#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bgt s LYS 2 N 0.00 3.59 -0.01 0.03 1.02 -1.26 -4.36 119.74 118.75 2bgt s LYS 2 Ca 0.00 -0.55 0.04 0.00 0.02 0.00 0.00 55.97 55.48 2bgt s LYS 2 Cb 0.00 -2.93 -0.03 0.00 -0.52 0.00 0.00 37.83 34.35 2bgt s LYS 2 CO 0.00 0.13 -0.13 0.42 -0.92 0.00 0.00 175.35 174.85 2bgt s ILE 3 N 0.64 3.13 0.04 2.17 1.09 -0.38 -0.07 121.20 127.82 2bgt s ILE 3 Ca -0.02 -0.86 0.06 0.00 -1.10 0.00 0.00 60.65 58.72 2bgt s ILE 3 Cb -0.14 -2.29 -0.02 0.00 -1.06 0.00 0.00 42.46 38.95 2bgt s ILE 3 CO 0.02 0.48 -0.16 0.00 -0.10 0.00 0.00 174.94 175.18 2bgt s ALA 4 N -0.85 1.37 -0.04 9.38 0.00 -1.07 -1.24 121.76 129.31 2bgt s ALA 4 Ca 0.14 -0.90 0.07 0.00 0.00 0.00 0.00 51.96 51.27 2bgt s ALA 4 Cb -0.11 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 2bgt s ALA 4 CO 0.03 0.28 -0.25 0.42 0.00 0.00 0.00 175.76 176.24 2bgt s ILE 5 N -0.81 2.05 -0.03 0.00 1.01 0.10 -1.45 121.20 122.06 2bgt s ILE 5 Ca 0.04 -1.09 0.03 0.00 0.00 0.00 0.00 60.65 59.63 2bgt s ILE 5 Cb -0.08 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.68 2bgt s ILE 5 CO 0.01 0.57 -0.11 -0.63 0.00 0.00 0.00 174.94 174.78 2bgt s ILE 6 N -0.39 0.98 -0.43 2.92 1.01 -0.14 -0.93 121.20 124.22 2bgt s ILE 6 Ca 0.03 -0.47 -0.17 0.00 0.00 0.00 0.00 60.65 60.05 2bgt s ILE 6 Cb -0.12 -0.86 0.03 0.00 0.01 0.00 0.00 42.46 41.52 2bgt s ILE 6 CO 0.01 0.30 0.42 0.21 0.00 0.00 0.00 174.94 175.88 2bgt s ASN 7 N 0.16 6.18 0.43 3.58 3.84 -1.26 -1.26 114.94 126.60 2bgt s ASN 7 Ca -0.04 -0.78 0.10 0.00 0.21 0.00 0.00 52.86 52.35 2bgt s ASN 7 Cb -0.10 -2.21 0.95 0.00 -0.55 0.00 0.00 41.25 39.35 2bgt s ASN 7 CO 0.01 -0.58 2.05 -0.03 -2.79 0.00 0.00 177.10 175.76 2bgt h MET 8 N 8.73 0.44 0.00 0.43 1.85 -1.27 -3.33 114.93 121.77 2bgt h MET 8 Ca -0.27 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 58.80 2bgt h MET 8 Cb 1.11 -0.10 0.00 0.00 0.43 0.00 0.00 31.60 33.04 2bgt h MET 8 CO 0.80 0.29 -0.33 0.41 -0.40 0.00 0.00 176.91 177.68 2bgt n GLY 9 N -1.49 0.41 3.25 1.39 0.00 -1.26 -3.87 105.19 103.61 2bgt n GLY 9 Ca 0.04 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 2bgt n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bgt s ASN 10 N -1.61 1.76 0.25 1.61 -0.87 -1.25 -4.63 114.94 110.20 2bgt s ASN 10 Ca 0.02 -1.01 -0.20 0.00 -1.57 0.00 0.00 52.86 50.10 2bgt s ASN 10 Cb 0.04 -0.01 -0.09 0.00 -0.02 0.00 0.00 41.25 41.18 2bgt s ASN 10 CO 0.24 -0.34 0.76 0.21 -2.57 0.00 0.00 177.10 175.40 2bgt s ASN 11 N -3.16 7.08 -0.13 -1.22 2.47 -1.26 -4.67 114.94 114.04 2bgt s ASN 11 Ca 0.16 1.47 0.01 0.00 0.42 0.00 0.00 52.86 54.93 2bgt s ASN 11 Cb 0.03 -2.44 0.02 0.00 -1.45 0.00 0.00 41.25 37.40 2bgt s ASN 11 CO 0.00 -0.00 -0.17 -0.69 -3.72 0.00 0.00 177.10 172.52 2bgt s VAL 12 N -1.58 1.68 0.00 -5.21 1.01 -1.26 -4.43 120.40 110.61 2bgt s VAL 12 Ca 0.45 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2bgt s VAL 12 Cb -0.16 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.69 2bgt s VAL 12 CO 0.21 0.48 0.00 2.30 0.00 0.00 0.00 175.10 178.09 2bgt n ILE 13 N 4.40 0.00 -3.63 2.22 -6.64 -1.26 -4.72 119.36 109.73 2bgt n ILE 13 Ca -0.19 0.00 -0.04 0.00 -1.77 0.00 0.00 62.75 60.75 2bgt n ILE 13 Cb 0.51 0.00 -0.01 0.00 -1.44 0.00 0.00 39.64 38.70 2bgt n ILE 13 CO 0.00 0.00 0.00 -0.46 -1.77 0.00 0.00 176.55 174.32 2bgt n ASN 14 N -1.05 -0.51 -0.83 7.28 2.04 -1.26 -4.68 115.26 116.25 2bgt n ASN 14 Ca 0.00 -1.60 0.09 0.00 -0.44 0.00 0.00 54.58 52.63 2bgt n ASN 14 Cb 0.00 0.92 0.25 0.00 -2.53 0.00 0.00 39.78 38.42 2bgt n ASN 14 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 2bgt n PHE 15 N -0.19 0.52 0.71 -2.53 3.01 -1.26 -3.67 117.46 114.06 2bgt n PHE 15 Ca -0.00 -0.26 -0.00 0.00 1.01 0.00 0.00 57.45 58.20 2bgt n PHE 15 Cb 0.19 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.71 2bgt n PHE 15 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2bgt n LYS 16 N 0.82 1.48 -3.67 -1.08 5.02 -1.26 -4.66 118.16 114.80 2bgt n LYS 16 Ca 0.16 -0.45 -0.11 0.00 -2.02 0.00 0.00 58.31 55.89 2bgt n LYS 16 Cb 0.40 -1.51 -0.08 0.00 -0.02 0.00 0.00 35.03 33.82 2bgt n LYS 16 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2bgt s THR 17 N -1.07 -0.01 0.11 -0.18 2.01 -1.26 -5.06 115.64 110.18 2bgt s THR 17 Ca 0.08 0.02 -0.29 0.00 0.31 0.00 0.00 61.69 61.82 2bgt s THR 17 Cb 0.06 -0.83 -0.09 0.00 0.01 0.00 0.00 72.50 71.66 2bgt s THR 17 CO 0.02 0.01 1.62 0.58 -0.69 0.00 0.00 174.62 176.16 2bgt h VAL 18 N 4.78 0.30 0.00 3.82 2.07 -1.94 -1.46 116.25 123.83 2bgt h VAL 18 Ca -0.31 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2bgt h VAL 18 Cb 1.19 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2bgt h VAL 18 CO 0.18 0.00 -0.03 1.55 0.02 0.00 0.00 177.57 179.29 2bgt h PRO 19 N -0.56 0.00 0.11 1.57 0.13 -1.97 -2.30 132.00 128.98 2bgt h PRO 19 Ca 0.03 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.86 2bgt h PRO 19 Cb 0.59 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.75 2bgt h PRO 19 CO -0.19 0.03 -1.23 1.03 -0.23 0.00 0.00 178.00 177.41 2bgt h SER 20 N 0.00 0.88 -0.20 1.44 0.87 -1.67 -3.16 113.55 111.71 2bgt h SER 20 Ca -0.00 -0.80 -0.01 0.00 -1.23 0.00 0.00 61.79 59.75 2bgt h SER 20 Cb 0.07 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2bgt h SER 20 CO 0.00 1.60 0.08 0.28 -0.53 0.00 0.00 176.83 178.27 2bgt h SER 21 N 0.29 0.27 -0.72 6.23 0.02 -0.74 -1.43 113.55 117.47 2bgt h SER 21 Ca -0.18 -0.16 -0.03 0.00 -0.84 0.00 0.00 61.79 60.58 2bgt h SER 21 Cb 1.90 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 64.34 2bgt h SER 21 CO 0.24 0.36 0.34 -0.33 -1.14 0.00 0.00 176.83 176.30 2bgt h GLU 22 N 0.17 1.05 -0.39 3.45 4.39 -1.58 -0.37 114.58 121.30 2bgt h GLU 22 Ca 0.07 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 2bgt h GLU 22 Cb 0.17 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 2bgt h GLU 22 CO -0.01 0.82 0.15 1.15 -1.16 0.00 0.00 179.01 179.96 2bgt h THR 23 N 1.04 1.20 -0.04 1.13 2.02 -1.48 -0.79 112.91 116.00 2bgt h THR 23 Ca 0.25 -0.64 -0.06 0.00 0.77 0.00 0.00 66.41 66.73 2bgt h THR 23 Cb 0.12 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2bgt h THR 23 CO -0.03 0.23 -0.28 0.40 0.37 0.00 0.00 175.52 176.21 2bgt h ILE 24 N 0.49 1.22 -0.17 3.11 2.04 -0.62 -1.66 117.51 121.92 2bgt h ILE 24 Ca 0.13 -1.03 -0.19 0.00 1.00 0.00 0.00 64.86 64.77 2bgt h ILE 24 Cb 0.21 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.79 2bgt h ILE 24 CO -0.01 0.30 -0.66 1.88 0.00 0.00 0.00 178.15 179.66 2bgt h TYR 25 N 0.07 0.87 0.02 1.37 0.05 -0.70 -0.95 116.97 117.70 2bgt h TYR 25 Ca 0.01 -0.35 -0.00 0.00 0.05 0.00 0.00 58.73 58.44 2bgt h TYR 25 Cb 0.53 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 38.12 2bgt h TYR 25 CO 0.00 1.14 -0.01 -0.07 -1.05 0.00 0.00 178.16 178.18 2bgt h LEU 26 N 0.48 -0.02 -0.82 3.88 3.38 -0.90 -2.21 115.31 119.10 2bgt h LEU 26 Ca -0.02 -0.18 0.15 0.00 0.09 0.00 0.00 57.88 57.92 2bgt h LEU 26 Cb 1.26 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.92 2bgt h LEU 26 CO 0.13 0.16 0.40 0.15 0.09 0.00 0.00 178.44 179.37 2bgt h PHE 27 N -0.21 0.69 -0.01 1.13 3.57 -1.23 -0.29 116.94 120.59 2bgt h PHE 27 Ca -0.00 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 2bgt h PHE 27 Cb 0.20 -0.18 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 2bgt h PHE 27 CO -0.01 0.14 0.01 -0.22 -2.23 0.00 0.00 178.31 176.00 2bgt h LYS 28 N 0.56 0.02 -0.38 1.11 3.64 -1.02 -0.30 116.57 120.20 2bgt h LYS 28 Ca 0.45 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.73 2bgt h LYS 28 Cb 0.65 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 2bgt h LYS 28 CO -0.38 0.10 -0.15 0.28 -2.27 0.00 0.00 179.45 177.04 2bgt h VAL 29 N -0.07 1.26 -0.34 2.00 2.07 -0.83 -0.64 116.25 119.69 2bgt h VAL 29 Ca 0.00 -1.18 -0.16 0.00 0.82 0.00 0.00 66.70 66.18 2bgt h VAL 29 Cb 0.09 1.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2bgt h VAL 29 CO -0.00 0.40 -0.43 0.40 0.02 0.00 0.00 177.57 177.96 2bgt h ILE 30 N 0.62 1.28 -0.39 4.57 2.04 -0.98 -2.74 117.51 121.91 2bgt h ILE 30 Ca 0.10 -1.61 -0.00 0.00 1.00 0.00 0.00 64.86 64.35 2bgt h ILE 30 Cb 0.60 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 2bgt h ILE 30 CO 0.04 0.53 0.23 0.28 0.00 0.00 0.00 178.15 179.23 2bgt h SER 31 N 0.70 0.48 0.16 1.72 0.02 -0.88 -0.79 113.55 114.95 2bgt h SER 31 Ca 0.04 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2bgt h SER 31 Cb 1.03 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2bgt h SER 31 CO 0.10 0.40 0.00 -0.62 -1.14 0.00 0.00 176.83 175.58 2bgt n GLU 32 N -4.76 0.03 0.00 3.45 1.02 -0.26 -0.34 120.64 119.77 2bgt n GLU 32 Ca 0.00 0.35 0.14 0.00 -0.02 0.00 0.00 57.16 57.63 2bgt n GLU 32 Cb 0.06 -1.50 0.65 0.00 -0.02 0.00 0.00 31.44 30.63 2bgt n GLU 32 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 2bgt n MET 33 N -1.43 0.15 -0.95 3.49 2.81 -0.30 -4.87 117.12 116.02 2bgt n MET 33 Ca 0.02 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.92 2bgt n MET 33 Cb 0.06 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.07 2bgt n MET 33 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2bgt n GLY 34 N 1.34 1.04 3.31 3.03 0.00 0.54 -5.09 105.19 109.35 2bgt n GLY 34 Ca 0.09 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.53 2bgt n GLY 34 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bgt s LEU 35 N -0.34 2.05 -0.56 0.99 1.43 -1.06 -5.08 118.68 116.11 2bgt s LEU 35 Ca 0.00 -0.47 -0.28 0.00 -1.03 0.00 0.00 54.13 52.35 2bgt s LEU 35 Cb 0.00 -1.34 0.02 0.00 0.03 0.00 0.00 46.19 44.90 2bgt s LEU 35 CO 0.00 0.32 1.34 0.21 0.23 0.00 0.00 176.35 178.45 2bgt s ASN 36 N -0.60 6.24 0.08 2.29 3.84 -1.26 -4.48 114.94 121.05 2bgt s ASN 36 Ca 0.10 0.24 0.06 0.00 0.21 0.00 0.00 52.86 53.47 2bgt s ASN 36 Cb -0.10 -2.55 -0.03 0.00 -0.55 0.00 0.00 41.25 38.02 2bgt s ASN 36 CO -0.01 -1.63 -0.17 -0.69 -2.79 0.00 0.00 177.10 171.82 2bgt s VAL 37 N 5.68 1.33 0.09 -5.21 1.01 -1.26 -1.25 120.40 120.79 2bgt s VAL 37 Ca 0.49 -1.38 0.02 0.00 0.00 0.00 0.00 61.98 61.12 2bgt s VAL 37 Cb -0.10 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.00 2bgt s VAL 37 CO 0.25 -0.16 -0.08 -1.81 0.00 0.00 0.00 175.10 173.31 2bgt s ASP 38 N -1.77 1.20 -0.14 3.32 1.01 -0.37 -4.98 116.67 114.94 2bgt s ASP 38 Ca 0.01 -0.87 -0.01 0.00 0.71 0.00 0.00 52.55 52.39 2bgt s ASP 38 Cb -0.10 0.06 -0.01 0.00 1.01 0.00 0.00 42.92 43.87 2bgt s ASP 38 CO 0.03 -0.36 -0.11 -0.63 0.21 0.00 0.00 175.17 174.31 2bgt s ILE 39 N -2.89 3.12 -0.18 0.77 1.01 -1.26 -0.72 121.20 121.04 2bgt s ILE 39 Ca 0.06 -0.63 -0.07 0.00 0.00 0.00 0.00 60.65 60.02 2bgt s ILE 39 Cb 0.00 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 2bgt s ILE 39 CO -0.02 0.51 0.04 -0.63 0.00 0.00 0.00 174.94 174.84 2bgt s ILE 40 N 0.52 4.56 0.00 2.92 -1.09 -0.11 -1.23 121.20 126.77 2bgt s ILE 40 Ca -0.08 -0.11 0.00 0.00 -2.23 0.00 0.00 60.65 58.23 2bgt s ILE 40 Cb -0.15 -3.05 0.00 0.00 -1.58 0.00 0.00 42.46 37.67 2bgt s ILE 40 CO 0.04 0.45 0.00 -0.24 -1.23 0.00 0.00 174.94 173.96 2bgt n SER 41 N 3.69 0.00 -0.16 3.58 2.88 0.13 -4.44 113.62 119.30 2bgt n SER 41 Ca -0.17 -0.35 -0.10 0.00 -1.33 0.00 0.00 58.87 56.92 2bgt n SER 41 Cb 0.52 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.01 2bgt n SER 41 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2bgt h LEU 42 N 0.00 0.99 -8.97 2.46 3.38 -1.85 0.36 115.31 111.68 2bgt h LEU 42 Ca 0.00 -0.35 -0.45 0.00 0.09 0.00 0.00 57.88 57.17 2bgt h LEU 42 Cb 0.00 -0.27 -0.14 0.00 0.09 0.00 0.00 40.66 40.34 2bgt h LEU 42 CO 0.00 1.13 -0.70 -0.54 0.09 0.00 0.00 178.44 178.42 2bgt s LYS 43 N -4.74 1.40 0.16 1.13 1.02 -1.26 -4.41 119.74 113.04 2bgt s LYS 43 Ca -0.11 -1.67 -0.17 0.00 0.02 0.00 0.00 55.97 54.04 2bgt s LYS 43 Cb 0.13 -1.05 -0.07 0.00 -0.52 0.00 0.00 37.83 36.31 2bgt s LYS 43 CO 0.86 0.09 0.62 -0.80 -0.92 0.00 0.00 175.35 175.21 2bgt s ASN 44 N -3.36 6.96 0.00 2.83 -0.87 -1.26 -3.54 114.94 115.70 2bgt s ASN 44 Ca 0.25 1.24 0.00 0.00 -1.57 0.00 0.00 52.86 52.79 2bgt s ASN 44 Cb 0.02 -2.35 0.00 0.00 -0.02 0.00 0.00 41.25 38.90 2bgt s ASN 44 CO 0.09 0.11 0.00 0.61 -2.57 0.00 0.00 177.10 175.33 2bgt n GLY 45 N 0.93 1.95 0.25 0.66 0.00 -0.67 -4.93 105.19 103.39 2bgt n GLY 45 Ca -0.05 -0.84 0.17 0.00 0.00 0.00 0.00 46.02 45.29 2bgt n GLY 45 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2bgt h VAL 46 N 0.54 0.00 0.00 1.61 3.04 -1.96 -3.31 116.25 116.17 2bgt h VAL 46 Ca 0.00 -0.40 -0.00 0.00 -1.01 0.00 0.00 66.70 65.29 2bgt h VAL 46 Cb 0.00 1.33 -0.00 0.00 -2.01 0.00 0.00 31.29 30.61 2bgt h VAL 46 CO 0.00 0.00 -1.04 -1.22 -1.01 0.00 0.00 177.57 174.30 2bgt n TYR 47 N -2.89 0.00 -4.55 3.17 4.01 -1.26 -5.10 117.16 110.54 2bgt n TYR 47 Ca 0.01 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.49 2bgt n TYR 47 Cb 0.26 -0.02 -0.11 0.00 -0.31 0.00 0.00 39.34 39.16 2bgt n TYR 47 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2bgt s THR 48 N -2.05 1.82 0.13 -0.72 -4.23 -1.25 -4.28 115.64 105.06 2bgt s THR 48 Ca -0.00 -2.05 0.10 0.00 -1.18 0.00 0.00 61.69 58.55 2bgt s THR 48 Cb 0.00 -2.83 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 2bgt s THR 48 CO 0.03 -0.07 -0.23 -0.54 -0.54 0.00 0.00 174.62 173.27 2bgt s LYS 49 N -3.74 1.27 0.40 3.99 1.02 -0.36 -1.67 119.74 120.65 2bgt s LYS 49 Ca 0.34 -1.29 -0.11 0.00 0.02 0.00 0.00 55.97 54.93 2bgt s LYS 49 Cb 0.08 -1.61 -0.07 0.00 -0.52 0.00 0.00 37.83 35.70 2bgt s LYS 49 CO 0.16 0.37 0.77 -1.54 -0.92 0.00 0.00 175.35 174.20 2bgt s SER 50 N -2.10 6.57 0.24 2.83 1.04 -1.23 0.17 113.70 121.21 2bgt s SER 50 Ca 0.11 1.18 -0.05 0.00 0.48 0.00 0.00 55.95 57.67 2bgt s SER 50 Cb -0.09 -2.34 0.38 0.00 0.10 0.00 0.00 66.02 64.06 2bgt s SER 50 CO 0.06 -0.38 1.81 -0.26 0.98 0.00 0.00 173.24 175.45 2bgt h PHE 51 N 1.41 0.81 0.00 5.02 0.04 -1.12 -1.90 116.94 121.20 2bgt h PHE 51 Ca -0.47 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.33 2bgt h PHE 51 Cb 1.19 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 39.09 2bgt h PHE 51 CO 0.61 0.33 0.00 -0.40 -0.60 0.00 0.00 178.31 178.25 2bgt n ASP 52 N -4.76 0.00 -0.96 2.17 5.75 -1.26 -3.08 116.55 114.40 2bgt n ASP 52 Ca 0.13 0.22 0.12 0.00 -0.01 0.00 0.00 54.79 55.24 2bgt n ASP 52 Cb 0.27 -0.38 0.11 0.00 -1.03 0.00 0.00 41.12 40.09 2bgt n ASP 52 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2bgt n GLU 53 N -1.38 2.28 -4.31 0.11 -0.58 -0.72 -4.96 120.64 111.07 2bgt n GLU 53 Ca 0.08 -1.95 -0.19 0.00 -0.42 0.00 0.00 57.16 54.68 2bgt n GLU 53 Cb 0.21 -1.46 -0.11 0.00 -0.57 0.00 0.00 31.44 29.52 2bgt n GLU 53 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2bgt s VAL 54 N -1.88 1.62 -0.30 2.62 -7.23 -1.18 -4.96 120.40 109.09 2bgt s VAL 54 Ca 0.29 -2.02 -0.11 0.00 -1.81 0.00 0.00 61.98 58.32 2bgt s VAL 54 Cb 0.20 -1.87 -0.03 0.00 0.56 0.00 0.00 36.38 35.24 2bgt s VAL 54 CO 0.30 -0.50 0.20 -0.62 -0.31 0.00 0.00 175.10 174.16 2bgt s ASP 55 N -2.96 5.92 0.30 4.85 2.15 -1.26 -4.98 116.67 120.69 2bgt s ASP 55 Ca 0.17 -0.23 0.04 0.00 0.43 0.00 0.00 52.55 52.96 2bgt s ASP 55 Cb -0.03 -2.10 0.80 0.00 -0.30 0.00 0.00 42.92 41.29 2bgt s ASP 55 CO 0.05 -0.13 1.62 1.62 -0.17 0.00 0.00 175.17 178.16 2bgt h VAL 56 N 5.46 0.20 -0.34 1.11 3.04 -1.93 0.23 116.25 124.02 2bgt h VAL 56 Ca -0.34 -0.04 -0.10 0.00 -1.01 0.00 0.00 66.70 65.21 2bgt h VAL 56 Cb 1.17 0.06 -0.06 0.00 -2.01 0.00 0.00 31.29 30.45 2bgt h VAL 56 CO 0.59 0.02 0.13 0.59 -1.01 0.00 0.00 177.57 177.89 2bgt n ASN 57 N -5.30 3.21 0.02 3.17 3.02 -1.26 -3.44 115.26 114.69 2bgt n ASN 57 Ca 0.24 -2.55 0.12 0.00 -0.03 0.00 0.00 54.58 52.36 2bgt n ASN 57 Cb 0.78 -0.61 0.11 0.00 -0.61 0.00 0.00 39.78 39.44 2bgt n ASN 57 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2bgt n ASP 58 N 0.05 0.63 -4.76 6.41 -0.08 0.80 -4.88 116.55 114.71 2bgt n ASP 58 Ca 0.19 -0.21 -0.34 0.00 -1.51 0.00 0.00 54.79 52.92 2bgt n ASP 58 Cb 0.83 0.52 -0.08 0.00 2.34 0.00 0.00 41.12 44.73 2bgt n ASP 58 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 2bgt s TYR 59 N -3.12 3.29 0.02 -0.67 2.02 -1.22 -4.77 117.35 112.89 2bgt s TYR 59 Ca 0.07 0.25 0.09 0.00 -0.37 0.00 0.00 57.07 57.11 2bgt s TYR 59 Cb 0.15 -1.78 -0.23 0.00 -0.40 0.00 0.00 41.96 39.70 2bgt s TYR 59 CO 0.76 0.55 0.89 -0.44 -1.57 0.00 0.00 175.55 175.75 2bgt h ASP 60 N 4.55 0.03 -3.97 2.29 3.32 -0.82 -3.46 116.42 118.35 2bgt h ASP 60 Ca -0.50 -0.05 -0.37 0.00 0.02 0.00 0.00 57.03 56.13 2bgt h ASP 60 Cb 1.19 -0.01 -0.29 0.00 0.22 0.00 0.00 39.33 40.44 2bgt h ASP 60 CO 0.59 1.04 -0.77 -0.13 -1.72 0.00 0.00 179.24 178.25 2bgt s ARG 61 N -2.64 0.64 -0.19 3.56 1.81 -1.14 -4.93 118.95 116.05 2bgt s ARG 61 Ca -0.03 -0.27 0.01 0.00 -1.72 0.00 0.00 55.73 53.72 2bgt s ARG 61 Cb 0.09 -0.62 0.03 0.00 -0.45 0.00 0.00 34.95 34.00 2bgt s ARG 61 CO 0.82 0.16 -0.15 -1.17 -0.68 0.00 0.00 175.30 174.28 2bgt s LEU 62 N -0.14 2.30 -0.20 2.53 2.96 -1.26 -2.61 118.68 122.26 2bgt s LEU 62 Ca 0.02 -0.80 -0.09 0.00 -0.22 0.00 0.00 54.13 53.04 2bgt s LEU 62 Cb -0.03 -1.38 -0.05 0.00 0.50 0.00 0.00 46.19 45.23 2bgt s LEU 62 CO -0.00 -0.08 0.11 -0.63 -1.32 0.00 0.00 176.35 174.44 2bgt s ILE 63 N 1.32 5.18 -0.09 6.68 1.01 -0.53 -0.19 121.20 134.59 2bgt s ILE 63 Ca 0.01 0.11 0.04 0.00 0.00 0.00 0.00 60.65 60.81 2bgt s ILE 63 Cb -0.15 -3.37 -0.01 0.00 0.01 0.00 0.00 42.46 38.94 2bgt s ILE 63 CO -0.10 0.42 -0.22 -0.69 0.00 0.00 0.00 174.94 174.35 2bgt s VAL 64 N 0.54 2.27 0.32 2.92 1.01 0.81 -0.96 120.40 127.31 2bgt s VAL 64 Ca 0.06 -0.96 0.09 0.00 0.00 0.00 0.00 61.98 61.17 2bgt s VAL 64 Cb -0.12 -1.87 -0.06 0.00 0.00 0.00 0.00 36.38 34.33 2bgt s VAL 64 CO 0.00 0.56 -0.09 0.68 0.00 0.00 0.00 175.10 176.25 2bgt s VAL 65 N 0.11 2.06 -0.06 2.92 -7.23 -0.39 -0.99 120.40 116.82 2bgt s VAL 65 Ca -0.11 -2.19 -0.18 0.00 -1.81 0.00 0.00 61.98 57.70 2bgt s VAL 65 Cb -0.16 -2.58 0.04 0.00 0.56 0.00 0.00 36.38 34.24 2bgt s VAL 65 CO 0.06 -0.24 0.42 0.21 -0.31 0.00 0.00 175.10 175.24 2bgt s ASN 66 N -3.56 -0.35 -0.37 4.85 2.47 -1.26 -0.71 114.94 116.01 2bgt s ASN 66 Ca 0.32 0.43 0.04 0.00 0.42 0.00 0.00 52.86 54.06 2bgt s ASN 66 Cb 0.03 0.52 0.32 0.00 -1.45 0.00 0.00 41.25 40.66 2bgt s ASN 66 CO 0.15 -0.40 1.29 -0.24 -3.72 0.00 0.00 177.10 174.18 2bgt n SER 67 N 1.64 -1.62 -2.72 -4.21 2.88 -1.26 -4.94 113.62 103.38 2bgt n SER 67 Ca -0.19 -2.44 -0.01 0.00 -1.33 0.00 0.00 58.87 54.91 2bgt n SER 67 Cb 0.56 1.37 -0.00 0.00 -0.75 0.00 0.00 64.21 65.38 2bgt n SER 67 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2bgt n LYS 75 N 0.59 -1.39 -1.66 -1.46 5.02 -1.26 -4.89 118.16 113.10 2bgt n LYS 75 Ca -0.01 1.20 -0.40 0.00 -2.02 0.00 0.00 58.31 57.09 2bgt n LYS 75 Cb 0.73 -1.25 0.03 0.00 -0.02 0.00 0.00 35.03 34.52 2bgt n LYS 75 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2bgt n PRO 76 N 2.30 1.43 -1.55 1.97 -0.02 -1.26 -5.02 135.00 132.85 2bgt n PRO 76 Ca -0.04 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2bgt n PRO 76 Cb 0.06 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 2bgt n PRO 76 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2bgt n ASN 77 N -0.26 0.00 0.14 2.55 0.23 -1.26 -5.03 115.26 111.63 2bgt n ASN 77 Ca 0.10 -0.95 -0.14 0.00 -0.53 0.00 0.00 54.58 53.06 2bgt n ASN 77 Cb 0.43 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.05 2bgt n ASN 77 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2bgt h LEU 78 N 0.00 -0.27 -0.67 -4.53 3.38 -1.98 -1.29 115.31 109.95 2bgt h LEU 78 Ca 0.00 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 57.91 2bgt h LEU 78 Cb 0.00 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 2bgt h LEU 78 CO 0.00 -0.03 0.37 0.00 0.09 0.00 0.00 178.44 178.86 2bgt h ALA 79 N 0.19 0.90 0.54 1.53 0.00 -1.91 -0.77 119.26 119.75 2bgt h ALA 79 Ca -0.03 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2bgt h ALA 79 Cb 0.38 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2bgt h ALA 79 CO 0.05 0.03 -0.26 0.82 0.00 0.00 0.00 179.25 179.89 2bgt h ILE 80 N 0.67 0.41 -0.82 0.00 2.04 -1.65 -0.42 117.51 117.74 2bgt h ILE 80 Ca 0.31 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 2bgt h ILE 80 Cb 0.22 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 2bgt h ILE 80 CO -0.20 0.04 0.45 -0.07 0.00 0.00 0.00 178.15 178.37 2bgt h LEU 81 N -0.89 1.02 -0.18 1.44 4.07 -1.15 -2.03 115.31 117.59 2bgt h LEU 81 Ca -0.07 -0.10 -0.02 0.00 0.08 0.00 0.00 57.88 57.77 2bgt h LEU 81 Cb 0.62 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 2bgt h LEU 81 CO 0.12 0.83 0.04 0.28 -1.08 0.00 0.00 178.44 178.63 2bgt h SER 82 N 1.14 0.28 -0.51 -0.43 0.02 -1.15 -1.64 113.55 111.26 2bgt h SER 82 Ca 0.29 -0.24 0.05 0.00 -0.84 0.00 0.00 61.79 61.04 2bgt h SER 82 Cb 0.03 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 62.45 2bgt h SER 82 CO -0.05 0.45 0.25 0.00 -1.14 0.00 0.00 176.83 176.34 2bgt h ALA 83 N 0.84 0.65 -0.16 3.77 0.00 -0.85 -1.09 119.26 122.42 2bgt h ALA 83 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2bgt h ALA 83 Cb 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2bgt h ALA 83 CO 0.00 -0.11 0.10 1.96 0.00 0.00 0.00 179.25 181.21 2bgt h GLN 84 N 0.48 0.21 -0.38 0.00 1.08 -1.26 0.10 115.11 115.34 2bgt h GLN 84 Ca 0.23 -0.02 0.06 0.00 -1.45 0.00 0.00 58.65 57.48 2bgt h GLN 84 Cb 0.15 -0.05 -0.06 0.00 -0.05 0.00 0.00 27.48 27.48 2bgt h GLN 84 CO -0.17 0.16 0.04 -0.22 -0.95 0.00 0.00 178.83 177.69 2bgt h LYS 85 N 0.20 0.15 -0.21 1.46 3.64 -0.98 0.12 116.57 120.94 2bgt h LYS 85 Ca 0.06 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.44 2bgt h LYS 85 Cb 0.00 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 2bgt h LYS 85 CO -0.01 0.10 0.09 0.35 -2.27 0.00 0.00 179.45 177.71 2bgt h PHE 86 N 0.15 0.17 -0.04 1.91 3.57 -0.72 -2.22 116.94 119.75 2bgt h PHE 86 Ca 0.19 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.60 2bgt h PHE 86 Cb 0.24 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 2bgt h PHE 86 CO -0.23 0.09 -0.41 0.52 -2.23 0.00 0.00 178.31 176.05 2bgt h MET 87 N 0.20 0.09 0.00 1.11 2.86 -0.57 -2.73 114.93 115.89 2bgt h MET 87 Ca 0.09 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2bgt h MET 87 Cb 0.04 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 2bgt h MET 87 CO -0.07 0.49 -0.12 0.00 1.06 0.00 0.00 176.91 178.27 2bgt h ALA 88 N 1.51 1.23 0.00 6.32 0.00 -0.15 -1.90 119.26 126.26 2bgt h ALA 88 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2bgt h ALA 88 Cb 0.76 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2bgt h ALA 88 CO 0.06 0.15 -0.83 1.63 0.00 0.00 0.00 179.25 180.26 2bgt n LYS 89 N -3.56 0.12 -2.21 0.00 5.02 -1.05 -4.80 118.16 111.68 2bgt n LYS 89 Ca -0.02 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 2bgt n LYS 89 Cb 0.25 -1.54 -0.03 0.00 -0.02 0.00 0.00 35.03 33.69 2bgt n LYS 89 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 2bgt s TYR 90 N -3.08 3.26 -2.73 2.13 5.04 -0.72 -4.82 117.35 116.43 2bgt s TYR 90 Ca 0.07 1.15 0.24 0.00 -2.44 0.00 0.00 57.07 56.10 2bgt s TYR 90 Cb 0.16 -3.62 0.45 0.00 0.35 0.00 0.00 41.96 39.30 2bgt s TYR 90 CO 0.78 -1.99 1.41 1.63 -1.34 0.00 0.00 175.55 176.04 2bgt n LYS 91 N 3.03 2.20 -1.60 4.97 5.02 -1.26 -4.74 118.16 125.79 2bgt n LYS 91 Ca 0.08 -1.76 0.00 0.00 -2.02 0.00 0.00 58.31 54.60 2bgt n LYS 91 