94 -1.26 -4.70 117.00 118.83 3gnd n LEU 26 Ca 0.04 1.06 -0.58 0.00 -1.11 0.00 0.00 56.01 55.41 3gnd n LEU 26 Cb 0.35 -1.34 -0.08 0.00 0.53 0.00 0.00 43.42 42.88 3gnd n LEU 26 CO 0.41 -0.38 1.39 1.17 -1.11 0.00 0.00 177.39 178.87 3gnd n LYS 27 N 4.33 0.91 -1.20 1.96 4.81 -1.26 -1.34 118.16 126.36 3gnd n LYS 27 Ca 0.20 0.32 -0.07 0.00 -0.87 0.00 0.00 58.31 57.89 3gnd n LYS 27 Cb 0.25 -2.02 -0.03 0.00 0.02 0.00 0.00 35.03 33.25 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 4.70 0.89 0.72 3.14 0.00 -1.25 -3.89 105.19 109.50 3gnd n GLY 28 Ca 0.31 -0.41 0.06 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.82 0.48 2.62 0.00 0.00 -1.26 -4.03 105.19 102.18 3gnd n GLY 30 Ca 0.16 -0.39 -0.07 0.00 0.00 0.00 0.00 46.02 45.72 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 0.43 3.31 -2.51 4.61 0.00 -1.26 -4.95 120.51 120.14 3gnd n ALA 31 Ca 0.13 -3.08 -0.27 0.00 0.00 0.00 0.00 53.44 50.23 3gnd n ALA 31 Cb 0.30 -0.74 -0.10 0.00 0.00 0.00 0.00 19.45 18.91 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 -3.70 2.76 0.93 0.00 1.43 -1.26 -5.12 118.68 113.72 3gnd s LEU 32 Ca 0.33 -0.70 -0.10 0.00 -1.03 0.00 0.00 54.13 52.63 3gnd s LEU 32 Cb 0.36 -1.46 0.15 0.00 0.03 0.00 0.00 46.19 45.26 3gnd s LEU 32 CO -0.02 0.11 1.09 -0.67 0.23 0.00 0.00 176.35 177.09 3gnd n ASP 33 N 0.10 0.10 -0.01 2.29 2.03 -1.26 -4.73 116.55 115.06 3gnd n ASP 33 Ca -0.11 0.40 -0.10 0.00 0.52 0.00 0.00 54.79 55.50 3gnd n ASP 33 Cb 0.56 -1.45 -0.03 0.00 -0.72 0.00 0.00 41.12 39.47 3gnd n ASP 33 CO 0.00 0.00 0.00 -0.25 -1.92 0.00 0.00 177.20 175.03 3gnd h TRP 34 N -1.91 -0.76 -0.38 -0.67 7.01 -2.00 -1.49 115.95 115.76 3gnd h TRP 34 Ca -0.44 0.04 0.08 0.00 2.11 0.00 0.00 58.89 60.68 3gnd h TRP 34 Cb 1.27 0.36 -0.08 0.00 -2.10 0.00 0.00 29.16 28.61 3gnd h TRP 34 CO 0.48 -0.36 -0.13 0.78 -2.79 0.00 0.00 178.44 176.43 3gnd h GLY 35 N -0.34 0.21 1.02 2.65 0.00 -1.92 0.30 103.07 105.00 3gnd h GLY 35 Ca 0.11 0.17 -0.07 0.00 0.00 0.00 0.00 47.33 47.53 3gnd h GLY 35 CO -0.35 -0.17 0.06 1.98 0.00 0.00 0.00 176.54 178.07 3gnd h MET 36 N -0.05 0.93 -0.50 4.80 1.85 -1.57 -0.70 114.93 119.69 3gnd h MET 36 Ca 0.19 -0.26 -0.00 0.00 -0.61 0.00 0.00 59.70 59.01 3gnd h MET 36 Cb 0.33 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.24 3gnd h MET 36 CO -0.42 0.91 0.29 1.96 -0.40 0.00 0.00 176.91 179.25 3gnd h GLN 37 N 0.81 0.67 0.01 0.39 4.20 -0.52 -0.98 115.11 119.70 3gnd h GLN 37 Ca 0.16 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.82 3gnd h GLN 37 Cb 0.45 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.09 3gnd h GLN 37 CO 0.02 0.48 -0.00 1.03 -0.67 0.00 0.00 178.83 179.68 3gnd h SER 38 N 0.68 -0.01 -0.82 1.46 0.87 0.31 0.01 113.55 116.05 3gnd h SER 38 Ca 0.18 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.67 3gnd h SER 38 Cb -0.01 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.92 3gnd h SER 38 CO -0.03 0.04 0.42 0.03 -0.53 0.00 0.00 176.83 176.76 3gnd h ARG 39 N -0.06 1.17 -0.35 2.24 3.08 -0.65 -1.80 114.38 118.00 3gnd h ARG 39 Ca -0.00 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 59.84 3gnd h ARG 39 Cb 0.06 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 3gnd h ARG 39 CO 0.00 0.88 0.00 -0.07 -1.07 0.00 0.00 179.97 179.71 3gnd h LEU 40 N 1.16 0.51 -1.07 3.04 3.38 -1.00 -1.59 115.31 119.73 3gnd h LEU 40 Ca 0.29 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3gnd h LEU 40 Cb 0.08 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3gnd h LEU 40 CO -0.04 0.58 0.00 0.28 0.09 0.00 0.00 178.44 179.35 3gnd h SER 41 N 0.52 0.00 0.91 -0.43 0.02 -0.16 0.21 113.55 114.62 3gnd h SER 41 Ca 0.11 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.93 3gnd h SER 41 Cb 0.34 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 3gnd h SER 41 CO 0.01 0.00 -0.61 0.03 -1.14 0.00 0.00 176.83 175.12 3gnd h ARG 42 N 0.00 0.00 0.00 3.45 3.08 -0.75 -3.36 114.38 116.80 3gnd h ARG 42 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 3gnd h ARG 42 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 3gnd h ARG 42 CO 0.00 0.61 -0.69 0.82 -1.07 0.00 0.00 179.97 179.64 3gnd h ILE 43 N 0.00 0.45 -3.55 2.04 2.04 -1.15 -3.45 117.51 113.89 3gnd h ILE 43 Ca -0.01 -1.51 -0.69 0.00 1.00 0.00 0.00 64.86 63.65 3gnd h ILE 43 Cb 1.23 1.02 -0.19 0.00 -0.74 0.00 0.00 36.82 38.14 3gnd h ILE 43 CO 0.08 0.15 -0.24 -0.36 0.00 0.00 0.00 178.15 177.78 3gnd s PHE 44 N -2.21 3.18 -0.33 1.37 0.08 0.62 -4.53 117.98 116.17 3gnd s PHE 44 Ca -0.18 -0.35 -0.40 0.00 0.12 0.00 0.00 56.93 56.12 3gnd s PHE 44 Cb 0.03 -2.83 -0.15 0.00 -0.57 0.00 0.00 43.02 39.50 3gnd s PHE 44 CO 0.36 -0.65 1.88 -1.71 -0.10 0.00 0.00 175.22 175.00 3gnd n ASN 45 N 5.52 2.11 -0.26 1.36 2.85 -0.62 -4.49 115.26 121.73 3gnd n ASN 45 Ca -0.08 0.89 0.15 0.00 -0.11 0.00 0.00 54.58 55.44 3gnd n ASN 45 Cb 0.48 -1.13 0.43 0.00 1.24 0.00 0.00 39.78 40.80 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 8.44 0.55 0.47 1.20 0.11 -1.90 1.59 132.00 142.46 3gnd h PRO 46 Ca -0.38 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.67 3gnd h PRO 46 Cb 1.33 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3gnd h PRO 46 CO 0.99 0.37 -0.22 0.87 -0.21 0.00 0.00 178.00 179.79 3gnd h LYS 47 N 0.57 -0.60 0.00 1.05 1.79 -1.98 -3.35 116.57 114.06 3gnd h LYS 47 Ca 0.46 0.04 -0.06 0.00 -2.18 0.00 0.00 60.65 58.91 3gnd h LYS 47 Cb 0.91 0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.69 3gnd h LYS 47 CO -0.21 -0.40 -0.51 1.79 -1.08 0.00 0.00 179.45 179.04 3gnd h THR 48 N -0.82 0.41 -0.10 -0.16 1.35 -1.88 -3.47 112.91 108.24 3gnd h THR 48 Ca -0.06 -1.61 -0.04 0.00 -0.55 0.00 0.00 66.41 64.14 3gnd h THR 48 Cb 0.48 2.10 -0.02 0.00 -1.73 0.00 0.00 68.15 68.99 3gnd h THR 48 CO 0.11 0.23 -0.04 0.61 -0.25 0.00 0.00 175.52 176.18 3gnd n GLY 49 N 1.20 0.54 3.51 5.82 0.00 0.54 -5.01 105.19 111.79 3gnd n GLY 49 Ca 0.01 -0.34 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.27 1.81 -0.11 1.61 1.02 -1.24 -4.77 119.74 116.79 3gnd s LYS 50 Ca 0.00 -2.06 -0.12 0.00 0.02 0.00 0.00 55.97 53.81 3gnd s LYS 50 Cb 0.00 -0.87 0.03 0.00 -0.52 0.00 0.00 37.83 36.47 3gnd s LYS 50 CO 0.00 -0.30 0.34 -0.08 -0.92 0.00 0.00 175.35 174.39 3gnd s THR 51 N -3.21 0.01 -0.35 2.17 -1.32 -0.74 -1.59 115.64 110.61 3gnd s THR 51 Ca 0.29 -0.08 -0.07 0.00 -1.21 0.00 0.00 61.69 60.63 3gnd s THR 51 Cb 0.06 -0.50 0.04 0.00 -1.51 0.00 0.00 72.50 70.59 3gnd s THR 51 CO 0.14 -0.04 0.13 -0.69 -2.21 0.00 0.00 174.62 171.95 3gnd s VAL 52 N -0.06 3.92 -0.19 5.08 1.01 -1.26 -1.91 120.40 126.98 3gnd s VAL 52 Ca -0.02 -1.14 -0.05 0.00 0.00 0.00 0.00 61.98 60.77 3gnd s VAL 52 Cb -0.03 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 3gnd s VAL 52 CO 0.01 -0.23 -0.01 -0.32 0.00 0.00 0.00 175.10 174.56 3gnd s MET 53 N 1.42 3.65 -0.41 2.72 1.75 0.00 -2.04 119.30 126.39 3gnd s MET 53 Ca -0.01 -0.51 -0.19 0.00 -1.25 0.00 0.00 55.69 53.73 3gnd s MET 53 Cb -0.20 -3.04 0.02 0.00 2.84 0.00 0.00 34.83 34.45 3gnd s MET 53 CO 0.03 0.09 0.58 -1.17 -0.65 0.00 0.00 175.02 173.89 3gnd s LEU 54 N 0.79 4.54 -0.23 4.11 2.96 -0.37 -1.38 118.68 129.11 3gnd s LEU 54 Ca 0.00 -0.34 -0.09 0.00 -0.22 0.00 0.00 54.13 53.49 3gnd s LEU 54 Cb -0.14 -2.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.87 3gnd s LEU 54 CO 0.02 -0.67 0.12 0.00 -1.32 0.00 0.00 176.35 174.49 3gnd s ALA 55 N 2.59 3.46 -0.28 5.97 0.00 0.11 -1.25 121.76 132.35 3gnd s ALA 55 Ca 0.20 -0.92 0.21 0.00 0.00 0.00 0.00 51.96 51.45 3gnd s ALA 55 Cb -0.15 -2.18 0.49 0.00 0.00 0.00 0.00 23.12 21.28 3gnd s ALA 55 CO 0.17 -0.18 1.06 1.97 0.00 0.00 0.00 175.76 178.78 3gnd n PHE 56 N 4.28 1.13 1.18 0.00 1.16 -0.36 -4.28 117.46 120.57 3gnd n PHE 56 Ca -0.16 -2.36 0.13 0.00 -1.87 0.00 0.00 57.45 53.19 3gnd n PHE 56 Cb 0.52 -0.23 0.24 0.00 -1.61 0.00 0.00 39.48 38.40 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 -0.43 2.10 -0.26 5.98 5.75 -1.23 -4.55 116.55 123.91 3gnd n ASP 57 Ca 0.07 -1.61 0.29 0.00 -0.01 0.00 0.00 54.79 53.53 3gnd n ASP 57 Cb 0.81 0.11 0.67 0.00 -1.03 0.00 0.00 41.12 41.68 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 3.10 0.19 0.00 2.11 3.86 -1.93 0.41 115.15 122.89 3gnd h HIS 58 Ca 0.00 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 3gnd h HIS 58 Cb 0.74 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.15 3gnd h HIS 58 CO 0.00 0.03 0.00 0.78 0.86 0.00 0.00 177.93 179.60 3gnd h GLY 59 N 0.12 0.00 2.00 2.45 0.00 -1.80 -2.81 103.07 103.02 3gnd h GLY 59 Ca 0.51 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.84 3gnd h GLY 59 CO -0.08 0.00 -0.02 