#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 1.67 -0.35 1.61 1.02 -1.26 -5.12 119.74 117.31 3gnd s LYS 11 Ca 0.00 -1.20 0.03 0.00 0.02 0.00 0.00 55.97 54.82 3gnd s LYS 11 Cb 0.00 -1.99 0.10 0.00 -0.52 0.00 0.00 37.83 35.43 3gnd s LYS 11 CO 0.00 0.49 0.08 0.34 -0.92 0.00 0.00 175.35 175.34 3gnd s ASP 12 N -1.71 4.53 0.00 2.83 2.15 -1.26 -4.96 116.67 118.25 3gnd s ASP 12 Ca 0.14 -2.11 0.18 0.00 0.43 0.00 0.00 52.55 51.19 3gnd s ASP 12 Cb -0.10 -1.43 0.69 0.00 -0.30 0.00 0.00 42.92 41.78 3gnd s ASP 12 CO 0.05 -0.37 1.50 0.49 -0.17 0.00 0.00 175.17 176.66 3gnd n PHE 13 N 4.29 0.22 -3.85 -5.34 3.72 -1.26 -4.93 117.46 110.31 3gnd n PHE 13 Ca 0.03 -0.11 -0.30 0.00 -0.05 0.00 0.00 57.45 57.02 3gnd n PHE 13 Cb 0.41 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.96 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 0.17 -0.61 0.00 -1.08 0.63 -1.26 -4.79 116.66 109.73 3gnd n ARG 14 Ca 0.14 0.06 0.14 0.00 -0.92 0.00 0.00 57.85 57.27 3gnd n ARG 14 Cb 0.27 -1.50 0.76 0.00 0.45 0.00 0.00 32.46 32.44 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 -3.44 0.06 1.46 5.15 -2.24 -1.26 -2.35 114.28 111.67 3gnd n THR 15 Ca -0.12 0.02 0.14 0.00 -2.27 0.00 0.00 64.05 61.81 3gnd n THR 15 Cb 0.43 -0.58 0.55 0.00 -2.10 0.00 0.00 70.33 68.63 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 -1.13 1.00 -3.70 3.42 5.68 -1.26 -4.68 116.55 115.88 3gnd n ASP 16 Ca 0.17 -1.09 -0.30 0.00 -0.50 0.00 0.00 54.79 53.08 3gnd n ASP 16 Cb 0.15 0.02 -0.14 0.00 -1.14 0.00 0.00 41.12 40.01 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 -2.23 0.79 0.58 0.11 0.74 -0.99 -5.12 119.66 113.53 3gnd s GLN 17 Ca 0.33 -1.25 -0.20 0.00 0.05 0.00 0.00 55.36 54.30 3gnd s GLN 17 Cb 0.20 -1.98 -0.04 0.00 1.10 0.00 0.00 33.01 32.30 3gnd s GLN 17 CO 0.42 -1.04 1.25 -2.14 -0.55 0.00 0.00 175.29 173.23 3gnd s PRO 18 N 1.35 3.00 0.27 1.67 0.02 -1.26 -4.97 135.00 135.09 3gnd s PRO 18 Ca 0.12 1.95 -0.29 0.00 0.02 0.00 0.00 61.00 62.79 3gnd s PRO 18 Cb -0.19 -2.02 -0.09 0.00 0.02 0.00 0.00 34.50 32.21 3gnd s PRO 18 CO -0.19 -1.21 1.19 -1.14 -0.33 0.00 0.00 177.00 175.32 3gnd s GLN 19 N -3.19 4.52 -0.02 5.54 0.74 -1.26 -5.05 119.66 120.94 3gnd s GLN 19 Ca 0.76 1.95 0.03 0.00 0.05 0.00 0.00 55.36 58.15 3gnd s GLN 19 Cb -0.34 -3.17 -0.00 0.00 1.10 0.00 0.00 33.01 30.61 3gnd s GLN 19 CO 0.37 0.02 -0.10 0.15 -0.55 0.00 0.00 175.29 175.18 3gnd s LYS 20 N -1.23 0.96 0.23 1.67 1.02 -1.26 -5.13 119.74 116.00 3gnd s LYS 20 Ca 0.48 -0.36 -0.30 0.00 0.02 0.00 0.00 55.97 55.81 3gnd s LYS 20 Cb -0.35 -0.91 -0.09 0.00 -0.52 0.00 0.00 37.83 35.96 3gnd s LYS 20 CO 0.43 0.17 1.37 -0.80 -0.92 0.00 0.00 175.35 175.61 3gnd s ASN 21 N -0.02 6.78 -0.23 2.83 0.01 -1.26 -5.01 114.94 118.04 3gnd s ASN 21 Ca 0.00 2.54 -0.24 0.00 -0.71 0.00 0.00 52.86 54.46 3gnd s ASN 21 Cb -0.07 -2.62 -0.01 0.00 0.41 0.00 0.00 41.25 38.97 3gnd s ASN 21 CO 0.00 -0.61 0.78 -0.63 -1.51 0.00 0.00 177.10 175.13 3gnd s ILE 22 N 0.01 4.88 0.46 0.60 1.01 -1.26 -5.03 121.20 121.87 3gnd s ILE 22 Ca 0.58 1.47 -0.24 0.00 0.00 0.00 0.00 60.65 62.45 3gnd s ILE 22 Cb -0.39 -4.07 -0.07 0.00 0.01 0.00 0.00 42.46 37.93 3gnd s ILE 22 CO 0.41 -0.03 1.27 -2.84 0.00 0.00 0.00 174.94 173.75 3gnd s PRO 23 N 2.61 3.71 -0.36 2.79 0.02 -1.26 -5.00 135.00 137.51 3gnd s PRO 23 Ca 0.33 2.04 -0.11 0.00 0.02 0.00 0.00 61.00 63.28 3gnd s PRO 23 Cb -0.16 -2.52 0.01 0.00 0.02 0.00 0.00 34.50 31.85 3gnd s PRO 23 CO 0.08 -0.67 0.21 0.12 -0.33 0.00 0.00 177.00 176.41 3gnd s PHE 24 N -1.37 3.22 -0.85 6.54 5.36 -1.26 -4.99 117.98 124.64 3gnd s PHE 24 Ca 0.62 -0.68 0.23 0.00 -0.96 0.00 0.00 56.93 56.14 3gnd s PHE 24 Cb -0.35 -2.44 0.09 0.00 -0.34 0.00 0.00 43.02 39.97 3gnd s PHE 24 CO 0.44 -0.54 1.09 0.25 -1.46 0.00 0.00 175.22 175.00 3gnd n THR 25 N 5.03 0.06 -1.66 0.12 -2.24 -1.26 -4.48 114.28 109.85 3gnd n THR 25 Ca -0.12 -0.09 -0.54 0.00 -2.27 0.00 0.00 64.05 61.03 3gnd n THR 25 Cb 0.48 0.48 -0.06 0.00 -2.10 0.00 0.00 70.33 69.13 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 -1.67 2.29 -4.74 3.22 7.94 -1.26 -4.72 117.00 118.06 3gnd n LEU 26 Ca 0.04 1.08 -0.65 0.00 -1.11 0.00 0.00 56.01 55.37 3gnd n LEU 26 Cb 0.37 -1.21 -0.09 0.00 0.53 0.00 0.00 43.42 43.02 3gnd n LEU 26 CO 0.40 -0.60 1.21 1.17 -1.11 0.00 0.00 177.39 178.45 3gnd n LYS 27 N 4.32 0.35 -1.21 1.96 4.81 -1.26 -1.13 118.16 126.00 3gnd n LYS 27 Ca 0.22 0.13 -0.07 0.00 -0.87 0.00 0.00 58.31 57.72 3gnd n LYS 27 Cb 0.18 -1.68 -0.03 0.00 0.02 0.00 0.00 35.03 33.52 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 4.07 0.86 0.53 3.14 0.00 -1.24 -3.89 105.19 108.66 3gnd n GLY 28 Ca 0.30 -0.25 0.07 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.03 0.81 2.74 0.00 0.00 -1.26 -3.89 105.19 102.57 3gnd n GLY 30 Ca 0.16 -0.45 -0.03 0.00 0.00 0.00 0.00 46.02 45.71 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 0.65 2.87 -2.53 4.61 0.00 -1.26 -4.94 120.51 119.90 3gnd n ALA 31 Ca 0.14 -2.87 -0.25 0.00 0.00 0.00 0.00 53.44 50.46 3gnd n ALA 31 Cb 0.35 -0.81 -0.10 0.00 0.00 0.00 0.00 19.45 18.89 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 -3.78 2.82 0.97 0.00 1.43 -1.25 -5.13 118.68 113.74 3gnd s LEU 32 Ca 0.30 -0.75 -0.11 0.00 -1.03 0.00 0.00 54.13 52.55 3gnd s LEU 32 Cb 0.33 -1.45 0.17 0.00 0.03 0.00 0.00 46.19 45.27 3gnd s LEU 32 CO -0.03 0.07 1.08 -0.67 0.23 0.00 0.00 176.35 177.03 3gnd n ASP 33 N -0.23 -0.17 0.03 2.29 2.03 -1.26 -4.75 116.55 114.50 3gnd n ASP 33 Ca -0.09 0.31 -0.11 0.00 0.52 0.00 0.00 54.79 55.43 3gnd n ASP 33 Cb 0.57 -1.42 -0.04 0.00 -0.72 0.00 0.00 41.12 39.51 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 -2.03 -0.62 -0.48 -0.67 7.01 -2.00 -1.14 115.95 116.03 3gnd h TRP 34 Ca -0.46 0.02 0.06 0.00 2.11 0.00 0.00 58.89 60.62 3gnd h TRP 34 Cb 1.28 0.28 -0.05 0.00 -2.10 0.00 0.00 29.16 28.57 3gnd h TRP 34 CO 0.45 -0.32 0.18 0.78 -2.79 0.00 0.00 178.44 176.74 3gnd h GLY 35 N -0.33 0.64 1.03 2.65 0.00 -1.92 0.14 103.07 105.28 3gnd h GLY 35 Ca 0.08 -0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 3gnd h GLY 35 CO -0.25 0.02 0.13 1.98 0.00 0.00 0.00 176.54 178.42 3gnd h MET 36 N 0.36 1.00 -0.25 4.80 1.85 -1.58 -0.37 114.93 120.74 3gnd h MET 36 Ca 0.23 -0.25 -0.04 0.00 -0.61 0.00 0.00 59.70 59.03 3gnd h MET 36 Cb 0.23 -0.13 -0.01 0.00 0.43 0.00 0.00 31.60 32.12 3gnd h MET 36 CO -0.23 0.92 -0.02 1.96 -0.40 0.00 0.00 176.91 179.14 3gnd h GLN 37 N 0.91 0.38 -0.11 0.39 4.20 -0.49 -0.88 115.11 119.51 3gnd h GLN 37 Ca 0.19 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.81 3gnd h GLN 37 Cb 0.38 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 3gnd h GLN 37 CO 0.01 0.43 0.00 1.03 -0.67 0.00 0.00 178.83 179.63 3gnd h SER 38 N 0.37 0.20 -0.69 1.46 0.87 0.09 0.16 113.55 116.00 3gnd h SER 38 Ca 0.08 -0.30 -0.01 0.00 -1.23 0.00 0.00 61.79 60.33 3gnd h SER 38 Cb 0.29 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.16 3gnd h SER 38 CO 0.01 0.45 0.38 0.03 -0.53 0.00 0.00 176.83 177.17 3gnd h ARG 39 N -0.06 0.96 -0.13 2.24 3.08 -0.70 -1.78 114.38 118.00 3gnd h ARG 39 Ca 0.03 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 59.94 3gnd h ARG 39 Cb 0.35 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3gnd h ARG 39 CO 0.01 0.72 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.48 3gnd h LEU 40 N 0.95 0.17 -0.44 3.04 3.38 -0.91 -1.29 115.31 120.21 3gnd h LEU 40 Ca 0.24 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3gnd h LEU 40 Cb 0.04 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3gnd h LEU 40 CO -0.04 0.28 0.00 0.28 0.09 0.00 0.00 178.44 179.05 3gnd h SER 41 N 0.18 0.00 0.45 -0.43 0.02 -0.14 0.14 113.55 113.76 3gnd h SER 41 Ca 0.04 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.88 3gnd h SER 41 Cb 0.