Cb 0.43 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 2bgt n LYS 91 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2bgt n SER 92 N 1.08 2.00 -4.76 4.39 7.64 -1.26 -5.02 113.62 117.69 2bgt n SER 92 Ca 0.16 -0.80 -0.40 0.00 1.01 0.00 0.00 58.87 58.84 2bgt n SER 92 Cb 0.53 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.70 2bgt n SER 92 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2bgt s LYS 93 N -1.39 4.53 -0.15 1.43 2.20 -1.26 -4.50 119.74 120.59 2bgt s LYS 93 Ca 0.00 1.90 -0.06 0.00 -0.36 0.00 0.00 55.97 57.45 2bgt s LYS 93 Cb 0.00 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 33.17 2bgt s LYS 93 CO 0.00 0.08 0.05 0.42 -0.36 0.00 0.00 175.35 175.54 2bgt s ILE 94 N -1.19 4.70 -0.38 5.43 1.01 -1.01 -4.19 121.20 125.58 2bgt s ILE 94 Ca 0.47 -0.07 -0.11 0.00 0.00 0.00 0.00 60.65 60.93 2bgt s ILE 94 Cb -0.33 -3.08 0.03 0.00 0.01 0.00 0.00 42.46 39.09 2bgt s ILE 94 CO 0.43 0.51 0.22 -0.31 0.00 0.00 0.00 174.94 175.79 2bgt s TYR 95 N -0.05 3.25 -0.25 3.97 1.51 0.74 -1.52 117.35 125.00 2bgt s TYR 95 Ca 0.06 -1.03 -0.14 0.00 -1.01 0.00 0.00 57.07 54.95 2bgt s TYR 95 Cb -0.12 -2.51 -0.04 0.00 -0.11 0.00 0.00 41.96 39.18 2bgt s TYR 95 CO 0.01 -0.68 0.32 -0.47 -1.11 0.00 0.00 175.55 173.62 2bgt s TYR 96 N 1.54 3.28 -0.47 2.71 5.04 0.02 -0.13 117.35 129.34 2bgt s TYR 96 Ca 0.02 0.38 -0.26 0.00 -2.44 0.00 0.00 57.07 54.77 2bgt s TYR 96 Cb -0.20 -2.49 0.03 0.00 0.35 0.00 0.00 41.96 39.65 2bgt s TYR 96 CO 0.06 -0.14 0.94 -0.51 -1.34 0.00 0.00 175.55 174.56 2bgt s LEU 97 N 1.73 3.99 -0.85 6.97 1.02 -0.16 -0.55 118.68 130.84 2bgt s LEU 97 Ca 0.13 0.11 -0.18 0.00 0.02 0.00 0.00 54.13 54.22 2bgt s LEU 97 Cb -0.15 -3.20 0.15 0.00 0.02 0.00 0.00 46.19 43.01 2bgt s LEU 97 CO 0.09 -1.07 0.97 0.12 0.02 0.00 0.00 176.35 176.48 2bgt s PHE 98 N 3.80 3.26 -0.76 0.29 5.36 0.96 -4.60 117.98 126.28 2bgt s PHE 98 Ca 0.37 -1.47 0.14 0.00 -0.96 0.00 0.00 56.93 55.02 2bgt s PHE 98 Cb -0.10 -4.12 -0.14 0.00 -0.34 0.00 0.00 43.02 38.32 2bgt s PHE 98 CO 0.26 -1.33 0.64 0.25 -1.46 0.00 0.00 175.22 173.58 2bgt n THR 99 N 5.10 0.00 -3.76 0.12 -2.24 -1.26 -1.06 114.28 111.18 2bgt n THR 99 Ca 0.16 -0.18 -0.17 0.00 -2.27 0.00 0.00 64.05 61.59 2bgt n THR 99 Cb 0.47 1.02 -0.17 0.00 -2.10 0.00 0.00 70.33 69.56 2bgt n THR 99 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2bgt s ASP 100 N -2.31 0.52 0.48 3.42 -1.08 -1.26 -4.97 116.67 111.47 2bgt s ASP 100 Ca 0.06 0.04 0.14 0.00 -0.52 0.00 0.00 52.55 52.27 2bgt s ASP 100 Cb 0.11 -0.13 1.13 0.00 -1.46 0.00 0.00 42.92 42.58 2bgt s ASP 100 CO 0.57 -0.17 2.09 0.40 0.52 0.00 0.00 175.17 178.58 2bgt h ILE 101 N 6.34 0.99 -0.00 4.11 1.08 -1.96 -0.60 117.51 127.47 2bgt h ILE 101 Ca -0.33 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 64.06 2bgt h ILE 101 Cb 1.12 0.76 0.00 0.00 -3.07 0.00 0.00 36.82 35.63 2bgt h ILE 101 CO 0.36 0.04 -0.00 0.54 -0.69 0.00 0.00 178.15 178.40 2bgt n ARG 102 N -4.50 0.39 -3.17 2.37 3.00 -1.26 -4.30 116.66 109.19 2bgt n ARG 102 Ca 0.02 -0.00 -0.27 0.00 -0.01 0.00 0.00 57.85 57.59 2bgt n ARG 102 Cb 0.16 -1.50 -0.06 0.00 0.00 0.00 0.00 32.46 31.06 2bgt n ARG 102 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2bgt n LEU 103 N -1.30 3.92 -4.85 0.55 4.77 -0.23 -5.08 117.00 114.77 2bgt n LEU 103 Ca 0.14 -5.53 -0.29 0.00 -0.03 0.00 0.00 56.01 50.29 2bgt n LEU 103 Cb 0.25 -0.53 0.09 0.00 -2.33 0.00 0.00 43.42 40.90 2bgt n LEU 103 CO 0.24 2.21 0.75 -2.16 -1.33 0.00 0.00 177.39 177.10 2bgt s PRO 104 N -2.93 2.03 0.55 3.23 0.04 -1.26 -4.71 135.00 131.94 2bgt s PRO 104 Ca 0.44 0.33 -0.20 0.00 0.04 0.00 0.00 61.00 61.61 2bgt s PRO 104 Cb 0.22 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.77 2bgt s PRO 104 CO -0.08 -1.59 1.20 0.12 0.04 0.00 0.00 177.00 176.69 2bgt s PHE 105 N -3.38 2.54 -0.02 0.56 5.36 -1.26 -5.02 117.98 116.76 2bgt s PHE 105 Ca 0.61 1.51 -0.29 0.00 -0.96 0.00 0.00 56.93 57.80 2bgt s PHE 105 Cb -0.12 -3.47 0.08 0.00 -0.34 0.00 0.00 43.02 39.17 2bgt s PHE 105 CO 0.52 -2.03 0.71 -1.54 -1.46 0.00 0.00 175.22 171.42 2bgt s SER 106 N -1.49 -0.59 0.43 6.13 1.04 -1.26 -4.90 113.70 113.06 2bgt s SER 106 Ca 0.73 0.49 0.00 0.00 0.48 0.00 0.00 55.95 57.65 2bgt s SER 106 Cb -0.30 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.33 2bgt s SER 106 CO 0.34 -0.65 0.00 0.00 0.98 0.00 0.00 173.24 173.91 2bgt n GLN 107 N 0.56 0.41 -0.07 4.02 1.13 -1.26 -5.11 117.38 117.05 2bgt n GLN 107 Ca -0.17 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.67 2bgt n GLN 107 Cb 0.59 0.00 -0.12 0.00 0.11 0.00 0.00 30.24 30.82 2bgt n GLN 107 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 2bgt h GLU 123 N 0.00 0.08 0.01 -1.09 4.57 -2.03 -3.52 114.58 112.59 2bgt h GLU 123 Ca 0.00 -0.13 -0.20 0.00 -1.18 0.00 0.00 59.36 57.85 2bgt h GLU 123 Cb 0.00 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 2bgt h GLU 123 CO 0.00 1.06 -0.92 1.05 -1.18 0.00 0.00 179.01 179.02 2bgt h GLU 124 N -0.71 0.04 0.00 1.92 4.11 -2.05 -2.91 114.58 114.99 2bgt h GLU 124 Ca -0.36 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.01 2bgt h GLU 124 Cb 1.50 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.77 2bgt h GLU 124 CO -0.12 0.93 0.00 -0.85 0.07 0.00 0.00 179.01 179.03 2bgt n GLU 125 N -3.50 0.34 -0.00 1.06 0.28 -1.26 -3.13 120.64 114.42 2bgt n GLU 125 Ca -0.01 0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 2bgt n GLU 125 Cb 0.86 -1.50 -0.00 0.00 1.43 0.00 0.00 31.44 32.23 2bgt n GLU 125 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2bgt n LEU 126 N -1.27 0.01 -4.66 -1.84 4.77 -1.21 -3.94 117.00 108.86 2bgt n LEU 126 Ca 0.11 -0.41 -0.43 0.00 -0.03 0.00 0.00 56.01 55.25 2bgt n LEU 126 Cb 0.17 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2bgt n LEU 126 CO 0.17 0.00 1.05 -0.22 -1.33 0.00 0.00 177.39 177.06 2bgt s LEU 127 N -2.20 4.17 -0.19 2.23 2.96 -1.10 -4.76 118.68 119.79 2bgt s LEU 127 Ca 0.00 1.63 -0.18 0.00 -0.22 0.00 0.00 54.13 55.36 2bgt s LEU 127 Cb 0.00 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.12 2bgt s LEU 127 CO 0.01 -0.74 0.51 -0.63 -1.32 0.00 0.00 176.35 174.18 2bgt s ILE 128 N 3.41 5.11 -0.26 6.68 1.01 -1.26 -4.64 121.20 131.25 2bgt s ILE 128 Ca 0.53 0.94 0.09 0.00 0.00 0.00 0.00 60.65 62.21 2bgt s ILE 128 Cb -0.20 -3.84 -0.12 0.00 0.01 0.00 0.00 42.46 38.31 2bgt s ILE 128 CO 0.13 0.19 0.31 0.29 0.00 0.00 0.00 174.94 175.86 2bgt n LYS 129 N 4.71 2.42 -1.47 2.79 5.02 -1.26 -4.94 118.16 125.43 2bgt n LYS 129 Ca -0.05 -0.04 -0.35 0.00 -2.02 0.00 0.00 58.31 55.85 2bgt n LYS 129 Cb 0.50 -1.06 0.09 0.00 -0.02 0.00 0.00 35.03 34.55 2bgt n LYS 129 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2bgt s SER 130 N -2.38 4.16 0.60 4.39 0.01 -1.26 -4.83 113.70 114.39 2bgt s SER 130 Ca 0.01 2.52 -0.16 0.00 1.31 0.00 0.00 55.95 59.62 2bgt s SER 130 Cb 0.07 -2.61 -0.03 0.00 0.21 0.00 0.00 66.02 63.66 2bgt s SER 130 CO 0.38 -2.30 1.08 -2.16 0.41 0.00 0.00 173.24 170.66 2bgt s PRO 131 N -3.71 3.18 -0.07 12.44 0.04 -1.26 -4.62 135.00 141.00 2bgt s PRO 131 Ca 0.79 1.34 0.02 0.00 0.04 0.00 0.00 61.00 63.19 2bgt s PRO 131 Cb -0.34 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.21 2bgt s PRO 131 CO 0.44 -0.94 -0.12 0.42 0.04 0.00 0.00 177.00 176.84 2bgt s ILE 132 N -2.28 1.14 -0.25 0.56 1.01 0.39 -2.40 121.20 119.37 2bgt s ILE 132 Ca 0.66 -0.48 -0.08 0.00 0.00 0.00 0.00 60.65 60.75 2bgt s ILE 132 Cb -0.19 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.20 2bgt s ILE 132 CO 0.36 0.36 0.10 -0.75 0.00 0.00 0.00 174.94 175.00 2bgt s LYS 133 N 0.70 3.76 -0.36 2.79 2.20 -0.57 -1.09 119.74 127.17 2bgt s LYS 133 Ca -0.14 -0.43 -0.16 0.00 -0.36 0.00 0.00 55.97 54.88 2bgt s LYS 133 Cb -0.16 -3.39 -0.00 0.00 -1.51 0.00 0.00 37.83 32.77 2bgt s LYS 133 CO 0.03 -0.13 0.41 0.08 -0.36 0.00 0.00 175.35 175.38 2bgt s VAL 134 N 1.50 5.12 -0.58 4.02 1.01 0.16 -0.80 120.40 130.82 2bgt s VAL 134 Ca 0.06 0.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.90 2bgt s VAL 134 Cb -0.15 -3.89 0.08 0.00 0.00 0.00 0.00 36.38 32.42 2bgt s VAL 134 CO 0.05 -0.17 0.75 -0.63 0.00 0.00 0.00 175.10 175.09 2bgt s ILE 135 N 2.13 4.72 -0.09 2.22 1.01 0.29 -1.37 121.20 130.10 2bgt s ILE 135 Ca 0.13 -0.71 -0.26 0.00 0.00 0.00 0.00 60.65 59.81 2bgt s ILE 135 Cb -0.16 -4.49 -0.03 0.00 0.01 0.00 0.00 42.46 37.79 2bgt s ILE 135 CO 0.12 -1.12 0.82 -0.55 0.00 0.00 0.00 174.94 174.22 2bgt s SER 136 N 3.40 7.08 0.36 3.58 0.15 0.26 -0.03 113.70 128.49 2bgt s SER 136 Ca 0.15 1.31 0.16 0.00 0.70 0.00 0.00 55.95 58.27 2bgt s SER 136 Cb -0.21 -2.47 0.65 0.00 -1.71 0.00 0.00 66.02 62.28 2bgt s SER 136 CO 0.09 -0.26 1.74 -0.61 1.20 0.00 0.00 173.24 175.40 2bgt h GLN 137 N 6.98 0.00 -6.55 5.44 4.15 -1.23 -1.78 115.11 122.11 2bgt h GLN 137 Ca -0.37 0.00 -0.52 0.00 0.77 0.00 0.00 58.65 58.53 2bgt h GLN 137 Cb 1.18 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.84 2bgt h GLN 137 CO 0.79 0.42 0.10 0.20 -1.93 0.00 0.00 178.83 178.41 2bgt s GLY 138 N -4.37 2.62 0.42 2.39 0.00 -1.26 -4.50 107.32 102.62 2bgt s GLY 138 Ca -0.01 0.16 0.28 0.00 0.00 0.00 0.00 44.72 45.15 2bgt s GLY 138 CO 0.71 0.52 1.79 1.19 0.00 0.00 0.00 173.10 177.31 2bgt h ILE 139 N 2.79 0.00 -3.06 0.90 2.10 -1.49 -3.41 117.51 115.33 2bgt h ILE 139 Ca -0.48 -0.62 -0.70 0.00 1.08 0.00 0.00 64.86 64.14 2bgt h ILE 139 Cb 1.19 1.58 -0.19 0.00 -1.09 0.00 0.00 36.82 38.31 2bgt h ILE 139 CO 0.65 0.00 0.06 0.21 -1.08 0.00 0.00 178.15 178.00 2bgt s ASN 140 N -5.47 6.20 0.17 2.19 3.84 -1.26 -4.91 114.94 115.69 2bgt s ASN 140 Ca 0.05 -1.23 0.22 0.00 0.21 0.00 0.00 52.86 52.11 2bgt s ASN 140 Cb 0.08 -2.29 0.89 0.00 -0.55 0.00 0.00 41.25 39.38 2bgt s ASN 140 CO 0.57 -1.00 1.69 0.18 -2.79 0.00 0.00 177.10 175.74 2bgt n LEU 141 N 6.20 0.48 0.02 3.21 4.77 -1.26 -2.86 117.00 127.56 2bgt n LEU 141 Ca -0.09 0.60 -0.10 0.00 -0.03 0.00 0.00 56.01 56.40 2bgt n LEU 141 Cb 0.44 -0.50 0.05 0.00 -2.33 0.00 0.00 43.42 41.07 2bgt n LEU 141 CO 0.56 -0.37 0.45 0.44 -1.33 0.00 0.00 177.39 177.14 2bgt h ASP 142 N 0.00 0.59 -0.44 -1.43 3.32 -1.97 0.24 116.42 116.73 2bgt h ASP 142 Ca 0.00 -0.33 -0.11 0.00 0.02 0.00 0.00 57.03 56.61 2bgt h ASP 142 Cb 0.42 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 2bgt h ASP 142 CO 0.00 1.04 -0.13 0.40 -1.72 0.00 0.00 179.24 178.84 2bgt h ILE 143 N 0.39 1.27 -0.57 0.35 2.04 -1.96 0.14 117.51 119.17 2bgt h ILE 143 Ca -0.00 -1.25 -0.11 0.00 1.00 0.00 0.00 64.86 64.51 2bgt h ILE 143 Cb 1.14 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 2bgt h ILE 143 CO 0.11 0.43 -0.06 0.00 0.00 0.00 0.00 178.15 178.63 2bgt h ALA 144 N 1.04 0.81 -0.28 1.87 0.00 -1.46 -2.19 119.26 119.06 2bgt h ALA 144 Ca 0.13 -0.33 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 2bgt h ALA 144 Cb 0.66 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2bgt h ALA 144 CO 0.05 0.67 -0.41 0.87 0.00 0.00 0.00 179.25 180.42 2bgt h LYS 145 N 0.93 0.77 -0.48 0.00 1.57 -0.26 -3.17 116.57 115.93 2bgt h LYS 145 Ca 0.15 -0.46 -0.08 0.00 -1.87 0.00 0.00 60.65 58.40 2bgt h LYS 145 Cb 0.62 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2bgt h LYS 145 CO 0.04 1.08 -0.03 0.00 -0.57 0.00 0.00 179.45 179.97 2bgt h ALA 146 N 0.68 1.04 0.00 3.86 0.00 -0.65 -2.36 119.26 121.83 2bgt h ALA 146 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2bgt h ALA 146 Cb 1.01 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2bgt h ALA 146 CO 0.10 0.59 0.00 0.00 0.00 0.00 0.00 179.25 179.94 2bgt h ALA 147 N 1.20 1.00 -0.19 0.00 0.00 -1.42 -2.34 119.26 117.50 2bgt h ALA 147 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2bgt