0.10 0.00 0.00 0.00 176.54 176.54 3gnd h TYR 60 N 0.00 0.00 0.00 5.60 -0.00 -1.21 -1.46 116.97 119.90 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 0.01 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.74 3gnd h TYR 60 CO 0.00 0.02 0.00 1.97 -0.00 0.00 0.00 178.16 180.15 3gnd n PHE 61 N -3.47 0.00 0.41 0.10 1.16 -1.19 -4.71 117.46 109.76 3gnd n PHE 61 Ca -0.03 0.00 0.05 0.00 -1.87 0.00 0.00 57.45 55.60 3gnd n PHE 61 Cb 0.11 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.92 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 -0.08 3.25 0.00 3.97 6.02 -1.07 -2.23 117.38 127.25 3gnd n GLN 62 Ca 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 3gnd n GLN 62 Cb 0.13 -1.01 0.00 0.00 1.02 0.00 0.00 30.24 30.38 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 1.33 -0.41 3.58 1.08 0.00 -0.56 -4.39 105.19 105.80 3gnd n GLY 63 Ca 0.01 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 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 2.80 0.63 1.61 0.02 -1.26 -4.09 135.00 134.71 3gnd s PRO 64 Ca 0.00 -1.16 -0.17 0.00 0.02 0.00 0.00 61.00 59.70 3gnd s PRO 64 Cb 0.00 -5.27 -0.01 0.00 0.02 0.00 0.00 34.50 29.24 3gnd s PRO 64 CO 0.00 -3.52 1.14 -0.08 -0.33 0.00 0.00 177.00 174.22 3gnd s THR 65 N 9.46 2.99 0.08 0.99 -1.32 -1.26 -4.79 115.64 121.80 3gnd s THR 65 Ca 0.65 0.52 -0.34 0.00 -1.21 0.00 0.00 61.69 61.32 3gnd s THR 65 Cb -0.01 -3.09 -0.13 0.00 -1.51 0.00 0.00 72.50 67.76 3gnd s THR 65 CO 0.09 -0.23 1.69 0.41 -2.21 0.00 0.00 174.62 174.38 3gnd n THR 66 N -2.08 0.21 0.00 5.08 -1.04 -1.26 -1.28 114.28 113.90 3gnd n THR 66 Ca 0.12 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 3gnd n THR 66 Cb 0.51 -1.70 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 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 3.79 2.96 0.41 3.41 0.00 -1.26 -4.86 105.19 109.65 3gnd n GLY 67 Ca 0.19 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.28 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 2.84 -0.12 0.99 4.77 -0.41 -4.66 117.00 120.41 3gnd n LEU 68 Ca 0.00 -3.30 -0.09 0.00 -0.03 0.00 0.00 56.01 52.59 3gnd n LEU 68 Cb 0.00 -0.49 -0.01 0.00 -2.33 0.00 0.00 43.42 40.59 3gnd n LEU 68 CO 0.00 0.89 0.92 -0.33 -1.33 0.00 0.00 177.39 177.54 3gnd h GLU 69 N 0.59 0.55 -2.75 3.23 3.07 -1.86 -3.37 114.58 114.05 3gnd h GLU 69 Ca 0.02 -0.09 -0.61 0.00 -0.50 0.00 0.00 59.36 58.18 3gnd h GLU 69 Cb 1.13 -0.09 -0.41 0.00 -0.84 0.00 0.00 28.75 28.54 3gnd h GLU 69 CO 0.07 0.52 -0.69 0.54 -1.40 0.00 0.00 179.01 178.05 3gnd n ARG 70 N -4.68 1.53 -0.32 2.33 5.12 -1.26 -4.92 116.66 114.45 3gnd n ARG 70 Ca -0.01 -4.18 0.19 0.00 -1.93 0.00 0.00 57.85 51.93 3gnd n ARG 70 Cb 0.13 -2.10 0.45 0.00 -1.16 0.00 0.00 32.46 29.78 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 4.15 0.60 0.00 0.55 1.08 -1.89 0.78 117.51 122.78 3gnd h ILE 71 Ca 0.18 -0.17 -0.00 0.00 -0.39 0.00 0.00 64.86 64.48 3gnd h ILE 71 Cb 0.78 0.05 -0.00 0.00 -3.07 0.00 0.00 36.82 34.58 3gnd h ILE 71 CO 0.65 0.09 -0.00 -2.24 -0.69 0.00 0.00 178.15 175.96 3gnd h ASP 72 N 0.50 0.00 0.00 1.72 2.03 -1.91 -0.81 116.42 117.96 3gnd h ASP 72 Ca 0.57 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 56.76 3gnd h ASP 72 Cb 1.26 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.75 3gnd h ASP 72 CO -0.31 0.00 -1.09 -0.38 -1.03 0.00 0.00 179.24 176.44 3gnd n ILE 73 N -3.09 1.12 0.06 4.15 5.41 0.05 -4.40 119.36 122.66 3gnd n ILE 73 Ca 0.00 0.06 -0.21 0.00 1.00 0.00 0.00 62.75 63.61 3gnd n ILE 73 Cb 0.27 -1.86 -0.11 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 -0.52 0.88 0.64 4.38 4.21 -1.07 -3.36 115.58 120.74 3gnd h ASN 74 Ca -0.16 -0.75 -0.26 0.00 1.21 0.00 0.00 56.30 56.34 3gnd h ASN 74 Cb 0.87 -0.27 -0.04 0.00 -1.12 0.00 0.00 38.32 37.76 3gnd h ASN 74 CO -0.10 1.55 -1.50 0.40 -1.29 0.00 0.00 177.43 176.49 3gnd h ILE 75 N 0.34 1.04 -0.48 2.81 1.08 -1.52 -3.39 117.51 117.39 3gnd h ILE 75 Ca -0.15 -2.84 0.09 0.00 -0.39 0.00 0.00 64.86 61.58 3gnd h ILE 75 Cb 1.78 2.50 -0.10 0.00 -3.07 0.00 0.00 36.82 37.93 3gnd h ILE 75 CO 0.22 0.59 -0.30 0.00 -0.69 0.00 0.00 178.15 177.97 3gnd h ALA 76 N 1.03 -0.04 0.00 1.87 0.00 -1.31 0.13 119.26 120.93 3gnd h ALA 76 Ca -0.21 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3gnd h ALA 76 Cb 1.92 0.68 0.00 0.00 0.00 0.00 0.00 17.79 20.40 3gnd h ALA 76 CO 0.09 -0.66 0.00 -2.30 0.00 0.00 0.00 179.25 176.38 3gnd n PRO 77 N -5.42 0.05 0.06 0.00 -0.02 -1.26 -2.48 135.00 125.93 3gnd n PRO 77 Ca 0.03 0.30 0.08 0.00 -2.02 0.00 0.00 63.50 61.89 3gnd n PRO 77 Cb 0.34 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.27 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 -1.39 0.69 0.04 2.45 4.77 0.43 -4.54 117.00 119.46 3gnd n LEU 78 Ca 0.02 0.28 -0.14 0.00 -0.03 0.00 0.00 56.01 56.14 3gnd n LEU 78 Cb 0.07 -0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.07 3gnd n LEU 78 CO 0.06 -0.06 0.56 -0.26 -1.33 0.00 0.00 177.39 176.35 3gnd h PHE 79 N 0.00 -1.34 -0.70 -1.77 0.04 -1.48 -1.03 116.94 110.67 3gnd h PHE 79 Ca -0.05 0.05 0.20 0.00 2.80 0.00 0.00 57.97 60.97 3gnd h PHE 79 Cb 1.17 0.59 -0.03 0.00 2.20 0.00 0.00 35.95 39.88 3gnd h PHE 79 CO 0.00 -0.52 0.57 1.05 -0.60 0.00 0.00 178.31 178.80 3gnd h GLU 80 N -0.60 0.00 -0.17 1.51 4.11 -1.81 0.29 114.58 117.93 3gnd h GLU 80 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 3gnd h GLU 80 Cb 0.68 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3gnd h GLU 80 CO -0.35 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.45 3gnd n HIS 81 N -4.07 0.22 -4.31 2.06 8.25 -0.39 -4.85 115.22 112.14 3gnd n HIS 81 Ca 0.14 -0.11 -0.30 0.00 -0.26 0.00 0.00 57.72 57.19 3gnd n HIS 81 Cb 0.83 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.83 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 -1.78 2.90 0.03 -1.41 0.00 0.10 -4.89 121.76 116.71 3gnd s ALA 82 Ca 0.18 -1.22 -0.21 0.00 0.00 0.00 0.00 51.96 50.71 3gnd s ALA 82 Cb 0.09 -0.88 -0.16 0.00 0.00 0.00 0.00 23.12 22.17 3gnd s ALA 82 CO 0.13 0.63 1.31 -0.44 0.00 0.00 0.00 175.76 177.39 3gnd h ASP 83 N 3.82 0.36 -4.82 0.00 3.32 -1.70 -3.47 116.42 113.93 3gnd h ASP 83 Ca -0.49 -0.51 -0.15 0.00 0.02 0.00 0.00 57.03 55.91 3gnd h ASP 83 Cb 1.17 -0.10 -0.21 0.00 0.22 0.00 0.00 39.33 40.40 3gnd h ASP 83 CO 0.51 0.80 -0.47 0.54 -1.72 0.00 0.00 179.24 178.90 3gnd s VAL 84 N -4.19 0.07 -0.05 -1.35 0.11 -1.19 -4.16 120.40 109.63 3gnd s VAL 84 Ca -0.14 -0.57 -0.02 0.00 -2.93 0.00 0.00 61.98 58.31 3gnd s VAL 84 Cb 0.05 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 3gnd s VAL 84 CO 0.75 -0.32 0.08 -0.76 -3.33 0.00 0.00 175.10 171.52 3gnd s LEU 85 N -1.18 3.95 -0.12 2.54 1.43 0.25 -1.23 118.68 124.32 3gnd s LEU 85 Ca -0.13 0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.22 3gnd s LEU 85 Cb -0.06 -2.13 0.01 0.00 0.03 0.00 0.00 46.19 44.04 3gnd s LEU 85 CO 0.02 0.33 -0.17 -0.32 0.23 0.00 0.00 176.35 176.44 3gnd s MET 86 N -1.36 2.46 0.12 1.70 -2.45 -0.38 -0.50 119.30 118.88 3gnd s MET 86 Ca 0.19 -0.65 -0.24 0.00 -1.25 0.00 0.00 55.69 53.74 3gnd s MET 86 Cb -0.12 -2.06 0.08 0.00 1.25 0.00 0.00 34.83 33.99 3gnd s MET 86 CO 0.09 -0.06 1.13 0.00 1.05 0.00 0.00 175.02 177.23 3gnd s THR 88 N -2.04 3.63 0.35 0.00 -4.23 -1.26 -1.43 115.64 110.65 3gnd s THR 88 Ca 0.26 0.25 0.26 0.00 -1.18 0.00 0.00 61.69 61.27 3gnd s THR 88 Cb -0.02 -3.48 0.27 0.00 1.34 0.00 0.00 72.50 70.61 3gnd s THR 88 CO 0.03 -0.57 2.01 0.08 -0.54 0.00 0.00 174.62 175.64 3gnd h ARG 89 N -0.39 0.00 0.40 3.99 0.11 -1.97 -0.86 114.38 115.66 3gnd h ARG 89 Ca -0.45 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.61 3gnd h ARG 89 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 3gnd h ARG 89 CO 0.62 0.15 -0.19 0.78 0.10 0.00 0.00 179.97 181.43 3gnd h GLY 90 N 1.13 -0.56 0.99 0.08 0.00 -1.97 -2.19 103.07 100.56 3gnd h GLY 90 Ca -0.00 0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 3gnd h GLY 90 CO 0.02 -0.20 0.31 -2.22 0.00 0.00 0.00 176.54 174.45 3gnd h ILE 91 N -0.94 1.16 -0.21 2.60 1.08 -1.96 -2.30 117.51 116.94 3gnd h ILE 91 Ca -0.05 -0.37 0.05 0.00 -0.39 0.00 0.00 64.86 64.10 3gnd h ILE 91 Cb 0.55 0.46 -0.07 0.00 -3.07 0.00 0.00 36.82 34.69 3gnd h ILE 91 CO 0.09 0.17 -0.36 0.25 -0.69 0.00 0.00 178.15 177.61 3gnd h LEU 92 N 0.70 -1.15 -0.86 1.44 5.85 -1.15 -0.64 115.31 119.51 3gnd h LEU 92 Ca 0.19 0.17 -0.09 0.00 0.84 0.00 0.00 57.88 58.99 3gnd h LEU 92 Cb -0.00 0.49 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3gnd h LEU 92 CO -0.03 -0.37 -0.13 0.03 -0.34 0.00 0.00 178.44 177.59 3gnd h ARG 93 N -0.39 0.71 0.17 