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 3gnd h SER 41 CO 0.01 0.00 -0.49 0.03 -1.14 0.00 0.00 176.83 175.24 3gnd h ARG 42 N 0.00 0.05 0.00 3.45 3.08 -0.53 -3.36 114.38 117.07 3gnd h ARG 42 Ca 0.00 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 59.90 3gnd h ARG 42 Cb 0.80 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.83 3gnd h ARG 42 CO 0.00 0.53 -0.79 0.82 -1.07 0.00 0.00 179.97 179.46 3gnd h ILE 43 N 0.04 0.77 -3.50 2.04 2.04 -1.29 -3.44 117.51 114.18 3gnd h ILE 43 Ca -0.00 -1.84 -0.72 0.00 1.00 0.00 0.00 64.86 63.30 3gnd h ILE 43 Cb 0.88 1.72 -0.22 0.00 -0.74 0.00 0.00 36.82 38.46 3gnd h ILE 43 CO 0.07 0.26 -0.44 -0.36 0.00 0.00 0.00 178.15 177.68 3gnd s PHE 44 N -2.25 3.24 -0.35 1.37 0.08 0.42 -4.52 117.98 115.98 3gnd s PHE 44 Ca -0.22 -0.75 -0.42 0.00 0.12 0.00 0.00 56.93 55.66 3gnd s PHE 44 Cb 0.03 -2.63 -0.17 0.00 -0.57 0.00 0.00 43.02 39.68 3gnd s PHE 44 CO 0.48 -0.64 1.74 -1.71 -0.10 0.00 0.00 175.22 174.98 3gnd n ASN 45 N 5.12 2.02 -0.09 1.36 2.85 -0.50 -4.52 115.26 121.50 3gnd n ASN 45 Ca -0.11 1.07 0.12 0.00 -0.11 0.00 0.00 54.58 55.55 3gnd n ASN 45 Cb 0.46 -1.07 0.50 0.00 1.24 0.00 0.00 39.78 40.92 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 6.85 0.39 0.61 1.20 0.11 -1.90 1.17 132.00 140.43 3gnd h PRO 46 Ca -0.44 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 3gnd h PRO 46 Cb 1.34 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.36 3gnd h PRO 46 CO 0.97 0.26 -0.29 0.87 -0.21 0.00 0.00 178.00 179.60 3gnd h LYS 47 N 0.40 -0.79 0.00 1.05 1.79 -1.98 -3.36 116.57 113.68 3gnd h LYS 47 Ca 0.29 0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.81 3gnd h LYS 47 Cb 0.58 0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 31.41 3gnd h LYS 47 CO -0.08 -0.52 -0.84 1.79 -1.08 0.00 0.00 179.45 178.71 3gnd h THR 48 N -1.21 0.00 -0.02 -0.16 1.35 -1.87 -3.47 112.91 107.53 3gnd h THR 48 Ca -0.08 -1.01 -0.01 0.00 -0.55 0.00 0.00 66.41 64.76 3gnd h THR 48 Cb 0.64 1.58 -0.00 0.00 -1.73 0.00 0.00 68.15 68.64 3gnd h THR 48 CO 0.14 0.00 -0.01 0.61 -0.25 0.00 0.00 175.52 176.01 3gnd n GLY 49 N 1.17 0.39 3.64 5.82 0.00 0.40 -5.01 105.19 111.60 3gnd n GLY 49 Ca 0.01 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.68 2.03 -0.08 1.61 1.02 -1.24 -4.76 119.74 117.63 3gnd s LYS 50 Ca 0.00 -2.24 -0.13 0.00 0.02 0.00 0.00 55.97 53.62 3gnd s LYS 50 Cb 0.00 -1.23 0.03 0.00 -0.52 0.00 0.00 37.83 36.10 3gnd s LYS 50 CO 0.00 -0.32 0.33 -0.08 -0.92 0.00 0.00 175.35 174.36 3gnd s THR 51 N -2.98 0.02 -0.35 2.17 -1.32 -0.82 -1.41 115.64 110.95 3gnd s THR 51 Ca 0.19 -0.19 -0.06 0.00 -1.21 0.00 0.00 61.69 60.42 3gnd s THR 51 Cb 0.04 -0.53 0.05 0.00 -1.51 0.00 0.00 72.50 70.55 3gnd s THR 51 CO 0.10 -0.11 0.12 -0.69 -2.21 0.00 0.00 174.62 171.83 3gnd s VAL 52 N -0.43 3.64 -0.23 5.08 1.01 -1.26 -2.29 120.40 125.92 3gnd s VAL 52 Ca -0.06 -1.32 -0.07 0.00 0.00 0.00 0.00 61.98 60.54 3gnd s VAL 52 Cb -0.04 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 3gnd s VAL 52 CO 0.02 -0.27 0.05 -0.32 0.00 0.00 0.00 175.10 174.59 3gnd s MET 53 N 1.35 3.68 -0.43 2.72 1.75 0.09 -2.08 119.30 126.38 3gnd s MET 53 Ca -0.01 -0.47 -0.21 0.00 -1.25 0.00 0.00 55.69 53.75 3gnd s MET 53 Cb -0.20 -3.26 0.02 0.00 2.84 0.00 0.00 34.83 34.23 3gnd s MET 53 CO 0.01 -0.09 0.67 -1.17 -0.65 0.00 0.00 175.02 173.79 3gnd s LEU 54 N 1.34 4.42 -0.22 4.11 2.96 -0.17 -2.08 118.68 129.03 3gnd s LEU 54 Ca 0.05 -0.23 -0.08 0.00 -0.22 0.00 0.00 54.13 53.65 3gnd s LEU 54 Cb -0.15 -2.79 -0.04 0.00 0.50 0.00 0.00 46.19 43.72 3gnd s LEU 54 CO 0.03 -0.78 0.10 0.00 -1.32 0.00 0.00 176.35 174.37 3gnd s ALA 55 N 2.90 3.41 -0.30 5.97 0.00 0.01 -1.23 121.76 132.53 3gnd s ALA 55 Ca 0.24 -0.89 0.20 0.00 0.00 0.00 0.00 51.96 51.51 3gnd s ALA 55 Cb -0.14 -2.09 0.48 0.00 0.00 0.00 0.00 23.12 21.37 3gnd s ALA 55 CO 0.19 -0.11 1.01 1.97 0.00 0.00 0.00 175.76 178.83 3gnd n PHE 56 N 4.12 1.21 1.04 0.00 1.16 -0.32 -4.25 117.46 120.42 3gnd n PHE 56 Ca -0.16 -2.54 0.11 0.00 -1.87 0.00 0.00 57.45 53.00 3gnd n PHE 56 Cb 0.52 -0.32 0.07 0.00 -1.61 0.00 0.00 39.48 38.13 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 -0.27 2.03 -0.42 5.98 5.75 -1.23 -4.59 116.55 123.79 3gnd n ASP 57 Ca 0.09 -1.50 0.35 0.00 -0.01 0.00 0.00 54.79 53.71 3gnd n ASP 57 Cb 0.81 0.37 0.66 0.00 -1.03 0.00 0.00 41.12 41.93 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 2.58 0.36 0.00 2.11 3.86 -1.93 -0.12 115.15 122.01 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 0.75 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 29.13 3gnd h HIS 58 CO 0.00 -0.06 0.00 0.78 0.86 0.00 0.00 177.93 179.51 3gnd h GLY 59 N 0.13 0.00 1.90 2.45 0.00 -1.81 -2.94 103.07 102.80 3gnd h GLY 59 Ca 0.72 0.00 0.01 0.00 0.00 0.00 0.00 47.33 48.06 3gnd h GLY 59 CO -0.24 0.00 0.04 0.10 0.00 0.00 0.00 176.54 176.45 3gnd h TYR 60 N 0.00 0.00 0.00 5.60 -0.00 -1.32 -1.74 116.97 119.52 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 0.05 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.78 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 -3.72 0.00 0.37 0.10 1.16 -1.21 -4.72 117.46 109.43 3gnd n PHE 61 Ca -0.02 0.00 0.04 0.00 -1.87 0.00 0.00 57.45 55.60 3gnd n PHE 61 Cb 0.13 0.00 -0.03 0.00 -1.61 0.00 0.00 39.48 37.96 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 -0.04 3.97 0.00 3.97 6.02 -1.10 -1.97 117.38 128.24 3gnd n GLN 62 Ca 0.00 -0.11 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 3gnd n GLN 62 Cb 0.16 -0.90 0.00 0.00 1.02 0.00 0.00 30.24 30.52 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 1.11 -0.14 3.57 1.08 0.00 -0.67 -4.40 105.19 105.72 3gnd n GLY 63 Ca 0.02 -1.03 -0.27 0.00 0.00 0.00 0.00 46.02 44.74 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 2.53 0.68 1.61 0.02 -1.26 -4.17 135.00 134.40 3gnd s PRO 64 Ca 0.00 -0.57 -0.14 0.00 0.02 0.00 0.00 61.00 60.31 3gnd s PRO 64 Cb 0.00 -5.12 0.01 0.00 0.02 0.00 0.00 34.50 29.41 3gnd s PRO 64 CO 0.00 -3.59 1.11 -0.08 -0.33 0.00 0.00 177.00 174.11 3gnd s THR 65 N 10.43 3.22 0.16 0.99 -1.32 -1.26 -4.80 115.64 123.07 3gnd s THR 65 Ca 0.70 0.54 -0.32 0.00 -1.21 0.00 0.00 61.69 61.39 3gnd s THR 65 Cb -0.05 -3.06 -0.12 0.00 -1.51 0.00 0.00 72.50 67.76 3gnd s THR 65 CO 0.04 -0.37 1.71 0.41 -2.21 0.00 0.00 174.62 174.20 3gnd n THR 66 N -2.58 0.10 0.00 5.08 -1.04 -1.26 -1.58 114.28 113.00 3gnd n THR 66 Ca 0.10 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 3gnd n THR 66 Cb 0.52 -1.88 0.00 0.00 -1.82 0.00 0.00 70.33 67.15 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 3.89 3.30 0.32 3.41 0.00 -1.26 -4.85 105.19 109.99 3gnd n GLY 67 Ca 0.17 0.00 0.09 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 2.77 -0.13 0.99 4.77 -0.62 -4.65 117.00 120.14 3gnd n LEU 68 Ca 0.00 -3.13 -0.08 0.00 -0.03 0.00 0.00 56.01 52.76 3gnd n LEU 68 Cb 0.00 -0.47 -0.00 0.00 -2.33 0.00 0.00 43.42 40.62 3gnd n LEU 68 CO 0.00 0.75 1.01 -0.33 -1.33 0.00 0.00 177.39 177.50 3gnd h GLU 69 N 0.50 0.53 -2.88 3.23 3.07 -1.86 -3.36 114.58 113.80 3gnd h GLU 69 Ca 0.01 -0.04 -0.61 0.00 -0.50 0.00 0.00 59.36 58.21 3gnd h GLU 69 Cb 1.12 -0.11 -0.41 0.00 -0.84 0.00 0.00 28.75 28.51 3gnd h GLU 69 CO 0.06 0.39 -0.66 0.54 -1.40 0.00 0.00 179.01 177.93 3gnd n ARG 70 N -4.78 1.50 -0.31 2.33 5.12 -1.26 -4.92 116.66 114.34 3gnd n ARG 70 Ca 0.00 -4.21 0.08 0.00 -1.93 0.00 0.00 57.85 51.79 3gnd n ARG 70 Cb 0.05 -2.15 0.24 0.00 -1.16 0.00 0.00 32.46 29.44 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 4.36 0.74 0.00 0.55 1.08 -1.89 0.70 117.51 123.06 3gnd h ILE 71 Ca 0.18 -0.23 -0.00 0.00 -0.39 0.00 0.00 64.86 64.41 3gnd h ILE 71 Cb 0.78 0.01 -0.00 0.00 -3.07 0.00 0.00 36.82 34.54 3gnd h ILE 71 CO 0.65 0.12 -0.01 -2.24 -0.69 0.00 0.00 178.15 175.98 3gnd h ASP 72 N 0.67 0.00 0.00 1.72 2.03 -1.91 -0.26 116.42 118.67 3gnd h ASP 72 Ca 0.48 0.00 -0.16 0.00 -0.73 0.00 0.00 57.03 56.62 3gnd h ASP 72 Cb 0.67 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.15 3gnd h ASP 72 CO -0.36 0.01 -1.36 -0.38 -1.03 0.00 0.00 179.24 176.13 3gnd n ILE 73 N -3.23 1.00 0.14 4.15 5.41 -0.25 -4.35 119.36 122.23 3gnd n ILE 73 Ca -0.02 -0.04 -0.24 0.00 1.00 0.00 0.00 62.75 63.45 3gnd n ILE 73 Cb 0.12 -1.80 -0.16 0.00 -0.71 0.00 0.00 39.64 37.09 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 0.80 0.50 4.38 4.21 -0.99 -3.37 115.58 120.59 3gnd h ASN 74 Ca -0.24 -0.86 -0.29 0.00 1.21 0.00 0.00 56.30 56.11 3gnd h ASN 74 Cb 1.04 -0.26 -0.04 0.00 -1.12 0.00 0.00 38.32 37.94 3gnd h ASN 74 CO -0.14 1.68 -1.64 0.40 -1.29 0.00 0.00 177.43 176.44 3gnd h ILE 75 N 0.14 0.96 -0.79 2.81 1.08 -1.44 -3.39 117.51 116.89 3gnd h ILE 75 Ca -0.25 -2.76 0.13 0.00 -0.39 0.00 0.00 64.86 61.60 3gnd h ILE 75 Cb 2.15 2.53 -0.14 0.00 -3.07 0.00 0.00 36.82 38.29 3gnd h ILE 75 CO 0.27 0.64 -0.34 0.00 -0.69 0.00 0.00 178.15 178.03 3gnd h ALA 76 N 0.81 0.11 0.00 1.87 0.00 -1.24 0.19 119.26 121.01 3gnd h ALA 76 Ca -0.26 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3gnd h ALA 76 Cb 1.99 0.86 0.00 0.00 0.00 0.00 0.00 17.79 20.64 3gnd h ALA 76 CO 0.10 -0.62 0.00 -2.30 0.00 0.00 0.00 179.25 176.42 3gnd n PRO 77 N -5.46 0.06 0.08 0.00 -0.02 -1.26 -2.47 135.00 125.93 3gnd n PRO 77 Ca 0.08 0.28 0.09 0.00 -2.02 0.00 0.00 63.50 61.93 3gnd n PRO 77 Cb 0.38 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.34 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 -1.40 0.82 -0.03 2.45 4.77 0.68 -4.52 117.00 119.77 3gnd n LEU 78 Ca 0.03 0.33 -0.08 0.00 -0.03 0.00 0.00 56.01 56.26 3gnd n LEU 78 Cb 0.09 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.13 3gnd n LEU 78 CO 0.07 -0.11 0.73 -0.26 -1.33 0.00 0.00 177.39 176.49 3gnd h PHE 79 N 0.00 -0.49 -0.07 -1.77 0.04 -1.49 -1.45 116.94 111.71 3gnd h PHE 79 Ca -0.04 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.78 3gnd h PHE 79 Cb 1.13 0.25 -0.00 0.00 2.20 0.00 0.00 35.95 39.52 3gnd h PHE 79 CO 0.00 -0.27 0.07 1.05 -0.60 0.00 0.00 178.31 178.57 3gnd h GLU 80 N -0.20 0.00 -0.17 1.51 4.11 -1.81 -0.11 114.58 117.91 3gnd h GLU 80 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.55 3gnd h GLU 80 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3gnd h GLU 80 CO -0.32 0.00 0.00 0.72 0.07 0.00 0.00 179.01 179.48 3gnd n HIS 81 N -3.93 0.23 -4.28 2.06 8.25 -0.55 -4.87 115.22 112.13 3gnd n HIS 