#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ghg n LYS 29 N -0.03 3.79 -4.58 0.00 3.00 -1.26 -4.99 118.16 114.10 3ghg n LYS 29 Ca 0.09 -4.36 -0.27 0.00 -0.00 0.00 0.00 58.31 53.77 3ghg n LYS 29 Cb 0.44 -2.62 -0.17 0.00 0.00 0.00 0.00 35.03 32.68 3ghg n LYS 29 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 3ghg s ASP 30 N 0.60 2.23 -0.75 3.14 3.68 -1.26 -5.08 116.67 119.23 3ghg s ASP 30 Ca 0.33 -0.38 0.03 0.00 2.13 0.00 0.00 52.55 54.66 3ghg s ASP 30 Cb -0.04 -1.01 0.30 0.00 -1.45 0.00 0.00 42.92 40.73 3ghg s ASP 30 CO -0.01 0.03 1.09 -0.24 0.13 0.00 0.00 175.17 176.17 3ghg n SER 31 N 3.99 4.97 0.25 -0.34 2.88 -1.26 -4.76 113.62 119.35 3ghg n SER 31 Ca -0.20 -3.56 0.15 0.00 -1.33 0.00 0.00 58.87 53.93 3ghg n SER 31 Cb 0.52 -0.80 0.46 0.00 -0.75 0.00 0.00 64.21 63.64 3ghg n SER 31 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 3ghg h ASP 32 N 3.97 0.00 -3.82 -3.46 3.32 -2.03 -3.48 116.42 110.91 3ghg h ASP 32 Ca 0.23 0.00 -0.50 0.00 0.02 0.00 0.00 57.03 56.78 3ghg h ASP 32 Cb 0.55 0.00 0.04 0.00 0.22 0.00 0.00 39.33 40.14 3ghg h ASP 32 CO 0.96 0.00 0.21 0.26 -1.72 0.00 0.00 179.24 178.95 3ghg s TRP 33 N -3.46 3.55 0.00 4.55 0.52 -1.26 -5.08 118.94 117.76 3ghg s TRP 33 Ca 0.04 0.94 0.00 0.00 0.02 0.00 0.00 56.10 57.10 3ghg s TRP 33 Cb 0.07 -2.48 0.00 0.00 -1.15 0.00 0.00 33.47 29.92 3ghg s TRP 33 CO 0.60 -0.46 0.00 -2.30 0.02 0.00 0.00 176.95 174.80 3ghg n PRO 34 N -2.45 -0.01 -4.15 4.98 -0.02 -1.26 -5.06 135.00 127.04 3ghg n PRO 34 Ca 0.03 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.16 3ghg n PRO 34 Cb 0.55 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 33.92 3ghg n PRO 34 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 3ghg s PHE 35 N -0.55 3.14 0.56 6.00 0.08 -1.26 -5.10 117.98 120.86 3ghg s PHE 35 Ca 0.00 -0.13 -0.19 0.00 0.12 0.00 0.00 56.93 56.73 3ghg s PHE 35 Cb 0.00 -2.04 -0.05 0.00 -0.57 0.00 0.00 43.02 40.36 3ghg s PHE 35 CO 0.00 0.03 1.13 0.00 -0.10 0.00 0.00 175.22 176.28 3ghg n SER 37 N -1.49 0.00 -0.11 0.00 3.41 -1.26 -5.05 113.62 109.12 3ghg n SER 37 Ca 0.12 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.51 3ghg n SER 37 Cb 0.51 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.37 3ghg n SER 37 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3ghg n ASP 38 N 0.00 1.79 -0.02 4.04 5.68 -1.26 -4.60 116.55 122.18 3ghg n ASP 38 Ca 0.00 0.18 0.13 0.00 -0.50 0.00 0.00 54.79 54.60 3ghg n ASP 38 Cb 0.00 -0.58 0.50 0.00 -1.14 0.00 0.00 41.12 39.90 3ghg n ASP 38 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3ghg n GLU 39 N -3.78 0.14 0.25 0.11 0.00 -1.26 -2.49 120.64 113.61 3ghg n GLU 39 Ca -0.43 -0.04 0.13 0.00 0.00 0.00 0.00 57.16 56.82 3ghg n GLU 39 Cb 0.84 -1.50 0.63 0.00 0.00 0.00 0.00 31.44 31.41 3ghg n GLU 39 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 3ghg h ASP 40 N 0.10 0.00 -3.84 -1.84 3.45 -1.93 -3.33 116.42 109.03 3ghg h ASP 40 Ca 0.00 0.00 -0.48 0.00 0.43 0.00 0.00 57.03 56.98 3ghg h ASP 40 Cb 0.47 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.21 3ghg h ASP 40 CO 0.00 0.13 0.23 0.86 -1.57 0.00 0.00 179.24 178.88 3ghg s TRP 41 N -3.82 3.47 0.00 4.55 -0.00 -1.04 0.91 118.94 123.00 3ghg s TRP 41 Ca -0.01 1.49 0.00 0.00 -0.00 0.00 0.00 56.10 57.58 3ghg s TRP 41 Cb 0.11 -2.73 0.00 0.00 -0.00 0.00 0.00 33.47 30.85 3ghg s TRP 41 CO 0.58 0.09 0.00 -1.71 -0.00 0.00 0.00 176.95 175.92 3ghg n ASN 42 N -0.07 0.00 -0.05 5.86 5.15 -1.26 -4.67 115.26 120.21 3ghg n ASN 42 Ca 0.03 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.90 3ghg n ASN 42 Cb 0.52 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.74 3ghg n ASN 42 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 3ghg n TYR 43 N -2.00 0.00 -3.70 1.20 0.53 -1.23 -4.97 117.16 106.99 3ghg n TYR 43 Ca 0.00 0.00 -0.35 0.00 -1.02 0.00 0.00 57.90 56.53 3ghg n TYR 43 Cb 0.00 -0.40 -0.08 0.00 -1.03 0.00 0.00 39.34 37.84 3ghg n TYR 43 CO 0.00 0.00 0.00 0.15 -1.02 0.00 0.00 176.86 175.99 3ghg s LYS 44 N -2.24 4.19 0.14 -0.72 3.01 0.26 -5.10 119.74 119.29 3ghg s LYS 44 Ca -0.16 -0.17 0.02 0.00 -1.01 0.00 0.00 55.97 54.65 3ghg s LYS 44 Cb 0.06 -3.42 -0.04 0.00 -1.01 0.00 0.00 37.83 33.41 3ghg s LYS 44 CO 0.20 0.30 -0.04 0.00 0.51 0.00 0.00 175.35 176.32 3ghg s PRO 46 N -3.86 2.62 0.42 0.00 0.04 -1.26 -4.99 135.00 127.97 3ghg s PRO 46 Ca 0.19 0.81 -0.26 0.00 0.04 0.00 0.00 61.00 61.77 3ghg s PRO 46 Cb 0.05 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.53 3ghg s PRO 46 CO 0.00 -1.28 1.39 -1.13 0.04 0.00 0.00 177.00 176.01 3ghg n SER 47 N -3.23 3.15 0.29 6.66 3.41 -1.26 -4.89 113.62 117.74 3ghg n SER 47 Ca 0.07 1.14 0.16 0.00 -0.26 0.00 0.00 58.87 59.99 3ghg n SER 47 Cb 0.55 -1.57 0.88 0.00 -0.26 0.00 0.00 64.21 63.81 3ghg n SER 47 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3ghg h GLY 48 N 2.37 0.00 0.96 5.00 0.00 -1.99 -2.69 103.07 106.72 3ghg h GLY 48 Ca -0.50 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.77 3ghg h GLY 48 CO 0.61 0.00 0.02 0.00 0.00 0.00 0.00 176.54 177.17 3ghg h ARG 50 N 0.59 -0.32 -0.55 0.00 2.43 -1.86 0.63 114.38 115.29 3ghg h ARG 50 Ca 0.12 0.02 0.11 0.00 -0.81 0.00 0.00 59.98 59.43 3ghg h ARG 50 Cb 0.45 0.07 -0.10 0.00 -0.42 0.00 0.00 29.97 29.97 3ghg h ARG 50 CO 0.02 -0.01 -0.14 0.52 -1.51 0.00 0.00 179.97 178.85 3ghg h MET 51 N -0.65 0.00 -0.61 0.20 2.86 -1.52 0.48 114.93 115.69 3ghg h MET 51 Ca -0.03 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.65 3ghg h MET 51 Cb 0.46 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.07 3ghg h MET 51 CO 0.06 0.00 0.34 -0.22 1.06 0.00 0.00 176.91 178.15 3ghg h LYS 52 N 0.00 0.63 -0.06 1.72 1.63 -1.14 0.16 116.57 119.51 3ghg h LYS 52 Ca 0.26 -0.04 0.02 0.00 -0.85 0.00 0.00 60.65 60.04 3ghg h LYS 52 Cb 0.40 -0.14 -0.00 0.00 -0.60 0.00 0.00 32.23 31.89 3ghg h LYS 52 CO -0.56 0.42 0.18 0.78 -3.45 0.00 0.00 179.45 176.81 3ghg h GLY 53 N 0.65 0.00 0.00 5.01 0.00 0.23 -2.35 103.07 106.61 3ghg h GLY 53 Ca 0.27 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.21 3ghg h GLY 53 CO -0.16 0.00 -2.45 1.04 0.00 0.00 0.00 176.54 174.97 3ghg n LEU 54 N -3.25 2.44 0.24 3.11 4.77 -0.06 -4.11 117.00 120.13 3ghg n LEU 54 Ca -0.01 -0.11 -0.18 0.00 -0.03 0.00 0.00 56.01 55.68 3ghg n LEU 54 Cb 0.26 -0.65 -0.10 0.00 -2.33 0.00 0.00 43.42 40.60 3ghg n LEU 54 CO 0.20 0.86 0.52 0.40 -1.33 0.00 0.00 177.39 178.04 3ghg h ILE 55 N 0.00 0.00 0.00 -0.08 2.04 -0.18 0.39 117.51 119.69 3ghg h ILE 55 Ca -0.57 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.22 3ghg h ILE 55 Cb 1.96 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 3ghg h ILE 55 CO -0.07 0.00 -0.35 -2.24 0.00 0.00 0.00 178.15 175.49 3ghg h ASP 56 N -0.94 0.00 0.19 1.72 2.03 -1.76 -0.86 116.42 116.80 3ghg h ASP 56 Ca -0.05 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.24 3ghg h ASP 56 Cb 0.85 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.35 3ghg h ASP 56 CO -0.13 0.35 -0.09 -0.08 -1.03 0.00 0.00 179.24 178.26 3ghg h GLU 57 N 0.00 -0.24 -0.79 4.15 4.81 -1.63 -0.24 114.58 120.64 3ghg h GLU 57 Ca -0.00 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 3ghg h GLU 57 Cb 0.67 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 3ghg h GLU 57 CO 0.05 -0.02 0.31 -0.24 -0.73 0.00 0.00 179.01 178.38 3ghg h VAL 58 N -0.44 1.26 -0.40 0.32 3.04 0.11 0.23 116.25 120.38 3ghg h VAL 58 Ca -0.03 -0.83 -0.06 0.00 -1.01 0.00 0.00 66.70 64.77 3ghg h VAL 58 Cb 0.34 0.32 -0.02 0.00 -2.01 0.00 0.00 31.29 29.92 3ghg h VAL 58 CO 0.04 0.34 -0.00 0.78 -1.01 0.00 0.00 177.57 177.72 3ghg h ASN 59 N 1.15 0.60 0.47 3.17 2.35 -1.16 -1.61 115.58 120.55 3ghg h ASN 59 Ca 0.26 -0.13 -0.02 0.00 -0.55 0.00 0.00 56.30 55.86 3ghg h ASN 59 Cb 0.22 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.44 3ghg h ASN 59 CO -0.02 0.68 -0.23 -0.61 -1.65 0.00 0.00 177.43 175.60 3ghg h GLN 60 N 0.60 -0.61 -1.13 0.81 -0.00 -0.38 -2.62 115.11 111.78 3ghg h GLN 60 Ca 0.12 0.04 0.36 0.00 -0.00 0.00 0.00 58.65 59.17 3ghg h GLN 60 Cb 0.39 0.14 -0.13 0.00 0.00 0.00 0.00 27.48 27.87 3ghg h GLN 60 CO 0.01 -0.35 0.69 -0.44 0.00 0.00 0.00 178.83 178.75 3ghg h ASP 61 N -0.75 0.39 0.97 -0.69 3.32 0.06 0.15 116.42 119.87 3ghg h ASP 61 Ca -0.06 0.15 -0.20 0.00 0.02 0.00 0.00 57.03 56.94 3ghg h ASP 61 Cb 0.54 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 3ghg h ASP 61 CO 0.11 -0.12 -1.08 -0.26 -1.72 0.00 0.00 179.24 176.16 3ghg h PHE 62 N 0.23 0.00 0.00 4.55 0.05 -1.31 -3.09 116.94 117.37 3ghg h PHE 62 Ca 0.75 0.00 0.00 0.00 3.82 0.00 0.00 57.97 62.54 3ghg h PHE 62 Cb 2.01 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.96 3ghg h PHE 62 CO -0.01 0.82 -0.79 1.79 -0.18 0.00 0.00 178.31 179.95 3ghg h THR 63 N 0.00 0.00 0.01 -1.55 1.35 -0.36 -1.16 112.91 111.21 3ghg h THR 63 Ca -0.09 -0.88 -0.02 0.00 -0.55 0.00 0.00 66.41 64.88 3ghg h THR 63 Cb 1.70 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.58 3ghg h THR 63 CO 0.09 0.00 -0.09 -0.55 -0.25 0.00 0.00 175.52 174.72 3ghg h ASN 64 N 0.00 0.05 -0.95 5.36 -1.07 -1.38 -2.67 115.58 114.92 3ghg h ASN 64 Ca 0.00 -0.98 -0.00 0.00 0.07 0.00 0.00 56.30 55.39 3ghg h ASN 64 Cb 0.94 -0.02 -0.05 0.00 -2.07 0.00 0.00 38.32 37.13 3ghg h ASN 64 CO 0.00 1.03 0.58 -0.09 0.07 0.00 0.00 177.43 179.02 3ghg h ARG 65 N -0.92 1.28 -0.26 4.14 2.43 -1.65 -1.88 114.38 117.52 3ghg h ARG 65 Ca -0.02 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.00 3ghg h ARG 65 Cb 1.06 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 3ghg h ARG 65 CO 0.02 0.89 -0.03 0.97 -1.51 0.00 0.00 179.97 180.31 3ghg h ILE 66 N 1.30 1.27 -0.08 1.20 6.09 -1.34 -1.56 117.51 124.40 3ghg h ILE 66 Ca 0.34 -0.98 -0.08 0.00 -1.37 0.00 0.00 64.86 62.77 3ghg h ILE 66 Cb -0.07 1.39 -0.01 0.00 0.47 0.00 0.00 36.82 38.60 3ghg h ILE 66 CO -0.07 0.31 -0.31 0.78 -3.07 0.00 0.00 178.15 175.79 3ghg h ASN 67 N 0.24 0.15 -0.16 2.19 -0.26 -1.20 0.26 115.58 116.80 3ghg h ASN 67 Ca 0.07 -0.05 -0.02 0.00 -0.56 0.00 0.00 56.30 55.74 3ghg h ASN 67 Cb 0.47 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.68 3ghg h ASN 67 CO 0.02 0.47 0.02 0.50 -1.06 0.00 0.00 177.43 177.38 3ghg h LYS 68 N 0.13 0.26 -0.68 0.81 3.64 -1.36 -2.50 116.57 116.88 3ghg h LYS 68 Ca 0.02 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.35 3ghg h LYS 68 Cb 0.63 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.38 3ghg h LYS 68 CO 0.05 0.44 0.43 1.25 -2.27 0.00 0.00 179.45 179.35 3ghg h LEU 69 N 0.04 0.72 0.01 5.20 7.12 -0.29 -1.31 115.31 126.80 3ghg h LEU 69 Ca 0.05 -0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.05 3ghg h LEU 69 Cb 0.31 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 40.28 3ghg h LEU 69 CO 0.00 0.50 -0.01 0.11 -0.13 0.00 0.00 178.44 178.92 3ghg h LYS 70 N 0.86 -0.01 -0.83 1.25 1.57 -0.59 -0.51 116.57 118.30 3ghg h LYS 70 Ca 0.27 0.00 0.16 0.00 -1.87 0.00 0.00 60.65 59.21 3ghg h LYS 70 Cb -0.01 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.15 3ghg h LYS 70 CO -0.09 0.10 -0.26 -0.97 -0.57 0.00 0.00 179.45 177.65 3ghg h ASN 71 N -0.12 -0.96 -0.25 0.86 -0.73 -1.06 -0.03 115.58 113.28 3ghg h ASN 71 Ca -0.00 0.26 -0.01 0.00 1.87 0.00 0.00 56.30 58.42 3ghg h ASN 71 Cb 0.12 0.58 -0.01 0.00 0.27 0.00 0.00 38.32 39.27 3ghg h ASN 71 CO 0.00 -0.29 0.10 0.28 -0.37 0.00 0.00 177.43 177.16 3ghg h SER 72 N -0.03 0.34 -0.49 1.15 0.02 -0.91 -2.75 113.55 110.88 3ghg h SER 72 Ca 0.37 -0.16 0.08 0.00 -0.84 0.00 0.00 61.79 61.24 3ghg h SER 72 