1.25 3.08 -1.36 -2.98 114.38 114.86 3gnd h ARG 93 Ca 0.11 -0.24 -0.29 0.00 0.07 0.00 0.00 59.98 59.64 3gnd h ARG 93 Cb 0.57 -0.06 0.02 0.00 0.08 0.00 0.00 29.97 30.58 3gnd h ARG 93 CO -0.43 0.81 -1.36 0.66 -1.07 0.00 0.00 179.97 178.58 3gnd h SER 94 N 0.64 0.56 0.00 7.04 4.64 -0.78 -3.42 113.55 122.23 3gnd h SER 94 Ca 0.11 -0.91 0.00 0.00 -0.47 0.00 0.00 61.79 60.51 3gnd h SER 94 Cb 0.59 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3gnd h SER 94 CO 0.04 1.63 0.00 1.33 -0.87 0.00 0.00 176.83 178.95 3gnd n VAL 95 N -3.85 0.00 -3.17 0.95 0.24 -0.31 -4.97 118.33 107.21 3gnd n VAL 95 Ca -0.20 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.34 61.52 3gnd n VAL 95 Cb 0.97 1.44 -0.07 0.00 -1.47 0.00 0.00 33.84 34.71 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 -0.11 4.92 0.18 3.34 1.01 -1.12 -4.78 120.40 123.84 3gnd s VAL 96 Ca 0.00 0.16 -0.31 0.00 0.00 0.00 0.00 61.98 61.83 3gnd s VAL 96 Cb 0.00 -4.11 -0.09 0.00 0.00 0.00 0.00 36.38 32.18 3gnd s VAL 96 CO 0.00 -0.44 1.44 -2.84 0.00 0.00 0.00 175.10 173.26 3gnd s PRO 97 N 2.60 4.29 0.54 2.72 0.02 -1.26 -4.72 135.00 139.19 3gnd s PRO 97 Ca 0.20 2.22 0.21 0.00 0.02 0.00 0.00 61.00 63.65 3gnd s PRO 97 Cb -0.15 -3.17 1.41 0.00 0.02 0.00 0.00 34.50 32.61 3gnd s PRO 97 CO 0.16 -0.45 2.14 -1.35 -0.33 0.00 0.00 177.00 177.17 3gnd h PRO 98 N 6.06 0.00 0.00 5.54 0.11 -1.96 0.56 132.00 142.30 3gnd h PRO 98 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 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 0.84 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.63 3gnd n ALA 99 N -2.50 1.93 0.28 -0.75 0.00 -1.26 -2.30 120.51 115.90 3gnd n ALA 99 Ca -0.01 -0.08 0.17 0.00 0.00 0.00 0.00 53.44 53.52 3gnd n ALA 99 Cb 0.19 -1.25 0.85 0.00 0.00 0.00 0.00 19.45 19.24 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 0.00 -6.94 0.00 2.02 -1.26 -3.45 112.91 103.28 3gnd h THR 100 Ca 0.00 -0.09 -0.59 0.00 0.77 0.00 0.00 66.41 66.50 3gnd h THR 100 Cb 0.09 0.88 -0.20 0.00 -1.74 0.00 0.00 68.15 67.17 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 -2.69 -0.17 -4.16 4.18 5.15 -0.97 -4.89 115.26 111.70 3gnd n ASN 101 Ca -0.01 -1.19 -0.24 0.00 -0.60 0.00 0.00 54.58 52.54 3gnd n ASN 101 Cb 0.11 -2.04 -0.15 0.00 -0.53 0.00 0.00 39.78 37.17 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 -7.13 1.29 0.37 1.20 6.06 -1.26 -5.13 118.95 114.34 3gnd s ARG 102 Ca 0.20 -0.65 -0.28 0.00 -2.50 0.00 0.00 55.73 52.51 3gnd s ARG 102 Cb -0.12 -1.27 -0.10 0.00 0.06 0.00 0.00 34.95 33.52 3gnd s ARG 102 CO 0.97 0.34 1.36 -2.14 -2.50 0.00 0.00 175.30 173.33 3gnd s PRO 103 N -0.57 4.17 0.14 5.12 0.02 -1.26 -4.80 135.00 137.82 3gnd s PRO 103 Ca 0.06 2.31 0.10 0.00 0.02 0.00 0.00 61.00 63.49 3gnd s PRO 103 Cb -0.07 -2.95 -0.04 0.00 0.02 0.00 0.00 34.50 31.46 3gnd s PRO 103 CO -0.00 -0.38 -0.23 0.14 -0.33 0.00 0.00 177.00 176.19 3gnd s VAL 104 N -1.17 2.48 -0.22 3.83 -7.23 -1.26 -0.58 120.40 116.26 3gnd s VAL 104 Ca 0.52 -1.73 0.02 0.00 -1.81 0.00 0.00 61.98 58.98 3gnd s VAL 104 Cb -0.41 -2.13 0.04 0.00 0.56 0.00 0.00 36.38 34.43 3gnd s VAL 104 CO 0.55 0.05 -0.16 -0.69 -0.31 0.00 0.00 175.10 174.54 3gnd s VAL 105 N -1.22 2.09 -0.06 1.32 1.01 0.35 -1.17 120.40 122.71 3gnd s VAL 105 Ca 0.17 -1.25 -0.25 0.00 0.00 0.00 0.00 61.98 60.66 3gnd s VAL 105 Cb -0.10 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 3gnd s VAL 105 CO 0.08 0.27 0.75 -0.76 0.00 0.00 0.00 175.10 175.44 3gnd s LEU 106 N 1.21 4.32 -0.03 3.92 1.43 -0.61 -2.75 118.68 126.18 3gnd s LEU 106 Ca -0.01 1.27 -0.30 0.00 -1.03 0.00 0.00 54.13 54.05 3gnd s LEU 106 Cb -0.16 -3.16 -0.06 0.00 0.03 0.00 0.00 46.19 42.83 3gnd s LEU 106 CO -0.09 -0.14 1.76 -0.60 0.23 0.00 0.00 176.35 177.50 3gnd s ARG 107 N 0.84 4.15 -0.18 1.70 6.06 -0.52 -0.65 118.95 130.35 3gnd s ARG 107 Ca 0.40 2.31 0.15 0.00 -2.50 0.00 0.00 55.73 56.09 3gnd s ARG 107 Cb -0.18 -4.05 0.39 0.00 0.06 0.00 0.00 34.95 31.17 3gnd s ARG 107 CO 0.20 -0.90 1.25 0.00 -2.50 0.00 0.00 175.30 173.34 3gnd n ALA 108 N 7.34 3.04 -2.23 6.12 0.00 0.14 -4.54 120.51 130.38 3gnd n ALA 108 Ca 0.18 -2.86 -0.13 0.00 0.00 0.00 0.00 53.44 50.63 3gnd n ALA 108 Cb 0.42 -0.46 -0.10 0.00 0.00 0.00 0.00 19.45 19.31 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 -2.83 1.30 0.00 0.00 1.04 -1.24 0.53 113.70 112.50 3gnd s SER 109 Ca 0.37 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.69 3gnd s SER 109 Cb 0.33 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.54 3gnd s SER 109 CO 0.00 -0.51 0.00 0.61 0.98 0.00 0.00 173.24 174.32 3gnd n GLY 110 N -0.19 -0.58 1.83 7.32 0.00 -0.54 -4.63 105.19 108.41 3gnd n GLY 110 Ca -0.08 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 0.00 -2.50 4.61 0.00 -1.26 0.04 120.51 121.40 3gnd n ALA 111 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 3gnd n ALA 111 Cb 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 19.45 19.33 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 -2.08 4.24 0.25 0.00 4.22 -1.24 -4.81 114.94 115.51 3gnd s ASN 112 Ca 0.00 -1.17 -0.14 0.00 -2.14 0.00 0.00 52.86 49.41 3gnd s ASN 112 Cb 0.00 -0.46 0.00 0.00 1.28 0.00 0.00 41.25 42.07 3gnd s ASN 112 CO 0.00 -0.50 0.51 -0.94 -2.04 0.00 0.00 177.10 174.13 3gnd s SER 113 N -3.83 -0.12 0.00 3.54 1.04 -1.26 -4.52 113.70 108.55 3gnd s SER 113 Ca 0.39 -0.86 0.20 0.00 0.48 0.00 0.00 55.95 56.15 3gnd s SER 113 Cb 0.06 0.60 0.90 0.00 0.10 0.00 0.00 66.02 67.68 3gnd s SER 113 CO 0.21 -1.15 1.62 2.30 0.98 0.00 0.00 173.24 177.19 3gnd n ILE 114 N -0.38 0.55 1.43 -1.02 -5.35 -0.94 -2.38 119.36 111.26 3gnd n ILE 114 Ca -0.03 0.14 0.14 0.00 -0.27 0.00 0.00 62.75 62.73 3gnd n ILE 114 Cb 0.62 -0.81 0.53 0.00 -1.74 0.00 0.00 39.64 38.24 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 -1.40 0.95 0.00 7.28 4.77 -1.26 -4.97 117.00 122.36 3gnd n LEU 115 Ca 0.07 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 3gnd n LEU 115 Cb 0.19 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3gnd n LEU 115 CO 0.17 0.17 0.00 0.00 -1.33 0.00 0.00 177.39 176.39 3gnd n ALA 116 N -0.50 0.00 -2.14 -1.18 0.00 -1.00 -5.10 120.51 110.60 3gnd n ALA 116 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.18 3gnd n ALA 116 Cb 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.74 3gnd n ALA 116 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3gnd s GLU 117 N 0.42 4.24 0.31 0.00 2.56 -1.26 -4.78 118.70 120.18 3gnd s GLU 117 Ca 0.00 2.05 0.01 0.00 0.00 0.00 0.00 54.97 57.03 3gnd s GLU 117 Cb 0.00 -3.70 0.49 0.00 2.00 0.00 0.00 34.13 32.92 3gnd s GLU 117 CO 0.00 -0.68 1.87 1.25 -0.56 0.00 0.00 175.26 177.14 3gnd h LEU 118 N 8.99 0.69 -0.10 2.70 5.85 -1.97 -2.54 115.31 128.94 3gnd h LEU 118 Ca -0.38 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.24 3gnd h LEU 118 Cb 1.17 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.02 3gnd h LEU 118 CO 0.93 0.67 0.00 -1.54 -0.34 0.00 0.00 178.44 178.16 3gnd n SER 119 N -4.31 0.14 -3.89 1.25 3.41 -1.26 -4.55 113.62 104.42 3gnd n SER 119 Ca 0.04 -1.50 -0.42 0.00 -0.26 0.00 0.00 58.87 56.72 3gnd n SER 119 Cb 0.20 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 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 -0.66 4.83 -4.75 4.04 5.15 -0.96 -4.47 115.26 118.43 3gnd n ASN 120 Ca 0.13 -3.04 -0.32 0.00 -0.60 0.00 0.00 54.58 50.75 3gnd n ASN 120 Cb 0.08 -1.53 -0.07 0.00 -0.53 0.00 0.00 39.78 37.73 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 1.16 2.89 0.37 1.20 2.02 -1.26 -3.71 118.70 121.36 3gnd s GLU 121 Ca 0.42 -0.63 0.09 0.00 0.02 0.00 0.00 54.97 54.87 3gnd s GLU 121 Cb 0.10 -2.74 -0.07 0.00 0.10 0.00 0.00 34.13 31.52 3gnd s GLU 121 CO -0.01 0.60 -0.06 0.00 0.02 0.00 0.00 175.26 175.81 3gnd s ALA 122 N -1.26 3.03 0.21 5.21 0.00 0.11 -4.71 121.76 124.35 3gnd s ALA 122 Ca 0.25 -2.17 -0.30 0.00 0.00 0.00 0.00 51.96 49.73 3gnd s ALA 122 Cb -0.12 0.04 -0.10 0.00 0.00 0.00 0.00 23.12 22.94 3gnd s ALA 122 CO 0.17 0.00 1.46 0.08 0.00 0.00 0.00 175.76 177.47 3gnd s VAL 123 N -2.66 2.72 -1.02 0.00 1.01 -1.26 -1.46 120.40 117.73 3gnd s VAL 123 Ca 0.33 0.57 0.15 0.00 0.00 0.00 0.00 61.98 63.03 3gnd s VAL 123 Cb 0.05 -3.37 -0.08 0.00 0.00 0.00 0.00 36.38 32.98 3gnd s VAL 123 CO 0.17 0.08 0.71 0.00 0.00 0.00 0.00 175.10 176.05 3gnd n ALA 124 N 2.89 3.51 -3.48 5.51 0.00 0.19 -4.80 120.51 124.33 3gnd n ALA 124 Ca 0.09 -0.46 -0.14 0.00 0.00 0.00 0.00 53.44 52.93 3gnd n ALA 124 Cb 0.40 -0.53 -0.08 0.00 0.00 0.00 0.00 19.45 19.24 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 -2.33 -0.20 0.54 0.00 0.05 -1.25 -4.89 118.68 