81 Ca -0.01 -0.11 -0.27 0.00 -0.26 0.00 0.00 57.72 57.07 3gnd n HIS 81 Cb 0.17 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.19 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 -1.77 2.98 -0.02 -1.41 0.00 -0.06 -4.88 121.76 116.59 3gnd s ALA 82 Ca 0.22 -1.46 -0.22 0.00 0.00 0.00 0.00 51.96 50.51 3gnd s ALA 82 Cb 0.11 -0.77 -0.24 0.00 0.00 0.00 0.00 23.12 22.22 3gnd s ALA 82 CO 0.16 0.47 1.05 -0.44 0.00 0.00 0.00 175.76 177.00 3gnd h ASP 83 N 2.89 0.41 -4.56 0.00 3.32 -1.71 -3.47 116.42 113.29 3gnd h ASP 83 Ca -0.47 -0.79 -0.16 0.00 0.02 0.00 0.00 57.03 55.63 3gnd h ASP 83 Cb 1.20 -0.13 -0.23 0.00 0.22 0.00 0.00 39.33 40.40 3gnd h ASP 83 CO 0.55 1.15 -0.52 0.54 -1.72 0.00 0.00 179.24 179.24 3gnd s VAL 84 N -3.08 0.06 -0.04 -1.35 0.11 -1.18 -4.20 120.40 110.72 3gnd s VAL 84 Ca -0.14 -0.46 -0.09 0.00 -2.93 0.00 0.00 61.98 58.35 3gnd s VAL 84 Cb 0.02 -0.35 -0.05 0.00 -1.53 0.00 0.00 36.38 34.48 3gnd s VAL 84 CO 0.79 -0.26 0.26 -0.76 -3.33 0.00 0.00 175.10 171.81 3gnd s LEU 85 N -0.88 4.41 -0.11 2.54 1.43 -0.01 -1.00 118.68 125.06 3gnd s LEU 85 Ca -0.10 0.65 0.02 0.00 -1.03 0.00 0.00 54.13 53.68 3gnd s LEU 85 Cb -0.05 -2.42 0.01 0.00 0.03 0.00 0.00 46.19 43.75 3gnd s LEU 85 CO 0.01 0.33 -0.18 -0.32 0.23 0.00 0.00 176.35 176.43 3gnd s MET 86 N -1.28 2.47 0.14 1.70 -2.45 -0.37 0.00 119.30 119.52 3gnd s MET 86 Ca 0.22 -0.66 -0.19 0.00 -1.25 0.00 0.00 55.69 53.81 3gnd s MET 86 Cb -0.14 -2.04 0.07 0.00 1.25 0.00 0.00 34.83 33.97 3gnd s MET 86 CO 0.11 -0.03 0.92 0.00 1.05 0.00 0.00 175.02 177.07 3gnd s THR 88 N -2.12 3.75 0.13 0.00 -4.23 -1.26 -1.11 115.64 110.80 3gnd s THR 88 Ca 0.21 -0.21 0.23 0.00 -1.18 0.00 0.00 61.69 60.74 3gnd s THR 88 Cb -0.02 -3.45 0.22 0.00 1.34 0.00 0.00 72.50 70.59 3gnd s THR 88 CO 0.04 -0.40 1.80 0.08 -0.54 0.00 0.00 174.62 175.60 3gnd h ARG 89 N 0.05 0.00 0.61 3.99 0.11 -1.97 -0.77 114.38 116.40 3gnd h ARG 89 Ca -0.46 0.00 -0.03 0.00 0.10 0.00 0.00 59.98 59.59 3gnd h ARG 89 Cb 1.26 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.34 3gnd h ARG 89 CO 0.59 0.25 -0.29 0.78 0.10 0.00 0.00 179.97 181.40 3gnd h GLY 90 N 2.11 -0.86 1.01 0.08 0.00 -1.97 -2.31 103.07 101.13 3gnd h GLY 90 Ca -0.00 0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.60 3gnd h GLY 90 CO 0.03 -0.31 0.22 -2.22 0.00 0.00 0.00 176.54 174.26 3gnd h ILE 91 N -0.83 1.24 0.30 2.60 1.08 -1.94 -2.27 117.51 117.68 3gnd h ILE 91 Ca -0.08 -0.81 0.00 0.00 -0.39 0.00 0.00 64.86 63.58 3gnd h ILE 91 Cb 0.63 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 34.93 3gnd h ILE 91 CO 0.14 0.31 -0.33 0.25 -0.69 0.00 0.00 178.15 177.83 3gnd h LEU 92 N 0.91 -0.92 -0.75 1.44 5.85 -1.13 -0.34 115.31 120.37 3gnd h LEU 92 Ca 0.21 0.08 -0.06 0.00 0.84 0.00 0.00 57.88 58.96 3gnd h LEU 92 Cb 0.27 0.32 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 3gnd h LEU 92 CO -0.01 -0.46 0.25 0.03 -0.34 0.00 0.00 178.44 177.90 3gnd h ARG 93 N -0.67 1.15 -0.01 1.25 3.08 -1.40 -2.91 114.38 114.86 3gnd h ARG 93 Ca -0.01 -0.24 -0.14 0.00 0.07 0.00 0.00 59.98 59.66 3gnd h ARG 93 Cb 0.62 -0.17 0.01 0.00 0.08 0.00 0.00 29.97 30.52 3gnd h ARG 93 CO -0.09 0.97 -0.55 0.66 -1.07 0.00 0.00 179.97 179.89 3gnd h SER 94 N 1.10 0.51 0.00 7.04 4.64 -0.96 -3.42 113.55 122.46 3gnd h SER 94 Ca 0.24 -0.75 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3gnd h SER 94 Cb 0.29 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3gnd h SER 94 CO -0.01 1.19 0.00 1.33 -0.87 0.00 0.00 176.83 178.47 3gnd n VAL 95 N -4.25 0.00 -3.19 0.95 0.24 -0.18 -4.98 118.33 106.92 3gnd n VAL 95 Ca -0.10 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.34 61.61 3gnd n VAL 95 Cb 0.65 1.35 -0.07 0.00 -1.47 0.00 0.00 33.84 34.29 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 -0.16 4.96 0.18 3.34 1.01 -1.10 -4.75 120.40 123.88 3gnd s VAL 96 Ca 0.00 0.35 -0.30 0.00 0.00 0.00 0.00 61.98 62.03 3gnd s VAL 96 Cb 0.00 -4.03 -0.09 0.00 0.00 0.00 0.00 36.38 32.26 3gnd s VAL 96 CO 0.00 -0.30 1.32 -2.84 0.00 0.00 0.00 175.10 173.27 3gnd s PRO 97 N 2.53 4.38 0.53 2.72 0.02 -1.26 -4.74 135.00 139.17 3gnd s PRO 97 Ca 0.20 2.05 0.21 0.00 0.02 0.00 0.00 61.00 63.49 3gnd s PRO 97 Cb -0.15 -3.21 1.35 0.00 0.02 0.00 0.00 34.50 32.51 3gnd s PRO 97 CO 0.14 -0.28 2.06 -1.35 -0.33 0.00 0.00 177.00 177.25 3gnd h PRO 98 N 5.61 0.00 0.00 5.54 0.11 -1.96 -0.05 132.00 141.25 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 0.79 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.58 3gnd n ALA 99 N -2.60 1.82 0.32 -0.75 0.00 -1.26 -2.31 120.51 115.74 3gnd n ALA 99 Ca 0.04 -0.07 0.20 0.00 0.00 0.00 0.00 53.44 53.62 3gnd n ALA 99 Cb 0.39 -1.23 1.08 0.00 0.00 0.00 0.00 19.45 19.70 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 0.12 -6.80 0.00 2.02 -1.37 -3.45 112.91 103.43 3gnd h THR 100 Ca 0.00 0.00 -0.56 0.00 0.77 0.00 0.00 66.41 66.62 3gnd h THR 100 Cb 0.12 0.93 -0.14 0.00 -1.74 0.00 0.00 68.15 67.32 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 -3.23 0.18 -4.10 4.18 5.15 -0.98 -4.90 115.26 111.57 3gnd n ASN 101 Ca -0.02 -1.14 -0.22 0.00 -0.60 0.00 0.00 54.58 52.59 3gnd n ASN 101 Cb 0.14 -2.32 -0.15 0.00 -0.53 0.00 0.00 39.78 36.92 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 -6.97 1.16 0.41 1.20 6.06 -1.26 -5.13 118.95 114.42 3gnd s ARG 102 Ca 0.04 -0.49 -0.26 0.00 -2.50 0.00 0.00 55.73 52.52 3gnd s ARG 102 Cb -0.02 -1.11 -0.09 0.00 0.06 0.00 0.00 34.95 33.79 3gnd s ARG 102 CO 0.95 0.28 1.35 -2.14 -2.50 0.00 0.00 175.30 173.24 3gnd s PRO 103 N -0.26 3.93 0.09 5.12 0.02 -1.26 -4.80 135.00 137.84 3gnd s PRO 103 Ca 0.04 2.27 0.10 0.00 0.02 0.00 0.00 61.00 63.43 3gnd s PRO 103 Cb -0.06 -2.77 -0.03 0.00 0.02 0.00 0.00 34.50 31.66 3gnd s PRO 103 CO -0.00 -0.57 -0.26 0.14 -0.33 0.00 0.00 177.00 175.98 3gnd s VAL 104 N -1.23 2.25 -0.24 3.83 -7.23 -1.26 -0.82 120.40 115.70 3gnd s VAL 104 Ca 0.57 -1.57 0.00 0.00 -1.81 0.00 0.00 61.98 59.17 3gnd s VAL 104 Cb -0.40 -1.95 0.04 0.00 0.56 0.00 0.00 36.38 34.62 3gnd s VAL 104 CO 0.52 0.22 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.74 3gnd s VAL 105 N -0.95 2.55 -0.05 1.32 1.01 0.10 -1.53 120.40 122.86 3gnd s VAL 105 Ca 0.13 -1.19 -0.27 0.00 0.00 0.00 0.00 61.98 60.65 3gnd s VAL 105 Cb -0.10 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 3gnd s VAL 105 CO 0.04 0.18 0.86 -0.76 0.00 0.00 0.00 175.10 175.43 3gnd s LEU 106 N 1.25 4.33 0.07 3.92 1.43 -0.41 -2.80 118.68 126.47 3gnd s LEU 106 Ca -0.02 1.43 -0.30 0.00 -1.03 0.00 0.00 54.13 54.21 3gnd s LEU 106 Cb -0.17 -3.35 -0.09 0.00 0.03 0.00 0.00 46.19 42.61 3gnd s LEU 106 CO -0.06 -0.23 1.81 -0.60 0.23 0.00 0.00 176.35 177.50 3gnd s ARG 107 N 1.07 4.16 -0.13 1.70 6.06 -0.27 -0.57 118.95 130.97 3gnd s ARG 107 Ca 0.45 2.49 0.15 0.00 -2.50 0.00 0.00 55.73 56.32 3gnd s ARG 107 Cb -0.19 -3.79 0.31 0.00 0.06 0.00 0.00 34.95 31.34 3gnd s ARG 107 CO 0.22 -0.85 1.16 0.00 -2.50 0.00 0.00 175.30 173.33 3gnd n ALA 108 N 6.33 2.69 -2.23 6.12 0.00 0.15 -4.58 120.51 128.99 3gnd n ALA 108 Ca 0.18 -2.66 -0.13 0.00 0.00 0.00 0.00 53.44 50.83 3gnd n ALA 108 Cb 0.40 -0.41 -0.10 0.00 0.00 0.00 0.00 19.45 19.34 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 -2.74 0.75 0.00 0.00 1.04 -1.24 0.46 113.70 111.98 3gnd s SER 109 Ca 0.31 -1.29 0.00 0.00 0.48 0.00 0.00 55.95 55.45 3gnd s SER 109 Cb 0.29 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.64 3gnd s SER 109 CO -0.02 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.10 3gnd n GLY 110 N -0.28 -0.51 2.21 7.32 0.00 -0.49 -4.58 105.19 108.86 3gnd n GLY 110 Ca -0.03 -0.88 -0.01 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.02 -2.49 4.61 0.00 -1.26 -0.41 120.51 120.93 3gnd n ALA 111 Ca 0.00 0.02 -0.27 0.00 0.00 0.00 0.00 53.44 53.20 3gnd n ALA 111 Cb 0.00 -0.51 -0.06 0.00 0.00 0.00 0.00 19.45 18.88 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 -2.28 4.39 0.21 0.00 4.22 -1.24 -4.80 114.94 115.44 3gnd s ASN 112 Ca 0.00 -1.23 -0.21 0.00 -2.14 0.00 0.00 52.86 49.28 3gnd s ASN 112 Cb 0.00 -0.10 0.04 0.00 1.28 0.00 0.00 41.25 42.47 3gnd s ASN 112 CO 0.00 -0.72 0.62 -0.94 -2.04 0.00 0.00 177.10 174.02 3gnd s SER 113 N -3.98 -0.38 0.00 3.54 1.04 -1.26 -4.55 113.70 108.12 3gnd s SER 113 Ca 0.33 -0.35 0.10 0.00 0.48 0.00 0.00 55.95 56.52 3gnd s SER 113 Cb 0.02 0.64 0.52 0.00 0.10 0.00 0.00 66.02 67.31 3gnd s SER 113 CO 0.19 -1.13 1.21 2.30 0.98 0.00 0.00 173.24 176.79 3gnd n ILE 114 N -0.40 0.73 1.19 -1.02 -5.35 -0.83 -1.84 119.36 111.84 3gnd n ILE 114 Ca -0.10 0.18 0.13 0.00 -0.27 0.00 0.00 62.75 62.68 3gnd n ILE 114 Cb 0.62 -1.01 0.26 0.00 -1.74 0.00 0.00 39.64 37.77 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 -1.28 2.16 0.00 7.28 4.77 -1.26 -4.98 117.00 123.70 3gnd n LEU 115 Ca 0.05 -0.72 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 3gnd n LEU 115 Cb 0.08 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 3gnd n LEU 115 CO 0.08 0.37 0.00 0.00 -1.33 0.00 0.00 177.39 176.51 3gnd n ALA 116 N 0.56 0.00 -1.76 -1.18 0.00 -0.77 -5.10 120.51 