h ALA 147 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2bgt h ALA 147 CO 0.03 0.00 0.00 0.72 0.00 0.00 0.00 179.25 180.00 2bgt n HIS 148 N -2.91 0.51 0.16 0.00 8.25 -1.00 -4.67 115.22 115.55 2bgt n HIS 148 Ca -0.00 -0.76 0.10 0.00 -0.26 0.00 0.00 57.72 56.80 2bgt n HIS 148 Cb 0.23 -0.18 0.54 0.00 1.12 0.00 0.00 29.99 31.70 2bgt n HIS 148 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2bgt n LYS 149 N -0.45 0.13 0.01 -0.41 2.85 -0.88 -0.95 118.16 118.46 2bgt n LYS 149 Ca 0.15 0.62 0.12 0.00 -1.05 0.00 0.00 58.31 58.15 2bgt n LYS 149 Cb 0.64 -1.92 0.21 0.00 -0.65 0.00 0.00 35.03 33.31 2bgt n LYS 149 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 2bgt n LYS 150 N -2.19 0.08 -2.90 -1.58 -0.00 -1.26 -4.85 118.16 105.45 2bgt n LYS 150 Ca -0.01 0.01 -0.41 0.00 -0.00 0.00 0.00 58.31 57.90 2bgt n LYS 150 Cb 0.04 -1.54 -0.04 0.00 -0.00 0.00 0.00 35.03 33.49 2bgt n LYS 150 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2bgt s VAL 151 N -3.05 4.87 -0.21 0.58 1.01 -0.13 -4.93 120.40 118.54 2bgt s VAL 151 Ca 0.09 1.58 0.17 0.00 0.00 0.00 0.00 61.98 63.82 2bgt s VAL 151 Cb 0.16 -4.12 0.08 0.00 0.00 0.00 0.00 36.38 32.51 2bgt s VAL 151 CO 0.72 -0.01 1.36 0.44 0.00 0.00 0.00 175.10 177.60 2bgt h ASP 152 N 7.50 0.00 -3.28 3.32 3.32 -1.89 -3.47 116.42 121.92 2bgt h ASP 152 Ca -0.27 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.23 2bgt h ASP 152 Cb 1.11 0.00 0.20 0.00 0.22 0.00 0.00 39.33 40.86 2bgt h ASP 152 CO 0.85 0.39 -0.46 0.59 -1.72 0.00 0.00 179.24 178.89 2bgt n ASN 153 N -3.12 -1.52 -4.75 6.45 4.13 -1.26 -4.88 115.26 110.31 2bgt n ASN 153 Ca 0.01 0.50 -0.41 0.00 1.68 0.00 0.00 54.58 56.35 2bgt n ASN 153 Cb 0.70 -1.21 -0.03 0.00 -1.54 0.00 0.00 39.78 37.70 2bgt n ASN 153 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2bgt s VAL 154 N -2.08 2.91 -0.10 2.41 1.01 -1.26 -4.90 120.40 118.39 2bgt s VAL 154 Ca 0.62 0.83 -0.09 0.00 0.00 0.00 0.00 61.98 63.34 2bgt s VAL 154 Cb -0.30 -3.53 0.03 0.00 0.00 0.00 0.00 36.38 32.58 2bgt s VAL 154 CO 0.61 0.16 0.27 -0.51 0.00 0.00 0.00 175.10 175.63 2bgt s ILE 155 N -0.50 -0.00 0.11 2.22 2.07 -1.26 -0.46 121.20 123.38 2bgt s ILE 155 Ca 0.53 0.01 0.06 0.00 -1.41 0.00 0.00 60.65 59.84 2bgt s ILE 155 Cb -0.39 -0.38 -0.04 0.00 0.13 0.00 0.00 42.46 41.79 2bgt s ILE 155 CO 0.45 0.00 -0.14 -1.83 -1.91 0.00 0.00 174.94 171.52 2bgt s GLU 156 N 0.23 0.97 0.04 3.50 -1.05 -0.25 -4.96 118.70 117.18 2bgt s GLU 156 Ca -0.01 -1.17 0.08 0.00 -0.15 0.00 0.00 54.97 53.72 2bgt s GLU 156 Cb -0.02 -0.87 -0.03 0.00 -0.44 0.00 0.00 34.13 32.77 2bgt s GLU 156 CO -0.00 0.17 -0.22 -0.06 0.95 0.00 0.00 175.26 176.10 2bgt s PHE 157 N -1.97 1.91 -0.12 4.83 0.40 -1.26 0.37 117.98 122.13 2bgt s PHE 157 Ca 0.06 -0.38 -0.13 0.00 -0.60 0.00 0.00 56.93 55.88 2bgt s PHE 157 Cb -0.06 -1.14 0.03 0.00 0.51 0.00 0.00 43.02 42.37 2bgt s PHE 157 CO 0.03 0.09 0.36 -2.00 0.70 0.00 0.00 175.22 174.40 2bgt s GLU 158 N -1.16 0.46 -0.01 0.44 2.12 -0.47 -4.95 118.70 115.12 2bgt s GLU 158 Ca 0.08 0.43 -0.16 0.00 0.36 0.00 0.00 54.97 55.68 2bgt s GLU 158 Cb -0.09 0.22 -0.06 0.00 0.26 0.00 0.00 34.13 34.47 2bgt s GLU 158 CO 0.02 -0.07 0.45 -0.47 -0.54 0.00 0.00 175.26 174.65 2bgt s TYR 159 N 0.01 3.70 -0.19 5.30 5.04 -1.26 -0.58 117.35 129.38 2bgt s TYR 159 Ca -0.02 1.03 -0.11 0.00 -2.44 0.00 0.00 57.07 55.53 2bgt s TYR 159 Cb -0.03 -2.38 0.06 0.00 0.35 0.00 0.00 41.96 39.96 2bgt s TYR 159 CO 0.01 0.54 0.47 0.12 -1.34 0.00 0.00 175.55 175.35 2bgt s PHE 160 N -0.75 -0.70 -1.18 4.97 5.36 -0.67 -4.90 117.98 120.12 2bgt s PHE 160 Ca 0.25 1.47 -0.21 0.00 -0.96 0.00 0.00 56.93 57.48 2bgt s PHE 160 Cb -0.17 0.34 0.03 0.00 -0.34 0.00 0.00 43.02 42.88 2bgt s PHE 160 CO 0.14 -0.38 1.71 -1.25 -1.46 0.00 0.00 175.22 173.98 2bgt s PRO 161 N 1.38 3.55 0.29 10.12 0.04 -1.26 -4.04 135.00 145.07 2bgt s PRO 161 Ca -0.09 -1.51 -0.02 0.00 0.04 0.00 0.00 61.00 59.42 2bgt s PRO 161 Cb -0.07 -5.41 0.41 0.00 0.04 0.00 0.00 34.50 29.47 2bgt s PRO 161 CO -0.13 -2.59 1.89 0.82 0.04 0.00 0.00 177.00 177.02 2bgt h ILE 162 N 6.12 1.22 0.00 0.56 2.04 -1.88 -3.11 117.51 122.46 2bgt h ILE 162 Ca 0.32 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2bgt h ILE 162 Cb 0.93 0.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 2bgt h ILE 162 CO 1.40 0.26 0.00 -1.84 0.00 0.00 0.00 178.15 177.97 2bgt n GLU 163 N -4.34 0.13 0.00 2.37 0.00 -1.26 -2.00 120.64 115.54 2bgt n GLU 163 Ca 0.06 0.63 0.09 0.00 0.00 0.00 0.00 57.16 57.94 2bgt n GLU 163 Cb 0.14 -1.92 0.50 0.00 0.00 0.00 0.00 31.44 30.16 2bgt n GLU 163 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2bgt n GLN 164 N -2.19 0.45 0.17 3.44 6.02 -1.18 -3.43 117.38 120.65 2bgt n GLN 164 Ca -0.01 0.05 0.14 0.00 -0.01 0.00 0.00 57.00 57.17 2bgt n GLN 164 Cb 0.03 -1.50 0.72 0.00 1.02 0.00 0.00 30.24 30.51 2bgt n GLN 164 CO 0.00 0.00 0.00 0.10 -1.01 0.00 0.00 177.06 176.15 2bgt h TYR 165 N 0.00 0.00 -0.14 1.08 -0.00 -1.67 -1.64 116.97 114.60 2bgt h TYR 165 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 58.73 58.57 2bgt h TYR 165 Cb 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.79 2bgt h TYR 165 CO 0.00 0.00 -0.59 0.87 -0.00 0.00 0.00 178.16 178.44 2bgt h LYS 166 N 0.00 0.46 0.00 0.10 1.57 -1.86 -3.10 116.57 113.75 2bgt h LYS 166 Ca 0.10 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2bgt h LYS 166 Cb 0.43 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2bgt h LYS 166 CO -0.00 0.92 0.00 -0.84 -0.57 0.00 0.00 179.45 178.96 2bgt h ILE 167 N 0.35 0.00 -0.28 1.86 3.07 -1.56 -2.99 117.51 117.95 2bgt h ILE 167 Ca -0.00 -0.80 0.00 0.00 1.55 0.00 0.00 64.86 65.61 2bgt h ILE 167 Cb 1.13 1.79 0.00 0.00 -0.27 0.00 0.00 36.82 39.46 2bgt h ILE 167 CO 0.10 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 178.61 2bgt n HIS 168 N -2.86 0.36 -2.01 0.16 8.25 -1.05 -4.78 115.22 113.28 2bgt n HIS 168 Ca 0.04 -0.18 -0.41 0.00 -0.26 0.00 0.00 57.72 56.91 2bgt n HIS 168 Cb 0.47 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.56 2bgt n HIS 168 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 2bgt s MET 169 N -1.64 4.27 0.58 -0.41 1.75 -1.13 -4.87 119.30 117.85 2bgt s MET 169 Ca 0.34 2.31 0.39 0.00 -1.25 0.00 0.00 55.69 57.48 2bgt s MET 169 Cb 0.19 -3.09 2.01 0.00 2.84 0.00 0.00 34.83 36.78 2bgt s MET 169 CO 0.28 -0.38 2.17 -0.91 -0.65 0.00 0.00 175.02 175.53 2bgt h ASN 170 N 4.44 0.00 -0.18 1.11 -0.26 -1.90 -2.48 115.58 116.30 2bgt h ASN 170 Ca -0.47 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.26 2bgt h ASN 170 Cb 1.22 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.48 2bgt h ASN 170 CO 0.73 0.00 -0.01 -0.90 -1.06 0.00 0.00 177.43 176.20 2bgt n ASP 171 N -2.92 3.33 -4.75 5.81 5.68 -1.26 -5.01 116.55 117.43 2bgt n ASP 171 Ca -0.02 -3.09 -0.41 0.00 -0.50 0.00 0.00 54.79 50.77 2bgt n ASP 171 Cb 0.11 -0.52 -0.03 0.00 -1.14 0.00 0.00 41.12 39.55 2bgt n ASP 171 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 2bgt s PHE 172 N -2.87 3.23 0.02 2.11 2.19 -0.94 -5.02 117.98 116.70 2bgt s PHE 172 Ca 0.39 1.32 -0.03 0.00 0.33 0.00 0.00 56.93 58.94 2bgt s PHE 172 Cb 0.33 -3.59 -0.02 0.00 -1.31 0.00 0.00 43.02 38.43 2bgt s PHE 172 CO 0.06 -1.75 0.04 -0.65 1.83 0.00 0.00 175.22 174.76 2bgt s GLN 173 N -0.69 0.45 0.34 10.12 -0.21 -1.26 -5.03 119.66 123.38 2bgt s GLN 173 Ca 0.53 -0.67 -0.23 0.00 0.02 0.00 0.00 55.36 55.02 2bgt s GLN 173 Cb -0.37 0.17 -0.10 0.00 1.00 0.00 0.00 33.01 33.72 2bgt s GLN 173 CO 0.42 -0.10 0.89 -0.51 -2.12 0.00 0.00 175.29 173.88 2bgt s LEU 174 N -1.78 4.21 0.54 2.90 1.02 -1.26 -4.95 118.68 119.35 2bgt s LEU 174 Ca -0.10 1.68 -0.19 0.00 0.02 0.00 0.00 54.13 55.55 2bgt s LEU 174 Cb -0.05 -4.10 -0.06 0.00 0.02 0.00 0.00 46.19 42.00 2bgt s LEU 174 CO -0.02 -0.14 1.08 -0.44 0.02 0.00 0.00 176.35 176.84 2bgt s SER 175 N -1.83 5.92 0.29 2.29 0.01 -0.32 -5.03 113.70 115.03 2bgt s SER 175 Ca 0.53 1.98 0.06 0.00 1.31 0.00 0.00 55.95 59.83 2bgt s SER 175 Cb -0.15 -2.56 -0.02 0.00 0.21 0.00 0.00 66.02 63.50 2bgt s SER 175 CO 0.20 -1.07 0.41 -0.54 0.41 0.00 0.00 173.24 172.65 2bgt s LYS 176 N -3.51 3.27 -0.20 12.44 1.02 -1.26 -4.56 119.74 126.93 2bgt s LYS 176 Ca 0.68 -0.90 -0.41 0.00 0.02 0.00 0.00 55.97 55.37 2bgt s LYS 176 Cb -0.19 -2.85 -0.18 0.00 -0.52 0.00 0.00 37.83 34.10 2bgt s LYS 176 CO 0.28 0.24 1.50 -2.30 -0.92 0.00 0.00 175.35 174.15 2bgt n PRO 177 N -1.52 0.69 -4.38 -1.68 -0.02 -1.26 -4.76 135.00 122.07 2bgt n PRO 177 Ca -0.04 0.25 -0.27 0.00 -2.02 0.00 0.00 63.50 61.41 2bgt n PRO 177 Cb 0.58 -1.85 -0.13 0.00 -0.02 0.00 0.00 33.50 32.07 2bgt n PRO 177 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2bgt s THR 178 N 2.11 2.07 0.06 3.45 2.01 -1.26 -5.10 115.64 118.98 2bgt s THR 178 Ca 0.95 -1.67 -0.31 0.00 0.31 0.00 0.00 61.69 60.98 2bgt s THR 178 Cb -1.18 -1.84 -0.06 0.00 0.01 0.00 0.00 72.50 69.43 2bgt s THR 178 CO 0.64 0.05 1.29 -0.54 -0.69 0.00 0.00 174.62 175.37 2bgt s LYS 179 N -1.97 4.37 0.05 4.92 1.02 -1.26 -4.95 119.74 121.91 2bgt s LYS 179 Ca 0.11 1.89 -0.27 0.00 0.02 0.00 0.00 55.97 57.72 2bgt s LYS 179 Cb -0.10 -3.37 -0.05 0.00 -0.52 0.00 0.00 37.83 33.79 2bgt s LYS 179 CO 0.05 -0.38 0.86 0.15 -0.92 0.00 0.00 175.35 175.11 2bgt s LYS 180 N 1.40 4.57 0.00 1.68 -0.14 -1.26 -4.71 119.74 121.27 2bgt s LYS 180 Ca 0.61 1.23 0.00 0.00 -1.36 0.00 0.00 55.97 56.45 2bgt s LYS 180 Cb -0.32 -3.39 0.00 0.00 -1.68 0.00 0.00 37.83 32.44 2bgt s LYS 180 CO 0.28 0.18 0.35 0.25 -0.76 0.00 0.00 175.35 175.66 2bgt n THR 181 N 3.09 0.12 -4.07 2.17 -2.24 -0.47 -5.04 114.28 107.84 2bgt n THR 181 Ca 0.01 -0.27 -0.07 0.00 -2.27 0.00 0.00 64.05 61.44 2bgt n THR 181 Cb 0.50 1.35 -0.10 0.00 -2.10 0.00 0.00 70.33 69.98 2bgt n THR 181 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2bgt s LEU 182 N -0.12 2.43 -0.17 3.22 1.43 -1.02 -5.04 118.68 119.41 2bgt s LEU 182 Ca 0.00 -0.92 -0.13 0.00 -1.03 0.00 0.00 54.13 52.05 2bgt s LEU 182 Cb 0.00 0.21 -0.08 0.00 0.03 0.00 0.00 46.19 46.35 2bgt s LEU 182 CO 0.00 -0.56 -0.10 0.47 0.23 0.00 0.00 176.35 176.39 2bgt n ASP 183 N 0.33 1.84 -4.05 2.29 8.00 -0.46 -2.36 116.55 122.13 2bgt n ASP 183 Ca -0.16 0.55 -0.19 0.00 0.71 0.00 0.00 54.79 55.70 2bgt n ASP 183 Cb 0.60 -0.88 -0.14 0.00 -0.02 0.00 0.00 41.12 40.67 2bgt n ASP 183 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2bgt s VAL 184 N -2.34 0.83 0.03 2.53 1.01 -1.14 -1.27 120.40 120.05 2bgt s VAL 184 Ca -0.20 -0.53 0.05 0.00 0.00 0.00 0.00 61.98 61.30 2bgt s VAL 184 Cb 0.04 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.69 2bgt s VAL 184 CO 0.34 0.18 -0.15 -0.51 0.00 0.00 0.00 175.10 174.95 2bgt s ILE 185 N -0.36 1.22 -0.08 2.22 2.07 -0.87 -1.99 121.20 123.41 2bgt s ILE 185 Ca 0.03 -0.96 -0.03 0.00 -1.41 0.00 0.00 60.65 58.27 2bgt s ILE 185 Cb -0.05 -1.08 0.04 0.00 0.13 0.00 0.00 42.46 41.51 2bgt s ILE 185 CO -0.00 0.10 0.17 -0.47 -1.91 0.00 0.00 174.94 172.83 2bgt s TYR 186 N -0.75 -0.20 -0.08 3.50 5.04 -0.60 -1.95 117.35 122.30 2bgt s TYR 186 Ca 0.03 0.57 0.01 0.00 -2.44 0.00 0.00 57.07 55.24 2bgt s TYR 186 Cb -0.08 -0.07 -0.02 0.00 0.35 0.00 0.00 41.96 42.14 2bgt s TYR 186 CO 0.01 -0.19 -0.11 0.20 -1.34 0.00 0.00 175.55 174.11 2bgt s GLY 187 N 1.32 1.59 0.00 8.97 0.00 -1.26 -1.22 107.32 116.72 2bgt s GLY 187 Ca -0.08 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.72 2bgt s GLY 187 CO -0.07 -0.55 0.00 0.61 0.00 0.00 0.00 173.10 173.10 2bgt n GLY 188 N 2.68 -0.82 3.61 0.20 0.00 -0.04 -4.96 105.19 105.86 2bgt n GLY 188 Ca -0.18 -1.13 -0.25 0.00 0.00 0.00 0.00 46.02 44.47 2bgt n GLY 188 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bgt