110.60 3gnd s LEU 125 Ca 0.09 1.15 -0.21 0.00 0.05 0.00 0.00 54.13 55.21 3gnd s LEU 125 Cb 0.11 1.98 -0.05 0.00 -2.05 0.00 0.00 46.19 46.18 3gnd s LEU 125 CO 0.49 -0.21 1.22 -0.94 -0.55 0.00 0.00 176.35 176.36 3gnd s SER 126 N 0.28 5.54 0.39 1.48 1.04 -1.26 -4.90 113.70 116.27 3gnd s SER 126 Ca -0.00 2.42 0.09 0.00 0.48 0.00 0.00 55.95 58.93 3gnd s SER 126 Cb -0.04 -2.61 0.86 0.00 0.10 0.00 0.00 66.02 64.34 3gnd s SER 126 CO 0.01 -1.35 1.98 -0.03 0.98 0.00 0.00 173.24 174.83 3gnd h MET 127 N 1.37 0.58 -0.44 4.02 4.05 -1.98 -1.62 114.93 120.90 3gnd h MET 127 Ca -0.50 -0.04 0.08 0.00 -0.28 0.00 0.00 59.70 58.96 3gnd h MET 127 Cb 1.28 -0.13 -0.10 0.00 -0.80 0.00 0.00 31.60 31.85 3gnd h MET 127 CO 0.57 0.39 -0.38 0.22 0.23 0.00 0.00 176.91 177.94 3gnd h ASP 128 N 0.60 -1.28 0.65 1.39 3.58 -1.98 -0.71 116.42 118.67 3gnd h ASP 128 Ca 0.27 0.21 -0.07 0.00 0.42 0.00 0.00 57.03 57.87 3gnd h ASP 128 Cb 0.31 0.58 -0.01 0.00 1.72 0.00 0.00 39.33 41.93 3gnd h ASP 128 CO -0.08 -0.34 -0.31 -0.78 -2.88 0.00 0.00 179.24 174.84 3gnd h ASP 129 N -0.27 0.00 -0.41 2.28 3.58 -1.68 -2.02 116.42 117.90 3gnd h ASP 129 Ca 0.17 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.53 3gnd h ASP 129 Cb 0.56 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 3gnd h ASP 129 CO -0.59 0.31 -0.09 0.00 -2.88 0.00 0.00 179.24 176.00 3gnd h ALA 130 N 1.69 0.56 -0.56 -0.78 0.00 -0.72 -1.44 119.26 118.01 3gnd h ALA 130 Ca -0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 3gnd h ALA 130 Cb 0.72 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3gnd h ALA 130 CO 0.04 0.43 0.21 0.28 0.00 0.00 0.00 179.25 180.21 3gnd h VAL 131 N 0.60 1.23 -0.71 0.00 2.07 -1.08 -1.93 116.25 116.43 3gnd h VAL 131 Ca 0.10 -0.73 0.15 0.00 0.82 0.00 0.00 66.70 67.04 3gnd h VAL 131 Cb 0.61 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 3gnd h VAL 131 CO 0.04 0.28 0.48 -0.09 0.02 0.00 0.00 177.57 178.30 3gnd h ARG 132 N 0.78 0.31 -0.38 1.57 2.43 -1.04 -1.16 114.38 116.90 3gnd h ARG 132 Ca 0.19 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3gnd h ARG 132 Cb 0.23 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3gnd h ARG 132 CO -0.01 0.21 0.00 1.28 -1.51 0.00 0.00 179.97 179.93 3gnd n LEU 133 N -4.45 2.60 -3.31 3.80 4.77 -0.57 -4.94 117.00 114.89 3gnd n LEU 133 Ca 0.13 -1.20 -0.24 0.00 -0.03 0.00 0.00 56.01 54.68 3gnd n LEU 133 Cb 0.55 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.43 3gnd n LEU 133 CO 0.34 0.60 0.08 -3.20 -1.33 0.00 0.00 177.39 173.88 3gnd n ASN 134 N 0.92 -5.86 -4.72 -1.43 5.15 -0.44 -4.96 115.26 103.93 3gnd n ASN 134 Ca 0.17 -0.42 -0.33 0.00 -0.60 0.00 0.00 54.58 53.40 3gnd n ASN 134 Cb 0.45 -4.69 0.10 0.00 -0.53 0.00 0.00 39.78 35.10 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 -2.94 4.10 0.13 1.20 0.01 -0.96 -4.76 113.70 110.48 3gnd s SER 135 Ca 0.43 2.27 0.21 0.00 1.31 0.00 0.00 55.95 60.17 3gnd s SER 135 Cb -0.20 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.38 3gnd s SER 135 CO 0.53 -2.32 0.91 0.00 0.41 0.00 0.00 173.24 172.78 3gnd s ALA 137 N -3.24 -1.70 0.09 0.00 0.00 -1.23 -4.23 121.76 111.46 3gnd s ALA 137 Ca -0.02 0.63 0.10 0.00 0.00 0.00 0.00 51.96 52.67 3gnd s ALA 137 Cb 0.10 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 3gnd s ALA 137 CO 0.81 -0.80 -0.24 0.14 0.00 0.00 0.00 175.76 175.68 3gnd s VAL 138 N -3.36 2.43 0.01 0.00 -7.23 -0.91 -1.57 120.40 109.77 3gnd s VAL 138 Ca 0.06 -1.52 0.04 0.00 -1.81 0.00 0.00 61.98 58.75 3gnd s VAL 138 Cb -0.01 -2.05 -0.01 0.00 0.56 0.00 0.00 36.38 34.87 3gnd s VAL 138 CO -0.07 0.20 -0.14 0.00 -0.31 0.00 0.00 175.10 174.79 3gnd s ALA 139 N -0.99 1.15 0.06 1.32 0.00 0.18 -0.05 121.76 123.44 3gnd s ALA 139 Ca 0.14 -0.68 -0.09 0.00 0.00 0.00 0.00 51.96 51.33 3gnd s ALA 139 Cb -0.10 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.77 3gnd s ALA 139 CO 0.06 0.26 0.20 0.00 0.00 0.00 0.00 175.76 176.28 3gnd s ALA 140 N -0.52 -0.33 0.17 0.00 0.00 -0.77 0.25 121.76 120.56 3gnd s ALA 140 Ca 0.04 -0.42 -0.19 0.00 0.00 0.00 0.00 51.96 51.39 3gnd s ALA 140 Cb -0.06 0.39 -0.08 0.00 0.00 0.00 0.00 23.12 23.37 3gnd s ALA 140 CO 0.00 -0.44 0.66 -0.65 0.00 0.00 0.00 175.76 175.34 3gnd s GLN 141 N -3.19 4.23 -0.10 0.00 -1.52 -1.26 -1.39 119.66 116.43 3gnd s GLN 141 Ca -0.00 0.80 0.03 0.00 -1.95 0.00 0.00 55.36 54.23 3gnd s GLN 141 Cb 0.02 -3.01 -0.01 0.00 -0.22 0.00 0.00 33.01 29.78 3gnd s GLN 141 CO -0.07 0.49 -0.18 0.54 -0.25 0.00 0.00 175.29 175.81 3gnd s VAL 142 N -1.38 2.61 -0.69 1.09 0.11 0.71 -4.77 120.40 118.09 3gnd s VAL 142 Ca 0.38 -0.84 0.05 0.00 -2.93 0.00 0.00 61.98 58.64 3gnd s VAL 142 Cb -0.18 -2.04 0.27 0.00 -1.53 0.00 0.00 36.38 32.91 3gnd s VAL 142 CO 0.21 0.55 0.89 -1.22 -3.33 0.00 0.00 175.10 172.20 3gnd n TYR 143 N 3.25 3.55 -1.87 1.54 4.01 -1.26 -1.30 117.16 125.07 3gnd n TYR 143 Ca -0.18 -3.92 -0.42 0.00 -0.16 0.00 0.00 57.90 53.22 3gnd n TYR 143 Cb 0.53 -0.64 -0.03 0.00 -0.31 0.00 0.00 39.34 38.89 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 -2.87 2.43 0.00 -0.72 -1.09 -1.26 -1.55 121.20 116.13 3gnd s ILE 144 Ca 0.40 0.31 0.00 0.00 -2.23 0.00 0.00 60.65 59.13 3gnd s ILE 144 Cb 0.16 -3.20 0.00 0.00 -1.58 0.00 0.00 42.46 37.84 3gnd s ILE 144 CO -0.02 0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.33 3gnd n GLY 145 N 3.69 2.32 3.99 6.18 0.00 -1.26 -4.97 105.19 115.14 3gnd n GLY 145 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.97 4.16 0.22 1.61 0.01 -0.60 -4.99 113.70 112.13 3gnd s SER 146 Ca 0.00 -0.34 -0.04 0.00 1.31 0.00 0.00 55.95 56.88 3gnd s SER 146 Cb 0.00 0.03 0.19 0.00 0.21 0.00 0.00 66.02 66.46 3gnd s SER 146 CO 0.00 -2.00 1.64 -0.08 0.41 0.00 0.00 173.24 173.21 3gnd h GLU 147 N -0.67 0.79 -0.95 12.44 4.81 -1.94 -2.98 114.58 126.08 3gnd h GLU 147 Ca -0.37 -0.30 -0.63 0.00 -0.13 0.00 0.00 59.36 57.93 3gnd h GLU 147 Cb 1.26 -0.04 -0.30 0.00 0.63 0.00 0.00 28.75 30.29 3gnd h GLU 147 CO 0.39 0.92 0.60 0.66 -0.73 0.00 0.00 179.01 180.85 3gnd n TYR 148 N -4.12 3.08 0.04 0.92 4.01 -1.26 -4.68 117.16 115.15 3gnd n TYR 148 Ca 0.00 -2.75 -0.11 0.00 -0.16 0.00 0.00 57.90 54.88 3gnd n TYR 148 Cb 0.42 -1.22 -0.06 0.00 -0.31 0.00 0.00 39.34 38.17 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 -0.09 -0.56 -0.72 4.81 -1.66 -1.64 114.58 116.60 3gnd h GLU 149 Ca 0.57 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.91 3gnd h GLU 149 Cb 1.17 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 30.49 3gnd h GLU 149 CO 1.39 -0.06 0.11 1.25 -0.73 0.00 0.00 179.01 180.98 3gnd h HIS 150 N -0.09 0.18 -0.42 0.92 2.76 -1.87 -1.64 115.15 114.98 3gnd h HIS 150 Ca 0.02 0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.13 3gnd h HIS 150 Cb 0.12 0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 3gnd h HIS 150 CO -0.12 -0.02 -0.11 0.37 -1.30 0.00 0.00 177.93 176.74 3gnd h GLN 151 N 0.25 0.82 -0.72 5.26 5.75 -1.87 -2.18 115.11 122.42 3gnd h GLN 151 Ca 0.29 -0.32 0.02 0.00 -0.15 0.00 0.00 58.65 58.49 3gnd h GLN 151 Cb 0.41 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.88 3gnd h GLN 151 CO -0.37 0.95 0.48 0.66 -2.65 0.00 0.00 178.83 177.89 3gnd h SER 152 N 0.65 0.79 -0.04 -0.69 4.64 -0.54 -0.36 113.55 117.99 3gnd h SER 152 Ca 0.11 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.26 3gnd h SER 152 Cb 0.65 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 3gnd h SER 152 CO 0.04 0.55 -0.50 0.40 -0.87 0.00 0.00 176.83 176.46 3gnd h ILE 153 N 0.92 1.31 -0.30 0.95 2.04 -0.97 -2.55 117.51 118.90 3gnd h ILE 153 Ca 0.28 -1.71 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 3gnd h ILE 153 Cb -0.01 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 3gnd h ILE 153 CO -0.07 0.54 0.12 0.11 0.00 0.00 0.00 178.15 178.85 3gnd h LYS 154 N 0.48 0.42 -0.65 2.37 1.57 -0.66 -0.43 116.57 119.66 3gnd h LYS 154 Ca 0.02 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3gnd h LYS 154 Cb 1.04 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.23 3gnd h LYS 154 CO 0.10 0.34 0.34 -0.91 -0.57 0.00 0.00 179.45 178.75 3gnd h ASN 155 N 0.42 0.83 -0.29 0.86 2.35 -0.69 0.52 115.58 119.58 3gnd h ASN 155 Ca 0.11 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3gnd h ASN 155 Cb 0.08 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.23 3gnd h ASN 155 CO -0.01 0.70 0.16 0.40 -1.65 0.00 0.00 177.43 177.03 3gnd h ILE 156 N 0.89 1.12 -0.83 2.81 1.08 -1.05 -1.77 117.51 119.76 3gnd h ILE 156 Ca 0.23 -0.31 0.05 0.00 -0.39 0.00 0.00 64.86 64.44 3gnd h ILE 156 Cb 0.07 0.80 -0.06 0.00 -3.07 0.00 0.00 36.82 34.56 3gnd h ILE 156 