112.27 3gnd n ALA 116 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.16 3gnd n ALA 116 Cb 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 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 -0.66 3.81 0.40 0.00 2.56 -1.26 -4.75 118.70 118.80 3gnd s GLU 117 Ca 0.00 2.26 0.10 0.00 0.00 0.00 0.00 54.97 57.33 3gnd s GLU 117 Cb 0.00 -4.18 0.90 0.00 2.00 0.00 0.00 34.13 32.84 3gnd s GLU 117 CO 0.00 -1.32 1.99 1.25 -0.56 0.00 0.00 175.26 176.62 3gnd h LEU 118 N 11.99 0.49 -0.47 2.70 5.85 -1.96 -2.28 115.31 131.63 3gnd h LEU 118 Ca -0.44 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.28 3gnd h LEU 118 Cb 1.22 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3gnd h LEU 118 CO 0.96 0.32 0.00 -1.54 -0.34 0.00 0.00 178.44 177.83 3gnd n SER 119 N -4.48 0.69 -3.84 1.25 3.41 -1.26 -4.50 113.62 104.90 3gnd n SER 119 Ca 0.08 -1.68 -0.42 0.00 -0.26 0.00 0.00 58.87 56.59 3gnd n SER 119 Cb 0.25 -0.06 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 -0.26 4.92 -4.78 4.04 5.15 -0.86 -4.42 115.26 119.05 3gnd n ASN 120 Ca 0.12 -3.08 -0.32 0.00 -0.60 0.00 0.00 54.58 50.70 3gnd n ASN 120 Cb 0.15 -1.50 -0.07 0.00 -0.53 0.00 0.00 39.78 37.83 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 0.75 3.03 0.40 1.20 2.02 -1.26 -3.73 118.70 121.12 3gnd s GLU 121 Ca 0.40 -0.53 0.08 0.00 0.02 0.00 0.00 54.97 54.94 3gnd s GLU 121 Cb 0.10 -2.83 -0.07 0.00 0.10 0.00 0.00 34.13 31.43 3gnd s GLU 121 CO -0.01 0.63 0.02 0.00 0.02 0.00 0.00 175.26 175.93 3gnd s ALA 122 N -1.24 3.21 0.08 5.21 0.00 0.45 -4.71 121.76 124.77 3gnd s ALA 122 Ca 0.24 -2.23 -0.31 0.00 0.00 0.00 0.00 51.96 49.67 3gnd s ALA 122 Cb -0.12 0.01 -0.07 0.00 0.00 0.00 0.00 23.12 22.94 3gnd s ALA 122 CO 0.16 -0.09 1.43 0.08 0.00 0.00 0.00 175.76 177.33 3gnd s VAL 123 N -2.67 3.35 -1.76 0.00 1.01 -1.26 -1.40 120.40 117.68 3gnd s VAL 123 Ca 0.36 0.91 0.19 0.00 0.00 0.00 0.00 61.98 63.44 3gnd s VAL 123 Cb 0.07 -3.58 -0.00 0.00 0.00 0.00 0.00 36.38 32.87 3gnd s VAL 123 CO 0.19 0.05 0.97 0.00 0.00 0.00 0.00 175.10 176.30 3gnd n ALA 124 N 4.47 3.34 -3.56 5.51 0.00 0.17 -4.84 120.51 125.60 3gnd n ALA 124 Ca 0.12 -0.59 -0.13 0.00 0.00 0.00 0.00 53.44 52.84 3gnd n ALA 124 Cb 0.42 -0.67 -0.08 0.00 0.00 0.00 0.00 19.45 19.12 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 -2.23 -0.51 0.56 0.00 0.05 -1.25 -4.89 118.68 110.41 3gnd s LEU 125 Ca 0.16 1.32 -0.18 0.00 0.05 0.00 0.00 54.13 55.47 3gnd s LEU 125 Cb 0.15 2.23 -0.05 0.00 -2.05 0.00 0.00 46.19 46.47 3gnd s LEU 125 CO 0.48 -0.23 1.10 -0.94 -0.55 0.00 0.00 176.35 176.21 3gnd s SER 126 N 0.42 5.76 0.29 1.48 1.04 -1.26 -4.91 113.70 116.53 3gnd s SER 126 Ca -0.01 2.05 -0.02 0.00 0.48 0.00 0.00 55.95 58.46 3gnd s SER 126 Cb -0.05 -2.57 0.44 0.00 0.10 0.00 0.00 66.02 63.95 3gnd s SER 126 CO -0.00 -1.19 1.92 -0.03 0.98 0.00 0.00 173.24 174.92 3gnd h MET 127 N 0.99 0.99 -0.91 4.02 4.05 -1.99 -0.50 114.93 121.59 3gnd h MET 127 Ca -0.49 -0.10 0.12 0.00 -0.28 0.00 0.00 59.70 58.95 3gnd h MET 127 Cb 1.25 -0.20 -0.13 0.00 -0.80 0.00 0.00 31.60 31.71 3gnd h MET 127 CO 0.57 0.72 -0.42 -3.47 0.23 0.00 0.00 176.91 174.54 3gnd n ASP 128 N -4.37 -0.72 0.17 1.39 2.03 -1.26 -0.69 116.55 113.10 3gnd n ASP 128 Ca 0.07 1.59 0.05 0.00 0.52 0.00 0.00 54.79 57.02 3gnd n ASP 128 Cb 0.09 -0.31 0.21 0.00 -0.72 0.00 0.00 41.12 40.39 3gnd n ASP 128 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 3gnd h ASP 129 N 0.00 0.00 -0.44 1.67 3.58 -1.49 -1.73 116.42 118.01 3gnd h ASP 129 Ca 0.26 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.64 3gnd h ASP 129 Cb 0.48 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.52 3gnd h ASP 129 CO -0.88 0.41 0.01 0.00 -2.88 0.00 0.00 179.24 175.90 3gnd h ALA 130 N 1.59 0.59 -0.27 -0.78 0.00 -0.15 -0.35 119.26 119.88 3gnd h ALA 130 Ca -0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 3gnd h ALA 130 Cb 1.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3gnd h ALA 130 CO 0.05 0.37 -0.34 0.28 0.00 0.00 0.00 179.25 179.62 3gnd h VAL 131 N 0.61 1.29 -0.59 0.00 2.07 -0.72 -2.36 116.25 116.55 3gnd h VAL 131 Ca 0.12 -1.46 -0.03 0.00 0.82 0.00 0.00 66.70 66.16 3gnd h VAL 131 Cb 0.48 1.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 3gnd h VAL 131 CO 0.02 0.47 0.24 -0.09 0.02 0.00 0.00 177.57 178.23 3gnd h ARG 132 N 0.50 0.86 -0.01 1.57 2.43 -0.99 -1.24 114.38 117.50 3gnd h ARG 132 Ca 0.06 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3gnd h ARG 132 Cb 0.82 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 3gnd h ARG 132 CO 0.07 0.70 0.00 1.28 -1.51 0.00 0.00 179.97 180.51 3gnd n LEU 133 N -4.33 0.28 -3.09 3.80 4.77 -0.17 -4.93 117.00 113.34 3gnd n LEU 133 Ca 0.05 -0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.72 3gnd n LEU 133 Cb 0.16 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.30 3gnd n LEU 133 CO 0.39 0.05 0.15 -3.20 -1.33 0.00 0.00 177.39 173.45 3gnd n ASN 134 N -0.71 -5.84 -4.75 -1.43 5.15 -0.47 -4.97 115.26 102.24 3gnd n ASN 134 Ca 0.20 -0.41 -0.33 0.00 -0.60 0.00 0.00 54.58 53.43 3gnd n ASN 134 Cb 0.14 -4.53 0.07 0.00 -0.53 0.00 0.00 39.78 34.93 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 -3.12 4.62 0.04 1.20 0.01 -0.95 -4.78 113.70 110.73 3gnd s SER 135 Ca 0.45 2.15 0.19 0.00 1.31 0.00 0.00 55.95 60.05 3gnd s SER 135 Cb -0.20 -2.57 -0.16 0.00 0.21 0.00 0.00 66.02 63.30 3gnd s SER 135 CO 0.55 -1.96 0.70 0.00 0.41 0.00 0.00 173.24 172.94 3gnd s ALA 137 N -3.11 -1.57 0.01 0.00 0.00 -1.23 -4.23 121.76 111.63 3gnd s ALA 137 Ca -0.04 0.30 0.08 0.00 0.00 0.00 0.00 51.96 52.29 3gnd s ALA 137 Cb 0.10 0.70 -0.03 0.00 0.00 0.00 0.00 23.12 23.90 3gnd s ALA 137 CO 0.83 -0.90 -0.23 0.14 0.00 0.00 0.00 175.76 175.60 3gnd s VAL 138 N -3.52 2.33 0.02 0.00 -7.23 -0.93 -1.28 120.40 109.77 3gnd s VAL 138 Ca 0.08 -1.17 0.07 0.00 -1.81 0.00 0.00 61.98 59.14 3gnd s VAL 138 Cb -0.02 -1.88 -0.02 0.00 0.56 0.00 0.00 36.38 35.01 3gnd s VAL 138 CO -0.03 0.47 -0.21 0.00 -0.31 0.00 0.00 175.10 175.02 3gnd s ALA 139 N -0.74 1.75 0.05 1.32 0.00 0.26 -0.31 121.76 124.09 3gnd s ALA 139 Ca 0.12 -0.99 -0.09 0.00 0.00 0.00 0.00 51.96 51.00 3gnd s ALA 139 Cb -0.10 -0.39 0.00 0.00 0.00 0.00 0.00 23.12 22.63 3gnd s ALA 139 CO 0.01 0.41 0.20 0.00 0.00 0.00 0.00 175.76 176.38 3gnd s ALA 140 N -0.66 -0.34 0.10 0.00 0.00 -0.68 0.31 121.76 120.49 3gnd s ALA 140 Ca 0.08 -0.36 -0.18 0.00 0.00 0.00 0.00 51.96 51.50 3gnd s ALA 140 Cb -0.08 0.33 -0.07 0.00 0.00 0.00 0.00 23.12 23.30 3gnd s ALA 140 CO 0.01 -0.40 0.57 -0.65 0.00 0.00 0.00 175.76 175.28 3gnd s GLN 141 N -2.89 4.13 -0.10 0.00 -1.52 -1.26 -1.09 119.66 116.93 3gnd s GLN 141 Ca -0.03 0.67 0.01 0.00 -1.95 0.00 0.00 55.36 54.06 3gnd s GLN 141 Cb 0.00 -3.14 -0.02 0.00 -0.22 0.00 0.00 33.01 29.64 3gnd s GLN 141 CO -0.06 0.59 -0.14 0.54 -0.25 0.00 0.00 175.29 175.97 3gnd s VAL 142 N -1.23 3.04 -0.67 1.09 0.11 0.10 -4.76 120.40 118.09 3gnd s VAL 142 Ca 0.32 -0.69 0.05 0.00 -2.93 0.00 0.00 61.98 58.73 3gnd s VAL 142 Cb -0.18 -2.24 0.27 0.00 -1.53 0.00 0.00 36.38 32.69 3gnd s VAL 142 CO 0.19 0.55 0.85 -1.22 -3.33 0.00 0.00 175.10 172.13 3gnd n TYR 143 N 3.10 3.61 -1.83 1.54 4.01 -1.26 -0.80 117.16 125.53 3gnd n TYR 143 Ca -0.18 -4.00 -0.42 0.00 -0.16 0.00 0.00 57.90 53.14 3gnd n TYR 143 Cb 0.53 -0.61 -0.03 0.00 -0.31 0.00 0.00 39.34 38.92 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 -2.82 2.28 0.00 -0.72 -1.09 -1.26 -1.54 121.20 116.06 3gnd s ILE 144 Ca 0.41 0.21 0.00 0.00 -2.23 0.00 0.00 60.65 59.04 3gnd s ILE 144 Cb 0.16 -3.13 0.00 0.00 -1.58 0.00 0.00 42.46 37.91 3gnd s ILE 144 CO -0.02 0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.32 3gnd n GLY 145 N 3.48 1.92 3.96 6.18 0.00 -1.26 -4.98 105.19 114.50 3gnd n GLY 145 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.56 4.46 0.24 1.61 0.01 -0.59 -4.99 113.70 111.89 3gnd s SER 146 Ca 0.00 0.04 -0.06 0.00 1.31 0.00 0.00 55.95 57.24 3gnd s SER 146 Cb 0.00 -0.53 0.25 0.00 0.21 0.00 0.00 66.02 65.95 3gnd s SER 146 CO 0.00 -1.79 1.84 -0.08 0.41 0.00 0.00 173.24 173.62 3gnd h GLU 147 N -0.61 1.15 -1.03 12.44 4.81 -1.93 -2.73 114.58 126.68 3gnd h GLU 147 Ca -0.41 -0.17 -0.67 0.00 -0.13 0.00 0.00 59.36 57.98 3gnd h GLU 147 Cb 1.28 -0.21 -0.30 0.00 0.63 0.00 0.00 28.75 30.15 3gnd h GLU 147 CO 0.48 0.89 0.70 0.66 -0.73 0.00 0.00 179.01 181.00 3gnd n TYR 148 N -4.31 3.18 0.09 0.92 4.01 -1.26 -4.71 117.16 115.08 3gnd n TYR 148 Ca 0.08 -2.92 -0.12 0.00 -0.16 0.00 0.00 57.90 54.78 3gnd n TYR 148 Cb 0.14 -1.32 -0.06 0.00 -0.31 0.00 0.00 39.34 37.80 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 2.07 -0.24 -0.60 -0.72 4.81 -1.62 -1.99 114.58 116.30 3gnd h GLU 149 Ca 0.58 0.02 0.11 0.00 -0.13 0.00 0.00 59.36 59.94 3gnd h GLU 149 Cb 0.85 0.05 -0.08 0.00 0.63 0.00 0.00 28.75 30.20 3gnd h GLU 149 CO 1.50 -0.16 0.14 1.25 -0.73 0.00 0.00 179.01 181.01 3gnd h HIS 150 N -0.25 0.23 -0.49 0.92 2.76 -1.87 -1.35 115.15 115.11 3gnd h HIS 150 Ca 0.01 0.04 -0.09 0.00 -2.20 0.00 0.00 60.37 58.12 3gnd h HIS 150 Cb 0.25 