s SER 189 N 0.00 4.42 -0.99 1.61 0.01 -1.26 -1.93 113.70 115.56 2bgt s SER 189 Ca 0.00 -0.60 -0.24 0.00 1.31 0.00 0.00 55.95 56.42 2bgt s SER 189 Cb 0.00 -0.80 -0.03 0.00 0.21 0.00 0.00 66.02 65.40 2bgt s SER 189 CO 0.00 0.05 1.86 0.12 0.41 0.00 0.00 173.24 175.68 2bgt s PHE 190 N -2.01 1.99 -0.33 2.43 5.36 -0.06 -4.91 117.98 120.45 2bgt s PHE 190 Ca 0.28 0.27 -0.14 0.00 -0.96 0.00 0.00 56.93 56.38 2bgt s PHE 190 Cb -0.08 -4.17 -0.02 0.00 -0.34 0.00 0.00 43.02 38.42 2bgt s PHE 190 CO 0.18 -1.68 0.33 1.03 -1.46 0.00 0.00 175.22 173.62 2bgt s ARG 191 N 6.47 3.64 0.94 10.12 0.52 -1.26 -5.05 118.95 134.33 2bgt s ARG 191 Ca 0.65 -0.39 -0.13 0.00 -0.52 0.00 0.00 55.73 55.35 2bgt s ARG 191 Cb -0.04 -3.78 0.16 0.00 0.52 0.00 0.00 34.95 31.81 2bgt s ARG 191 CO 0.01 -0.46 1.15 0.45 0.02 0.00 0.00 175.30 176.47 2bgt s SER 192 N 1.72 3.24 0.44 0.23 0.15 -1.26 -1.23 113.70 116.99 2bgt s SER 192 Ca 0.11 0.89 0.00 0.00 0.70 0.00 0.00 55.95 57.65 2bgt s SER 192 Cb -0.17 -1.40 0.00 0.00 -1.71 0.00 0.00 66.02 62.74 2bgt s SER 192 CO 0.11 -2.71 0.00 0.61 1.20 0.00 0.00 173.24 172.45 2bgt n GLY 193 N -2.19 1.09 0.18 9.45 0.00 -1.26 -4.02 105.19 108.43 2bgt n GLY 193 Ca 0.08 -0.97 -0.09 0.00 0.00 0.00 0.00 46.02 45.04 2bgt n GLY 193 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2bgt h GLN 194 N 0.00 0.54 -0.17 1.61 4.15 -1.96 -1.20 115.11 118.08 2bgt h GLN 194 Ca 0.00 -0.07 0.04 0.00 0.77 0.00 0.00 58.65 59.39 2bgt h GLN 194 Cb 0.00 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.55 2bgt h GLN 194 CO 0.00 0.46 -0.08 0.00 -1.93 0.00 0.00 178.83 177.28 2bgt h ARG 195 N 0.48 -0.06 -0.34 1.69 2.47 -1.72 0.36 114.38 117.25 2bgt h ARG 195 Ca 0.13 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 58.89 2bgt h ARG 195 Cb 0.09 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 28.39 2bgt h ARG 195 CO -0.02 -0.04 0.14 1.49 0.56 0.00 0.00 179.97 182.10 2bgt h GLU 196 N -0.07 0.29 -0.57 0.04 4.81 -0.98 0.69 114.58 118.79 2bgt h GLU 196 Ca 0.09 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2bgt h GLU 196 Cb 0.21 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 2bgt h GLU 196 CO -0.21 0.19 0.38 1.03 -0.73 0.00 0.00 179.01 179.67 2bgt h SER 197 N 0.30 0.61 1.07 1.04 0.87 -0.65 -1.80 113.55 115.00 2bgt h SER 197 Ca 0.15 -0.01 -0.18 0.00 -1.23 0.00 0.00 61.79 60.52 2bgt h SER 197 Cb 0.10 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 2bgt h SER 197 CO -0.14 0.43 -0.87 0.11 -0.53 0.00 0.00 176.83 175.83 2bgt h LYS 198 N 0.72 0.00 -0.23 2.24 1.57 0.87 -2.48 116.57 119.25 2bgt h LYS 198 Ca 0.22 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.87 2bgt h LYS 198 Cb 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 2bgt h LYS 198 CO -0.05 0.87 -0.38 0.52 -0.57 0.00 0.00 179.45 179.84 2bgt h MET 199 N 0.00 0.67 -0.32 3.15 2.86 -0.53 -1.47 114.93 119.30 2bgt h MET 199 Ca -0.01 -0.41 -0.08 0.00 -2.06 0.00 0.00 59.70 57.14 2bgt h MET 199 Cb 1.65 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 33.33 2bgt h MET 199 CO 0.11 1.03 -0.13 0.28 1.06 0.00 0.00 176.91 179.27 2bgt h VAL 200 N 0.38 1.24 -0.01 -2.22 2.07 -1.38 -0.17 116.25 116.15 2bgt h VAL 200 Ca 0.02 -1.06 -0.00 0.00 0.82 0.00 0.00 66.70 66.48 2bgt h VAL 200 Cb 0.98 1.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2bgt h VAL 200 CO 0.09 0.35 -0.01 -0.08 0.02 0.00 0.00 177.57 177.94 2bgt h GLU 201 N 0.50 0.03 0.00 1.57 4.57 -1.31 -3.07 114.58 116.88 2bgt h GLU 201 Ca 0.09 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.14 2bgt h GLU 201 Cb 0.52 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.09 2bgt h GLU 201 CO 0.03 0.44 -1.20 0.74 -1.18 0.00 0.00 179.01 177.84 2bgt h PHE 202 N -0.38 0.00 0.00 0.92 0.04 -1.24 -3.37 116.94 112.91 2bgt h PHE 202 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2bgt h PHE 202 Cb 0.43 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.58 2bgt h PHE 202 CO 0.07 0.41 -0.56 1.28 -0.60 0.00 0.00 178.31 178.91 2bgt n LEU 203 N -2.87 0.45 -4.76 1.54 4.77 -0.08 -4.93 117.00 111.11 2bgt n LEU 203 Ca -0.06 -0.46 -0.28 0.00 -0.03 0.00 0.00 56.01 55.18 2bgt n LEU 203 Cb 0.75 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.78 2bgt n LEU 203 CO 0.42 0.11 -0.26 -0.36 -1.33 0.00 0.00 177.39 175.97 2bgt s PHE 204 N -2.03 3.11 -1.27 -1.77 0.40 -1.16 -4.09 117.98 111.17 2bgt s PHE 204 Ca 0.03 -0.00 -0.10 0.00 -0.60 0.00 0.00 56.93 56.26 2bgt s PHE 204 Cb 0.08 -1.53 0.08 0.00 0.51 0.00 0.00 43.02 42.15 2bgt s PHE 204 CO 0.42 0.51 0.47 -0.25 0.70 0.00 0.00 175.22 177.08 2bgt n ASP 205 N 0.03 -3.55 0.01 1.36 8.00 -0.48 -4.85 116.55 117.07 2bgt n ASP 205 Ca -0.09 -0.39 -0.05 0.00 0.71 0.00 0.00 54.79 54.97 2bgt n ASP 205 Cb 0.53 -2.95 -0.11 0.00 -0.02 0.00 0.00 41.12 38.57 2bgt n ASP 205 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2bgt h THR 206 N -0.92 0.75 0.00 -3.53 1.35 -1.85 -3.48 112.91 105.23 2bgt h THR 206 Ca -0.42 -2.45 0.00 0.00 -0.55 0.00 0.00 66.41 62.99 2bgt h THR 206 Cb 1.28 2.29 0.00 0.00 -1.73 0.00 0.00 68.15 69.99 2bgt h THR 206 CO 0.53 0.43 0.00 0.61 -0.25 0.00 0.00 175.52 176.84 2bgt n GLY 207 N 1.47 0.45 3.76 5.82 0.00 -1.26 -5.00 105.19 110.44 2bgt n GLY 207 Ca -0.13 -0.59 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 2bgt n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bgt s LEU 208 N 0.00 3.45 -0.80 0.99 1.02 -1.26 -5.05 118.68 117.02 2bgt s LEU 208 Ca 0.00 -0.56 -0.22 0.00 0.02 0.00 0.00 54.13 53.36 2bgt s LEU 208 Cb 0.00 -1.98 0.08 0.00 0.02 0.00 0.00 46.19 44.31 2bgt s LEU 208 CO 0.00 -0.19 1.14 0.21 0.02 0.00 0.00 176.35 177.53 2bgt s ASN 209 N -3.84 6.35 -0.04 2.29 2.47 -1.26 -4.99 114.94 115.91 2bgt s ASN 209 Ca 0.36 -1.26 0.03 0.00 0.42 0.00 0.00 52.86 52.40 2bgt s ASN 209 Cb -0.05 -2.46 -0.03 0.00 -1.45 0.00 0.00 41.25 37.26 2bgt s ASN 209 CO 0.23 -1.42 -0.11 -0.63 -3.72 0.00 0.00 177.10 171.46 2bgt s ILE 210 N 4.12 3.35 -0.01 -5.21 1.01 -1.26 -1.36 121.20 121.83 2bgt s ILE 210 Ca 0.31 -0.68 0.07 0.00 0.00 0.00 0.00 60.65 60.34 2bgt s ILE 210 Cb -0.09 -2.36 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 2bgt s ILE 210 CO 0.02 0.55 -0.21 -0.70 0.00 0.00 0.00 174.94 174.59 2bgt s GLU 211 N -0.92 1.71 -0.23 2.79 2.12 -0.84 -1.21 118.70 122.12 2bgt s GLU 211 Ca 0.13 -0.78 0.01 0.00 0.36 0.00 0.00 54.97 54.69 2bgt s GLU 211 Cb -0.11 -1.67 0.05 0.00 0.26 0.00 0.00 34.13 32.67 2bgt s GLU 211 CO 0.02 0.45 -0.09 0.12 -0.54 0.00 0.00 175.26 175.23 2bgt s PHE 212 N -0.53 2.65 0.26 5.30 2.19 0.77 -1.56 117.98 127.06 2bgt s PHE 212 Ca 0.08 -1.86 0.07 0.00 0.33 0.00 0.00 56.93 55.55 2bgt s PHE 212 Cb -0.08 -1.70 -0.04 0.00 -1.31 0.00 0.00 43.02 39.89 2bgt s PHE 212 CO -0.01 -0.80 0.17 -0.59 1.83 0.00 0.00 175.22 175.83 2bgt s PHE 213 N 1.31 3.03 0.00 10.12 -0.71 -0.36 -0.72 117.98 130.65 2bgt s PHE 213 Ca -0.05 -0.14 0.00 0.00 -1.04 0.00 0.00 56.93 55.69 2bgt s PHE 213 Cb -0.18 -1.39 0.00 0.00 -1.21 0.00 0.00 43.02 40.23 2bgt s PHE 213 CO -0.07 0.52 0.00 0.41 -1.34 0.00 0.00 175.22 174.74 2bgt n GLY 214 N -1.14 -0.31 3.13 1.99 0.00 -0.58 -0.86 105.19 107.41 2bgt n GLY 214 Ca -0.07 -2.22 -0.43 0.00 0.00 0.00 0.00 46.02 43.30 2bgt n GLY 214 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bgt n ASN 215 N 0.00 4.64 -3.65 1.61 3.02 -0.81 -4.24 115.26 115.83 2bgt n ASN 215 Ca 0.00 -2.94 -0.11 0.00 -0.03 0.00 0.00 54.58 51.50 2bgt n ASN 215 Cb 0.00 -1.64 -0.08 0.00 -0.61 0.00 0.00 39.78 37.45 2bgt n ASN 215 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2bgt s ALA 216 N 2.72 -1.65 0.06 5.41 0.00 -1.26 -0.88 121.76 126.16 2bgt s ALA 216 Ca 0.47 2.00 0.06 0.00 0.00 0.00 0.00 51.96 54.49 2bgt s ALA 216 Cb 0.07 -1.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.00 2bgt s ALA 216 CO -0.01 -0.33 -0.16 1.03 0.00 0.00 0.00 175.76 176.30 2bgt s ARG 217 N 0.82 0.97 0.26 0.00 0.52 -1.26 -4.81 118.95 115.46 2bgt s ARG 217 Ca -0.04 -0.92 -0.01 0.00 -0.52 0.00 0.00 55.73 54.24 2bgt s ARG 217 Cb -0.05 -1.04 0.55 0.00 0.52 0.00 0.00 34.95 34.94 2bgt s ARG 217 CO -0.06 0.25 1.74 1.49 0.02 0.00 0.00 175.30 178.74 2bgt h GLU 218 N 4.53 0.53 0.00 3.54 4.81 -1.97 -0.70 114.58 125.33 2bgt h GLU 218 Ca -0.41 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2bgt h GLU 218 Cb 1.18 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.44 2bgt h GLU 218 CO 0.42 0.35 0.08 0.87 -0.73 0.00 0.00 179.01 180.00 2bgt h LYS 219 N 0.55 0.00 0.00 1.92 1.57 -2.04 0.49 116.57 119.06 2bgt h LYS 219 Ca 0.47 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.24 2bgt h LYS 219 Cb 0.72 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 2bgt h LYS 219 CO -0.40 0.00 -0.07 1.96 -0.57 0.00 0.00 179.45 180.37 2bgt h GLN 220 N 0.00 0.00 -3.58 3.15 4.20 -1.54 -3.37 115.11 113.97 2bgt h GLN 220 Ca 0.00 0.00 -0.75 0.00 0.06 0.00 0.00 58.65 57.96 2bgt h GLN 220 Cb 0.16 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.81 2bgt h GLN 220 CO 0.00 0.07 2.17 1.19 -0.67 0.00 0.00 178.83 181.60 2bgt n PHE 221 N -3.12 3.03 -1.42 2.96 3.01 0.16 -4.63 117.46 117.44 2bgt n PHE 221 Ca 0.03 -2.82 0.07 0.00 1.01 0.00 0.00 57.45 55.75 2bgt n PHE 221 Cb 0.54 -2.03 0.19 0.00 -0.01 0.00 0.00 39.48 38.17 2bgt n PHE 221 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 2bgt n LYS 222 N 4.17 1.49 -3.15 -1.08 2.85 -1.26 -5.01 118.16 116.17 2bgt n LYS 222 Ca 0.41 -3.06 -0.41 0.00 -1.05 0.00 0.00 58.31 54.20 2bgt n LYS 222 Cb 0.37 -1.58 -0.07 0.00 -0.65 0.00 0.00 35.03 33.09 2bgt n LYS 222 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 2bgt s ASN 223 N -3.11 6.44 0.18 -5.58 3.84 -1.26 -4.91 114.94 110.54 2bgt s ASN 223 Ca 0.36 0.29 0.13 0.00 0.21 0.00 0.00 52.86 53.86 2bgt s ASN 223 Cb 0.34 -2.31 0.70 0.00 -0.55 0.00 0.00 41.25 39.42 2bgt s ASN 223 CO -0.03 -0.48 1.40 -0.81 -2.79 0.00 0.00 177.10 174.39 2bgt n PRO 224 N 5.85 0.08 0.04 0.43 -0.04 -1.26 -0.94 135.00 139.17 2bgt n PRO 224 Ca -0.02 0.56 -0.07 0.00 -0.04 0.00 0.00 63.50 63.93 2bgt n PRO 224 Cb 0.49 -1.76 0.10 0.00 -0.04 0.00 0.00 33.50 32.28 2bgt n PRO 224 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 2bgt h LYS 225 N 0.00 0.42 -3.19 0.54 3.64 -2.02 -3.37 116.57 112.59 2bgt h LYS 225 Ca 0.00 -0.26 -0.63 0.00 -1.27 0.00 0.00 60.65 58.49 2bgt h LYS 225 Cb 0.03 0.03 -0.42 0.00 -0.41 0.00 0.00 32.23 31.46 2bgt h LYS 225 CO 0.00 0.85 -0.60 0.71 -2.27 0.00 0.00 179.45 178.14 2bgt s TYR 226 N -3.96 3.36 0.43 1.91 2.02 -0.11 -5.10 117.35 115.90 2bgt s TYR 226 Ca -0.06 -3.25 -0.24 0.00 -0.37 0.00 0.00 57.07 53.15 2bgt s TYR 226 Cb 0.12 -2.72 -0.08 0.00 -0.40 0.00 0.00 41.96 38.88 2bgt s TYR 226 CO 0.82 -0.63 1.11 -1.25 -1.57 0.00 0.00 175.55 174.03 2bgt s PRO 227 N -0.95 3.97 0.13 -1.71 0.04 -1.26 -4.77 135.00 130.46 2bgt s PRO 227 Ca 0.22 1.66 -0.19 0.00 0.04 0.00 0.00 61.00 62.72 2bgt s PRO 227 Cb -0.13 -2.49 0.05 0.00 0.04 0.00 0.00 34.50 31.97 2bgt s PRO 227 CO -0.10 -0.34 0.49 1.67 0.04 0.00 0.00 177.00 178.77 2bgt s TRP 228 N -1.59 -0.36 -0.19 0.56 1.48 -1.26 -5.04 118.94 112.54 2bgt s TRP 228 Ca 0.60 0.12 -0.10 0.00 -1.06 0.00 0.00 56.10 55.66 2bgt s TRP 228 Cb -0.26 0.39 -0.08 0.00 -1.16 0.00 0.00 33.47 32.37 2bgt s TRP 228 CO 0.32 -0.76 -0.25 2.41 -4.06 0.00 0.00 176.95 174.61 2bgt n THR 229 N -0.25 1.06 -4.47 0.66 -1.04 -1.26 -5.00 114.28 103.98 2bgt n THR 229 Ca -0.17 -0.24 -0.33 0.00 -2.04 0.00 0.00 64.05 61.27 2bgt n THR 229 Cb 0.64 -1.77 -0.16 0.00 -1.82 0.00 0.00 70.33 67.21 2bgt n THR 229 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2bgt s LYS 230 N -2.36 3.04 0.51 -2.82 2.20 -1.26 -5.04 119.74 114.01 2bgt s LYS 230 Ca -0.26 -0.83 -0.03 0.00 -0.36 0.00 0.00 55.97 54.49 2bgt s LYS 230 Cb 0.10 -2.51 -0.00 0.00 -1.51 0.00 0.00 37.83 33.91 2bgt s LYS 230 CO 0.33 -0.07 0.77 0.00 -0.36 0.00 0.00 175.35 176.02 2bgt s ALA 231 N 0.97 3.55 0.92 3.13 0.00 -1.26 -1.38 121.76 127.69 2bgt s ALA 231 Ca -0.03 -0.87 -0.15 0.00 0.00 0.00 0.00 51.96 50.91 2bgt s ALA 231 Cb -0.15 -2.36 0.17 0.00 0.00 0.00 0.00 23.12 20.78 2bgt s ALA 231 CO -0.05 -0.54 1.28 -1.25 0.00 0.00 0.00 175.76 175.20 2bgt s PRO 232 N -4.74 1.01 -0.17 0.00 0.04 -1.26 -4.90 135.00 124.98 2bgt s PRO 232 Ca 0.50 -0.25 -0.27 0.00 0.04 0.00 0.00 61.00 61.02 2bgt s PRO 232 Cb -0.10 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 2bgt s PRO 232 CO 0.41 -2.19 0.91 0.08 0.04 0.00 0.00 177.00 176.25 2bgt s VAL 233 N -3.79 4.82 -0.13 -0.36 1.01 -0.35 -4.87 120.40 116.72 2bgt s VAL 233 Ca 0.70 1.79 -0.17 0.00 0.00 0.00 0.00 61.98 64.31 2bgt s VAL 233 Cb -0.06 -4.