CO -0.03 0.12 0.52 0.40 -0.69 0.00 0.00 178.15 178.46 3gnd h ILE 157 N 0.35 1.07 -0.30 -0.67 2.04 -0.70 -0.61 117.51 118.70 3gnd h ILE 157 Ca 0.10 -0.33 -0.05 0.00 1.00 0.00 0.00 64.86 65.58 3gnd h ILE 157 Cb 0.05 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 3gnd h ILE 157 CO -0.02 0.18 0.00 -0.61 0.00 0.00 0.00 178.15 177.70 3gnd h GLN 158 N 0.97 0.52 -0.72 2.37 4.15 -0.72 -0.97 115.11 120.71 3gnd h GLN 158 Ca 0.35 -0.16 -0.05 0.00 0.77 0.00 0.00 58.65 59.55 3gnd h GLN 158 Cb 0.10 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.71 3gnd h GLN 158 CO -0.15 0.66 0.24 -0.07 -1.93 0.00 0.00 178.83 177.58 3gnd h LEU 159 N 0.31 1.02 -0.22 -2.39 3.38 -0.88 -1.65 115.31 114.89 3gnd h LEU 159 Ca 0.08 -0.18 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 3gnd h LEU 159 Cb 0.42 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3gnd h LEU 159 CO 0.01 0.94 -0.16 0.58 0.09 0.00 0.00 178.44 179.90 3gnd h VAL 160 N 1.06 1.32 -0.64 1.22 2.07 -0.93 0.36 116.25 120.70 3gnd h VAL 160 Ca 0.24 -1.28 0.11 0.00 0.82 0.00 0.00 66.70 66.59 3gnd h VAL 160 Cb 0.27 1.68 -0.08 0.00 -1.52 0.00 0.00 31.29 31.64 3gnd h VAL 160 CO -0.01 0.39 0.20 0.44 0.02 0.00 0.00 177.57 178.61 3gnd h ASP 161 N 0.18 0.14 -0.05 0.57 3.32 -1.04 -0.41 116.42 119.13 3gnd h ASP 161 Ca 0.04 0.10 -0.24 0.00 0.02 0.00 0.00 57.03 56.95 3gnd h ASP 161 Cb 0.68 0.11 0.01 0.00 0.22 0.00 0.00 39.33 40.35 3gnd h ASP 161 CO 0.04 0.07 -0.91 0.00 -1.72 0.00 0.00 179.24 176.72 3gnd h ALA 162 N 1.48 0.23 -0.02 3.45 0.00 -0.99 -3.23 119.26 120.19 3gnd h ALA 162 Ca 0.34 -0.65 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 3gnd h ALA 162 Cb 0.48 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3gnd h ALA 162 CO -0.37 0.69 -0.36 0.78 0.00 0.00 0.00 179.25 179.99 3gnd h GLY 163 N 0.53 0.04 2.00 0.00 0.00 0.27 -2.85 103.07 103.05 3gnd h GLY 163 Ca -0.09 -0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 3gnd h GLY 163 CO 0.18 0.03 -0.25 -0.33 0.00 0.00 0.00 176.54 176.17 3gnd h MET 164 N 0.03 0.00 0.00 4.80 2.07 -1.11 0.56 114.93 121.29 3gnd h MET 164 Ca 0.00 0.00 -0.01 0.00 -2.07 0.00 0.00 59.70 57.62 3gnd h MET 164 Cb 0.66 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.39 3gnd h MET 164 CO 0.05 0.25 -0.06 0.87 1.07 0.00 0.00 176.91 179.09 3gnd h LYS 165 N 0.00 0.00 0.00 1.72 1.57 -1.59 -3.33 116.57 114.94 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 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3gnd h LYS 165 CO 0.03 0.06 0.00 0.28 -0.57 0.00 0.00 179.45 179.25 3gnd n VAL 166 N -3.17 0.00 -1.75 0.50 0.31 -0.65 -5.01 118.33 108.56 3gnd n VAL 166 Ca 0.01 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 3gnd n VAL 166 Cb 0.37 1.01 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 0.74 0.48 3.54 2.92 0.00 0.18 -4.93 105.19 108.12 3gnd n GLY 167 Ca 0.00 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.77 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 -3.57 3.58 0.50 1.61 0.00 -0.31 -3.85 119.30 117.27 3gnd s MET 168 Ca 0.00 -0.56 -0.23 0.00 0.00 0.00 0.00 55.69 54.90 3gnd s MET 168 Cb 0.00 -3.78 -0.06 0.00 0.00 0.00 0.00 34.83 30.99 3gnd s MET 168 CO 0.00 -0.41 1.30 -2.14 0.00 0.00 0.00 175.02 173.77 3gnd s PRO 169 N 1.76 3.42 -0.09 4.11 0.02 -1.26 -4.38 135.00 138.59 3gnd s PRO 169 Ca 0.07 2.10 0.00 0.00 0.02 0.00 0.00 61.00 63.19 3gnd s PRO 169 Cb -0.17 -2.36 -0.03 0.00 0.02 0.00 0.00 34.50 31.96 3gnd s PRO 169 CO 0.11 -0.92 -0.08 0.99 -0.33 0.00 0.00 177.00 176.77 3gnd s THR 170 N -1.37 3.57 -0.21 0.99 2.01 -1.26 -2.14 115.64 117.23 3gnd s THR 170 Ca 0.67 -0.51 -0.03 0.00 0.31 0.00 0.00 61.69 62.12 3gnd s THR 170 Cb -0.37 -2.47 -0.01 0.00 0.01 0.00 0.00 72.50 69.66 3gnd s THR 170 CO 0.44 0.57 -0.05 -0.32 -0.69 0.00 0.00 174.62 174.57 3gnd s MET 171 N -0.47 3.37 -0.19 4.92 1.75 0.93 -1.31 119.30 128.31 3gnd s MET 171 Ca 0.07 -0.63 -0.09 0.00 -1.25 0.00 0.00 55.69 53.78 3gnd s MET 171 Cb -0.12 -2.97 -0.05 0.00 2.84 0.00 0.00 34.83 34.53 3gnd s MET 171 CO 0.02 -0.17 0.11 0.00 -0.65 0.00 0.00 175.02 174.34 3gnd s ALA 172 N 1.39 3.61 -0.18 4.11 0.00 0.10 -1.84 121.76 128.95 3gnd s ALA 172 Ca 0.05 -0.70 -0.02 0.00 0.00 0.00 0.00 51.96 51.28 3gnd s ALA 172 Cb -0.14 -2.10 -0.01 0.00 0.00 0.00 0.00 23.12 20.87 3gnd s ALA 172 CO -0.03 0.17 -0.08 0.08 0.00 0.00 0.00 175.76 175.91 3gnd s VAL 173 N 0.34 3.27 -0.85 0.00 1.01 -0.48 -1.11 120.40 122.57 3gnd s VAL 173 Ca 0.07 -0.55 -0.23 0.00 0.00 0.00 0.00 61.98 61.26 3gnd s VAL 173 Cb -0.11 -2.44 0.06 0.00 0.00 0.00 0.00 36.38 33.89 3gnd s VAL 173 CO -0.01 0.47 1.23 0.42 0.00 0.00 0.00 175.10 177.21 3gnd s THR 174 N 0.97 4.11 0.20 3.92 -4.23 -0.17 -0.21 115.64 120.24 3gnd s THR 174 Ca -0.01 -0.52 -0.19 0.00 -1.18 0.00 0.00 61.69 59.80 3gnd s THR 174 Cb -0.15 -4.89 -0.08 0.00 1.34 0.00 0.00 72.50 68.73 3gnd s THR 174 CO -0.00 -1.73 0.69 -0.83 -0.54 0.00 0.00 174.62 172.21 3gnd s GLY 175 N 4.10 2.59 0.00 3.99 0.00 -0.42 -4.80 107.32 112.78 3gnd s GLY 175 Ca 0.35 0.11 0.00 0.00 0.00 0.00 0.00 44.72 45.18 3gnd s GLY 175 CO 0.01 0.46 0.00 -0.62 0.00 0.00 0.00 173.10 172.95 3gnd n VAL 176 N 0.78 0.00 -0.97 1.40 0.31 -1.26 -4.37 118.33 114.22 3gnd n VAL 176 Ca -0.03 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.92 3gnd n VAL 176 Cb 0.51 -0.56 -0.05 0.00 -0.91 0.00 0.00 33.84 32.83 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 -0.23 0.00 -3.61 2.52 3.14 -1.26 -5.05 118.33 113.84 3gnd n VAL 181 Ca 0.00 0.00 -0.36 0.00 -2.96 0.00 0.00 64.34 61.02 3gnd n VAL 181 Cb 0.00 -0.06 -0.06 0.00 -1.06 0.00 0.00 33.84 32.66 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 1.25 2.72 -3.76 1.45 1.74 -1.26 -4.93 116.66 113.87 3gnd n ARG 182 Ca 0.14 -4.49 -0.26 0.00 -0.77 0.00 0.00 57.85 52.48 3gnd n ARG 182 Cb 0.03 -2.42 0.01 0.00 -1.02 0.00 0.00 32.46 29.07 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 -0.20 4.68 0.13 0.55 -4.77 -1.26 -4.94 116.67 110.86 3gnd s ASP 183 Ca 0.28 -1.23 -0.18 0.00 -3.30 0.00 0.00 52.55 48.13 3gnd s ASP 183 Cb -0.06 0.51 -0.03 0.00 -1.09 0.00 0.00 42.92 42.24 3gnd s ASP 183 CO -0.12 -1.20 1.75 -0.61 0.70 0.00 0.00 175.17 175.69 3gnd h GLN 184 N 0.61 0.43 -0.35 2.11 -0.00 -1.92 -2.70 115.11 113.29 3gnd h GLN 184 Ca -0.35 -0.04 -0.03 0.00 -0.00 0.00 0.00 58.65 58.23 3gnd h GLN 184 Cb 1.30 -0.09 -0.02 0.00 0.00 0.00 0.00 27.48 28.68 3gnd h GLN 184 CO 0.54 0.34 0.10 0.07 0.00 0.00 0.00 178.83 179.89 3gnd h ARG 185 N 0.39 0.50 0.34 1.69 0.11 -1.95 0.19 114.38 115.64 3gnd h ARG 185 Ca 0.11 -0.07 -0.02 0.00 0.10 0.00 0.00 59.98 60.10 3gnd h ARG 185 Cb 0.03 -0.09 0.00 0.00 1.11 0.00 0.00 29.97 31.03 3gnd h ARG 185 CO -0.02 0.45 -0.16 -0.92 0.10 0.00 0.00 179.97 179.41 3gnd h TYR 186 N 0.49 -0.42 0.00 4.08 3.20 -1.89 -2.71 116.97 119.72 3gnd h TYR 186 Ca 0.12 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 3gnd h TYR 186 Cb 0.16 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 3gnd h TYR 186 CO 0.01 -0.09 -0.20 0.74 -1.64 0.00 0.00 178.16 176.98 3gnd h PHE 187 N -0.80 0.00 0.14 -3.82 0.04 -1.20 -1.40 116.94 109.90 3gnd h PHE 187 Ca -0.05 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.73 3gnd h PHE 187 Cb 0.52 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.66 3gnd h PHE 187 CO 0.02 0.20 -0.14 0.77 -0.60 0.00 0.00 178.31 178.56 3gnd h SER 188 N 0.00 -0.36 -0.16 2.17 0.02 -0.98 0.94 113.55 115.19 3gnd h SER 188 Ca -0.00 0.03 0.05 0.00 -0.84 0.00 0.00 61.79 61.03 3gnd h SER 188 Cb 0.38 0.12 -0.06 0.00 0.14 0.00 0.00 62.40 62.98 3gnd h SER 188 CO 0.03 -0.21 -0.31 0.25 -1.14 0.00 0.00 176.83 175.45 3gnd h LEU 189 N -0.30 -0.96 -0.18 5.07 5.85 -1.06 -1.04 115.31 122.69 3gnd h LEU 189 Ca 0.00 0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 3gnd h LEU 189 Cb 0.29 0.42 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3gnd h LEU 189 CO -0.03 -0.34 0.04 0.00 -0.34 0.00 0.00 178.44 177.77 3gnd h ALA 190 N 0.49 0.24 -0.34 1.25 0.00 -1.10 -2.14 119.26 117.66 3gnd h ALA 190 Ca 0.10 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 3gnd h ALA 190 Cb 0.53 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3gnd h ALA 190 CO -0.36 -0.11 -0.09 1.79 0.00 0.00 0.00 179.25 180.47 3gnd h THR 191 N 0.10 1.28 -0.63 0.00 1.35 -0.75 -2.56 112.91 111.70 3gnd h THR 191 Ca 0.06 -1.16 -0.03 0.00 -0.55 0.00 0.00 66.41 64.72 3gnd h THR 191 Cb 0.27 1.33 -0.03 0.00 -1.73 0.00 0.00 68.15 68.00 3gnd h THR 191 CO 0.00 0.38 0.27 -0.09 -0.25 0.00 0.00 175.52 175.83 3gnd h ARG 192 N 0.45 0.93 -0.13 4.72 9.65 -1.15 -1.20 114.38 127.65 3gnd h