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.18 3gnd h HIS 150 CO -0.13 -0.02 -0.06 0.37 -1.30 0.00 0.00 177.93 176.79 3gnd h GLN 151 N 0.28 0.90 -0.60 5.26 5.75 -1.90 -2.00 115.11 122.79 3gnd h GLN 151 Ca 0.31 -0.32 -0.03 0.00 -0.15 0.00 0.00 58.65 58.47 3gnd h GLN 151 Cb 0.46 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.92 3gnd h GLN 151 CO -0.39 0.96 0.27 0.66 -2.65 0.00 0.00 178.83 177.68 3gnd h SER 152 N 0.75 0.78 0.04 -0.69 4.64 -0.50 0.55 113.55 119.11 3gnd h SER 152 Ca 0.13 -0.09 -0.18 0.00 -0.47 0.00 0.00 61.79 61.19 3gnd h SER 152 Cb 0.60 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 3gnd h SER 152 CO 0.04 0.67 -0.63 0.40 -0.87 0.00 0.00 176.83 176.45 3gnd h ILE 153 N 0.85 1.33 -0.65 0.95 2.04 -1.01 -2.56 117.51 118.46 3gnd h ILE 153 Ca 0.21 -1.90 0.01 0.00 1.00 0.00 0.00 64.86 64.18 3gnd h ILE 153 Cb 0.12 1.87 -0.03 0.00 -0.74 0.00 0.00 36.82 38.04 3gnd h ILE 153 CO -0.02 0.59 0.43 0.11 0.00 0.00 0.00 178.15 179.25 3gnd h LYS 154 N 0.42 0.83 -0.76 2.37 1.57 -0.61 0.21 116.57 120.60 3gnd h LYS 154 Ca -0.01 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.79 3gnd h LYS 154 Cb 1.19 -0.19 -0.06 0.00 0.08 0.00 0.00 32.23 33.26 3gnd h LYS 154 CO 0.12 0.55 0.45 -0.91 -0.57 0.00 0.00 179.45 179.08 3gnd h ASN 155 N 0.85 0.68 -0.27 0.86 2.35 -0.52 0.84 115.58 120.37 3gnd h ASN 155 Ca 0.24 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.99 3gnd h ASN 155 Cb -0.06 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 3gnd h ASN 155 CO -0.06 0.43 0.07 0.40 -1.65 0.00 0.00 177.43 176.62 3gnd h ILE 156 N 0.81 1.21 -0.46 2.81 1.08 -0.85 -1.29 117.51 120.82 3gnd h ILE 156 Ca 0.34 -0.69 0.07 0.00 -0.39 0.00 0.00 64.86 64.19 3gnd h ILE 156 Cb 0.21 1.16 -0.06 0.00 -3.07 0.00 0.00 36.82 35.06 3gnd h ILE 156 CO -0.19 0.23 0.12 0.40 -0.69 0.00 0.00 178.15 178.01 3gnd h ILE 157 N 0.26 0.78 -0.69 -0.67 2.04 -0.49 -0.49 117.51 118.26 3gnd h ILE 157 Ca 0.08 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 3gnd h ILE 157 Cb 0.28 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 3gnd h ILE 157 CO 0.00 0.05 0.21 -0.61 0.00 0.00 0.00 178.15 177.80 3gnd h GLN 158 N 0.26 1.07 -0.53 2.37 4.15 -0.74 -0.82 115.11 120.88 3gnd h GLN 158 Ca 0.22 -0.23 -0.09 0.00 0.77 0.00 0.00 58.65 59.32 3gnd h GLN 158 Cb 0.27 -0.15 -0.02 0.00 0.21 0.00 0.00 27.48 27.79 3gnd h GLN 158 CO -0.27 0.92 -0.03 -0.07 -1.93 0.00 0.00 178.83 177.45 3gnd h LEU 159 N 1.00 0.94 -0.22 -2.39 3.38 -0.60 -1.92 115.31 115.50 3gnd h LEU 159 Ca 0.22 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 3gnd h LEU 159 Cb 0.30 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3gnd h LEU 159 CO -0.01 1.04 0.01 0.58 0.09 0.00 0.00 178.44 180.15 3gnd h VAL 160 N 0.82 1.25 -0.47 1.22 2.07 -0.99 0.28 116.25 120.43 3gnd h VAL 160 Ca 0.15 -0.86 0.10 0.00 0.82 0.00 0.00 66.70 66.90 3gnd h VAL 160 Cb 0.57 1.39 -0.09 0.00 -1.52 0.00 0.00 31.29 31.64 3gnd h VAL 160 CO 0.03 0.27 -0.16 0.44 0.02 0.00 0.00 177.57 178.17 3gnd h ASP 161 N 0.15 -0.57 0.08 0.57 3.32 -1.07 -0.38 116.42 118.52 3gnd h ASP 161 Ca 0.06 0.15 -0.15 0.00 0.02 0.00 0.00 57.03 57.11 3gnd h ASP 161 Cb 0.39 0.34 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 3gnd h ASP 161 CO 0.01 -0.20 -0.54 0.00 -1.72 0.00 0.00 179.24 176.79 3gnd h ALA 162 N 1.36 0.74 -0.02 3.45 0.00 -1.11 -3.16 119.26 120.51 3gnd h ALA 162 Ca 0.23 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 54.54 3gnd h ALA 162 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3gnd h ALA 162 CO -0.51 0.69 -0.41 0.78 0.00 0.00 0.00 179.25 179.80 3gnd h GLY 163 N 1.13 0.05 2.00 0.00 0.00 0.31 -3.03 103.07 103.52 3gnd h GLY 163 Ca 0.01 -0.05 -0.06 0.00 0.00 0.00 0.00 47.33 47.23 3gnd h GLY 163 CO 0.10 0.04 -0.30 -0.33 0.00 0.00 0.00 176.54 176.06 3gnd h MET 164 N 0.04 0.00 0.00 4.80 2.07 -1.06 0.39 114.93 121.17 3gnd h MET 164 Ca 0.00 0.00 -0.02 0.00 -2.07 0.00 0.00 59.70 57.62 3gnd h MET 164 Cb 0.75 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.48 3gnd h MET 164 CO 0.06 0.30 -0.08 0.87 1.07 0.00 0.00 176.91 179.12 3gnd h LYS 165 N 0.00 0.00 0.00 1.72 1.57 -1.61 -3.34 116.57 114.91 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 0.85 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.16 3gnd h LYS 165 CO 0.04 0.08 -0.23 0.28 -0.57 0.00 0.00 179.45 179.04 3gnd n VAL 166 N -3.22 0.00 -1.25 0.50 0.31 -0.79 -5.01 118.33 108.87 3gnd n VAL 166 Ca 0.00 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 3gnd n VAL 166 Cb 0.33 0.76 0.00 0.00 -0.91 0.00 0.00 33.84 34.02 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 1.01 0.74 3.56 2.92 0.00 0.12 -4.94 105.19 108.60 3gnd n GLY 167 Ca 0.00 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.69 3.68 0.66 1.61 0.00 -0.41 -3.82 119.30 118.34 3gnd s MET 168 Ca 0.00 -0.41 -0.16 0.00 0.00 0.00 0.00 55.69 55.12 3gnd s MET 168 Cb 0.00 -3.76 0.00 0.00 0.00 0.00 0.00 34.83 31.08 3gnd s MET 168 CO 0.00 -0.40 1.18 -2.14 0.00 0.00 0.00 175.02 173.66 3gnd s PRO 169 N 1.88 2.60 -0.06 4.11 0.02 -1.26 -4.47 135.00 137.81 3gnd s PRO 169 Ca 0.09 1.69 0.06 0.00 0.02 0.00 0.00 61.00 62.86 3gnd s PRO 169 Cb -0.17 -1.90 -0.01 0.00 0.02 0.00 0.00 34.50 32.45 3gnd s PRO 169 CO 0.11 -1.47 -0.24 0.99 -0.33 0.00 0.00 177.00 176.06 3gnd s THR 170 N -1.94 2.11 -0.21 0.99 2.01 -1.26 -2.20 115.64 115.14 3gnd s THR 170 Ca 0.73 -1.04 -0.05 0.00 0.31 0.00 0.00 61.69 61.64 3gnd s THR 170 Cb -0.27 -1.77 -0.02 0.00 0.01 0.00 0.00 72.50 70.45 3gnd s THR 170 CO 0.40 0.57 -0.01 -0.32 -0.69 0.00 0.00 174.62 174.56 3gnd s MET 171 N -0.12 3.51 -0.17 4.92 1.75 0.58 -1.08 119.30 128.69 3gnd s MET 171 Ca -0.05 -0.57 -0.12 0.00 -1.25 0.00 0.00 55.69 53.71 3gnd s MET 171 Cb -0.14 -3.07 -0.05 0.00 2.84 0.00 0.00 34.83 34.42 3gnd s MET 171 CO 0.04 -0.10 0.22 0.00 -0.65 0.00 0.00 175.02 174.53 3gnd s ALA 172 N 1.27 3.65 -0.17 4.11 0.00 -0.43 -1.68 121.76 128.51 3gnd s ALA 172 Ca 0.03 -0.56 -0.02 0.00 0.00 0.00 0.00 51.96 51.42 3gnd s ALA 172 Cb -0.15 -2.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.68 3gnd s ALA 172 CO 0.00 0.15 -0.09 0.08 0.00 0.00 0.00 175.76 175.90 3gnd s VAL 173 N 0.32 3.24 -0.87 0.00 1.01 -0.25 -1.51 120.40 122.35 3gnd s VAL 173 Ca 0.13 -0.57 -0.24 0.00 0.00 0.00 0.00 61.98 61.30 3gnd s VAL 173 Cb -0.12 -2.41 0.05 0.00 0.00 0.00 0.00 36.38 33.90 3gnd s VAL 173 CO 0.02 0.49 1.30 0.42 0.00 0.00 0.00 175.10 177.33 3gnd s THR 174 N 0.77 3.97 0.12 3.92 -4.23 -0.43 0.03 115.64 119.79 3gnd s THR 174 Ca -0.04 -0.37 -0.12 0.00 -1.18 0.00 0.00 61.69 59.98 3gnd s THR 174 Cb -0.15 -4.94 -0.06 0.00 1.34 0.00 0.00 72.50 68.69 3gnd s THR 174 CO 0.01 -1.82 0.48 -0.83 -0.54 0.00 0.00 174.62 171.93 3gnd s GLY 175 N 4.25 2.40 0.00 3.99 0.00 0.02 -4.80 107.32 113.18 3gnd s GLY 175 Ca 0.38 -0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.85 3gnd s GLY 175 CO 0.01 0.00 0.00 -0.62 0.00 0.00 0.00 173.10 172.49 3gnd n VAL 176 N 0.83 0.00 -0.05 1.40 0.31 -1.26 -4.39 118.33 115.18 3gnd n VAL 176 Ca -0.06 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.25 3gnd n VAL 176 Cb 0.52 -0.66 -0.00 0.00 -0.91 0.00 0.00 33.84 32.79 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 -0.25 0.00 -3.60 2.52 3.14 -1.26 -5.06 118.33 113.82 3gnd n VAL 181 Ca 0.00 0.00 -0.38 0.00 -2.96 0.00 0.00 64.34 61.00 3gnd n VAL 181 Cb 0.00 -0.01 -0.06 0.00 -1.06 0.00 0.00 33.84 32.71 3gnd n VAL 181 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 3gnd s ARG 182 N 0.07 3.35 0.54 1.45 0.52 -1.26 -4.92 118.95 118.70 3gnd s ARG 182 Ca 0.03 -3.19 0.06 0.00 -0.52 0.00 0.00 55.73 52.11 3gnd s ARG 182 Cb -0.04 -4.03 0.04 0.00 0.52 0.00 0.00 34.95 31.43 3gnd s ARG 182 CO 0.02 -1.25 0.42 0.16 0.02 0.00 0.00 175.30 174.67 3gnd s ASP 183 N 0.18 4.67 0.17 0.23 -4.77 -1.26 -4.94 116.67 110.96 3gnd s ASP 183 Ca 0.27 -1.20 -0.14 0.00 -3.30 0.00 0.00 52.55 48.18 3gnd s ASP 183 Cb -0.09 0.34 0.07 0.00 -1.09 0.00 0.00 42.92 42.15 3gnd s ASP 183 CO -0.11 -1.08 1.83 -0.61 0.70 0.00 0.00 175.17 175.90 3gnd h GLN 184 N 0.75 0.71 -0.49 2.11 -0.00 -1.92 -2.73 115.11 113.55 3gnd h GLN 184 Ca -0.37 -0.05 -0.03 0.00 -0.00 0.00 0.00 58.65 58.20 3gnd h GLN 184 Cb 1.30 -0.16 -0.02 0.00 0.00 0.00 0.00 27.48 28.60 3gnd h GLN 184 CO 0.57 0.49 0.17 0.07 0.00 0.00 0.00 178.83 180.12 3gnd h ARG 185 N 0.72 0.71 0.45 1.69 0.11 -1.95 0.20 114.38 116.30 3gnd h ARG 185 Ca 0.19 -0.11 -0.02 0.00 0.10 0.00 0.00 59.98 60.14 3gnd h ARG 185 Cb -0.06 -0.12 0.00 0.00 1.11 0.00 0.00 29.97 30.90 3gnd h ARG 185 CO -0.04 0.60 -0.22 -0.92 0.10 0.00 0.00 179.97 179.50 3gnd h TYR 186 N 0.70 -0.56 -0.38 4.08 3.20 -1.87 -2.70 116.97 119.44 3gnd h TYR 186 Ca 0.17 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.02 3gnd h TYR 186 Cb 0.18 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.61 3gnd h TYR 186 CO 0.01 -0.24 0.25 0.74 -1.64 0.00 0.00 178.16 177.28 3gnd h PHE 187 N -0.88 0.49 -0.28 -3.82 0.04 -1.37 -1.01 116.94 110.11 3gnd h PHE 187 Ca -0.06 0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.77 3gnd