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 2bgt s VAL 233 CO 0.52 -0.03 0.42 -0.36 0.00 0.00 0.00 175.10 175.65 2bgt s PHE 234 N 2.38 3.50 0.29 5.22 0.40 -1.26 -0.16 117.98 128.35 2bgt s PHE 234 Ca 0.41 0.79 0.07 0.00 -0.60 0.00 0.00 56.93 57.60 2bgt s PHE 234 Cb -0.16 -2.48 -0.06 0.00 0.51 0.00 0.00 43.02 40.83 2bgt s PHE 234 CO 0.12 0.19 -0.06 0.95 0.70 0.00 0.00 175.22 177.12 2bgt s THR 235 N 0.56 1.69 0.00 0.64 -4.23 0.10 -4.95 115.64 109.45 2bgt s THR 235 Ca 0.23 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 2bgt s THR 235 Cb -0.14 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.23 2bgt s THR 235 CO 0.08 -0.29 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 2bgt n GLY 236 N -0.60 -2.95 3.88 3.99 0.00 -1.26 -3.16 105.19 105.09 2bgt n GLY 236 Ca -0.05 -1.35 -0.30 0.00 0.00 0.00 0.00 46.02 44.32 2bgt n GLY 236 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bgt s LYS 237 N -2.59 2.96 0.14 1.61 1.02 -1.26 -1.53 119.74 120.10 2bgt s LYS 237 Ca 0.00 0.46 0.07 0.00 0.02 0.00 0.00 55.97 56.52 2bgt s LYS 237 Cb 0.00 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.22 2bgt s LYS 237 CO 0.00 -0.94 -0.15 0.96 -0.92 0.00 0.00 175.35 174.30 2bgt s ILE 238 N -3.30 1.48 0.19 2.17 -4.36 -1.26 -4.87 121.20 111.24 2bgt s ILE 238 Ca 0.57 -1.81 -0.33 0.00 -0.26 0.00 0.00 60.65 58.82 2bgt s ILE 238 Cb -0.11 -1.66 -0.15 0.00 1.25 0.00 0.00 42.46 41.80 2bgt s ILE 238 CO 0.51 -0.41 1.31 -2.65 0.24 0.00 0.00 174.94 173.95 2bgt n PRO 239 N 0.39 1.58 -1.15 0.37 -0.02 -1.26 -4.78 135.00 130.13 2bgt n PRO 239 Ca -0.14 0.56 -0.38 0.00 -2.02 0.00 0.00 63.50 61.52 2bgt n PRO 239 Cb 0.57 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 2bgt n PRO 239 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2bgt n MET 240 N 2.11 1.90 0.00 -0.52 2.81 -1.26 -1.28 117.12 120.87 2bgt n MET 240 Ca 0.14 -1.88 0.00 0.00 -1.81 0.00 0.00 57.70 54.16 2bgt n MET 240 Cb 0.27 -2.86 0.00 0.00 -0.71 0.00 0.00 33.22 29.92 2bgt n MET 240 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2bgt n ASN 241 N 6.42 0.00 -0.22 7.83 6.94 -1.26 -4.96 115.26 130.02 2bgt n ASN 241 Ca 0.50 -0.08 0.04 0.00 -0.02 0.00 0.00 54.58 55.01 2bgt n ASN 241 Cb 0.34 0.00 0.05 0.00 -2.36 0.00 0.00 39.78 37.81 2bgt n ASN 241 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2bgt n MET 242 N 0.00 0.83 0.06 -3.83 2.81 -0.40 -4.82 117.12 111.77 2bgt n MET 242 Ca 0.00 -1.56 -0.12 0.00 -1.81 0.00 0.00 57.70 54.21 2bgt n MET 242 Cb 0.04 -0.92 -0.06 0.00 -0.71 0.00 0.00 33.22 31.57 2bgt n MET 242 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2bgt h VAL 243 N 3.10 0.83 -0.84 2.03 2.07 -1.93 0.06 116.25 121.57 2bgt h VAL 243 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2bgt h VAL 243 Cb 1.09 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 2bgt h VAL 243 CO 0.00 0.00 0.46 0.28 0.02 0.00 0.00 177.57 178.33 2bgt h SER 244 N -0.14 1.04 -0.06 0.57 0.02 -1.88 -0.06 113.55 113.03 2bgt h SER 244 Ca 0.02 -0.08 -0.15 0.00 -0.84 0.00 0.00 61.79 60.73 2bgt h SER 244 Cb 0.15 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2bgt h SER 244 CO -0.05 0.83 -0.47 -0.08 -1.14 0.00 0.00 176.83 175.91 2bgt h GLU 245 N 1.17 0.62 -0.18 3.45 4.81 -1.83 -0.70 114.58 121.91 2bgt h GLU 245 Ca 0.30 -0.35 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 2bgt h GLU 245 Cb 0.02 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2bgt h GLU 245 CO -0.05 0.96 -0.02 -0.22 -0.73 0.00 0.00 179.01 178.94 2bgt h LYS 246 N 0.49 0.34 -0.43 1.92 1.63 -0.69 -3.12 116.57 116.72 2bgt h LYS 246 Ca 0.03 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 2bgt h LYS 246 Cb 1.01 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.59 2bgt h LYS 246 CO 0.09 0.58 0.27 -0.91 -3.45 0.00 0.00 179.45 176.04 2bgt h ASN 247 N 0.07 0.50 0.30 4.20 2.35 -0.87 -2.80 115.58 119.34 2bgt h ASN 247 Ca 0.05 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2bgt h ASN 247 Cb 0.44 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.69 2bgt h ASN 247 CO 0.01 0.37 0.00 -1.20 -1.65 0.00 0.00 177.43 174.96 2bgt n SER 248 N -4.46 0.25 0.00 5.81 7.64 -0.28 -2.07 113.62 120.51 2bgt n SER 248 Ca 0.03 0.59 0.13 0.00 1.01 0.00 0.00 58.87 60.63 2bgt n SER 248 Cb 0.06 -0.63 0.59 0.00 -1.01 0.00 0.00 64.21 63.22 2bgt n SER 248 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bgt n GLN 249 N -1.80 0.09 -4.23 1.43 6.02 -1.06 -4.60 117.38 113.24 2bgt n GLN 249 Ca 0.01 0.04 -0.23 0.00 -0.01 0.00 0.00 57.00 56.82 2bgt n GLN 249 Cb 0.11 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.80 2bgt n GLN 249 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bgt s ALA 250 N -2.90 3.29 -0.01 -1.58 0.00 -0.88 -1.37 121.76 118.31 2bgt s ALA 250 Ca 0.16 -1.70 -0.25 0.00 0.00 0.00 0.00 51.96 50.17 2bgt s ALA 250 Cb 0.17 -0.78 -0.19 0.00 0.00 0.00 0.00 23.12 22.32 2bgt s ALA 250 CO 0.46 0.19 1.31 0.82 0.00 0.00 0.00 175.76 178.54 2bgt h ILE 251 N 1.76 1.36 -3.80 0.00 1.08 -1.06 -3.38 117.51 113.47 2bgt h ILE 251 Ca -0.44 -1.10 -0.28 0.00 -0.39 0.00 0.00 64.86 62.64 2bgt h ILE 251 Cb 1.25 2.06 -0.18 0.00 -3.07 0.00 0.00 36.82 36.88 2bgt h ILE 251 CO 0.61 0.29 -0.72 0.00 -0.69 0.00 0.00 178.15 177.64 2bgt s ALA 252 N -4.37 0.96 0.01 1.87 0.00 -0.40 -0.75 121.76 119.07 2bgt s ALA 252 Ca -0.16 -1.14 0.05 0.00 0.00 0.00 0.00 51.96 50.72 2bgt s ALA 252 Cb 0.02 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 2bgt s ALA 252 CO 0.68 -0.09 -0.17 0.00 0.00 0.00 0.00 175.76 176.19 2bgt s ALA 253 N -2.53 1.40 -0.01 0.00 0.00 -0.11 -2.06 121.76 118.45 2bgt s ALA 253 Ca 0.04 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.19 2bgt s ALA 253 Cb -0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 2bgt s ALA 253 CO -0.01 0.32 0.08 -1.17 0.00 0.00 0.00 175.76 174.98 2bgt s LEU 254 N -0.70 3.90 -0.29 0.00 2.96 -0.82 -1.69 118.68 122.03 2bgt s LEU 254 Ca 0.06 0.16 -0.04 0.00 -0.22 0.00 0.00 54.13 54.09 2bgt s LEU 254 Cb -0.07 -2.25 0.03 0.00 0.50 0.00 0.00 46.19 44.40 2bgt s LEU 254 CO 0.00 0.28 0.02 -0.63 -1.32 0.00 0.00 176.35 174.70 2bgt s ILE 255 N -1.18 3.29 -0.08 6.68 -1.09 -0.21 -4.80 121.20 123.81 2bgt s ILE 255 Ca 0.22 -1.12 -0.04 0.00 -2.23 0.00 0.00 60.65 57.48 2bgt s ILE 255 Cb -0.12 -2.79 -0.04 0.00 -1.58 0.00 0.00 42.46 37.93 2bgt s ILE 255 CO 0.13 -0.01 0.10 -0.63 -1.23 0.00 0.00 174.94 173.30 2bgt s ILE 256 N 1.34 5.06 0.65 2.92 1.01 -1.26 -1.17 121.20 129.76 2bgt s ILE 256 Ca -0.02 -0.06 -0.14 0.00 0.00 0.00 0.00 60.65 60.43 2bgt s ILE 256 Cb -0.18 -3.23 -0.01 0.00 0.01 0.00 0.00 42.46 39.05 2bgt s ILE 256 CO -0.01 0.53 1.07 -0.83 0.00 0.00 0.00 174.94 175.71 2bgt s GLY 257 N -1.23 2.01 0.02 6.18 0.00 -1.26 -4.99 107.32 108.04 2bgt s GLY 257 Ca 0.17 0.36 -0.06 0.00 0.00 0.00 0.00 44.72 45.19 2bgt s GLY 257 CO 0.07 0.69 0.12 -0.35 0.00 0.00 0.00 173.10 173.63 2bgt s ASP 258 N -2.97 0.10 0.35 1.64 -1.08 -1.26 -4.54 116.67 108.90 2bgt s ASP 258 Ca 0.63 -0.36 -0.28 0.00 -0.52 0.00 0.00 52.55 52.02 2bgt s ASP 258 Cb -0.17 0.21 -0.11 0.00 -1.46 0.00 0.00 42.92 41.40 2bgt s ASP 258 CO 0.43 -0.43 1.40 -0.75 0.52 0.00 0.00 175.17 176.34 2bgt s LYS 259 N -1.94 4.23 0.00 4.34 2.47 -1.26 -2.39 119.74 125.19 2bgt s LYS 259 Ca -0.10 2.39 0.00 0.00 -1.56 0.00 0.00 55.97 56.70 2bgt s LYS 259 Cb -0.05 -3.02 0.00 0.00 -1.46 0.00 0.00 37.83 33.30 2bgt s LYS 259 CO -0.01 -0.37 0.00 0.09 0.16 0.00 0.00 175.35 175.22 2bgt n ASN 260 N 0.73 0.00 0.01 1.43 5.03 -1.26 -4.63 115.26 116.57 2bgt n ASN 260 Ca 0.01 0.00 -0.16 0.00 0.87 0.00 0.00 54.58 55.30 2bgt n ASN 260 Cb 0.40 -0.59 -0.14 0.00 -1.02 0.00 0.00 39.78 38.44 2bgt n ASN 260 CO 0.00 0.00 0.00 1.88 -1.83 0.00 0.00 177.26 177.31 2bgt h TYR 261 N 0.00 0.31 -2.48 3.10 -1.99 -1.90 -3.41 116.97 110.61 2bgt h TYR 261 Ca 0.00 -0.23 -0.57 0.00 2.00 0.00 0.00 58.73 59.93 2bgt h TYR 261 Cb 0.00 -0.01 0.06 0.00 2.00 0.00 0.00 36.73 38.78 2bgt h TYR 261 CO 0.00 1.44 0.81 0.09 -0.00 0.00 0.00 178.16 180.50 2bgt n ASN 262 N -3.33 3.23 -2.58 3.88 3.02 -1.00 -0.96 115.26 117.52 2bgt n ASN 262 Ca -0.24 1.09 -0.17 0.00 -0.03 0.00 0.00 54.58 55.23 2bgt n ASN 262 Cb 1.05 -1.46 -0.00 0.00 -0.61 0.00 0.00 39.78 38.75 2bgt n ASN 262 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2bgt n ASP 263 N 3.19 -4.83 0.00 6.41 8.00 -0.41 -4.70 116.55 124.21 2bgt n ASP 263 Ca 0.15 0.02 0.00 0.00 0.71 0.00 0.00 54.79 55.67 2bgt n ASP 263 Cb 0.31 -4.03 0.00 0.00 -0.02 0.00 0.00 41.12 37.37 2bgt n ASP 263 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2bgt n ASN 264 N -2.00 0.00 -4.90 -2.24 5.15 -0.75 -4.72 115.26 105.79 2bgt n ASN 264 Ca -0.17 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 53.52 2bgt n ASN 264 Cb 0.63 0.10 -0.03 0.00 -0.53 0.00 0.00 39.78 39.95 2bgt n ASN 264 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 2bgt s PHE 265 N -0.97 3.47 0.00 1.20 0.40 -0.14 -1.35 117.98 120.60 2bgt s PHE 265 Ca 0.00 0.75 0.08 0.00 -0.60 0.00 0.00 56.93 57.16 2bgt s PHE 265 Cb 0.00 -2.20 -0.02 0.00 0.51 0.00 0.00 43.02 41.31 2bgt s PHE 265 CO 0.00 0.09 -0.25 0.42 0.70 0.00 0.00 175.22 176.18 2bgt s ILE 266 N -2.17 2.00 0.42 0.64 -1.09 -1.26 -4.82 121.20 114.93 2bgt s ILE 266 Ca 0.46 -1.16 0.06 0.00 -2.23 0.00 0.00 60.65 57.79 2bgt s ILE 266 Cb -0.11 -1.67 -0.06 0.00 -1.58 0.00 0.00 42.46 39.04 2bgt s ILE 266 CO 0.30 0.49 0.06 0.42 -1.23 0.00 0.00 174.94 174.98 2bgt s THR 267 N -0.65 1.99 0.37 2.92 -4.23 -1.26 -4.86 115.64 109.92 2bgt s THR 267 Ca 0.10 -1.92 0.06 0.00 -1.18 0.00 0.00 61.69 58.75 2bgt s THR 267 Cb -0.10 -2.90 0.22 0.00 1.34 0.00 0.00 72.50 71.06 2bgt s THR 267 CO -0.00 0.00 1.98 -0.07 -0.54 0.00 0.00 174.62 175.99 2bgt h LEU 268 N 1.63 0.50 -1.31 4.79 3.38 -2.00 -2.14 115.31 120.15 2bgt h LEU 268 Ca -0.44 -0.05 0.09 0.00 0.09 0.00 0.00 57.88 57.57 2bgt h LEU 268 Cb 1.25 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.82 2bgt h LEU 268 CO 0.77 0.45 0.53 -0.09 0.09 0.00 0.00 178.44 180.19 2bgt h ARG 269 N 0.55 0.77 -0.25 1.13 2.43 -1.97 0.05 114.38 117.08 2bgt h ARG 269 Ca 0.14 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2bgt h ARG 269 Cb 0.10 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2bgt h ARG 269 CO -0.02 0.51 0.14 0.28 -1.51 0.00 0.00 179.97 179.37 2bgt h VAL 270 N 0.79 1.12 -0.31 0.20 2.07 -1.78 0.91 116.25 119.24 2bgt h VAL 270 Ca 0.36 -0.34 -0.13 0.00 0.82 0.00 0.00 66.70 67.42 2bgt h VAL 270 Cb 0.38 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2bgt h VAL 270 CO -0.14 0.12 -0.30 -0.50 0.02 0.00 0.00 177.57 176.77 2bgt h TRP 271 N 0.29 0.91 -0.83 1.57 4.06 -1.44 0.25 115.95 120.76 2bgt h TRP 