ARG 192 Ca 0.08 -0.16 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 3gnd h ARG 192 Cb 0.60 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 3gnd h ARG 192 CO 0.04 0.77 0.09 0.82 2.80 0.00 0.00 179.97 184.48 3gnd h ILE 193 N 0.88 1.04 -0.35 1.20 2.04 -1.36 0.19 117.51 121.15 3gnd h ILE 193 Ca 0.21 -0.08 0.03 0.00 1.00 0.00 0.00 64.86 66.03 3gnd h ILE 193 Cb 0.17 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 3gnd h ILE 193 CO -0.02 0.04 0.14 0.00 0.00 0.00 0.00 178.15 178.31 3gnd h ALA 194 N 1.04 0.41 -0.50 1.87 0.00 -1.27 -0.46 119.26 120.36 3gnd h ALA 194 Ca 0.05 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3gnd h ALA 194 Cb -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3gnd h ALA 194 CO -0.01 -0.25 0.32 0.00 0.00 0.00 0.00 179.25 179.31 3gnd h ALA 195 N 1.21 0.64 -0.78 0.00 0.00 -1.01 -1.73 119.26 117.58 3gnd h ALA 195 Ca 0.15 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3gnd h ALA 195 Cb 0.11 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 3gnd h ALA 195 CO -0.14 0.10 0.51 1.49 0.00 0.00 0.00 179.25 181.22 3gnd h GLU 196 N 0.68 0.83 0.00 0.00 4.57 0.01 -1.57 114.58 119.10 3gnd h GLU 196 Ca 0.18 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.23 3gnd h GLU 196 Cb -0.05 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.34 3gnd h GLU 196 CO -0.04 0.55 -0.38 0.52 -1.18 0.00 0.00 179.01 178.49 3gnd h MET 197 N 0.86 0.00 0.00 1.92 2.86 -0.20 -3.46 114.93 116.90 3gnd h MET 197 Ca 0.33 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.97 3gnd h MET 197 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 3gnd h MET 197 CO -0.11 0.38 0.00 0.41 1.06 0.00 0.00 176.91 178.64 3gnd n GLY 198 N 0.30 0.35 3.72 8.32 0.00 -0.59 -4.90 105.19 112.38 3gnd n GLY 198 Ca -0.00 0.00 -0.43 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 2.01 0.06 4.61 0.00 -1.09 -4.88 120.51 121.22 3gnd n ALA 199 Ca 0.00 0.39 0.08 0.00 0.00 0.00 0.00 53.44 53.91 3gnd n ALA 199 Cb 0.00 -2.39 -0.06 0.00 0.00 0.00 0.00 19.45 17.00 3gnd n ALA 199 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3gnd n GLN 200 N 2.13 0.62 -4.83 0.00 3.00 -0.42 -4.58 117.38 113.31 3gnd n GLN 200 Ca 0.10 0.08 -0.25 0.00 -0.01 0.00 0.00 57.00 56.92 3gnd n GLN 200 Cb 0.35 -1.76 -0.16 0.00 0.00 0.00 0.00 30.24 28.67 3gnd n GLN 200 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 3gnd s ILE 201 N -3.26 1.39 -0.11 5.09 1.01 -0.96 -4.11 121.20 120.25 3gnd s ILE 201 Ca -0.03 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 59.93 3gnd s ILE 201 Cb 0.10 -1.18 0.00 0.00 0.01 0.00 0.00 42.46 41.39 3gnd s ILE 201 CO 0.82 0.40 -0.23 -0.63 0.00 0.00 0.00 174.94 175.29 3gnd s ILE 202 N -0.19 2.05 -0.15 2.92 -1.09 -0.77 -0.72 121.20 123.25 3gnd s ILE 202 Ca 0.02 -1.00 -0.01 0.00 -2.23 0.00 0.00 60.65 57.43 3gnd s ILE 202 Cb -0.09 -1.78 -0.01 0.00 -1.58 0.00 0.00 42.46 39.00 3gnd s ILE 202 CO 0.01 0.55 -0.12 -0.75 -1.23 0.00 0.00 174.94 173.40 3gnd s LYS 203 N 0.46 3.33 0.12 2.79 2.20 -0.27 -0.79 119.74 127.58 3gnd s LYS 203 Ca -0.16 -0.70 0.03 0.00 -0.36 0.00 0.00 55.97 54.78 3gnd s LYS 203 Cb -0.17 -2.70 -0.01 0.00 -1.51 0.00 0.00 37.83 33.44 3gnd s LYS 203 CO 0.06 0.07 0.11 -2.37 -0.36 0.00 0.00 175.35 172.86 3gnd n THR 204 N 3.94 0.00 -3.99 3.43 5.66 -0.33 -1.00 114.28 121.99 3gnd n THR 204 Ca -0.18 -0.90 -0.28 0.00 -3.05 0.00 0.00 64.05 59.64 3gnd n THR 204 Cb 0.52 0.45 -0.04 0.00 -1.55 0.00 0.00 70.33 69.71 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 -2.60 3.37 0.39 1.09 2.02 -1.26 -1.14 117.35 119.22 3gnd s TYR 205 Ca 0.15 0.11 -0.23 0.00 -0.37 0.00 0.00 57.07 56.72 3gnd s TYR 205 Cb 0.01 -1.64 -0.10 0.00 -0.40 0.00 0.00 41.96 39.83 3gnd s TYR 205 CO 0.10 0.53 0.97 -0.47 -1.57 0.00 0.00 175.55 175.12 3gnd s TYR 206 N -1.65 3.42 0.01 2.71 5.04 -1.26 -4.95 117.35 120.67 3gnd s TYR 206 Ca 0.33 1.68 0.06 0.00 -2.44 0.00 0.00 57.07 56.70 3gnd s TYR 206 Cb -0.11 -2.95 -0.02 0.00 0.35 0.00 0.00 41.96 39.23 3gnd s TYR 206 CO 0.26 -0.15 -0.18 0.08 -1.34 0.00 0.00 175.55 174.23 3gnd s VAL 207 N -1.85 1.42 0.23 3.14 1.01 -1.26 -5.04 120.40 118.05 3gnd s VAL 207 Ca 0.57 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 3gnd s VAL 207 Cb -0.16 -1.21 0.19 0.00 0.00 0.00 0.00 36.38 35.20 3gnd s VAL 207 CO 0.20 0.26 1.73 -0.33 0.00 0.00 0.00 175.10 176.96 3gnd h GLU 208 N 5.30 0.38 -3.58 2.72 4.39 -1.97 -3.39 114.58 118.43 3gnd h GLU 208 Ca -0.39 -0.02 -0.24 0.00 0.34 0.00 0.00 59.36 59.05 3gnd h GLU 208 Cb 1.16 -0.09 -0.29 0.00 -0.10 0.00 0.00 28.75 29.43 3gnd h GLU 208 CO 0.46 0.25 -0.68 -1.59 -1.16 0.00 0.00 179.01 176.29 3gnd s LYS 209 N -6.06 0.03 0.00 2.33 -2.85 -1.26 -4.86 119.74 107.08 3gnd s LYS 209 Ca -0.13 0.11 0.00 0.00 -1.00 0.00 0.00 55.97 54.95 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 -0.05 0.00 0.41 0.10 0.00 0.00 175.35 176.56 3gnd n GLY 210 N 3.38 0.46 0.37 0.59 0.00 -1.26 -4.42 105.19 104.31 3gnd n GLY 210 Ca -0.16 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.89 1.61 3.57 -1.89 0.35 116.94 120.69 3gnd h PHE 211 Ca 0.00 0.03 0.20 0.00 3.53 0.00 0.00 57.97 61.72 3gnd h PHE 211 Cb 0.00 -0.32 -0.07 0.00 2.79 0.00 0.00 35.95 38.35 3gnd h PHE 211 CO 0.00 0.46 0.59 0.93 -2.23 0.00 0.00 178.31 178.06 3gnd h GLU 212 N 0.93 0.41 -0.06 1.11 5.08 -1.94 -0.25 114.58 119.86 3gnd h GLU 212 Ca 0.42 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.58 3gnd h GLU 212 Cb 0.39 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 3gnd h GLU 212 CO -0.19 0.27 -0.73 0.00 -1.00 0.00 0.00 179.01 177.37 3gnd h ARG 213 N 0.42 0.34 0.00 2.33 3.08 -1.28 -0.63 114.38 118.63 3gnd h ARG 213 Ca 0.46 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 60.23 3gnd h ARG 213 Cb 1.12 0.06 0.00 0.00 0.08 0.00 0.00 29.97 31.23 3gnd h ARG 213 CO -0.18 0.93 -0.00 0.82 -1.07 0.00 0.00 179.97 180.47 3gnd h ILE 214 N 0.23 1.04 0.11 2.04 2.04 -0.96 -1.29 117.51 120.73 3gnd h ILE 214 Ca -0.03 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 3gnd h ILE 214 Cb 1.30 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 3gnd h ILE 214 CO 0.12 0.03 -0.05 0.58 0.00 0.00 0.00 178.15 178.83 3gnd h VAL 215 N -0.06 0.90 -0.36 1.67 2.07 -1.32 -2.77 116.25 116.38 3gnd h VAL 215 Ca -0.00 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.50 3gnd h VAL 215 Cb 0.06 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3gnd h VAL 215 CO 0.00 0.01 0.24 0.00 0.02 0.00 0.00 177.57 177.84 3gnd h ALA 216 N 0.72 1.86 -0.01 1.67 0.00 -0.99 -1.91 119.26 120.60 3gnd h ALA 216 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3gnd h ALA 216 Cb 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3gnd h ALA 216 CO 0.03 0.10 -0.09 0.41 0.00 0.00 0.00 179.25 179.70 3gnd n GLY 217 N -1.50 -0.30 3.43 0.00 0.00 -0.50 -4.78 105.19 101.55 3gnd n GLY 217 Ca 0.03 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 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 4.91 0.11 -4.51 0.00 -0.02 -1.26 -4.80 135.00 129.43 3gnd n PRO 219 Ca -0.16 0.34 -0.24 0.00 -2.02 0.00 0.00 63.50 61.42 3gnd n PRO 219 Cb 0.51 -1.71 -0.11 0.00 -0.02 0.00 0.00 33.50 32.18 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 -3.17 1.72 0.35 -1.45 -7.23 -1.26 -3.75 120.40 105.61 3gnd s VAL 220 Ca 0.06 -2.06 -0.28 0.00 -1.81 0.00 0.00 61.98 57.88 3gnd s VAL 220 Cb 0.10 -2.76 -0.11 0.00 0.56 0.00 0.00 36.38 34.17 3gnd s VAL 220 CO 0.34 -0.10 1.46 -2.65 -0.31 0.00 0.00 175.10 173.84 3gnd n PRO 221 N -0.77 2.55 -4.82 4.82 -0.02 -1.25 -4.78 135.00 130.73 3gnd n PRO 221 Ca -0.04 0.90 -0.32 0.00 -2.02 0.00 0.00 63.50 62.01 3gnd n PRO 221 Cb 0.65 -2.61 -0.13 0.00 -0.02 0.00 0.00 33.50 31.40 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 -0.91 3.08 0.01 4.25 1.01 -1.26 -1.84 121.20 125.54 3gnd s ILE 222 Ca 0.56 -0.79 0.05 0.00 0.00 0.00 0.00 60.65 60.47 3gnd s ILE 222 Cb -0.50 -2.23 -0.02 0.00 0.01 0.00 0.00 42.46 39.72 3gnd s ILE 222 CO 0.61 0.54 -0.15 -0.69 0.00 0.00 0.00 174.94 175.24 3gnd s VAL 223 N -0.78 1.22 -0.04 2.92 1.01 0.03 0.15 120.40 124.91 3gnd s VAL 223 Ca 0.12 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.26 3gnd s VAL 223 Cb -0.11 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 3gnd s VAL 223 CO 0.02 0.21 0.03 0.27 0.00 0.00 0.00 175.10 175.63 3gnd s ILE 224 N -0.57 4.48 0.45 2.22 -4.36 -0.96 -1.19 121.20 121.26 3gnd s ILE 224 Ca 0.05 -0.35 -0.22 0.00 -0.26 0.00 0.00 60.65 59.87 3gnd s ILE 224 Cb -0.07 -2.97 -0.09 0.00 1.25 0.00 0.00 42.46 40.59 3gnd s ILE 224 CO 0.00 0.47 1.04 0.00 0.24 0.00 0.00 174.94 176.70 3gnd