h PHE 187 Cb 0.57 -0.16 -0.05 0.00 2.20 0.00 0.00 35.95 38.50 3gnd h PHE 187 CO 0.01 0.32 -0.07 0.77 -0.60 0.00 0.00 178.31 178.73 3gnd h SER 188 N 0.52 -0.26 0.24 2.17 0.02 -0.98 -0.21 113.55 115.05 3gnd h SER 188 Ca 0.14 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3gnd h SER 188 Cb -0.04 0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 3gnd h SER 188 CO -0.03 -0.09 -0.23 0.25 -1.14 0.00 0.00 176.83 175.59 3gnd h LEU 189 N -0.00 -0.60 0.04 5.07 5.85 -0.95 -1.60 115.31 123.13 3gnd h LEU 189 Ca 0.13 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3gnd h LEU 189 Cb 0.20 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.44 3gnd h LEU 189 CO -0.29 -0.33 -0.02 0.00 -0.34 0.00 0.00 178.44 177.46 3gnd h ALA 190 N 0.20 -0.06 -0.56 1.25 0.00 -1.11 -1.99 119.26 116.99 3gnd h ALA 190 Ca -0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3gnd h ALA 190 Cb 0.45 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 3gnd h ALA 190 CO -0.05 -0.52 0.18 1.79 0.00 0.00 0.00 179.25 180.65 3gnd h THR 191 N -0.08 1.24 -0.42 0.00 1.35 -1.06 -2.56 112.91 111.37 3gnd h THR 191 Ca -0.01 -0.79 -0.11 0.00 -0.55 0.00 0.00 66.41 64.95 3gnd h THR 191 Cb 0.07 0.69 -0.02 0.00 -1.73 0.00 0.00 68.15 67.16 3gnd h THR 191 CO 0.01 0.30 -0.19 -0.09 -0.25 0.00 0.00 175.52 175.29 3gnd h ARG 192 N 0.78 0.83 -0.06 4.72 9.65 -1.22 -1.12 114.38 127.96 3gnd h ARG 192 Ca 0.18 -0.33 -0.01 0.00 -1.10 0.00 0.00 59.98 58.73 3gnd h ARG 192 Cb 0.27 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.81 3gnd h ARG 192 CO -0.01 0.95 0.02 0.82 2.80 0.00 0.00 179.97 184.56 3gnd h ILE 193 N 0.73 1.17 -0.42 1.20 2.04 -1.35 -0.66 117.51 120.22 3gnd h ILE 193 Ca 0.10 -0.51 0.04 0.00 1.00 0.00 0.00 64.86 65.49 3gnd h ILE 193 Cb 0.72 1.40 -0.04 0.00 -0.74 0.00 0.00 36.82 38.15 3gnd h ILE 193 CO 0.05 0.14 0.19 0.00 0.00 0.00 0.00 178.15 178.54 3gnd h ALA 194 N 0.83 0.52 -0.62 1.87 0.00 -1.25 0.43 119.26 121.04 3gnd h ALA 194 Ca 0.02 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3gnd h ALA 194 Cb 0.21 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3gnd h ALA 194 CO -0.00 -0.18 0.37 0.00 0.00 0.00 0.00 179.25 179.44 3gnd h ALA 195 N 1.24 0.79 -0.87 0.00 0.00 -1.17 -2.22 119.26 117.02 3gnd h ALA 195 Ca 0.19 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3gnd h ALA 195 Cb 0.12 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 3gnd h ALA 195 CO -0.15 0.27 0.58 1.49 0.00 0.00 0.00 179.25 181.43 3gnd h GLU 196 N 0.83 1.14 0.00 0.00 4.57 -0.52 -1.16 114.58 119.45 3gnd h GLU 196 Ca 0.22 -0.07 -0.06 0.00 -1.18 0.00 0.00 59.36 58.27 3gnd h GLU 196 Cb -0.02 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.31 3gnd h GLU 196 CO -0.04 0.76 -0.27 0.52 -1.18 0.00 0.00 179.01 178.79 3gnd h MET 197 N 1.18 0.00 0.00 1.92 2.86 -0.35 -3.47 114.93 117.07 3gnd h MET 197 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 3gnd h MET 197 Cb -0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.53 3gnd h MET 197 CO -0.07 0.27 0.00 0.41 1.06 0.00 0.00 176.91 178.59 3gnd n GLY 198 N -0.33 0.25 3.73 8.32 0.00 -0.44 -4.92 105.19 111.80 3gnd n GLY 198 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 2.02 0.06 4.61 0.00 -1.14 -4.86 120.51 121.21 3gnd n ALA 199 Ca 0.00 0.37 0.11 0.00 0.00 0.00 0.00 53.44 53.92 3gnd n ALA 199 Cb 0.00 -2.38 -0.07 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 1.39 0.63 -4.88 0.00 3.00 -0.24 -4.60 117.38 112.68 3gnd n GLN 200 Ca 0.06 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.80 3gnd n GLN 200 Cb 0.36 -1.71 -0.16 0.00 0.00 0.00 0.00 30.24 28.73 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 -3.41 1.46 -0.08 5.09 1.01 -0.99 -4.15 121.20 120.14 3gnd s ILE 201 Ca -0.03 -0.76 0.04 0.00 0.00 0.00 0.00 60.65 59.89 3gnd s ILE 201 Cb 0.11 -1.24 -0.01 0.00 0.01 0.00 0.00 42.46 41.33 3gnd s ILE 201 CO 0.84 0.42 -0.19 -0.63 0.00 0.00 0.00 174.94 175.37 3gnd s ILE 202 N -0.17 2.54 -0.15 2.92 -1.09 -0.71 -1.31 121.20 123.24 3gnd s ILE 202 Ca 0.01 -0.88 0.02 0.00 -2.23 0.00 0.00 60.65 57.57 3gnd s ILE 202 Cb -0.10 -1.99 0.01 0.00 -1.58 0.00 0.00 42.46 38.80 3gnd s ILE 202 CO 0.01 0.56 -0.21 -0.75 -1.23 0.00 0.00 174.94 173.32 3gnd s LYS 203 N -0.09 3.04 0.00 2.79 2.20 -0.57 -0.69 119.74 126.42 3gnd s LYS 203 Ca -0.04 -0.84 0.00 0.00 -0.36 0.00 0.00 55.97 54.73 3gnd s LYS 203 Cb -0.14 -2.48 0.00 0.00 -1.51 0.00 0.00 37.83 33.70 3gnd s LYS 203 CO 0.04 -0.04 0.00 -2.37 -0.36 0.00 0.00 175.35 172.62 3gnd n THR 204 N 4.15 0.00 -4.06 3.43 5.66 -0.00 -1.31 114.28 122.15 3gnd n THR 204 Ca -0.20 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.54 3gnd n THR 204 Cb 0.51 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.24 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 -1.73 3.19 0.35 1.09 2.02 -1.26 -0.88 117.35 120.14 3gnd s TYR 205 Ca 0.00 0.01 -0.25 0.00 -0.37 0.00 0.00 57.07 56.46 3gnd s TYR 205 Cb 0.00 -1.54 -0.10 0.00 -0.40 0.00 0.00 41.96 39.92 3gnd s TYR 205 CO 0.00 0.52 0.97 -0.47 -1.57 0.00 0.00 175.55 175.00 3gnd s TYR 206 N -1.73 3.54 0.03 2.71 5.04 -1.26 -4.95 117.35 120.73 3gnd s TYR 206 Ca 0.31 1.73 0.07 0.00 -2.44 0.00 0.00 57.07 56.74 3gnd s TYR 206 Cb -0.10 -2.96 -0.02 0.00 0.35 0.00 0.00 41.96 39.22 3gnd s TYR 206 CO 0.24 -0.04 -0.20 0.08 -1.34 0.00 0.00 175.55 174.29 3gnd s VAL 207 N -1.70 1.59 0.22 3.14 1.01 -1.26 -5.03 120.40 118.37 3gnd s VAL 207 Ca 0.53 -1.09 -0.08 0.00 0.00 0.00 0.00 61.98 61.34 3gnd s VAL 207 Cb -0.18 -1.37 0.20 0.00 0.00 0.00 0.00 36.38 35.02 3gnd s VAL 207 CO 0.23 0.25 1.69 -0.33 0.00 0.00 0.00 175.10 176.94 3gnd h GLU 208 N 5.07 0.22 -3.71 2.72 4.39 -1.97 -3.39 114.58 117.91 3gnd h GLU 208 Ca -0.41 -0.01 -0.25 0.00 0.34 0.00 0.00 59.36 59.03 3gnd h GLU 208 Cb 1.16 -0.05 -0.29 0.00 -0.10 0.00 0.00 28.75 29.47 3gnd h GLU 208 CO 0.45 0.14 -0.72 -1.59 -1.16 0.00 0.00 179.01 176.13 3gnd s LYS 209 N -6.10 0.01 0.00 2.33 -2.85 -1.26 -4.85 119.74 107.02 3gnd s LYS 209 Ca -0.13 0.03 0.00 0.00 -1.00 0.00 0.00 55.97 54.87 3gnd s LYS 209 Cb 0.19 -0.07 0.00 0.00 -2.06 0.00 0.00 37.83 35.90 3gnd s LYS 209 CO 0.74 -0.03 0.00 0.41 0.10 0.00 0.00 175.35 176.58 3gnd n GLY 210 N 3.29 0.40 0.36 0.59 0.00 -1.26 -4.41 105.19 104.16 3gnd n GLY 210 Ca -0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.97 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 1.05 -0.97 1.61 3.57 -1.89 0.34 116.94 120.65 3gnd h PHE 211 Ca 0.00 0.03 0.22 0.00 3.53 0.00 0.00 57.97 61.75 3gnd h PHE 211 Cb 0.00 -0.33 -0.08 0.00 2.79 0.00 0.00 35.95 38.33 3gnd h PHE 211 CO 0.00 0.34 0.62 0.93 -2.23 0.00 0.00 178.31 177.97 3gnd h GLU 212 N 0.84 0.49 -0.04 1.11 5.08 -1.94 -0.90 114.58 119.22 3gnd h GLU 212 Ca 0.52 -0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 58.70 3gnd h GLU 212 Cb 0.71 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3gnd h GLU 212 CO -0.30 0.33 -0.67 0.00 -1.00 0.00 0.00 179.01 177.37 3gnd h ARG 213 N 0.51 0.17 0.16 2.33 3.08 -1.28 -1.21 114.38 118.13 3gnd h ARG 213 Ca 0.53 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.44 3gnd h ARG 213 Cb 1.18 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3gnd h ARG 213 CO -0.26 0.78 -0.08 0.82 -1.07 0.00 0.00 179.97 180.16 3gnd h ILE 214 N 0.12 0.89 -0.13 2.04 2.04 -1.08 -1.95 117.51 119.43 3gnd h ILE 214 Ca -0.01 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.69 3gnd h ILE 214 Cb 1.20 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 3gnd h ILE 214 CO 0.10 0.04 0.03 0.58 0.00 0.00 0.00 178.15 178.90 3gnd h VAL 215 N -0.29 0.95 -0.15 1.67 2.07 -1.41 -2.96 116.25 116.14 3gnd h VAL 215 Ca -0.02 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 3gnd h VAL 215 Cb 0.23 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3gnd h VAL 215 CO 0.04 0.02 -0.02 0.00 0.02 0.00 0.00 177.57 177.63 3gnd h ALA 216 N 1.09 1.70 -0.01 1.67 0.00 -1.19 -2.12 119.26 120.41 3gnd h ALA 216 Ca 0.06 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3gnd h ALA 216 Cb 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3gnd h ALA 216 CO -0.07 0.23 -0.08 0.41 0.00 0.00 0.00 179.25 179.74 3gnd n GLY 217 N -1.20 -0.56 3.31 0.00 0.00 -0.74 -4.79 105.19 101.22 3gnd n GLY 217 Ca -0.01 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 4.54 0.07 -4.43 0.00 -0.05 -1.26 -4.81 135.00 129.05 3gnd n PRO 219 Ca -0.18 0.21 -0.21 0.00 -0.05 0.00 0.00 63.50 63.26 3gnd n PRO 219 Cb 0.51 -1.61 -0.10 0.00 -0.05 0.00 0.00 33.50 32.25 3gnd n PRO 219 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 175.50 175.59 3gnd s VAL 220 N -3.07 1.46 0.25 0.52 -7.23 -1.26 -3.59 120.40 107.49 3gnd s VAL 220 Ca 0.09 -2.07 -0.31 0.00 -1.81 0.00 0.00 61.98 57.88 3gnd s VAL 220 Cb 0.12 -2.57 -0.13 0.00 0.56 0.00 0.00 36.38 34.36 3gnd s VAL 220 CO 0.40 -0.20 1.37 -2.65 -0.31 0.00 0.00 175.10 173.71 3gnd n PRO 221 N -0.62 2.00 -4.64 4.82 -0.02 -1.25 -4.78 135.00 130.51 3gnd n PRO 221 Ca -0.04 0.71 -0.32 0.00 -2.02 0.00 0.00 63.50 61.82 3gnd n PRO 221 Cb 0.65 -2.34 -0.12 0.00 -0.02 0.00 0.00 33.50 