Cb 0.61 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 62.99 3ghg h SER 72 CO -0.86 0.40 0.10 0.25 -1.14 0.00 0.00 176.83 175.58 3ghg h LEU 73 N 0.25 0.01 -1.38 5.07 7.12 0.04 -0.72 115.31 125.70 3ghg h LEU 73 Ca 0.08 0.09 0.06 0.00 0.13 0.00 0.00 57.88 58.23 3ghg h LEU 73 Cb 0.17 0.12 -0.04 0.00 -0.53 0.00 0.00 40.66 40.37 3ghg h LEU 73 CO -0.01 0.03 0.47 -0.26 -0.13 0.00 0.00 178.44 178.54 3ghg h PHE 74 N 0.24 0.77 0.00 1.25 0.04 -0.92 -0.84 116.94 117.47 3ghg h PHE 74 Ca 0.24 0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.03 3ghg h PHE 74 Cb 0.32 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.22 3ghg h PHE 74 CO -0.22 0.42 0.00 0.93 -0.60 0.00 0.00 178.31 178.83 3ghg h GLU 75 N 0.77 0.00 0.00 1.51 4.39 -0.87 -2.42 114.58 117.96 3ghg h GLU 75 Ca 0.30 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.72 3ghg h GLU 75 Cb 0.20 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.81 3ghg h GLU 75 CO -0.10 0.00 -1.73 0.66 -1.16 0.00 0.00 179.01 176.68 3ghg n TYR 76 N -2.90 0.88 0.07 4.33 4.01 -0.59 -4.07 117.16 118.90 3ghg n TYR 76 Ca 0.03 0.32 -0.07 0.00 -0.16 0.00 0.00 57.90 58.02 3ghg n TYR 76 Cb 0.39 -1.14 0.09 0.00 -0.31 0.00 0.00 39.34 38.37 3ghg n TYR 76 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 3ghg h GLN 77 N 0.00 0.32 -0.70 -0.72 4.20 -1.08 -2.86 115.11 114.27 3ghg h GLN 77 Ca -0.29 -0.22 0.02 0.00 0.06 0.00 0.00 58.65 58.22 3ghg h GLN 77 Cb 1.96 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 29.73 3ghg h GLN 77 CO 0.07 0.83 0.45 1.57 -0.67 0.00 0.00 178.83 181.08 3ghg h LYS 78 N 0.23 0.87 0.00 1.46 2.10 -1.61 -2.83 116.57 116.79 3ghg h LYS 78 Ca -0.01 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.59 3ghg h LYS 78 Cb 1.14 -0.20 0.00 0.00 -0.90 0.00 0.00 32.23 32.28 3ghg h LYS 78 CO 0.10 0.58 0.00 0.09 -2.00 0.00 0.00 179.45 178.22 3ghg n ASN 79 N -4.64 0.28 -0.03 7.07 4.13 -1.18 -2.66 115.26 118.24 3ghg n ASN 79 Ca 0.07 0.54 -0.11 0.00 1.68 0.00 0.00 54.58 56.76 3ghg n ASN 79 Cb 0.05 -0.61 -0.05 0.00 -1.54 0.00 0.00 39.78 37.63 3ghg n ASN 79 CO 0.00 0.00 0.00 -1.13 0.28 0.00 0.00 177.26 176.41 3ghg h ASN 80 N 0.00 0.19 -0.68 6.41 -0.73 -1.26 -1.84 115.58 117.67 3ghg h ASN 80 Ca 0.00 -0.14 -0.05 0.00 1.87 0.00 0.00 56.30 57.98 3ghg h ASN 80 Cb 0.49 -0.05 -0.03 0.00 0.27 0.00 0.00 38.32 39.00 3ghg h ASN 80 CO 0.00 0.27 0.23 0.11 -0.37 0.00 0.00 177.43 177.67 3ghg h LYS 81 N 0.09 1.05 -0.32 6.67 1.79 -1.57 0.85 116.57 125.13 3ghg h LYS 81 Ca 0.05 -0.22 -0.09 0.00 -2.18 0.00 0.00 60.65 58.21 3ghg h LYS 81 Cb 0.14 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.62 3ghg h LYS 81 CO -0.01 0.90 -0.16 -0.44 -1.08 0.00 0.00 179.45 178.66 3ghg h ASP 82 N 0.99 0.70 -0.39 0.86 3.32 -1.59 -1.79 116.42 118.51 3ghg h ASP 82 Ca 0.22 -0.41 -0.10 0.00 0.02 0.00 0.00 57.03 56.76 3ghg h ASP 82 Cb 0.28 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3ghg h ASP 82 CO -0.01 0.95 -0.14 0.77 -1.72 0.00 0.00 179.24 179.10 3ghg h SER 83 N 0.44 0.79 -0.89 6.45 4.64 -1.23 -2.72 113.55 121.03 3ghg h SER 83 Ca 0.07 -0.38 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 3ghg h SER 83 Cb 0.69 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.52 3ghg h SER 83 CO 0.05 0.99 0.55 -0.74 -0.87 0.00 0.00 176.83 176.81 3ghg h HIS 84 N 0.58 1.16 -0.55 4.77 -0.00 -0.82 -1.74 115.15 118.54 3ghg h HIS 84 Ca 0.09 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.50 3ghg h HIS 84 Cb 0.67 -0.38 -0.04 0.00 -0.00 0.00 0.00 27.41 27.66 3ghg h HIS 84 CO 0.05 0.76 0.32 0.66 -0.00 0.00 0.00 177.93 179.72 3ghg h SER 85 N 1.22 0.50 -0.43 3.26 4.64 -1.22 -0.92 113.55 120.60 3ghg h SER 85 Ca 0.32 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.54 3ghg h SER 85 Cb -0.07 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.92 3ghg h SER 85 CO -0.06 0.35 -0.19 -0.07 -0.87 0.00 0.00 176.83 175.99 3ghg h LEU 86 N 0.62 0.91 -0.51 5.97 3.38 -1.09 -1.93 115.31 122.67 3ghg h LEU 86 Ca 0.23 -0.39 -0.16 0.00 0.09 0.00 0.00 57.88 57.64 3ghg h LEU 86 Cb 0.06 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3ghg h LEU 86 CO -0.12 1.10 -0.58 0.74 0.09 0.00 0.00 178.44 179.68 3ghg h THR 87 N 0.72 1.33 -0.14 0.22 2.02 -1.25 -0.85 112.91 114.96 3ghg h THR 87 Ca 0.10 -1.85 -0.05 0.00 0.77 0.00 0.00 66.41 65.38 3ghg h THR 87 Cb 0.75 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 3ghg h THR 87 CO 0.06 0.57 -0.13 0.74 0.37 0.00 0.00 175.52 177.13 3ghg h THR 88 N 0.39 1.17 -0.16 3.16 2.02 -1.15 0.30 112.91 118.64 3ghg h THR 88 Ca 0.00 -0.76 -0.15 0.00 0.77 0.00 0.00 66.41 66.27 3ghg h THR 88 Cb 1.12 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 68.75 3ghg h THR 88 CO 0.11 0.24 -0.49 0.78 0.37 0.00 0.00 175.52 176.52 3ghg h ASN 89 N 0.21 0.71 0.84 4.18 2.35 -0.86 -1.93 115.58 121.07 3ghg h ASN 89 Ca 0.04 -0.59 0.00 0.00 -0.55 0.00 0.00 56.30 55.20 3ghg h ASN 89 Cb 0.37 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.53 3ghg h ASN 89 CO 0.02 1.18 -0.24 2.30 -1.65 0.00 0.00 177.43 179.04 3ghg n ILE 90 N -4.19 0.08 0.15 2.81 -5.35 -0.37 -1.77 119.36 110.72 3ghg n ILE 90 Ca -0.07 -0.05 0.07 0.00 -0.27 0.00 0.00 62.75 62.44 3ghg n ILE 90 Cb 0.59 -0.19 0.07 0.00 -1.74 0.00 0.00 39.64 38.36 3ghg n ILE 90 CO 0.00 0.00 0.00 -0.03 -1.76 0.00 0.00 176.55 174.76 3ghg h MET 91 N 0.00 0.00 0.00 6.28 4.05 -0.38 -3.34 114.93 121.54 3ghg h MET 91 Ca 0.00 0.00 -0.36 0.00 -0.28 0.00 0.00 59.70 59.06 3ghg h MET 91 Cb 0.54 0.00 -0.07 0.00 -0.80 0.00 0.00 31.60 31.28 3ghg h MET 91 CO 0.00 0.20 -2.35 -0.85 0.23 0.00 0.00 176.91 174.15 3ghg n GLU 92 N -3.05 0.71 0.05 0.39 -0.00 -0.73 -3.87 120.64 114.14 3ghg n GLU 92 Ca 0.01 0.09 -0.06 0.00 -0.00 0.00 0.00 57.16 57.20 3ghg n GLU 