271 Ca 0.09 -0.27 -0.00 0.00 2.06 0.00 0.00 58.89 60.77 2bgt h TRP 271 Cb 0.08 -0.19 -0.04 0.00 -1.00 0.00 0.00 29.16 28.00 2bgt h TRP 271 CO -0.03 1.04 0.51 0.93 -3.56 0.00 0.00 178.44 177.33 2bgt h GLU 272 N 0.52 1.12 -0.12 0.49 5.08 -0.86 -0.42 114.58 120.40 2bgt h GLU 272 Ca 0.05 -0.09 -0.23 0.00 -1.00 0.00 0.00 59.36 58.09 2bgt h GLU 272 Cb 0.88 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.90 2bgt h GLU 272 CO 0.08 0.77 -0.84 1.15 -1.00 0.00 0.00 179.01 179.16 2bgt h THR 273 N 1.14 1.28 -0.43 1.13 2.02 -0.67 -2.96 112.91 114.41 2bgt h THR 273 Ca 0.30 -2.04 -0.04 0.00 0.77 0.00 0.00 66.41 65.40 2bgt h THR 273 Cb -0.07 2.08 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 2bgt h THR 273 CO -0.06 0.64 0.10 -0.03 0.37 0.00 0.00 175.52 176.55 2bgt h MET 274 N 0.50 0.64 0.00 6.66 -1.53 -0.36 -2.55 114.93 118.30 2bgt h MET 274 Ca -0.07 -0.11 -0.08 0.00 -3.44 0.00 0.00 59.70 56.00 2bgt h MET 274 Cb 1.48 -0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 32.41 2bgt h MET 274 CO 0.17 0.59 -0.38 0.00 0.14 0.00 0.00 176.91 177.43 2bgt h ALA 275 N 1.49 0.97 -2.10 0.39 0.00 -1.08 -3.40 119.26 115.53 2bgt h ALA 275 Ca 0.14 -0.34 -0.42 0.00 0.00 0.00 0.00 54.91 54.29 2bgt h ALA 275 Cb 0.24 -0.06 0.19 0.00 0.00 0.00 0.00 17.79 18.16 2bgt h ALA 275 CO -0.00 0.47 0.13 -1.54 0.00 0.00 0.00 179.25 178.31 2bgt s SER 276 N -6.43 1.22 0.00 0.00 1.04 -0.96 -1.17 113.70 107.40 2bgt s SER 276 Ca 0.00 0.79 0.15 0.00 0.48 0.00 0.00 55.95 57.37 2bgt s SER 276 Cb 0.11 -1.15 0.49 0.00 0.10 0.00 0.00 66.02 65.57 2bgt s SER 276 CO 0.69 -3.96 1.38 -0.67 0.98 0.00 0.00 173.24 171.66 2bgt n ASP 277 N -4.67 1.87 -4.84 7.02 2.03 -1.26 -4.66 116.55 112.04 2bgt n ASP 277 Ca 0.11 -1.89 -0.36 0.00 0.52 0.00 0.00 54.79 53.17 2bgt n ASP 277 Cb 0.59 -0.19 -0.07 0.00 -0.72 0.00 0.00 41.12 40.73 2bgt n ASP 277 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2bgt s ALA 278 N -1.62 3.75 0.05 -1.67 0.00 -1.26 -4.91 121.76 116.10 2bgt s ALA 278 Ca 0.28 -0.70 -0.31 0.00 0.00 0.00 0.00 51.96 51.23 2bgt s ALA 278 Cb 0.15 -1.84 -0.06 0.00 0.00 0.00 0.00 23.12 21.37 2bgt s ALA 278 CO 0.21 0.63 1.36 0.08 0.00 0.00 0.00 175.76 178.04 2bgt s VAL 279 N -1.04 3.63 -0.33 0.00 1.01 0.07 -4.70 120.40 119.04 2bgt s VAL 279 Ca 0.16 1.11 -0.27 0.00 0.00 0.00 0.00 61.98 62.98 2bgt s VAL 279 Cb -0.12 -3.71 0.01 0.00 0.00 0.00 0.00 36.38 32.56 2bgt s VAL 279 CO 0.06 0.04 0.95 -0.32 0.00 0.00 0.00 175.10 175.83 2bgt s MET 280 N 1.72 3.98 -0.13 2.72 1.75 -1.26 -0.94 119.30 127.14 2bgt s MET 280 Ca 0.63 0.80 -0.01 0.00 -1.25 0.00 0.00 55.69 55.86 2bgt s MET 280 Cb -0.33 -3.75 -0.02 0.00 2.84 0.00 0.00 34.83 33.57 2bgt s MET 280 CO 0.28 -0.84 -0.09 -0.51 -0.65 0.00 0.00 175.02 173.21 2bgt s LEU 281 N 3.39 2.96 -0.11 4.11 1.43 -0.68 -4.79 118.68 124.98 2bgt s LEU 281 Ca 0.40 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.28 2bgt s LEU 281 Cb -0.13 -1.68 -0.02 0.00 0.03 0.00 0.00 46.19 44.39 2bgt s LEU 281 CO 0.15 0.19 -0.12 -0.63 0.23 0.00 0.00 176.35 176.17 2bgt s ILE 282 N 0.23 3.18 -0.00 -0.59 1.01 0.10 -1.04 121.20 124.08 2bgt s ILE 282 Ca -0.06 -0.63 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 2bgt s ILE 282 Cb -0.15 -2.32 -0.08 0.00 0.01 0.00 0.00 42.46 39.92 2bgt s ILE 282 CO 0.04 0.54 1.92 -0.62 0.00 0.00 0.00 174.94 176.82 2bgt s ASP 283 N 0.08 6.42 0.29 3.58 2.15 -0.32 -1.67 116.67 127.20 2bgt s ASP 283 Ca -0.05 2.51 0.02 0.00 0.43 0.00 0.00 52.55 55.47 2bgt s ASP 283 Cb -0.14 -2.53 0.72 0.00 -0.30 0.00 0.00 42.92 40.67 2bgt s ASP 283 CO 0.04 -1.10 1.65 -0.08 -0.17 0.00 0.00 175.17 175.51 2bgt h GLU 284 N 10.73 0.22 0.00 4.34 4.57 -1.54 -0.40 114.58 132.50 2bgt h GLU 284 Ca -0.47 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2bgt h GLU 284 Cb 1.22 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.76 2bgt h GLU 284 CO 0.95 0.15 -0.01 1.49 -1.18 0.00 0.00 179.01 180.40 2bgt h GLU 285 N 0.23 0.00 0.00 1.92 4.81 -1.89 -1.86 114.58 117.79 2bgt h GLU 285 Ca 0.56 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.74 2bgt h GLU 285 Cb 1.12 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 2bgt h GLU 285 CO -0.64 0.01 -0.21 0.35 -0.73 0.00 0.00 179.01 177.79 2bgt h PHE 286 N 0.00 0.00 -0.90 0.92 3.57 -1.44 -3.41 116.94 115.68 2bgt h PHE 286 Ca -0.00 0.00 -0.29 0.00 3.53 0.00 0.00 57.97 61.21 2bgt h PHE 286 Cb 0.14 0.00 -0.21 0.00 2.79 0.00 0.00 35.95 38.67 2bgt h PHE 286 CO 0.00 0.21 -0.63 -3.47 -2.23 0.00 0.00 178.31 172.19 2bgt n ASP 287 N -3.18 -2.41 0.25 0.41 2.03 -0.74 -1.29 116.55 111.62 2bgt n ASP 287 Ca 0.03 -2.98 0.12 0.00 0.52 0.00 0.00 54.79 52.48 2bgt n ASP 287 Cb 0.57 1.19 0.62 0.00 -0.72 0.00 0.00 41.12 42.79 2bgt n ASP 287 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2bgt h THR 288 N 3.77 0.46 -0.01 5.18 1.35 -1.67 -2.37 112.91 119.62 2bgt h THR 288 Ca 0.00 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 2bgt h THR 288 Cb 1.02 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 2bgt h THR 288 CO 0.24 0.15 -0.22 0.29 -0.25 0.00 0.00 175.52 175.72 2bgt n LYS 289 N -3.42 1.08 -3.26 4.72 4.76 -1.26 -4.95 118.16 115.82 2bgt n LYS 289 Ca -0.01 -0.68 -0.15 0.00 -2.87 0.00 0.00 58.31 54.60 2bgt n LYS 289 Cb 0.33 -1.49 0.08 0.00 -1.84 0.00 0.00 35.03 32.11 2bgt n LYS 289 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2bgt n HIS 290 N -0.36 -2.04 -0.03 2.13 8.25 -0.89 -4.96 115.22 117.31 2bgt n HIS 290 Ca 0.13 0.84 -0.16 0.00 -0.26 0.00 0.00 57.72 58.28 2bgt n HIS 290 Cb 0.37 -4.66 -0.09 0.00 1.12 0.00 0.00 29.99 26.72 2bgt n HIS 290 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bgt h ARG 291 N -1.60 0.42 0.21 -0.41 3.08 -1.93 -3.31 114.38 110.84 2bgt h ARG 291 Ca -0.54 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.16 2bgt h ARG 291 Cb 1.30 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.41 2bgt h ARG 291 CO 0.45 0.99 -0.19 0.82 -1.07 0.00 0.00 179.97 180.96 2bgt h ILE 292 N -0.04 0.57 -3.19 2.04 2.04 -1.93 -3.42 117.51 113.59 2bgt h ILE 292 Ca -0.03 0.00 -0.26 0.00 1.00 0.00 0.00 64.86 65.57 2bgt h ILE 292 Cb 1.07 0.57 -0.33 0.00 -0.74 0.00 0.00 36.82 37.39 2bgt h ILE 292 CO 0.09 0.00 -0.61 -0.63 0.00 0.00 0.00 178.15 176.99 2bgt s ILE 293 N -6.11 -0.13 -1.32 -0.67 1.01 -1.26 -5.06 121.20 107.67 2bgt s ILE 293 Ca -0.15 0.25 -0.09 0.00 0.00 0.00 0.00 60.65 60.66 2bgt s ILE 293 Cb 0.06 -0.26 0.14 0.00 0.01 0.00 0.00 42.46 42.41 2bgt s ILE 293 CO 0.65 0.10 2.05 -3.20 0.00 0.00 0.00 174.94 174.54 2bgt n ASN 294 N 4.65 5.73 -3.41 3.58 5.15 -1.25 -4.76 115.26 124.95 2bgt n ASN 294 Ca -0.18 -3.08 -0.05 0.00 -0.60 0.00 0.00 54.58 50.68 2bgt n ASN 294 Cb 0.51 -1.47 -0.06 0.00 -0.53 0.00 0.00 39.78 38.23 2bgt n ASN 294 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2bgt s ASP 295 N 0.98 -0.45 0.57 1.20 -1.08 -1.26 -5.04 116.67 111.59 2bgt s ASP 295 Ca 0.44 0.74 0.28 0.00 -0.52 0.00 0.00 52.55 53.48 2bgt s ASP 295 Cb 0.12 1.57 1.52 0.00 -1.46 0.00 0.00 42.92 44.67 2bgt s ASP 295 CO -0.03 -0.26 2.00 0.00 0.52 0.00 0.00 175.17 177.41 2bgt h ALA 296 N 8.11 2.14 0.00 3.66 0.00 -1.97 -2.53 119.26 128.67 2bgt h ALA 296 Ca -0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2bgt h ALA 296 Cb 1.14 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2bgt h ALA 296 CO 0.21 -0.54 -0.01 0.00 0.00 0.00 0.00 179.25 178.92 2bgt h ARG 297 N 0.00 0.00 -0.00 0.00 -0.00 -1.96 -2.23 114.38 110.18 2bgt h ARG 297 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.66 2bgt h ARG 297 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.83 2bgt h ARG 297 CO -0.00 0.01 -0.05 1.19 0.00 0.00 0.00 179.97 181.11 2bgt n PHE 298 N -3.90 0.00 -4.88 3.04 3.01 -0.95 -4.89 117.46 108.89 2bgt n PHE 298 Ca -0.03 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.10 2bgt n PHE 298 Cb 0.09 -0.10 -0.13 0.00 -0.01 0.00 0.00 39.48 39.33 2bgt n PHE 298 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 2bgt s TYR 299 N -2.25 2.71 0.00 1.38 1.51 -0.84 0.01 117.35 119.87 2bgt s TYR 299 Ca 0.36 -0.19 0.05 0.00 -1.01 0.00 0.00 57.07 56.28 2bgt s TYR 299 Cb 0.21 -1.64 -0.01 0.00 -0.11 0.00 0.00 41.96 40.40 2bgt s TYR 299 CO 0.42 0.16 -0.15 0.14 -1.11 0.00 0.00 175.55 175.01 2bgt s VAL 300 N -0.66 1.19 -0.13 0.71 -7.23 -0.67 -4.92 120.40 108.70 2bgt s VAL 300 Ca 0.10 -0.73 0.17 0.00 -1.81 0.00 0.00 61.98 59.71 2bgt s VAL 300 Cb -0.11 -1.01 -0.24 0.00 0.56 0.00 0.00 36.38 35.58 2bgt s VAL 300 CO 0.01 0.27 0.39 0.59 -0.31 0.00 0.00 175.10 176.05 2bgt n ASN 301 N 2.53 0.33 -2.50 4.85 3.02 -1.26 -1.34 115.26 120.89 2bgt n ASN 301 Ca -0.15 0.15 -0.09 0.00 -0.03 0.00 0.00 54.58 54.46 2bgt n ASN 301 Cb 0.55 0.79 0.01 0.00 -0.61 0.00 0.00 39.78 40.52 2bgt n ASN 301 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2bgt n ASN 302 N -2.76 -1.66 -0.12 6.41 0.23 -1.26 -4.86 115.26 111.25 2bgt n ASN 302 Ca -0.21 -2.37 -0.05 0.00 -0.53 0.00 0.00 54.58 51.42 2bgt n ASN 302 Cb 0.99 2.83 0.03 0.00 -2.08 0.00 0.00 39.78 41.54 2bgt n ASN 302 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 2bgt h ARG 303 N 0.00 0.26 -0.52 -3.83 2.43 -1.93 -2.32 114.38 108.47 2bgt h ARG 303 Ca -0.26 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.00 2bgt h ARG 303 Cb 1.00 -0.06 -0.08 0.00 -0.42 0.00 0.00 29.97 30.41 2bgt h ARG 303 CO 0.33 0.17 0.02 0.00 -1.51 0.00 0.00 179.97 178.98 2bgt h ALA 304 N 1.26 0.51 -0.36 2.80 0.00 -1.97 -1.41 119.26 120.09 2bgt h ALA 304 Ca 0.18 0.15 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 2bgt h ALA 304 Cb 0.18 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2bgt h ALA 304 CO -0.20 -0.38 -0.12 0.93 0.00 0.00 0.00 179.25 179.48 2bgt h GLU 305 N 0.14 0.63 -0.45 0.00 5.08 -1.90 -1.74 114.58 116.33 2bgt h GLU 305 Ca 0.26 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2bgt h GLU 305 Cb 0.40 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2bgt h GLU 305 CO -0.42 0.74 0.15 1.25 -1.00 0.00 0.00 179.01 179.73 2bgt h LEU 306 N 0.57 0.64 0.04 1.33 7.12 -0.77 0.31 115.31 124.55 2bgt h LEU 306 Ca 0.10 -0.19 -0.00 0.00 0.13 0.00 0.00 57.88 57.92 2bgt h LEU 306 Cb 0.55 -0.17 -0.00 0.00 -0.53 0.00 0.00 40.66 40.51 2bgt h LEU 306 CO 0.03 0.67 -0.03 0.40 -0.13 0.00 0.00 178.44 179.38 2bgt h ILE 307 N 0.59 0.94 -0.72 4.05 2.04 -1.06 -0.24 117.51 123.10 2bgt h ILE 307 Ca 0.15 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.99 2bgt h ILE 307 Cb 0.24 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2bgt h ILE 307 CO -0.01 0.00 0.38 0.44 0.00 0.00 0.00 178.15 178.97 2bgt h ASP 308 N -0.07 0.91 -0.34 1.72 3.32 -1.22 -1.98 116.42 118.77 2bgt h ASP 308 Ca -0.00 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 56.90 2bgt h ASP 308 Cb 0.06 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2bgt h ASP 308 CO -0.00 0.76 0.03 -0.09 -1.72 0.00 0.00 179.24 178.21 2bgt h ARG 309 N 1.00 0.58 -0.91 3.56 9.65 -0.59 -1.48 114.38 126.18 2bgt h ARG 309 Ca 0.25 -0.17 -0.02 0.00 -1.10 0.00 0.00 59.98 58.95 2bgt h ARG 309 Cb 0.06 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 28.54 2bgt h ARG 309 CO -0.04 0.68 0.51 0.28 2.80 0.00 0.00 179.97 184.20 2bgt h VAL 310 N 0.39 1.26 -0.61 0.20 2.07 -0.93 -1.66 116.25 116.97 2bgt h VAL 310 Ca 0.10 -0.63 -0.08 0.00 0.82 0.00 0.00 66.70 66.92 2bgt h VAL 310 Cb 0.40 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 2bgt h VAL 310 CO 0.01 0.29 0.08 0.78 0.02 0.00 0.00 177.57 178.75 2bgt h ASN 311 N 1.27 0.98 -0.50 0.57 -0.26 -1.21 0.15 115.58 116.57 2bgt h ASN 311 Ca 0.32 -0.27 0.03 0.00 -0.56 0.00 0.00 56.30 55.83 2bgt h ASN 311 Cb 0.01 -0.26 -0.04 