31.67 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 -0.25 3.39 -0.01 4.25 1.01 -1.26 -1.73 121.20 126.60 3gnd s ILE 222 Ca 0.66 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 60.60 3gnd s ILE 222 Cb -0.64 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.40 3gnd s ILE 222 CO 0.52 0.49 -0.14 -0.69 0.00 0.00 0.00 174.94 175.12 3gnd s VAL 223 N -0.87 1.08 -0.05 2.92 1.01 0.13 -0.16 120.40 124.46 3gnd s VAL 223 Ca 0.14 -0.58 -0.04 0.00 0.00 0.00 0.00 61.98 61.50 3gnd s VAL 223 Cb -0.11 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 3gnd s VAL 223 CO 0.04 0.31 0.15 0.27 0.00 0.00 0.00 175.10 175.86 3gnd s ILE 224 N -0.30 5.32 0.44 2.22 -4.36 -0.92 -0.82 121.20 122.78 3gnd s ILE 224 Ca 0.05 -0.07 -0.21 0.00 -0.26 0.00 0.00 60.65 60.15 3gnd s ILE 224 Cb -0.06 -3.41 -0.10 0.00 1.25 0.00 0.00 42.46 40.14 3gnd s ILE 224 CO -0.00 0.44 0.98 0.00 0.24 0.00 0.00 174.94 176.59 3gnd s ALA 225 N -1.19 3.00 0.24 2.27 0.00 -0.06 0.25 121.76 126.26 3gnd s ALA 225 Ca 0.22 0.47 -0.04 0.00 0.00 0.00 0.00 51.96 52.61 3gnd s ALA 225 Cb -0.12 -3.19 0.25 0.00 0.00 0.00 0.00 23.12 20.06 3gnd s ALA 225 CO 0.12 -0.01 1.73 0.78 0.00 0.00 0.00 175.76 178.39 3gnd h GLY 226 N 1.87 0.98 -0.47 0.00 0.00 -1.91 -3.42 103.07 100.12 3gnd h GLY 226 Ca -0.49 -0.66 0.06 0.00 0.00 0.00 0.00 47.33 46.24 3gnd h GLY 226 CO 0.61 0.61 -0.08 0.61 0.00 0.00 0.00 176.54 178.29 3gnd n GLY 227 N -0.61 -2.06 3.70 4.60 0.00 -1.26 -4.88 105.19 104.68 3gnd n GLY 227 Ca 0.03 -1.41 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 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 -0.81 1.38 0.26 1.61 -2.85 -1.26 -4.45 119.74 113.62 3gnd s LYS 228 Ca 0.00 1.45 -0.31 0.00 -1.00 0.00 0.00 55.97 56.11 3gnd s LYS 228 Cb 0.00 -1.78 -0.13 0.00 -2.06 0.00 0.00 37.83 33.87 3gnd s LYS 228 CO 0.00 -2.34 1.47 1.17 0.10 0.00 0.00 175.35 175.75 3gnd n LYS 229 N -4.01 2.28 -4.30 1.78 3.00 -1.26 -4.83 118.16 110.83 3gnd n LYS 229 Ca 0.11 0.81 -0.16 0.00 -0.00 0.00 0.00 58.31 59.07 3gnd n LYS 229 Cb 0.52 -2.51 -0.10 0.00 0.00 0.00 0.00 35.03 32.94 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 -0.14 2.30 0.29 3.14 1.43 -1.26 -5.07 118.68 119.37 3gnd s LEU 230 Ca 0.66 -1.15 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 3gnd s LEU 230 Cb -0.59 -0.29 -0.13 0.00 0.03 0.00 0.00 46.19 45.22 3gnd s LEU 230 CO 0.50 -0.45 1.34 -2.65 0.23 0.00 0.00 176.35 175.31 3gnd n PRO 231 N -0.33 2.06 -0.33 1.29 -0.02 -1.26 -4.72 135.00 131.68 3gnd n PRO 231 Ca -0.07 0.73 0.16 0.00 -2.02 0.00 0.00 63.50 62.30 3gnd n PRO 231 Cb 0.63 -2.33 0.35 0.00 -0.02 0.00 0.00 33.50 32.13 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 3.34 0.49 -0.53 -0.52 3.07 -1.99 0.18 114.58 118.62 3gnd h GLU 232 Ca -0.45 -0.03 -0.08 0.00 -0.50 0.00 0.00 59.36 58.30 3gnd h GLU 232 Cb 1.28 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 29.06 3gnd h GLU 232 CO 0.69 0.32 0.02 -0.09 -1.40 0.00 0.00 179.01 178.56 3gnd h ARG 233 N 0.50 0.88 -0.24 2.33 2.43 -1.97 -2.04 114.38 116.27 3gnd h ARG 233 Ca 0.61 -0.24 -0.19 0.00 -0.81 0.00 0.00 59.98 59.35 3gnd h ARG 233 Cb 1.16 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3gnd h ARG 233 CO -0.50 0.86 -0.60 0.93 -1.51 0.00 0.00 179.97 179.16 3gnd h GLU 234 N 0.82 0.79 -0.54 0.20 5.08 -1.02 -2.09 114.58 117.81 3gnd h GLU 234 Ca 0.16 -0.53 0.05 0.00 -1.00 0.00 0.00 59.36 58.05 3gnd h GLU 234 Cb 0.46 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.73 3gnd h GLU 234 CO 0.02 1.15 0.26 0.00 -1.00 0.00 0.00 179.01 179.45 3gnd h ALA 235 N 0.73 0.69 -0.67 3.43 0.00 -1.11 -1.06 119.26 121.27 3gnd h ALA 235 Ca -0.00 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 3gnd h ALA 235 Cb 1.20 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 3gnd h ALA 235 CO 0.13 -0.09 0.15 -0.07 0.00 0.00 0.00 179.25 179.37 3gnd h LEU 236 N 0.50 1.02 -0.66 0.00 3.38 -1.25 -1.56 115.31 116.73 3gnd h LEU 236 Ca 0.24 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.06 3gnd h LEU 236 Cb 0.18 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 3gnd h LEU 236 CO -0.18 0.98 0.37 -0.33 0.09 0.00 0.00 178.44 179.37 3gnd h GLU 237 N 1.02 0.66 -0.19 1.13 4.39 -0.80 0.04 114.58 120.82 3gnd h GLU 237 Ca 0.21 -0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.89 3gnd h GLU 237 Cb 0.37 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 3gnd h GLU 237 CO 0.00 0.44 0.07 1.98 -1.16 0.00 0.00 179.01 180.34 3gnd h MET 238 N 0.68 0.16 -0.18 2.33 4.05 -0.65 -0.31 114.93 121.02 3gnd h MET 238 Ca 0.30 -0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.75 3gnd h MET 238 Cb 0.18 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 30.90 3gnd h MET 238 CO -0.18 0.11 -0.11 0.00 0.23 0.00 0.00 176.91 176.96 3gnd h TRP 240 N -0.10 0.68 0.16 0.00 7.01 -0.45 0.01 115.95 123.26 3gnd h TRP 240 Ca 0.10 0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.12 3gnd h TRP 240 Cb 0.25 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.08 3gnd h TRP 240 CO -0.25 0.38 -0.14 1.96 -2.79 0.00 0.00 178.44 177.60 3gnd h GLN 241 N 0.71 -0.30 0.03 2.65 1.08 -0.69 0.87 115.11 119.46 3gnd h GLN 241 Ca 0.25 0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.50 3gnd h GLN 241 Cb 0.05 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 27.50 3gnd h GLN 241 CO -0.12 -0.20 -0.33 0.00 -0.95 0.00 0.00 178.83 177.23 3gnd h ALA 242 N 0.50 -0.51 -0.03 3.87 0.00 -0.61 0.30 119.26 122.79 3gnd h ALA 242 Ca -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3gnd h ALA 242 Cb 0.29 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 3gnd h ALA 242 CO -0.02 -0.85 -0.01 0.82 0.00 0.00 0.00 179.25 179.19 3gnd h ILE 243 N -0.50 0.97 -0.59 0.00 1.08 -0.95 -1.80 117.51 115.71 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 0.57 0.97 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 3gnd h ILE 243 CO -0.25 0.00 0.40 -0.78 -0.69 0.00 0.00 178.15 176.83 3gnd h ASP 244 N -0.00 0.25 -0.34 1.72 3.58 -0.44 -0.54 116.42 120.65 3gnd h ASP 244 Ca 0.01 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.47 3gnd h ASP 244 Cb 0.02 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.03 3gnd h ASP 244 CO -0.03 0.14 0.00 0.00 -2.88 0.00 0.00 179.24 176.47 3gnd n GLN 245 N -4.45 2.06 0.00 0.28 6.02 0.06 -4.93 117.38 116.43 3gnd n GLN 245 Ca 0.10 -1.62 0.00 0.00 -0.01 0.00 0.00 57.00 55.47 3gnd n GLN 245 Cb 0.47 -1.42 0.00 0.00 1.02 0.00 0.00 30.24 30.31 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 1.27 1.14 3.75 1.08 0.00 -0.21 -4.52 105.19 107.70 3gnd n GLY 246 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 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 2.64 -1.95 4.61 0.00 -0.80 -4.81 121.76 119.45 3gnd s ALA 247 Ca 0.00 1.08 0.16 0.00 0.00 0.00 0.00 51.96 53.20 3gnd s ALA 247 Cb 0.00 -3.47 0.47 0.00 0.00 0.00 0.00 23.12 20.11 3gnd s ALA 247 CO 0.00 -1.17 1.39 0.43 0.00 0.00 0.00 175.76 176.40 3gnd n SER 248 N -1.37 2.86 0.00 0.00 7.64 0.78 -4.64 113.62 118.89 3gnd n SER 248 Ca 0.12 -2.02 0.00 0.00 1.01 0.00 0.00 58.87 57.98 3gnd n SER 248 Cb 0.48 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 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 1.30 0.91 3.37 0.23 0.00 -1.23 -1.94 105.19 107.83 3gnd n GLY 249 Ca 0.18 -1.70 -0.24 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 -1.48 2.05 -0.63 1.61 -7.23 -0.97 -2.17 120.40 111.59 3gnd s VAL 250 Ca 0.00 -1.95 0.06 0.00 -1.81 0.00 0.00 61.98 58.28 3gnd s VAL 250 Cb 0.00 -1.95 0.27 0.00 0.56 0.00 0.00 36.38 35.26 3gnd s VAL 250 CO 0.00 -0.21 0.79 -0.67 -0.31 0.00 0.00 175.10 174.70 3gnd n ASP 251 N 0.32 3.90 -4.77 4.85 2.03 0.14 -0.73 116.55 122.30 3gnd n ASP 251 Ca -0.13 -3.49 -0.41 0.00 0.52 0.00 0.00 54.79 51.28 3gnd n ASP 251 Cb 0.56 -0.65 -0.02 0.00 -0.72 0.00 0.00 41.12 40.30 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 -2.69 4.32 0.00 -0.67 -1.94 -0.89 -3.24 119.30 114.20 3gnd s MET 252 Ca 0.42 2.26 0.00 0.00 -1.71 0.00 0.00 55.69 56.65 3gnd s MET 252 Cb 0.18 -3.07 0.00 0.00 2.01 0.00 0.00 34.83 33.95 3gnd s MET 252 CO -0.04 -0.24 0.00 0.41 -0.01 0.00 0.00 175.02 175.14 3gnd n GLY 253 N 0.94 0.37 0.37 -0.03 0.00 -1.26 -0.81 105.19 104.77 3gnd n GLY 253 Ca 0.01 0.00 -0.02 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 1.28 0.00 1.61 3.08 -1.85 -1.11 114.38 117.40 3gnd h ARG 254 Ca 0.00 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.95 3gnd h ARG 254 Cb 0.00 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 29.77 3gnd h ARG 254 CO 0.00 0.87 0.00 0.09 -1.07 0.00 0.00 179.97 179.86 3gnd n ASN 255 N -4.37 0.00 0.01 7.04 3.02 -1.26 -0.91 115.26 118.79 3gnd n ASN 255 Ca 0.11 0.03 -0.03 0.00 -0.03 0.00 0.00 54.58 54.66 3gnd n ASN 255 Cb 0.04 -0.20 -0.01 0.00 -0.61 0.00 0.00 39.78 38.99 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 -1.20 1.26 0.59 2.41 5.41 -0.58 -4.53 119.36 122.73 3gnd n ILE 256 Ca 0.05 0.31 0.11 0.00 1.00 0.00 0.00 62.75 64.22 3gnd n ILE 256 Cb 0.06 -1.79 0.44 0.00 -0.71 0.00 0.00 39.64 37.64 