92 Cb 0.64 -1.48 0.13 0.00 -0.00 0.00 0.00 31.44 30.72 3ghg n GLU 92 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.13 176.29 3ghg h ILE 93 N 0.00 1.34 0.08 3.84 -0.00 -1.56 -2.27 117.51 118.94 3ghg h ILE 93 Ca -0.53 -1.75 -0.18 0.00 -0.00 0.00 0.00 64.86 62.39 3ghg h ILE 93 Cb 1.95 1.79 0.02 0.00 -0.00 0.00 0.00 36.82 40.58 3ghg h ILE 93 CO -0.04 0.53 -0.76 -0.07 -0.00 0.00 0.00 178.15 177.80 3ghg h LEU 94 N 0.30 0.54 -0.61 0.16 3.38 -1.80 -3.02 115.31 114.26 3ghg h LEU 94 Ca 0.01 -0.85 0.09 0.00 0.09 0.00 0.00 57.88 57.22 3ghg h LEU 94 Cb 1.00 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 41.51 3ghg h LEU 94 CO 0.09 1.34 0.25 -0.09 0.09 0.00 0.00 178.44 180.12 3ghg h ARG 95 N -0.18 0.44 -0.67 1.13 2.43 -1.67 -0.56 114.38 115.29 3ghg h ARG 95 Ca -0.12 -0.03 0.15 0.00 -0.81 0.00 0.00 59.98 59.18 3ghg h ARG 95 Cb 1.52 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.93 3ghg h ARG 95 CO 0.15 0.29 0.46 0.78 -1.51 0.00 0.00 179.97 180.14 3ghg h GLY 96 N 0.45 0.44 1.32 2.80 0.00 -1.44 -2.13 103.07 104.52 3ghg h GLY 96 Ca 0.30 -0.11 -0.23 0.00 0.00 0.00 0.00 47.33 47.28 3ghg h GLY 96 CO -0.28 0.04 -0.89 -1.80 0.00 0.00 0.00 176.54 173.61 3ghg h ASP 97 N 0.27 0.79 -0.17 0.19 -0.00 -0.99 -3.00 116.42 113.50 3ghg h ASP 97 Ca 0.33 -0.58 -0.21 0.00 -0.00 0.00 0.00 57.03 56.57 3ghg h ASP 97 Cb 0.91 -0.24 0.01 0.00 -0.00 0.00 0.00 39.33 40.01 3ghg h ASP 97 CO -0.07 1.37 -0.73 -0.26 -0.00 0.00 0.00 179.24 179.54 3ghg h PHE 98 N 0.39 1.06 -0.64 0.28 -1.00 -0.76 0.77 116.94 117.05 3ghg h PHE 98 Ca -0.08 -0.46 -0.01 0.00 2.81 0.00 0.00 57.97 60.23 3ghg h PHE 98 Cb 1.53 -0.17 -0.03 0.00 3.61 0.00 0.00 35.95 40.89 3ghg h PHE 98 CO 0.08 1.29 0.35 0.77 -1.61 0.00 0.00 178.31 179.19 3ghg h SER 99 N 0.53 0.80 0.05 2.17 0.02 -1.55 0.25 113.55 115.83 3ghg h SER 99 Ca -0.04 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 3ghg h SER 99 Cb 1.36 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.69 3ghg h SER 99 CO 0.15 0.66 -0.05 0.28 -1.14 0.00 0.00 176.83 176.74 3ghg h SER 100 N 0.88 -0.13 -0.66 3.07 0.02 -1.38 -2.12 113.55 113.22 3ghg h SER 100 Ca 0.23 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 61.20 3ghg h SER 100 Cb 0.04 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 3ghg h SER 100 CO -0.04 -0.08 0.43 0.00 -1.14 0.00 0.00 176.83 176.01 3ghg h ALA 101 N 0.83 0.85 0.42 3.77 0.00 -0.62 0.80 119.26 125.31 3ghg h ALA 101 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3ghg h ALA 101 Cb 0.11 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3ghg h ALA 101 CO -0.01 0.24 -0.31 -0.91 0.00 0.00 0.00 179.25 178.26 3ghg h ASN 102 N 0.87 -0.79 -0.31 0.00 4.21 -0.80 0.28 115.58 119.04 3ghg h ASN 102 Ca 0.25 0.06 0.06 0.00 1.21 0.00 0.00 56.30 57.88 3ghg h ASN 102 Cb -0.06 0.25 -0.05 0.00 -1.12 0.00 0.00 38.32 37.33 3ghg h ASN 102 CO -0.07 -0.47 -0.03 -1.13 -1.29 0.00 0.00 177.43 174.45 3ghg h ASN 103 N -0.72 -0.18 -0.79 5.81 -0.73 -1.29 0.31 115.58 118.00 3ghg h ASN 103 Ca -0.04 0.08 -0.02 0.00 1.87 0.00 0.00 56.30 58.19 3ghg h ASN 103 Cb 0.61 0.15 -0.04 0.00 0.27 0.00 0.00 38.32 39.31 3ghg h ASN 103 CO 0.01 -0.05 0.43 -0.09 -0.37 0.00 0.00 177.43 177.36 3ghg h ARG 104 N 0.06 1.10 0.00 6.67 2.43 -0.42 -2.51 114.38 121.70 3ghg h ARG 104 Ca 0.15 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3ghg h ARG 104 Cb 0.21 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3ghg h ARG 104 CO -0.27 0.81 -1.19 -3.47 -1.51 0.00 0.00 179.97 174.33 3ghg n ASP 105 N -4.43 0.56 -0.13 -3.80 -0.08 0.95 -1.79 116.55 107.83 3ghg n ASP 105 Ca 0.07 -0.16 0.02 0.00 -1.51 0.00 0.00 54.79 53.21 3ghg n ASP 105 Cb 0.09 0.98 0.32 0.00 2.34 0.00 0.00 41.12 44.85 3ghg n ASP 105 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 3ghg h ASN 106 N 0.00 0.70 -0.20 1.67 -0.00 -0.85 -1.39 115.58 115.50 3ghg h ASN 106 Ca 0.00 -0.02 -0.07 0.00 -0.00 0.00 0.00 56.30 56.21 3ghg h ASN 106 Cb 0.79 -0.17 -0.00 0.00 -0.00 0.00 0.00 38.32 38.94 3ghg h ASN 106 CO 0.00 0.50 -0.15 0.74 -0.00 0.00 0.00 177.43 178.53 3ghg h THR 107 N 0.82 1.32 -0.87 6.14 2.02 -1.33 -1.56 112.91 119.46 3ghg h THR 107 Ca 0.23 -1.26 0.05 0.00 0.77 0.00 0.00 66.41 66.20 3ghg h THR 107 Cb -0.07 1.70 -0.05 0.00 -1.74 0.00 0.00 68.15 67.99 3ghg h THR 107 CO -0.05 0.38 0.57 0.22 0.37 0.00 0.00 175.52 177.01 3ghg h TYR 108 N 0.14 1.02 0.24 3.16 5.03 -1.15 -2.68 116.97 122.73 3ghg h TYR 108 Ca 0.04 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.36 3ghg h TYR 108 Cb 0.66 -0.34 0.00 0.00 1.55 0.00 0.00 36.73 38.61 3ghg h TYR 108 CO 0.07 0.56 -0.12 -0.97 -1.32 0.00 0.00 178.16 176.38 3ghg h ASN 109 N 1.02 -0.28 -0.84 -2.11 -1.24 -1.19 -3.21 115.58 107.74 3ghg h ASN 109 Ca 0.36 -0.17 0.19 0.00 0.71 0.00 0.00 56.30 57.40 3ghg h ASN 109 Cb 0.13 0.07 -0.15 0.00 0.73 0.00 0.00 38.32 39.10 3ghg h ASN 109 CO -0.12 0.02 -0.05 -0.09 -1.29 0.00 0.00 177.43 175.90 3ghg h ARG 110 N -0.59 0.05 -0.80 6.67 2.43 -0.96 0.23 114.38 121.41 3ghg h ARG 110 Ca -0.03 -0.00 0.17 0.00 -0.81 0.00 0.00 59.98 59.30 3ghg h ARG 110 Cb 0.43 -0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 29.86 3ghg h ARG 110 CO 0.06 0.03 0.31 0.28 -1.51 0.00 0.00 179.97 179.14 3ghg h VAL 111 N 0.05 0.59 -0.53 0.20 2.07 -1.50 -1.08 116.25 116.05 3ghg h VAL 111 Ca 0.45 -0.14 -0.08 0.00 0.82 0.00 0.00 66.70 67.75 3ghg h VAL 111 Cb 0.81 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.69 3ghg h VAL 111 CO -0.78 0.08 0.02 0.28 0.02 0.00 0.00 177.57 177.18 3ghg h SER 112 N 0.42 0.86 -0.43 0.57 0.02 -0.55 -1.86 113.55 112.57 3ghg h SER 112 Ca 0.46 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 3ghg h SER 112 Cb 0.75 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 