s ALA 225 N -1.04 2.96 0.23 2.27 0.00 -0.29 -0.01 121.76 125.88 3gnd s ALA 225 Ca 0.18 0.64 -0.07 0.00 0.00 0.00 0.00 51.96 52.71 3gnd s ALA 225 Cb -0.12 -3.26 0.20 0.00 0.00 0.00 0.00 23.12 19.94 3gnd s ALA 225 CO 0.08 -0.26 1.80 0.78 0.00 0.00 0.00 175.76 178.16 3gnd h GLY 226 N 1.95 1.25 -0.24 0.00 0.00 -1.89 -3.43 103.07 100.72 3gnd h GLY 226 Ca -0.49 -0.67 0.03 0.00 0.00 0.00 0.00 47.33 46.20 3gnd h GLY 226 CO 0.60 0.63 -0.04 0.61 0.00 0.00 0.00 176.54 178.35 3gnd n GLY 227 N -0.91 -2.12 3.71 4.60 0.00 -1.26 -4.88 105.19 104.33 3gnd n GLY 227 Ca 0.07 -1.45 -0.33 0.00 0.00 0.00 0.00 46.02 44.32 3gnd n GLY 227 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gnd s LYS 228 N -0.68 1.86 0.21 1.61 -2.85 -1.26 -4.44 119.74 114.19 3gnd s LYS 228 Ca 0.00 1.64 -0.32 0.00 -1.00 0.00 0.00 55.97 56.29 3gnd s LYS 228 Cb 0.00 -1.81 -0.14 0.00 -2.06 0.00 0.00 37.83 33.82 3gnd s LYS 228 CO 0.00 -2.02 1.38 1.17 0.10 0.00 0.00 175.35 175.98 3gnd n LYS 229 N -3.19 1.86 -4.40 1.78 3.00 -1.26 -4.83 118.16 111.12 3gnd n LYS 229 Ca 0.13 0.66 -0.20 0.00 -0.00 0.00 0.00 58.31 58.90 3gnd n LYS 229 Cb 0.51 -2.30 -0.10 0.00 0.00 0.00 0.00 35.03 33.13 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 0.31 2.39 0.23 3.14 1.43 -1.26 -5.06 118.68 119.85 3gnd s LEU 230 Ca 0.71 -1.20 -0.31 0.00 -1.03 0.00 0.00 54.13 52.30 3gnd s LEU 230 Cb -0.70 -0.52 -0.14 0.00 0.03 0.00 0.00 46.19 44.86 3gnd s LEU 230 CO 0.49 -0.40 1.28 -2.65 0.23 0.00 0.00 176.35 175.30 3gnd n PRO 231 N -0.53 1.68 -0.32 1.29 -0.02 -1.26 -4.73 135.00 131.11 3gnd n PRO 231 Ca -0.05 0.60 0.19 0.00 -2.02 0.00 0.00 63.50 62.21 3gnd n PRO 231 Cb 0.64 -2.17 0.38 0.00 -0.02 0.00 0.00 33.50 32.33 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 3.65 0.25 -0.60 -0.52 3.07 -1.99 0.15 114.58 118.58 3gnd h GLU 232 Ca -0.44 -0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 58.32 3gnd h GLU 232 Cb 1.30 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 29.14 3gnd h GLU 232 CO 0.72 0.16 0.04 -0.09 -1.40 0.00 0.00 179.01 178.44 3gnd h ARG 233 N 0.26 1.02 -0.25 2.33 2.43 -1.97 -1.96 114.38 116.22 3gnd h ARG 233 Ca 0.65 -0.29 -0.19 0.00 -0.81 0.00 0.00 59.98 59.34 3gnd h ARG 233 Cb 1.41 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 3gnd h ARG 233 CO -0.64 0.97 -0.59 0.93 -1.51 0.00 0.00 179.97 179.12 3gnd h GLU 234 N 0.94 0.83 -0.74 0.20 5.08 -1.13 -2.17 114.58 117.59 3gnd h GLU 234 Ca 0.18 -0.55 0.04 0.00 -1.00 0.00 0.00 59.36 58.03 3gnd h GLU 234 Cb 0.49 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 3gnd h GLU 234 CO 0.02 1.18 0.45 0.00 -1.00 0.00 0.00 179.01 179.66 3gnd h ALA 235 N 0.70 0.98 -0.39 3.43 0.00 -0.96 -1.32 119.26 121.70 3gnd h ALA 235 Ca 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3gnd h ALA 235 Cb 1.20 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 3gnd h ALA 235 CO 0.13 0.20 -0.12 -0.07 0.00 0.00 0.00 179.25 179.39 3gnd h LEU 236 N 0.85 0.67 -0.42 0.00 3.38 -1.29 -2.13 115.31 116.37 3gnd h LEU 236 Ca 0.31 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 58.11 3gnd h LEU 236 Cb 0.09 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3gnd h LEU 236 CO -0.14 0.82 0.23 -0.33 0.09 0.00 0.00 178.44 179.11 3gnd h GLU 237 N 0.62 0.45 -0.29 1.13 4.39 -0.67 -0.20 114.58 120.01 3gnd h GLU 237 Ca 0.11 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.83 3gnd h GLU 237 Cb 0.56 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.06 3gnd h GLU 237 CO 0.04 0.30 -0.03 1.98 -1.16 0.00 0.00 179.01 180.14 3gnd h MET 238 N 0.46 0.05 -0.33 2.33 4.05 -1.04 0.57 114.93 121.03 3gnd h MET 238 Ca 0.17 -0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.63 3gnd h MET 238 Cb 0.05 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.80 3gnd h MET 238 CO -0.10 0.03 0.11 0.00 0.23 0.00 0.00 176.91 177.18 3gnd h TRP 240 N 0.25 0.79 0.20 0.00 7.01 -0.48 -0.34 115.95 123.37 3gnd h TRP 240 Ca 0.15 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.16 3gnd h TRP 240 Cb 0.13 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 26.93 3gnd h TRP 240 CO -0.15 0.50 -0.10 1.96 -2.79 0.00 0.00 178.44 177.86 3gnd h GLN 241 N 0.85 -0.26 0.06 2.65 1.08 -0.63 -0.15 115.11 118.71 3gnd h GLN 241 Ca 0.23 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.48 3gnd h GLN 241 Cb -0.09 0.06 -0.04 0.00 -0.05 0.00 0.00 27.48 27.35 3gnd h GLN 241 CO -0.05 -0.17 -0.31 0.00 -0.95 0.00 0.00 178.83 177.34 3gnd h ALA 242 N 0.54 -0.50 -0.13 3.87 0.00 -0.74 0.48 119.26 122.79 3gnd h ALA 242 Ca -0.03 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3gnd h ALA 242 Cb 0.21 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 3gnd h ALA 242 CO 0.04 -0.84 -0.09 0.82 0.00 0.00 0.00 179.25 179.18 3gnd h ILE 243 N -0.50 0.73 -0.65 0.00 1.08 -1.09 -1.25 117.51 115.84 3gnd h ILE 243 Ca 0.05 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.64 3gnd h ILE 243 Cb 0.56 0.73 -0.04 0.00 -3.07 0.00 0.00 36.82 35.00 3gnd h ILE 243 CO -0.22 0.00 0.44 -0.78 -0.69 0.00 0.00 178.15 176.89 3gnd h ASP 244 N -0.10 0.34 -0.18 1.72 3.58 -0.70 -0.73 116.42 120.36 3gnd h ASP 244 Ca 0.08 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.54 3gnd h ASP 244 Cb 0.22 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.21 3gnd h ASP 244 CO -0.19 0.19 0.00 0.00 -2.88 0.00 0.00 179.24 176.36 3gnd n GLN 245 N -4.46 1.90 0.00 0.28 6.02 0.13 -4.93 117.38 116.32 3gnd n GLN 245 Ca 0.11 -1.35 0.00 0.00 -0.01 0.00 0.00 57.00 55.75 3gnd n GLN 245 Cb 0.45 -1.43 0.00 0.00 1.02 0.00 0.00 30.24 30.28 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 1.22 1.13 3.74 1.08 0.00 -0.28 -4.56 105.19 107.52 3gnd n GLY 246 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 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 2.44 -1.94 4.61 0.00 -0.54 -4.82 121.76 119.51 3gnd s ALA 247 Ca 0.00 1.06 0.17 0.00 0.00 0.00 0.00 51.96 53.19 3gnd s ALA 247 Cb 0.00 -3.49 0.50 0.00 0.00 0.00 0.00 23.12 20.14 3gnd s ALA 247 CO 0.00 -1.39 1.42 0.43 0.00 0.00 0.00 175.76 176.21 3gnd n SER 248 N -1.84 3.09 0.00 0.00 7.64 0.12 -4.62 113.62 118.01 3gnd n SER 248 Ca 0.14 -2.03 0.00 0.00 1.01 0.00 0.00 58.87 57.99 3gnd n SER 248 Cb 0.49 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 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 1.36 0.22 3.30 0.23 0.00 -1.24 -1.79 105.19 107.27 3gnd n GLY 249 Ca 0.19 -1.78 -0.22 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.64 1.71 -0.74 1.61 -7.23 -0.80 -2.27 120.40 111.03 3gnd s VAL 250 Ca 0.00 -1.76 0.04 0.00 -1.81 0.00 0.00 61.98 58.45 3gnd s VAL 250 Cb 0.00 -1.69 0.22 0.00 0.56 0.00 0.00 36.38 35.46 3gnd s VAL 250 CO 0.00 -0.24 0.70 -0.67 -0.31 0.00 0.00 175.10 174.58 3gnd n ASP 251 N 0.60 3.72 -4.78 4.85 2.03 0.98 -0.82 116.55 123.14 3gnd n ASP 251 Ca -0.16 -3.29 -0.37 0.00 0.52 0.00 0.00 54.79 51.48 3gnd n ASP 251 Cb 0.56 -0.81 -0.05 0.00 -0.72 0.00 0.00 41.12 40.09 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 -1.90 4.45 0.00 -0.67 -1.94 -0.48 -2.94 119.30 115.82 3gnd s MET 252 Ca 0.31 1.48 0.00 0.00 -1.71 0.00 0.00 55.69 55.77 3gnd s MET 252 Cb 0.03 -2.78 0.00 0.00 2.01 0.00 0.00 34.83 34.08 3gnd s MET 252 CO -0.09 0.12 0.00 0.41 -0.01 0.00 0.00 175.02 175.45 3gnd n GLY 253 N 0.62 0.34 0.29 -0.03 0.00 -1.26 0.04 105.19 105.19 3gnd n GLY 253 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 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 0.95 0.00 1.61 3.08 -1.85 -0.90 114.38 117.27 3gnd h ARG 254 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3gnd h ARG 254 Cb 0.00 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.84 3gnd h ARG 254 CO 0.00 0.63 0.00 0.09 -1.07 0.00 0.00 179.97 179.62 3gnd n ASN 255 N -4.59 0.00 0.01 7.04 3.02 -1.26 -0.92 115.26 118.55 3gnd n ASN 255 Ca 0.08 -0.32 -0.02 0.00 -0.03 0.00 0.00 54.58 54.28 3gnd n ASN 255 Cb 0.04 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.21 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 -0.98 1.11 0.79 2.41 5.41 -0.48 -4.55 119.36 123.06 3gnd n ILE 256 Ca 0.07 0.30 0.10 0.00 1.00 0.00 0.00 62.75 64.23 3gnd n ILE 256 Cb 0.03 -1.70 0.47 0.00 -0.71 0.00 0.00 39.64 37.73 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 -3.57 0.00 -0.14 1.39 1.16 -0.47 -1.58 117.46 114.25 3gnd n PHE 257 Ca -0.03 0.00 0.11 0.00 -1.87 0.00 0.00 57.45 55.66 3gnd n PHE 257 Cb 0.12 -0.46 0.27 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 -1.46 2.64 -2.46 3.97 6.02 -0.10 -4.83 117.38 121.16 3gnd n GLN 258 Ca 0.06 -2.49 -0.30 0.00 -0.01 0.00 0.00 57.00 54.26 3gnd n GLN 