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 -3.75 0.40 -0.16 1.39 1.16 -0.52 -1.86 117.46 114.11 3gnd n PHE 257 Ca -0.05 0.14 0.12 0.00 -1.87 0.00 0.00 57.45 55.79 3gnd n PHE 257 Cb 0.17 -0.73 0.30 0.00 -1.61 0.00 0.00 39.48 37.61 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 -1.85 2.66 -2.83 3.97 6.02 -0.08 -4.85 117.38 120.41 3gnd n GLN 258 Ca 0.04 -2.56 -0.29 0.00 -0.01 0.00 0.00 57.00 54.19 3gnd n GLN 258 Cb 0.27 -1.56 -0.02 0.00 1.02 0.00 0.00 30.24 29.95 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 6.39 0.16 1.08 0.15 -0.78 -4.96 113.70 114.61 3gnd s SER 259 Ca 0.47 0.97 0.26 0.00 0.70 0.00 0.00 55.95 58.34 3gnd s SER 259 Cb 0.25 -2.26 0.92 0.00 -1.71 0.00 0.00 66.02 63.22 3gnd s SER 259 CO 0.33 -0.45 1.78 0.47 1.20 0.00 0.00 173.24 176.58 3gnd n ASP 260 N -1.69 0.58 -3.23 5.45 8.00 -1.26 -4.11 116.55 120.29 3gnd n ASP 260 Ca 0.01 0.57 -0.25 0.00 0.71 0.00 0.00 54.79 55.83 3gnd n ASP 260 Cb 0.55 -0.72 -0.07 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 -2.06 0.14 0.03 1.24 8.25 -1.26 -5.00 115.22 116.56 3gnd n HIS 261 Ca 0.05 -3.63 -0.10 0.00 -0.26 0.00 0.00 57.72 53.78 3gnd n HIS 261 Cb 0.37 -0.35 -0.04 0.00 1.12 0.00 0.00 29.99 31.09 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 4.11 -0.30 -0.28 -0.41 0.11 -1.74 -1.12 132.00 132.36 3gnd h PRO 262 Ca 0.10 0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.24 3gnd h PRO 262 Cb 0.85 0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.01 3gnd h PRO 262 CO 0.51 -0.20 0.15 0.28 -0.21 0.00 0.00 178.00 178.53 3gnd h VAL 263 N -0.31 1.01 -0.27 3.15 2.07 -1.94 -0.35 116.25 119.59 3gnd h VAL 263 Ca 0.08 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.54 3gnd h VAL 263 Cb 0.42 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 3gnd h VAL 263 CO -0.23 0.06 -0.03 0.00 0.02 0.00 0.00 177.57 177.38 3gnd h ALA 264 N 1.14 0.21 -0.73 1.67 0.00 -1.88 -2.06 119.26 117.62 3gnd h ALA 264 Ca 0.11 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.18 3gnd h ALA 264 Cb 0.02 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 3gnd h ALA 264 CO -0.07 -0.44 0.41 1.98 0.00 0.00 0.00 179.25 181.13 3gnd h MET 265 N 0.04 0.72 -0.51 0.00 -1.53 -0.45 -1.63 114.93 111.56 3gnd h MET 265 Ca 0.13 -0.04 0.01 0.00 -3.44 0.00 0.00 59.70 56.35 3gnd h MET 265 Cb 0.18 -0.16 -0.03 0.00 -0.55 0.00 0.00 31.60 31.05 3gnd h MET 265 CO -0.25 0.47 0.33 0.52 0.14 0.00 0.00 176.91 178.13 3gnd h MET 266 N 0.74 0.66 -0.84 0.39 2.86 -0.70 0.13 114.93 118.16 3gnd h MET 266 Ca 0.33 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.93 3gnd h MET 266 Cb 0.23 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 31.70 3gnd h MET 266 CO -0.20 0.44 0.50 0.87 1.06 0.00 0.00 176.91 179.58 3gnd h LYS 267 N 0.68 1.15 0.51 1.72 1.57 -0.85 0.14 116.57 121.48 3gnd h LYS 267 Ca 0.19 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 3gnd h LYS 267 Cb -0.07 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.01 3gnd h LYS 267 CO -0.05 0.81 -0.24 0.00 -0.57 0.00 0.00 179.45 179.40 3gnd h ALA 268 N 1.38 -0.68 -1.00 3.86 0.00 -0.71 -1.45 119.26 120.66 3gnd h ALA 268 Ca 0.30 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 55.21 3gnd h ALA 268 Cb -0.04 0.26 -0.10 0.00 0.00 0.00 0.00 17.79 17.92 3gnd h ALA 268 CO -0.06 -0.86 0.62 0.28 0.00 0.00 0.00 179.25 179.23 3gnd h VAL 269 N -0.73 0.82 -0.34 0.00 2.07 -0.19 0.04 116.25 117.92 3gnd h VAL 269 Ca -0.07 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 3gnd h VAL 269 Cb 0.54 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3gnd h VAL 269 CO 0.11 0.16 0.18 1.56 0.02 0.00 0.00 177.57 179.60 3gnd h GLN 270 N 0.88 0.47 -0.72 1.57 1.08 -0.59 -1.10 115.11 116.70 3gnd h GLN 270 Ca 0.53 -0.06 0.07 0.00 -1.45 0.00 0.00 58.65 57.74 3gnd h GLN 270 Cb 0.68 -0.09 -0.06 0.00 -0.05 0.00 0.00 27.48 27.96 3gnd h GLN 270 CO -0.32 0.40 0.41 0.00 -0.95 0.00 0.00 178.83 178.37 3gnd h ALA 271 N 1.04 0.98 -0.26 3.87 0.00 0.08 0.24 119.26 125.21 3gnd h ALA 271 Ca 0.12 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3gnd h ALA 271 Cb 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3gnd h ALA 271 CO -0.02 0.09 -0.15 0.28 0.00 0.00 0.00 179.25 179.45 3gnd h VAL 272 N 0.74 1.30 -0.00 0.00 2.07 -1.02 -2.34 116.25 117.00 3gnd h VAL 272 Ca 0.33 -1.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 3gnd h VAL 272 Cb 0.22 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 3gnd h VAL 272 CO -0.19 0.39 -0.06 0.58 0.02 0.00 0.00 177.57 178.31 3gnd h VAL 273 N 0.30 1.59 0.00 2.57 2.07 -0.75 -3.23 116.25 118.79 3gnd h VAL 273 Ca 0.06 -1.80 -0.22 0.00 0.82 0.00 0.00 66.70 65.55 3gnd h VAL 273 Cb 0.67 2.78 -0.04 0.00 -1.52 0.00 0.00 31.29 33.19 3gnd h VAL 273 CO 0.04 0.48 -1.44 0.45 0.02 0.00 0.00 177.57 177.12 3gnd h HIS 274 N -0.68 0.00 -0.02 1.57 3.86 -1.10 -3.40 115.15 115.37 3gnd h HIS 274 Ca -0.01 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 3gnd h HIS 274 Cb 0.81 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.28 3gnd h HIS 274 CO 0.19 0.77 -0.01 0.72 0.86 0.00 0.00 177.93 180.46 3gnd n HIS 275 N -3.01 0.08 -2.11 2.45 8.25 -0.91 -4.95 115.22 115.03 3gnd n HIS 275 Ca -0.11 -1.00 -0.08 0.00 -0.26 0.00 0.00 57.72 56.27 3gnd n HIS 275 Cb 0.93 -0.17 -0.01 0.00 1.12 0.00 0.00 29.99 31.86 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 -1.36 -2.62 -4.57 0.41 3.02 -1.21 -4.92 115.26 104.01 3gnd n ASN 276 Ca 0.17 0.27 -0.32 0.00 -0.03 0.00 0.00 54.58 54.67 3gnd n ASN 276 Cb 0.66 -2.38 0.14 0.00 -0.61 0.00 0.00 39.78 37.60 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 -2.36 -0.26 -2.88 3.52 -0.58 -1.04 -5.00 120.64 112.04 3gnd n GLU 277 Ca -0.09 -0.01 -0.26 0.00 -0.42 0.00 0.00 57.16 56.37 3gnd n GLU 277 Cb 0.48 -2.18 -0.01 0.00 -0.57 0.00 0.00 31.44 29.17 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 -2.43 4.97 0.22 2.62 -4.23 -1.26 -4.67 115.64 110.85 3gnd s THR 278 Ca 0.64 0.01 -0.08 0.00 -1.18 0.00 0.00 61.69 61.08 3gnd s THR 278 Cb -0.24 -3.86 0.16 0.00 1.34 0.00 0.00 72.50 69.90 3gnd s THR 278 CO 0.60 -0.74 1.78 0.00 -0.54 0.00 0.00 174.62 175.72 3gnd h ALA 279 N 0.44 0.91 0.39 3.99 0.00 -1.96 -0.65 119.26 122.39 3gnd h ALA 279 Ca -0.48 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3gnd h ALA 279 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3gnd h ALA 279 CO 0.62 -0.04 -0.19 -0.44 0.00 0.00 0.00 179.25 179.20 3gnd h ASP 280 N 0.60 -0.45 -0.68 0.00 3.32 -1.95 -1.02 116.42 116.24 3gnd h ASP 280 Ca 0.32 -0.13 0.15 0.00 0.02 0.00 0.00 57.03 57.39 3gnd h ASP 280 Cb 0.30 0.12 -0.11 0.00 0.22 0.00 0.00 39.33 39.85 3gnd h ASP 280 CO -0.24 -0.06 0.09 0.03 -1.72 0.00 0.00 179.24 177.34 3gnd h ARG 281 N -0.92 0.19 -0.49 3.56 2.47 -1.95 -0.89 114.38 116.34 3gnd h ARG 281 Ca -0.05 -0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.66 3gnd h ARG 281 Cb 0.55 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.80 3gnd h ARG 281 CO 0.09 0.12 0.32 0.00 0.56 0.00 0.00 179.97 181.06 3gnd h ALA 282 N 1.59 0.63 -0.49 0.04 0.00 -1.08 -1.90 119.26 118.06 3gnd h ALA 282 Ca 0.37 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.32 3gnd h ALA 282 Cb 0.62 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 3gnd h ALA 282 CO -0.52 0.05 0.33 -0.92 0.00 0.00 0.00 179.25 178.18 3gnd h TYR 283 N 0.65 0.42 0.00 0.00 3.20 0.14 0.27 116.97 121.65 3gnd h TYR 283 Ca 0.19 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.93 3gnd h TYR 283 Cb -0.05 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.06 3gnd h TYR 283 CO -0.05 0.23 -0.65 0.93 -1.64 0.00 0.00 178.16 176.98 3gnd h GLU 284 N 0.42 0.00 -0.17 1.82 5.08 -0.61 0.01 114.58 121.13 3gnd h GLU 284 Ca 0.21 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.53 3gnd h GLU 284 Cb 0.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 3gnd h GLU 284 CO -0.05 0.65 -0.09 1.25 -1.00 0.00 0.00 179.01 179.77 3gnd h LEU 285 N 0.00 0.24 -0.10 1.33 7.12 -0.26 -2.30 115.31 121.35 3gnd h LEU 285 Ca -0.01 -0.04 -0.24 0.00 0.13 0.00 0.00 57.88 57.72 3gnd h LEU 285 Cb 1.21 -0.06 0.01 0.00 -0.53 0.00 0.00 40.66 41.29 3gnd h LEU 285 CO 0.08 0.36 -1.01 0.22 -0.13 0.00 0.00 178.44 177.96 3gnd h TYR 286 N 0.25 0.67 0.00 1.25 3.20 -0.22 -3.20 116.97 118.92 3gnd h TYR 286 Ca 0.05 -0.38 -0.03 0.00 3.14 0.00 0.00 58.73 61.51 3gnd h TYR 286 Cb 0.31 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.51 3gnd h TYR 286 CO 0.01 1.22 -0.12 -0.07 -1.64 0.00 0.00 178.16 177.55 3gnd h LEU 287 N 0.23 0.00 -0.18 2.82 3.38 -0.88 -2.89 115.31 117.81 3gnd h LEU 287 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3gnd h LEU 287 Cb 1.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.41 3gnd h LEU 287 CO 0.18 0.12 0.00 0.77 0.09 0.00 0.00 178.44 179.60 3gnd h SER 288 N 0.00 0.00 -0.01 -0.43 4.64 -1.42 -3.51 113.55 112.82 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 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 3gnd h SER 288 CO 0.02 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.36