3ghg h SER 112 CO -0.45 0.91 0.28 -0.08 -1.14 0.00 0.00 176.83 176.34 3ghg h GLU 113 N 0.83 0.57 0.21 3.45 4.81 -0.88 -1.83 114.58 121.74 3ghg h GLU 113 Ca 0.16 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3ghg h GLU 113 Cb 0.47 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 3ghg h GLU 113 CO 0.02 0.40 -0.25 0.22 -0.73 0.00 0.00 179.01 178.67 3ghg h ASP 114 N 0.58 -0.67 -0.21 1.04 1.82 -1.08 -2.25 116.42 115.65 3ghg h ASP 114 Ca 0.16 0.07 0.06 0.00 -0.39 0.00 0.00 57.03 56.92 3ghg h ASP 114 Cb -0.04 0.24 -0.07 0.00 0.68 0.00 0.00 39.33 40.14 3ghg h ASP 114 CO -0.03 -0.35 -0.25 -0.07 -1.61 0.00 0.00 179.24 176.93 3ghg h LEU 115 N -0.51 -0.78 -0.79 2.28 3.38 -1.17 -1.61 115.31 116.11 3ghg h LEU 115 Ca 0.00 0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.23 3ghg h LEU 115 Cb 0.49 0.36 -0.09 0.00 0.09 0.00 0.00 40.66 41.51 3ghg h LEU 115 CO -0.08 -0.28 0.39 0.03 0.09 0.00 0.00 178.44 178.59 3ghg h ARG 116 N -0.27 0.58 -0.36 1.13 3.08 -1.27 -1.34 114.38 115.94 3ghg h ARG 116 Ca 0.13 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 3ghg h ARG 116 Cb 0.46 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 3ghg h ARG 116 CO -0.37 0.39 0.06 0.66 -1.07 0.00 0.00 179.97 179.64 3ghg h SER 117 N 0.60 0.49 0.73 7.04 4.64 -0.68 0.10 113.55 126.47 3ghg h SER 117 Ca 0.41 -0.07 -0.16 0.00 -0.47 0.00 0.00 61.79 61.51 3ghg h SER 117 Cb 0.54 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 3ghg h SER 117 CO -0.33 0.52 -0.74 0.03 -0.87 0.00 0.00 176.83 175.44 3ghg h ARG 118 N 0.52 0.01 0.22 4.77 3.08 -0.87 -2.87 114.38 119.24 3ghg h ARG 118 Ca 0.12 -0.01 -0.29 0.00 0.07 0.00 0.00 59.98 59.87 3ghg h ARG 118 Cb 0.24 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.33 3ghg h ARG 118 CO 0.00 0.74 -1.27 0.82 -1.07 0.00 0.00 179.97 179.19 3ghg h ILE 119 N 0.00 1.36 -0.23 2.04 1.08 -0.41 -2.82 117.51 118.53 3ghg h ILE 119 Ca -0.01 -2.65 0.00 0.00 -0.39 0.00 0.00 64.86 61.82 3ghg h ILE 119 Cb 1.30 3.10 -0.01 0.00 -3.07 0.00 0.00 36.82 38.14 3ghg h ILE 119 CO 0.10 0.78 0.15 -0.33 -0.69 0.00 0.00 178.15 178.16 3ghg h GLU 120 N -0.02 0.30 -0.64 2.37 5.08 -0.92 -1.87 114.58 118.88 3ghg h GLU 120 Ca -0.22 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.09 3ghg h GLU 120 Cb 2.00 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 31.15 3ghg h GLU 120 CO 0.24 0.20 0.27 0.28 -1.00 0.00 0.00 179.01 179.00 3ghg h VAL 121 N 0.31 1.23 0.02 3.13 2.07 -1.50 -3.30 116.25 118.21 3ghg h VAL 121 Ca 0.08 -0.70 -0.22 0.00 0.82 0.00 0.00 66.70 66.68 3ghg h VAL 121 Cb -0.03 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 3ghg h VAL 121 CO -0.02 0.28 -1.04 -0.07 0.02 0.00 0.00 177.57 176.75 3ghg h LEU 122 N 0.90 0.08 -1.53 2.57 -0.00 -1.12 -3.17 115.31 113.04 3ghg h LEU 122 Ca 0.22 -0.08 -0.03 0.00 -0.00 0.00 0.00 57.88 57.98 3ghg h LEU 122 Cb 0.18 -0.03 -0.00 0.00 -0.00 0.00 0.00 40.66 40.81 3ghg h LEU 122 CO -0.02 1.06 -0.14 0.11 -0.00 0.00 0.00 178.44 179.45 3ghg h LYS 123 N 0.01 0.00 -0.02 1.13 6.56 -1.45 2.88 116.57 125.69 3ghg h LYS 123 Ca -0.03 0.00 -0.23 0.00 -1.06 0.00 0.00 60.65 59.33 3ghg h LYS 123 Cb 1.79 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 33.46 3ghg h LYS 123 CO 0.14 0.14 -0.92 0.00 -2.06 0.00 0.00 179.45 176.75 3ghg h ARG 124 N 0.00 0.49 0.03 3.15 3.08 -1.64 -3.19 114.38 116.29 3ghg h ARG 124 Ca -0.00 -0.50 -0.00 0.00 0.07 0.00 0.00 59.98 59.55 3ghg h ARG 124 Cb 0.53 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.72 3ghg h ARG 124 CO 0.02 1.14 -0.01 -0.22 -1.07 0.00 0.00 179.97 179.82 3ghg h LYS 125 N 0.29 -0.04 0.00 0.04 3.64 -0.76 -3.12 116.57 116.62 3ghg h LYS 125 Ca -0.08 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 3ghg h LYS 125 Cb 1.55 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.38 3ghg h LYS 125 CO 0.17 0.59 -0.16 -0.24 -2.27 0.00 0.00 179.45 177.54 3ghg h VAL 126 N -0.71 0.77 -0.15 2.00 3.04 0.48 -2.03 116.25 119.65 3ghg h VAL 126 Ca -0.00 -0.63 -0.09 0.00 -1.01 0.00 0.00 66.70 64.96 3ghg h VAL 126 Cb 0.65 1.38 -0.00 0.00 -2.01 0.00 0.00 31.29 31.30 3ghg h VAL 126 CO 0.01 0.16 -0.26 0.40 -1.01 0.00 0.00 177.57 176.87 3ghg h ILE 127 N 0.00 1.36 -0.70 3.17 2.04 -1.66 -1.72 117.51 120.00 3ghg h ILE 127 Ca -0.00 -1.49 0.05 0.00 1.00 0.00 0.00 64.86 64.42 3ghg h ILE 127 Cb 0.37 1.95 -0.05 0.00 -0.74 0.00 0.00 36.82 38.35 3ghg h ILE 127 CO 0.02 0.45 0.41 -0.33 0.00 0.00 0.00 178.15 178.70 3ghg h GLU 128 N 0.07 0.74 -0.31 2.37 5.08 -1.31 3.37 114.58 124.59 3ghg h GLU 128 Ca 0.01 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.26 3ghg h GLU 128 Cb 0.84 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 3ghg h GLU 128 CO 0.06 0.49 -0.08 0.87 -1.00 0.00 0.00 179.01 179.35 3ghg h LYS 129 N 0.76 0.60 -0.56 2.33 1.79 -1.55 -1.17 116.57 118.77 3ghg h LYS 129 Ca 0.30 -0.23 -0.08 0.00 -2.18 0.00 0.00 60.65 58.46 3ghg h LYS 129 Cb 0.14 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 3ghg h LYS 129 CO -0.16 0.79 0.03 -0.24 -1.08 0.00 0.00 179.45 178.79 3ghg h VAL 130 N 0.37 1.25 -0.48 0.50 3.04 -0.37 -1.75 116.25 118.81 3ghg h VAL 130 Ca 0.08 -1.05 0.03 0.00 -1.01 0.00 0.00 66.70 64.75 3ghg h VAL 130 Cb 0.57 0.79 -0.04 0.00 -2.01 0.00 0.00 31.29 30.61 3ghg h VAL 130 CO 0.03 0.38 0.26 -0.61 -1.01 0.00 0.00 177.57 176.62 3ghg h GLN 131 N 0.88 0.50 -0.66 4.17 5.75 0.64 0.14 115.11 126.52 3ghg h GLN 131 Ca 0.17 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 3ghg h GLN 131 Cb 0.48 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 3ghg h GLN 131 CO 0.02 0.33 0.41 0.45 -2.65 0.00 0.00 178.83 177.40 3ghg h HIS 132 N 0.52 0.85 -0.55 3.99 3.86 -1.01 -2.47 115.15 120.34 3ghg h HIS 132 Ca 0.20 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.39 