0.00 -1.06 0.00 0.00 38.32 36.97 2bgt h ASN 311 CO -0.05 1.00 0.28 -0.33 -1.06 0.00 0.00 177.43 177.27 2bgt h GLU 312 N 0.93 0.53 -0.54 0.81 4.39 -0.86 -0.28 114.58 119.56 2bgt h GLU 312 Ca 0.18 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.79 2bgt h GLU 312 Cb 0.45 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 2bgt h GLU 312 CO 0.02 0.35 0.12 -0.07 -1.16 0.00 0.00 179.01 178.26 2bgt h LEU 313 N 0.55 0.83 -1.32 1.33 4.07 -0.90 -1.27 115.31 118.60 2bgt h LEU 313 Ca 0.21 -0.24 -0.06 0.00 0.08 0.00 0.00 57.88 57.87 2bgt h LEU 313 Cb 0.08 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.59 2bgt h LEU 313 CO -0.12 0.86 -0.22 0.11 -1.08 0.00 0.00 178.44 177.98 2bgt h LYS 314 N 0.76 0.18 -0.00 1.13 1.57 -0.28 -3.11 116.57 116.81 2bgt h LYS 314 Ca 0.17 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 2bgt h LYS 314 Cb 0.36 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2bgt h LYS 314 CO 0.00 0.40 -0.58 0.72 -0.57 0.00 0.00 179.45 179.43 2bgt n HIS 315 N -4.21 0.00 -3.65 -1.35 8.25 -0.15 -4.71 115.22 109.41 2bgt n HIS 315 Ca -0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.15 2bgt n HIS 315 Cb 0.33 -0.11 -0.14 0.00 1.12 0.00 0.00 29.99 31.18 2bgt n HIS 315 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2bgt s SER 316 N -2.79 3.72 0.51 0.41 0.15 -0.51 -4.95 113.70 110.24 2bgt s SER 316 Ca 0.15 -1.74 0.23 0.00 0.70 0.00 0.00 55.95 55.29 2bgt s SER 316 Cb 0.18 -0.69 1.35 0.00 -1.71 0.00 0.00 66.02 65.14 2bgt s SER 316 CO 0.68 -0.39 2.07 -0.78 1.20 0.00 0.00 173.24 176.02 2bgt h ASP 317 N 7.86 0.00 -0.32 5.45 3.58 -1.84 -1.86 116.42 129.29 2bgt h ASP 317 Ca -0.11 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.17 2bgt h ASP 317 Cb 1.00 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.04 2bgt h ASP 317 CO 0.44 0.13 -0.48 0.58 -2.88 0.00 0.00 179.24 177.03 2bgt h VAL 318 N 0.00 1.27 -0.00 2.25 2.07 -1.92 -1.35 116.25 118.58 2bgt h VAL 318 Ca -0.00 -1.65 -0.00 0.00 0.82 0.00 0.00 66.70 65.86 2bgt h VAL 318 Cb 0.29 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2bgt h VAL 318 CO 0.02 0.54 -0.00 0.25 0.02 0.00 0.00 177.57 178.40 2bgt h LEU 319 N 0.69 0.01 -0.36 2.57 6.46 -1.76 -1.90 115.31 121.02 2bgt h LEU 319 Ca 0.03 -0.35 0.06 0.00 -0.12 0.00 0.00 57.88 57.50 2bgt h LEU 319 Cb 1.08 -0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 40.95 2bgt h LEU 319 CO 0.11 0.36 0.01 -0.09 -0.62 0.00 0.00 178.44 178.21 2bgt h ARG 320 N -0.35 0.11 -0.30 1.25 2.43 -1.36 0.68 114.38 116.84 2bgt h ARG 320 Ca 0.00 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 2bgt h ARG 320 Cb 0.36 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2bgt h ARG 320 CO 0.00 0.07 -0.19 0.87 -1.51 0.00 0.00 179.97 179.22 2bgt h LYS 321 N 0.11 0.54 -0.11 0.20 1.57 -1.25 -1.35 116.57 116.28 2bgt h LYS 321 Ca 0.17 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2bgt h LYS 321 Cb 0.23 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.50 2bgt h LYS 321 CO -0.28 0.70 -0.02 1.49 -0.57 0.00 0.00 179.45 180.77 2bgt h GLU 322 N 0.49 0.21 -0.57 3.15 4.81 -0.69 -2.35 114.58 119.63 2bgt h GLU 322 Ca 0.08 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2bgt h GLU 322 Cb 0.60 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.94 2bgt h GLU 322 CO 0.04 0.50 0.32 0.52 -0.73 0.00 0.00 179.01 179.66 2bgt h MET 323 N -0.10 0.78 -0.73 1.92 2.86 -0.73 -2.25 114.93 116.68 2bgt h MET 323 Ca 0.03 -0.09 0.04 0.00 -2.06 0.00 0.00 59.70 57.62 2bgt h MET 323 Cb 0.42 -0.16 -0.05 0.00 0.06 0.00 0.00 31.60 31.88 2bgt h MET 323 CO 0.01 0.59 0.45 -0.07 1.06 0.00 0.00 176.91 178.95 2bgt h LEU 324 N 0.76 0.72 -1.02 1.22 3.38 -1.25 -0.94 115.31 118.18 2bgt h LEU 324 Ca 0.20 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2bgt h LEU 324 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2bgt h LEU 324 CO -0.03 0.49 -0.46 0.77 0.09 0.00 0.00 178.44 179.29 2bgt h SER 325 N 0.86 0.05 -0.20 -0.43 4.64 -1.18 -0.62 113.55 116.67 2bgt h SER 325 Ca 0.30 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.55 2bgt h SER 325 Cb 0.07 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 2bgt h SER 325 CO -0.13 0.51 -0.05 0.40 -0.87 0.00 0.00 176.83 176.69 2bgt h ILE 326 N 0.04 1.29 -0.21 0.95 2.04 -0.70 -1.02 117.51 119.90 2bgt h ILE 326 Ca -0.00 -1.03 -0.11 0.00 1.00 0.00 0.00 64.86 64.72 2bgt h ILE 326 Cb 0.84 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 2bgt h ILE 326 CO 0.06 0.31 -0.34 0.06 0.00 0.00 0.00 178.15 178.25 2bgt h GLN 327 N 0.10 0.44 0.00 2.37 3.07 -0.97 -1.69 115.11 118.43 2bgt h GLN 327 Ca 0.05 -0.19 -0.09 0.00 0.09 0.00 0.00 58.65 58.50 2bgt h GLN 327 Cb 0.50 -0.01 -0.01 0.00 0.08 0.00 0.00 27.48 28.03 2bgt h GLN 327 CO 0.02 0.73 -0.44 0.45 0.09 0.00 0.00 178.83 179.68 2bgt h HIS 328 N 0.38 0.00 -0.24 0.06 3.86 -1.06 -1.31 115.15 116.83 2bgt h HIS 328 Ca 0.04 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.19 2bgt h HIS 328 Cb 0.78 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.24 2bgt h HIS 328 CO 0.02 0.44 -0.11 0.22 0.86 0.00 0.00 177.93 179.36 2bgt h ASP 329 N 0.00 0.52 -0.75 2.45 3.58 -0.67 -1.19 116.42 120.36 2bgt h ASP 329 Ca -0.00 -0.41 -0.05 0.00 0.42 0.00 0.00 57.03 56.99 2bgt h ASP 329 Cb 0.88 -0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.75 2bgt h ASP 329 CO 0.06 0.81 0.28 0.40 -2.88 0.00 0.00 179.24 177.91 2bgt h ILE 330 N 0.23 1.26 -0.51 2.25 2.04 -1.03 -0.93 117.51 120.81 2bgt h ILE 330 Ca 0.05 -0.83 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 2bgt h ILE 330 Cb 0.61 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2bgt h ILE 330 CO 0.03 0.33 0.32 0.25 0.00 0.00 0.00 178.15 179.08 2bgt h LEU 331 N 1.09 0.61 -0.71 1.44 5.85 -1.11 -2.60 115.31 119.88 2bgt h LEU 331 Ca 0.25 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.82 2bgt h LEU 331 Cb 0.24 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2bgt h LEU 331 CO -0.02 0.48 -0.04 0.78 -0.34 0.00 0.00 178.44 179.30 2bgt h ASN 332 N 0.69 0.93 -0.76 1.25 2.35 -0.75 -1.88 115.58 117.40 2bgt h ASN 332 Ca 0.18 -0.27 -0.04 0.00 -0.55 0.00 0.00 56.30 55.63 2bgt h ASN 332 Cb -0.03 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.06 2bgt h ASN 332 CO -0.04 1.01 0.33 0.11 -1.65 0.00 0.00 177.43 177.19 2bgt h LYS 333 N 0.86 1.12 -0.38 0.81 1.57 -1.05 -0.89 116.57 118.61 2bgt h LYS 333 Ca 0.15 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2bgt h LYS 333 Cb 0.57 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 2bgt h LYS 333 CO 0.03 0.90 0.24 1.15 -0.57 0.00 0.00 179.45 181.20 2bgt h THR 334 N 1.09 1.11 0.00 -0.16 2.02 -1.09 -1.19 112.91 114.69 2bgt h THR 334 Ca 0.26 -0.22 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 2bgt h THR 334 Cb 0.17 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2bgt h THR 334 CO -0.03 0.11 -0.12 0.03 0.37 0.00 0.00 175.52 175.88 2bgt h ARG 335 N 0.51 0.00 0.00 6.66 3.08 -1.03 -1.50 114.38 122.10 2bgt h ARG 335 Ca 0.14 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.17 2bgt h ARG 335 Cb -0.03 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 2bgt h ARG 335 CO -0.03 0.12 -0.07 0.00 -1.07 0.00 0.00 179.97 178.93 2bgt h ALA 336 N 1.88 1.07 -0.79 0.04 0.00 0.11 -2.81 119.26 118.76 2bgt h ALA 336 Ca -0.00 -0.06 -0.36 0.00 0.00 0.00 0.00 54.91 54.49 2bgt h ALA 336 Cb 0.42 -0.01 -0.21 0.00 0.00 0.00 0.00 17.79 17.99 2bgt h ALA 336 CO 0.02 0.08 0.45 1.63 0.00 0.00 0.00 179.25 181.43 2bgt n LYS 337 N -3.26 2.57 -0.24 0.00 5.02 -0.56 -4.63 118.16 117.05 2bgt n LYS 337 Ca -0.01 -2.63 0.01 0.00 -2.02 0.00 0.00 58.31 53.66 2bgt n LYS 337 Cb 0.27 -2.05 0.13 0.00 -0.02 0.00 0.00 35.03 33.36 2bgt n LYS 337 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2bgt h LYS 338 N 1.41 0.56 -0.47 1.97 3.64 -1.64 -2.16 116.57 119.88 2bgt h LYS 338 Ca 0.44 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.82 2bgt h LYS 338 Cb 2.45 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 34.11 2bgt h LYS 338 CO 0.85 0.37 0.25 0.00 -2.27 0.00 0.00 179.45 178.64 2bgt h ALA 339 N 1.42 0.60 -0.05 5.00 0.00 -1.88 -0.11 119.26 124.23 2bgt h ALA 339 Ca 0.34 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.16 2bgt h ALA 339 Cb 0.35 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2bgt h ALA 339 CO -0.27 -0.09 -0.43 0.93 0.00 0.00 0.00 179.25 179.39 2bgt h GLU 340 N 0.49 0.12 -0.30 0.00 3.07 -1.84 -0.99 114.58 115.13 2bgt h GLU 340 Ca 0.20 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.36 58.94 2bgt h GLU 340 Cb 0.09 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 2bgt h GLU 340 CO -0.13 0.54 -0.06 2.35 -1.40 0.00 0.00 179.01 180.31 2bgt h TRP 341 N 0.10 0.65 -0.17 4.33 7.01 -0.78 0.56 115.95 127.65 2bgt h TRP 341 Ca 0.01 -0.13 -0.00 0.00 2.11 0.00 0.00 58.89 60.87 2bgt h TRP 341 Cb 0.81 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.71 2bgt h TRP 341 CO 0.01 0.76 0.10 1.96 -2.79 0.00 0.00 178.44 178.47 2bgt h GLN 342 N 0.35 0.22 -0.74 2.65 4.20 -0.73 -1.11 115.11 119.95 2bgt h GLN 342 Ca 0.08 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 2bgt h GLN 342 Cb 0.54 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 2bgt h GLN 342 CO 0.03 0.18 0.34 -0.44 -0.67 0.00 0.00 178.83 178.27 2bgt h ASP 343 N 0.20 0.96 -0.66 1.46 3.32 -1.07 -1.95 116.42 118.68 2bgt h ASP 343 Ca 0.06 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 2bgt h ASP 343 Cb 0.02 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 2bgt h ASP 343 CO -0.01 0.82 0.14 0.00 -1.72 0.00 0.00 179.24 178.47 2bgt h ALA 344 N 1.32 0.98 0.05 3.45 0.00 -0.56 -1.93 119.26 122.57 2bgt h ALA 344 Ca 0.25 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2bgt h ALA 344 Cb 0.13 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2bgt h ALA 344 CO -0.03 0.65 -0.03 0.35 0.00 0.00 0.00 179.25 180.20 2bgt h PHE 345 N 1.02 -0.07 -0.62 0.00 3.57 -0.62 -1.03 116.94 119.19 2bgt h PHE 345 Ca 0.21 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.77 2bgt h PHE 345 Cb 0.39 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 2bgt h PHE 345 CO 0.03 -0.01 0.33 0.87 -2.23 0.00 0.00 178.31 177.30 2bgt h LYS 346 N -0.11 0.60 -0.69 1.11 1.57 -1.25 -0.76 116.57 117.04 2bgt h LYS 346 Ca -0.01 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2bgt h LYS 346 Cb 0.09 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 2bgt h LYS 346 CO 0.01 0.39 0.41 0.87 -0.57 0.00 0.00 179.45 180.56 2bgt h LYS 347 N 0.61 0.93 0.00 3.15 1.57 -1.07 -0.39 116.57 121.37 2bgt h LYS 347 Ca 0.28 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.93 2bgt h LYS 347 Cb 0.19 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2bgt h LYS 347 CO -0.19 0.66 -0.23 0.00 -0.57 0.00 0.00 179.45 179.12 2bgt h ALA 348 N 1.50 1.56 -0.93 3.86 0.00 0.19 -1.78 119.26 123.66 2bgt h ALA 348 Ca 0.25 -0.21 -0.45 0.00 0.00 0.00 0.00 54.91 54.50 2bgt h ALA 348 Cb -0.03 -0.04 -0.27 0.00 0.00 0.00 0.00 17.79 17.46 2bgt h ALA 348 CO -0.05 0.29 0.56 0.44 0.00 0.00 0.00 179.25 180.49 2bgt n ILE 349 N -4.18 3.14 -3.48 0.00 -5.35 -0.56 -4.93 119.36 104.01 2bgt n ILE 349 Ca -0.02 -1.87 -0.25 0.00 -0.27 0.00 0.00 62.75 60.33 2bgt n ILE 349 Cb 0.29 -0.44 0.04 0.00 -1.74 0.00 0.00 39.64 37.79 2bgt n ILE 349 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2bgt n ASP 350 N -0.92 -5.39 -0.64 7.28 8.00 -0.67 -5.01 116.55 119.19 2bgt n ASP 350 Ca 0.55 -0.51 0.08 0.00 0.71 0.00 0.00 54.79 55.63 2bgt n ASP 350 Cb 1.60 -4.32 0.07 0.00 -0.02 0.00 0.00 41.12 38.45 2bgt n ASP 350 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99