258 Cb 0.24 -1.52 -0.01 0.00 1.02 0.00 0.00 30.24 29.96 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 -1.14 6.40 0.18 1.08 0.15 -0.61 -4.96 113.70 114.80 3gnd s SER 259 Ca 0.43 1.24 0.24 0.00 0.70 0.00 0.00 55.95 58.56 3gnd s SER 259 Cb 0.23 -2.38 0.91 0.00 -1.71 0.00 0.00 66.02 63.07 3gnd s SER 259 CO 0.31 -0.60 1.73 0.47 1.20 0.00 0.00 173.24 176.35 3gnd n ASP 260 N -1.96 0.57 -3.17 5.45 8.00 -1.26 -4.14 116.55 120.04 3gnd n ASP 260 Ca 0.04 0.60 -0.22 0.00 0.71 0.00 0.00 54.79 55.91 3gnd n ASP 260 Cb 0.54 -0.73 -0.06 0.00 -0.02 0.00 0.00 41.12 40.85 3gnd n ASP 260 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3gnd n HIS 261 N -2.08 -0.42 0.05 1.24 8.25 -1.26 -5.01 115.22 115.99 3gnd n HIS 261 Ca 0.04 -3.52 -0.14 0.00 -0.26 0.00 0.00 57.72 53.85 3gnd n HIS 261 Cb 0.31 -0.27 -0.07 0.00 1.12 0.00 0.00 29.99 31.08 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 3.83 -0.55 -0.54 -0.41 0.11 -1.74 -0.76 132.00 131.93 3gnd h PRO 262 Ca 0.06 0.04 0.08 0.00 0.11 0.00 0.00 66.00 66.29 3gnd h PRO 262 Cb 0.90 0.13 -0.06 0.00 0.11 0.00 0.00 31.00 32.07 3gnd h PRO 262 CO 0.46 -0.37 0.19 0.28 -0.21 0.00 0.00 178.00 178.35 3gnd h VAL 263 N -0.57 0.80 -0.18 3.15 2.07 -1.95 0.16 116.25 119.73 3gnd h VAL 263 Ca 0.05 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.47 3gnd h VAL 263 Cb 0.66 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 3gnd h VAL 263 CO -0.34 0.07 0.01 0.00 0.02 0.00 0.00 177.57 177.33 3gnd h ALA 264 N 1.37 0.17 -0.51 1.67 0.00 -1.84 -1.77 119.26 118.35 3gnd h ALA 264 Ca 0.27 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.30 3gnd h ALA 264 Cb 0.31 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 3gnd h ALA 264 CO -0.27 -0.42 0.12 1.98 0.00 0.00 0.00 179.25 180.65 3gnd h MET 265 N 0.08 0.25 -0.25 0.00 -1.53 -0.19 -1.24 114.93 112.06 3gnd h MET 265 Ca 0.08 -0.02 0.02 0.00 -3.44 0.00 0.00 59.70 56.35 3gnd h MET 265 Cb 0.09 -0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 31.06 3gnd h MET 265 CO -0.13 0.17 0.09 0.52 0.14 0.00 0.00 176.91 177.70 3gnd h MET 266 N 0.26 0.21 -0.58 0.39 2.86 -0.70 0.54 114.93 117.91 3gnd h MET 266 Ca 0.25 -0.01 0.06 0.00 -2.06 0.00 0.00 59.70 57.94 3gnd h MET 266 Cb 0.33 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 3gnd h MET 266 CO -0.32 0.14 0.38 0.87 1.06 0.00 0.00 176.91 179.05 3gnd h LYS 267 N 0.21 0.54 0.07 1.72 1.57 -0.59 0.14 116.57 120.24 3gnd h LYS 267 Ca 0.11 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3gnd h LYS 267 Cb 0.06 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.25 3gnd h LYS 267 CO -0.10 0.36 -0.03 0.00 -0.57 0.00 0.00 179.45 179.11 3gnd h ALA 268 N 1.69 -0.09 -0.87 3.86 0.00 -0.34 -1.87 119.26 121.64 3gnd h ALA 268 Ca 0.25 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.05 3gnd h ALA 268 Cb 0.27 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 3gnd h ALA 268 CO -0.07 -0.41 0.57 0.28 0.00 0.00 0.00 179.25 179.62 3gnd h VAL 269 N -0.37 1.13 -0.31 0.00 2.07 0.06 -1.41 116.25 117.41 3gnd h VAL 269 Ca -0.01 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 3gnd h VAL 269 Cb 0.32 -0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 3gnd h VAL 269 CO 0.02 0.19 0.17 1.56 0.02 0.00 0.00 177.57 179.53 3gnd h GLN 270 N 1.06 0.44 -0.59 1.57 1.08 -0.66 -1.02 115.11 116.99 3gnd h GLN 270 Ca 0.35 -0.05 0.08 0.00 -1.45 0.00 0.00 58.65 57.58 3gnd h GLN 270 Cb 0.06 -0.09 -0.06 0.00 -0.05 0.00 0.00 27.48 27.34 3gnd h GLN 270 CO -0.11 0.37 0.24 0.00 -0.95 0.00 0.00 178.83 178.38 3gnd h ALA 271 N 1.04 0.76 -0.45 3.87 0.00 -0.43 0.85 119.26 124.89 3gnd h ALA 271 Ca 0.11 0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 3gnd h ALA 271 Cb 0.06 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3gnd h ALA 271 CO -0.02 -0.16 -0.25 0.28 0.00 0.00 0.00 179.25 179.11 3gnd h VAL 272 N 0.44 1.27 0.07 0.00 2.07 -1.17 -2.02 116.25 116.91 3gnd h VAL 272 Ca 0.29 -1.41 -0.10 0.00 0.82 0.00 0.00 66.70 66.29 3gnd h VAL 272 Cb 0.31 1.20 0.01 0.00 -1.52 0.00 0.00 31.29 31.30 3gnd h VAL 272 CO -0.27 0.48 -0.43 0.58 0.02 0.00 0.00 177.57 177.96 3gnd h VAL 273 N 0.81 1.63 0.00 2.57 2.07 -0.64 -3.26 116.25 119.42 3gnd h VAL 273 Ca 0.10 -2.39 -0.21 0.00 0.82 0.00 0.00 66.70 65.01 3gnd h VAL 273 Cb 0.83 3.22 -0.04 0.00 -1.52 0.00 0.00 31.29 33.79 3gnd h VAL 273 CO 0.07 0.65 -1.66 1.41 0.02 0.00 0.00 177.57 178.07 3gnd n HIS 274 N -4.36 0.77 -0.43 1.57 -0.00 0.24 -4.49 115.22 108.53 3gnd n HIS 274 Ca -0.12 0.26 0.05 0.00 -0.00 0.00 0.00 57.72 57.91 3gnd n HIS 274 Cb 0.65 -1.05 0.11 0.00 -0.00 0.00 0.00 29.99 29.70 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 -2.85 0.27 -1.90 4.41 8.25 -0.81 -4.95 115.22 117.64 3gnd n HIS 275 Ca -0.14 -0.67 -0.17 0.00 -0.26 0.00 0.00 57.72 56.49 3gnd n HIS 275 Cb 0.91 -0.11 -0.04 0.00 1.12 0.00 0.00 29.99 31.87 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 -0.43 -4.59 -4.58 0.41 3.02 -1.16 -4.94 115.26 102.98 3gnd n ASN 276 Ca 0.10 0.27 -0.32 0.00 -0.03 0.00 0.00 54.58 54.60 3gnd n ASN 276 Cb 0.48 -4.02 0.15 0.00 -0.61 0.00 0.00 39.78 35.79 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 -0.41 -2.90 3.52 -0.58 -0.87 -4.98 120.64 111.97 3gnd n GLU 277 Ca -0.18 -0.06 -0.25 0.00 -0.42 0.00 0.00 57.16 56.25 3gnd n GLU 277 Cb 0.59 -2.20 0.00 0.00 -0.57 0.00 0.00 31.44 29.26 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 -2.56 4.60 0.20 2.62 -4.23 -1.26 -4.62 115.64 110.39 3gnd s THR 278 Ca 0.64 -0.18 -0.10 0.00 -1.18 0.00 0.00 61.69 60.86 3gnd s THR 278 Cb -0.22 -3.72 0.13 0.00 1.34 0.00 0.00 72.50 70.02 3gnd s THR 278 CO 0.61 -0.60 1.81 0.00 -0.54 0.00 0.00 174.62 175.91 3gnd h ALA 279 N 0.37 0.85 0.29 3.99 0.00 -1.95 -0.99 119.26 121.82 3gnd h ALA 279 Ca -0.47 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 3gnd h ALA 279 Cb 1.23 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3gnd h ALA 279 CO 0.60 0.05 -0.14 -0.44 0.00 0.00 0.00 179.25 179.33 3gnd h ASP 280 N 0.68 -0.33 -0.71 0.00 3.32 -1.95 -0.78 116.42 116.64 3gnd h ASP 280 Ca 0.28 -0.20 0.15 0.00 0.02 0.00 0.00 57.03 57.28 3gnd h ASP 280 Cb 0.14 0.09 -0.10 0.00 0.22 0.00 0.00 39.33 39.67 3gnd h ASP 280 CO -0.16 0.06 0.19 0.03 -1.72 0.00 0.00 179.24 177.65 3gnd h ARG 281 N -0.79 0.30 -0.42 3.56 2.47 -1.95 -1.17 114.38 116.37 3gnd h ARG 281 Ca -0.04 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.63 3gnd h ARG 281 Cb 0.51 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.74 3gnd h ARG 281 CO 0.07 0.20 0.15 0.00 0.56 0.00 0.00 179.97 180.94 3gnd h ALA 282 N 1.57 0.55 -0.69 0.04 0.00 -1.12 -1.97 119.26 117.63 3gnd h ALA 282 Ca 0.39 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.22 3gnd h ALA 282 Cb 0.64 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3gnd h ALA 282 CO -0.47 0.18 0.45 -0.92 0.00 0.00 0.00 179.25 178.50 3gnd h TYR 283 N 0.54 0.66 -0.06 0.00 3.20 -0.13 -0.13 116.97 121.04 3gnd h TYR 283 Ca 0.14 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.90 3gnd h TYR 283 Cb 0.23 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 3gnd h TYR 283 CO 0.01 0.33 -0.53 0.93 -1.64 0.00 0.00 178.16 177.26 3gnd h GLU 284 N 0.63 0.16 -0.23 1.82 5.08 -0.71 -0.12 114.58 121.21 3gnd h GLU 284 Ca 0.31 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.56 3gnd h GLU 284 Cb 0.38 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 3gnd h GLU 284 CO -0.10 0.65 0.10 1.25 -1.00 0.00 0.00 179.01 179.91 3gnd h LEU 285 N 0.13 0.28 -0.06 1.33 7.12 -0.35 -2.02 115.31 121.75 3gnd h LEU 285 Ca 0.00 -0.02 -0.25 0.00 0.13 0.00 0.00 57.88 57.74 3gnd h LEU 285 Cb 0.98 -0.07 0.01 0.00 -0.53 0.00 0.00 40.66 41.04 3gnd h LEU 285 CO 0.08 0.26 -1.06 0.22 -0.13 0.00 0.00 178.44 177.80 3gnd h TYR 286 N 0.32 0.62 0.00 1.25 3.20 -0.16 -3.20 116.97 119.01 3gnd h TYR 286 Ca 0.08 -0.38 -0.05 0.00 3.14 0.00 0.00 58.73 61.53 3gnd h TYR 286 Cb 0.06 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 3gnd h TYR 286 CO 0.00 1.23 -0.23 -0.07 -1.64 0.00 0.00 178.16 177.44 3gnd h LEU 287 N 0.19 0.00 -0.51 2.82 3.38 -0.71 -2.84 115.31 117.64 3gnd h LEU 287 Ca -0.11 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3gnd h LEU 287 Cb 1.73 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.48 3gnd h LEU 287 CO 0.18 0.23 -0.07 0.77 0.09 0.00 0.00 178.44 179.65 3gnd h SER 288 N 0.00 0.00 -0.02 -0.43 4.64 -1.38 -3.51 113.55 112.86 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 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 3gnd h SER 288 CO 0.03 0.07 0.00 -0.62 -0.87 0.00 0.00 176.83 175.44