3ghg h HIS 132 Cb 0.08 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.24 3ghg h HIS 132 CO -0.09 0.56 0.23 0.82 0.86 0.00 0.00 177.93 180.32 3ghg h ILE 133 N 0.90 1.22 -0.26 2.45 5.03 -0.37 0.12 117.51 126.60 3ghg h ILE 133 Ca 0.24 -0.66 0.04 0.00 -0.12 0.00 0.00 64.86 64.36 3ghg h ILE 133 Cb -0.06 0.62 -0.04 0.00 -3.03 0.00 0.00 36.82 34.31 3ghg h ILE 133 CO -0.05 0.26 0.02 1.56 -0.68 0.00 0.00 178.15 179.25 3ghg h GLN 134 N 0.75 0.10 -0.35 2.37 4.20 -0.58 0.37 115.11 121.97 3ghg h GLN 134 Ca 0.19 -0.01 -0.16 0.00 0.06 0.00 0.00 58.65 58.73 3ghg h GLN 134 Cb 0.18 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 3ghg h GLN 134 CO -0.02 0.06 -0.41 -0.07 -0.67 0.00 0.00 178.83 177.73 3ghg h LEU 135 N 0.10 0.94 -0.55 1.46 3.38 -1.28 -2.80 115.31 116.57 3ghg h LEU 135 Ca 0.12 -0.44 -0.16 0.00 0.09 0.00 0.00 57.88 57.50 3ghg h LEU 135 Cb 0.15 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3ghg h LEU 135 CO -0.19 1.22 -0.55 -0.07 0.09 0.00 0.00 178.44 178.94 3ghg h LEU 136 N 0.71 0.56 -0.00 1.67 3.38 -0.73 -0.76 115.31 120.13 3ghg h LEU 136 Ca 0.05 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.75 3ghg h LEU 136 Cb 0.99 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.55 3ghg h LEU 136 CO 0.10 1.00 -0.17 1.56 0.09 0.00 0.00 178.44 181.02 3ghg h GLN 137 N 0.39 -0.26 0.37 1.13 4.20 -0.23 -1.74 115.11 118.96 3ghg h GLN 137 Ca 0.01 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 3ghg h GLN 137 Cb 1.08 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.89 3ghg h GLN 137 CO 0.10 -0.18 -0.52 -0.22 -0.67 0.00 0.00 178.83 177.34 3ghg h LYS 138 N -0.27 -0.89 -0.88 1.46 1.63 -1.43 -3.06 116.57 113.12 3ghg h LYS 138 Ca 0.06 0.06 0.23 0.00 -0.85 0.00 0.00 60.65 60.14 3ghg h LYS 138 Cb 0.35 0.20 -0.05 0.00 -0.60 0.00 0.00 32.23 32.13 3ghg h LYS 138 CO -0.16 -0.60 0.61 -0.91 -3.45 0.00 0.00 179.45 174.94 3ghg h ASN 139 N -0.93 0.22 0.03 4.20 2.35 -0.87 -0.68 115.58 119.89 3ghg h ASN 139 Ca -0.04 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3ghg h ASN 139 Cb 0.84 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.20 3ghg h ASN 139 CO -0.15 0.08 -0.01 -0.37 -1.65 0.00 0.00 177.43 175.33 3ghg h VAL 140 N 0.22 1.28 -0.96 2.81 -1.51 -1.22 -1.55 116.25 115.32 3ghg h VAL 140 Ca 0.45 -0.99 0.07 0.00 -1.23 0.00 0.00 66.70 65.00 3ghg h VAL 140 Cb 1.40 1.94 -0.07 0.00 -2.13 0.00 0.00 31.29 32.43 3ghg h VAL 140 CO -0.10 0.25 0.62 -0.09 -1.23 0.00 0.00 177.57 177.01 3ghg h ARG 141 N -0.47 1.07 0.00 5.19 2.43 -1.09 2.94 114.38 124.45 3ghg h ARG 141 Ca -0.00 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 3ghg h ARG 141 Cb 0.44 -0.24 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 3ghg h ARG 141 CO 0.01 0.71 -0.07 0.00 -1.51 0.00 0.00 179.97 179.11 3ghg h ALA 142 N 1.45 1.15 0.06 2.80 0.00 -1.38 0.63 119.26 123.96 3ghg h ALA 142 Ca 0.42 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 55.12 3ghg h ALA 142 Cb 0.19 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3ghg h ALA 142 CO -0.18 0.09 -0.77 0.37 0.00 0.00 0.00 179.25 178.75 3ghg h GLN 143 N 0.00 0.12 -0.38 0.00 4.15 0.66 -3.36 115.11 116.30 3ghg h GLN 143 Ca -0.00 -0.21 0.02 0.00 0.77 0.00 0.00 58.65 59.23 3ghg h GLN 143 Cb 0.32 0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.06 3ghg h GLN 143 CO 0.01 1.10 0.21 1.25 -1.93 0.00 0.00 178.83 179.47 3ghg h LEU 144 N -0.70 0.33 -0.36 -2.39 5.85 0.60 -1.02 115.31 117.63 3ghg h LEU 144 Ca -0.17 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.61 3ghg h LEU 144 Cb 1.38 -0.06 -0.08 0.00 0.37 0.00 0.00 40.66 42.27 3ghg h LEU 144 CO 0.00 0.24 -0.51 1.62 -0.34 0.00 0.00 178.44 179.46 3ghg h VAL 145 N 0.43 0.04 -0.68 1.05 3.04 0.00 -2.52 116.25 117.62 3ghg h VAL 145 Ca 0.15 0.00 0.13 0.00 -1.01 0.00 0.00 66.70 65.97 3ghg h VAL 145 Cb 0.03 0.04 -0.09 0.00 -2.01 0.00 0.00 31.29 29.26 3ghg h VAL 145 CO -0.08 0.00 0.20 -0.78 -1.01 0.00 0.00 177.57 175.89 3ghg h ASP 146 N -0.41 0.11 -0.10 3.17 1.82 -1.36 0.24 116.42 119.89 3ghg h ASP 146 Ca 0.09 0.11 0.01 0.00 -0.39 0.00 0.00 57.03 56.86 3ghg h ASP 146 Cb 0.61 0.13 -0.01 0.00 0.68 0.00 0.00 39.33 40.74 3ghg h ASP 146 CO -0.56 0.04 0.01 0.24 -1.61 0.00 0.00 179.24 177.36 3ghg h MET 147 N 0.33 0.04 -0.95 0.28 2.86 -1.05 0.82 114.93 117.26 3ghg h MET 147 Ca 0.36 -0.00 0.29 0.00 -2.06 0.00 0.00 59.70 58.29 3ghg h MET 147 Cb 0.55 -0.01 -0.17 0.00 0.06 0.00 0.00 31.60 32.04 3ghg h MET 147 CO -0.42 0.03 0.20 -0.22 1.06 0.00 0.00 176.91 177.56 3ghg h LYS 148 N 0.05 0.08 0.00 1.72 3.64 -0.15 0.55 116.57 122.45 3ghg h LYS 148 Ca 0.04 -0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.21 3ghg h LYS 148 Cb 0.05 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 3ghg h LYS 148 CO -0.07 0.05 -1.04 0.00 -2.27 0.00 0.00 179.45 176.12 3ghg h ARG 149 N 0.08 0.00 0.00 1.90 3.08 0.10 -2.40 114.38 117.14 3ghg h ARG 149 Ca 0.63 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.65 3ghg h ARG 149 Cb 1.38 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.42 3ghg h ARG 149 CO -0.80 0.93 -0.49 1.25 -1.07 0.00 0.00 179.97 179.79 3ghg h LEU 150 N 0.00 0.00 0.16 3.04 5.85 0.21 -1.29 115.31 123.29 3ghg h LEU 150 Ca -0.03 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 3ghg h LEU 150 Cb 1.77 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.80 3ghg h LEU 150 CO 0.12 0.12 -0.08 -0.08 -0.34 0.00 0.00 178.44 178.18 3ghg h GLU 151 N 0.00 -0.21 0.00 1.25 4.57 0.01 -2.90 114.58 117.29 3ghg h GLU 151 Ca -0.01 0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.13 3ghg h GLU 151 Cb 1.10 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 3ghg h GLU 151 CO 0.01 -0.14 -0.25 -0.24 -1.18 0.00 0.00 179.01 177.21 3ghg h VAL 152 N -0.87 1.12 -0.16 0.32 3.04 -1.54 0.43 116.25 118.59 3ghg h VAL 152 Ca -0.02 -0.88 0.05 0.00 -1.01 0.00 0.00 66.70 64.83 3ghg h VAL 152 Cb 0.17 1.48 -0.05 0.00 -2.01 0.00 0.00 31.29 30.88 3ghg h VAL 152 CO 0.04 0.25 -0.18 -0.78 -1.01 0.00 0.00 177.57 175.89 3ghg h ASP 153 N 0.00 -0.56 0.66 3.17 3.58 -1.36 -2.74 116.42 119.18 3ghg h ASP 153 Ca -0.00 0.10 -0.14 0.00 0.42 0.00 0.00 57.03 57.41 3ghg h ASP 153 Cb 0.46 0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.76 3ghg h ASP 153 CO 0.03 -0.22 -0.68 0.40 -2.88 0.00 0.00 179.24 175.89 3ghg h ILE 154 N -0.21 1.48 -0.84 2.25 2.04 -0.82 -2.13 117.51 119.28 3ghg h ILE 154 Ca 0.11 -2.31 0.21 0.00 1.00 0.00 0.00 64.86 63.87 3ghg h ILE 154 Cb 0.37 2.24 -0.14 0.00 -0.74 0.00 0.00 36.82 38.55 3ghg h ILE 154 CO -0.28 0.66 0.13 -0.78 0.00 0.00 0.00 178.15 177.88 3ghg h ASP 155 N 0.01 -0.17 0.00 1.72 -0.00 0.08 -0.90 116.42 117.15 3ghg h ASP 155 Ca -0.01 0.20 0.00 0.00 -0.00 0.00 0.00 57.03 57.23 3ghg h ASP 155 Cb 1.20 0.32 0.00 0.00 -0.00 0.00 0.00 39.33 40.84 3ghg h ASP 155 CO 0.09 -0.18 -0.09 0.40 -0.00 0.00 0.00 179.24 179.46 3ghg h ILE 156 N 0.15 0.00 -1.25 2.25 2.04 -1.45 -3.29 117.51 115.96 3ghg h ILE 156 Ca 0.51 -0.96 0.41 0.00 1.00 0.00 0.00 64.86 65.81 3ghg h ILE 156 Cb 0.98 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.93 3ghg h ILE 156 CO -0.68 0.00 0.79 0.11 0.00 0.00 0.00 178.15 178.37 3ghg h LYS 157 N -0.96 0.13 -0.20 2.37 1.57 -1.09 3.67 116.57 122.06 3ghg h LYS 157 Ca 0.00 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 3ghg h LYS 157 Cb 0.09 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3ghg h LYS 157 CO 0.00 0.09 0.04 0.82 -0.57 0.00 0.00 179.45 179.83 3ghg h ILE 158 N 0.13 1.21 0.00 1.86 2.04 -1.34 -2.94 117.51 118.47 3ghg h ILE 158 Ca 0.79 -0.68 -0.03 0.00 1.00 0.00 0.00 64.86 65.94 3ghg h ILE 158 Cb 2.37 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 39.73 3ghg h ILE 158 CO -0.43 0.21 -0.16 -0.09 0.00 0.00 0.00 178.15 177.68 3ghg h ARG 159 N 0.13 0.00 -0.07 2.37 2.43 0.67 -0.34 114.38 119.57 3ghg h ARG 159 Ca 0.06 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3ghg h ARG 159 Cb 0.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 3ghg h ARG 159 CO 0.00 0.16 0.00 0.45 -1.51 0.00 0.00 179.97 179.07 3ghg n SER 160 N -4.23 0.07 -0.55 -3.80 2.88 0.38 0.15 113.62 108.53 3ghg n SER 160 Ca -0.02 -0.91 0.08 0.00 -1.33 0.00 0.00 58.87 56.68 3ghg n SER 160 Cb 0.23 -0.04 0.04 0.00 -0.75 0.00 0.00 64.21 63.70 3ghg n SER 160 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ghg h ARG 162 N 2.70 0.00 -0.66 0.00 2.43 -0.42 0.37 114.38 118.79 3ghg h ARG 162 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ghg h ARG 162 Cb 0.63 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 3ghg h ARG 162 CO 0.00 0.37 0.00 0.41 -1.51 0.00 0.00 179.97 179.24 3ghg n GLY 163 N 0.07 2.58 0.00 2.80 0.00 -1.26 -4.42 105.19 104.96 3ghg n GLY 163 Ca -0.01 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 3ghg n GLY 163 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ghg n SER 164 N 1.14 0.00 -3.98 1.61 7.64 -0.96 -5.10 113.62 113.97 3ghg n SER 164 Ca 0.25 -0.49 -0.12 0.00 1.01 0.00 0.00 58.87 59.52 3ghg n SER 164 Cb 0.84 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.92 3ghg n SER 164 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ghg h SER 166 N 5.11 -1.43 -3.26 0.00 4.64 -1.90 -3.41 113.55 113.30 3ghg h SER 166 Ca -0.31 0.19 -0.64 0.00 -0.47 0.00 0.00 61.79 60.56 3ghg h SER 166 Cb 1.20 0.59 -0.17 0.00 -0.31 0.00 0.00 62.40 63.71 3ghg h SER 166 CO 0.44 -0.43 -0.60 -0.60 -0.87 0.00 0.00 176.83 174.78 3ghg s ARG 167 N -5.84 3.65 -0.17 4.77 3.52 -1.26 -5.04 118.95 118.59 3ghg s ARG 167 Ca -0.15 -0.39 0.01 0.00 -0.13 0.00 0.00 55.73 55.06 3ghg s ARG 167 Cb 0.09 -3.04 0.03 0.00 -1.56 0.00 0.00 34.95 30.47 3ghg s ARG 167 CO 0.64 0.39 -0.14 0.00 -0.81 0.00 0.00 175.30 175.37 3ghg s ALA 168 N 0.01 2.01 -0.24 6.12 0.00 -1.26 -4.83 121.76 123.57 3ghg s ALA 168 Ca 0.04 -1.06 -0.29 0.00 0.00 0.00 0.00 51.96 50.65 3ghg s ALA 168 Cb -0.13 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 3ghg s ALA 168 CO 0.01 -0.49 1.68 -1.17 0.00 0.00 0.00 175.76 175.79 3ghg s LEU 169 N 1.42 3.82 -0.22 0.00 0.20 -1.26 -4.96 118.68 117.67 3ghg s LEU 169 Ca 0.03 1.59 -0.25 0.00 0.69 0.00 0.00 54.13 56.18 3ghg s LEU 169 Cb -0.14 -3.53 -0.01 0.00 -0.43 0.00 0.00 46.19 42.09 3ghg s LEU 169 CO -0.11 -1.36 0.86 0.00 -0.29 0.00 0.00 176.35 175.45 3ghg s ALA 170 N 5.59 3.62 -0.29 5.97 0.00 -1.26 -4.83 121.76 130.57 3ghg s ALA 170 Ca 0.74 -0.04 -0.19 0.00 0.00 0.00 0.00 51.96 52.48 3ghg s ALA 170 Cb -0.25 -3.31 0.13 0.00 0.00 0.00 0.00 23.12 19.69 3ghg s ALA 170 CO 0.31 -0.87 0.94 -0.98 0.00 0.00 0.00 175.76 175.16 3ghg s ARG 171 N 2.70 0.48 0.97 0.00 1.70 -1.26 -5.18 118.95 118.36 3ghg s ARG 171 Ca 0.37 0.73 -0.15 0.00 -0.47 0.00 0.00 55.73 56.21 3ghg s ARG 171 Cb -0.16 0.15 0.18 0.00 -0.57 0.00 0.00 34.95 34.55 3ghg s ARG 171 CO 0.09 -0.08 1.23 -1.21 -1.08 0.00 0.00 175.30 174.24 3ghg s GLU 172 N 1.02 0.62 0.03 3.89 8.01 -1.26 -5.05 118.70 125.96 3ghg s GLU 172 Ca -0.05 -0.13 0.05 0.00 0.01 0.00 0.00 54.97 54.85 3ghg s GLU 172 Cb -0.04 -1.82 -0.02 0.00 -4.31 0.00 0.00 34.13 27.94 3ghg s GLU 172 CO -0.13 -2.47 -0.16 0.08 0.01 0.00 0.00 175.26 172.60 3ghg s VAL 173 N -3.56 1.25 -0.62 2.63 1.01 -1.26 -5.07 120.40 114.78 3ghg s VAL 173 Ca 0.70 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 3ghg s VAL 173 Cb -0.08 -1.09 0.16 0.00 0.00 0.00 0.00 36.38 35.36 3ghg s VAL 173 CO 0.53 0.14 0.43 -0.62 0.00 0.00 0.00 175.10 175.57 3ghg s ASP 174 N -0.93 5.19 0.06 3.32 3.68 -1.26 -4.90 116.67 121.83 3ghg s ASP 174 Ca 0.04 -2.85 -0.17 0.00 2.13 0.00 0.00 52.55 51.69 3ghg s ASP 174 Cb -0.07 -1.84 -0.15 0.00 -1.45 0.00 0.00 42.92 39.41 3ghg s ASP 174 CO 0.01 -0.36 1.30 0.17 0.13 0.00 0.00 175.17 176.42 3ghg h LEU 175 N 7.02 0.61 -0.50 -1.34 8.10 -1.99 -3.14 115.31 124.06 3ghg h LEU 175 Ca -0.02 -0.56 0.06 0.00 0.11 0.00 0.00 57.88 57.46 3ghg h LEU 175 Cb 0.95 -0.18 -0.07 0.00 -0.44 0.00 0.00 40.66 40.93 3ghg h LEU 175 CO 0.71 1.06 -0.25 0.29 -4.11 0.00 0.00 178.44 176.14 3ghg n LYS 176 N -4.31 -0.18 -0.20 0.17 5.02 -1.26 0.25 118.16 117.65 3ghg n LYS 176 Ca -0.06 0.76 -0.08 0.00 -2.02 0.00 0.00 58.31 56.90 3ghg n LYS 176 Cb 0.52 -1.12 0.02 0.00 -0.02 0.00 0.00 35.03 34.42 3ghg n LYS 176 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 3ghg h ASP 177 N 0.00 0.86 -0.74 4.39 3.58 -1.99 -1.75 116.42 120.76 3ghg h ASP 177 Ca 0.12 -0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.32 3ghg h ASP 177 Cb 0.24 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.03 3ghg h ASP 177 CO -0.48 0.86 0.38 1.88 -2.88 0.00 0.00 179.24 179.00 3ghg h TYR 178 N 0.82 1.05 0.00 0.28 -1.99 0.18 -2.04 116.97 115.26 3ghg h TYR 178 Ca 0.18 -0.04 -0.04 0.00 2.00 0.00 0.00 58.73 60.84 3ghg h TYR 178 Cb 0.33 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 38.72 3ghg h TYR 178 CO 0.02 0.75 -0.18 0.93 -0.00 0.00 0.00 178.16 179.69 3ghg h GLU 179 N 1.03 0.00 0.00 4.88 4.39 0.35 -1.72 114.58 123.52 3ghg h GLU 179 Ca 0.26 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.94 3ghg h GLU 179 Cb 0.08 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 3ghg h GLU 179 CO -0.04 0.18 -0.29 -0.44 -1.16 0.00 0.00 179.01 177.26 3ghg h ASP 180 N 0.00 0.00 0.33 1.42 3.32 -1.19 -1.92 116.42 118.38 3ghg h ASP 180 Ca -0.00 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.88 3ghg h ASP 180 Cb 0.85 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.40 3ghg h ASP 180 CO 0.02 0.74 0.00 0.00 -1.72 0.00 0.00 179.24 178.28 3ghg n GLN 181 N -4.67 0.00 -0.10 3.56 1.13 -0.78 0.17 117.38 116.69 3ghg n GLN 181 Ca -0.07 0.33 -0.20 0.00 -1.94 0.00 0.00 57.00 55.13 3ghg n GLN 181 Cb 0.21 -1.50 -0.10 0.00 0.11 0.00 0.00 30.24 28.96 3ghg n GLN 181 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 3ghg n GLN 182 N -1.50 0.55 -0.06 -1.09 7.27 -0.64 -3.66 117.38 118.25 3ghg n GLN 182 Ca 0.02 0.52 -0.10 0.00 0.07 0.00 0.00 57.00 57.52 3ghg n GLN 182 Cb 0.11 -1.70 -0.04 0.00 2.41 0.00 0.00 30.24 31.02 3ghg n GLN 182 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 3ghg h LYS 183 N -1.00 -0.35 -0.60 3.69 3.64 -0.76 -0.66 116.57 120.54 3ghg h LYS 183 Ca -0.34 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.19 3ghg h LYS 183 Cb 1.22 0.08 -0.10 0.00 -0.41 0.00 0.00 32.23 33.02 3ghg h LYS 183 CO -0.20 -0.23 0.02 0.37 -2.27 0.00 0.00 179.45 177.13 3ghg h GLN 184 N -0.36 0.13 -0.74 1.90 4.15 0.15 -0.59 115.11 119.76 3ghg h GLN 184 Ca 0.12 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.51 3ghg h GLN 184 Cb 0.57 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.19 3ghg h GLN 184 CO -0.46 0.09 0.36 1.25 -1.93 0.00 0.00 178.83 178.14 3ghg h LEU 185 N 0.14 0.97 -0.96 -2.39 7.12 -1.51 -3.09 115.31 115.58 3ghg h LEU 185 Ca 0.31 -0.13 -0.10 0.00 0.13 0.00 0.00 57.88 58.09 3ghg h LEU 185 Cb 0.49 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.36 3ghg h LEU 185 CO -0.49 0.83 -0.49 -0.08 -0.13 0.00 0.00 178.44 178.08 3ghg h GLU 186 N 1.04 0.00 -0.16 1.25 4.57 0.36 -1.90 114.58 119.74 3ghg h GLU 186 Ca 0.25 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.43 3ghg h GLU 186 Cb 0.11 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3ghg h GLU 186 CO -0.03 0.49 0.08 0.37 -1.18 0.00 0.00 179.01 178.73 3ghg h GLN 187 N 0.00 0.21 0.00 1.92 4.15 -1.18 -3.30 115.11 116.91 3ghg h GLN 187 Ca -0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 3ghg h GLN 187 Cb 0.92 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.56 3ghg h GLN 187 CO 0.06 0.16 0.00 0.28 -1.93 0.00 0.00 178.83 177.41 3ghg n VAL 188 N -4.49 0.00 -0.29 2.39 0.31 -0.72 -4.37 118.33 111.16 3ghg n VAL 188 Ca -0.01 0.82 0.28 0.00 -0.01 0.00 0.00 64.34 65.43 3ghg n VAL 188 Cb 0.10 -1.66 0.51 0.00 -0.91 0.00 0.00 33.84 31.89 3ghg n VAL 188 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3ghg n ILE 189 N -1.52 -0.34 0.30 2.52 5.41 -1.17 -2.44 119.36 122.12 3ghg n ILE 189 Ca 0.00 1.71 0.14 0.00 1.00 0.00 0.00 62.75 65.59 3ghg n ILE 189 Cb 0.00 -2.78 0.68 0.00 -0.71 0.00 0.00 39.64 36.83 3ghg n ILE 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ghg h ALA 190 N 1.66 1.53 -2.50 -1.39 0.00 -1.76 -3.37 119.26 113.43 3ghg h ALA 190 Ca 0.73 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.64 3ghg h ALA 190 Cb 1.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.79 3ghg h ALA 190 CO -0.62 -0.49 0.00 1.63 0.00 0.00 0.00 179.25 179.77 3ghg n LYS 191 N -2.90 0.00 -2.66 0.00 5.02 -1.02 -5.00 118.16 111.59 3ghg n LYS 191 Ca -0.00 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.87 3ghg n LYS 191 Cb 0.52 -0.11 -0.03 0.00 -0.02 0.00 0.00 35.03 35.38 3ghg n LYS 191 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3ghg s ASP 192 N -1.49 7.35 0.00 4.39 2.15 -1.26 -4.90 116.67 122.91 3ghg s ASP 192 Ca 0.00 1.77 0.00 0.00 0.43 0.00 0.00 52.55 54.75 3ghg s ASP 192 Cb 0.00 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 3ghg s ASP 192 CO 0.00 -0.25 0.73 0.18 -0.17 0.00 0.00 175.17 175.66 3ghg n LEU 193 N 3.59 0.00 -4.13 -1.34 4.77 -1.26 -5.03 117.00 113.59 3ghg n LEU 193 Ca 0.06 -0.75 -0.30 0.00 -0.03 0.00 0.00 56.01 54.99 3ghg n LEU 193 Cb 0.50 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.54 3ghg n LEU 193 CO 0.52 0.35 -0.24 -0.11 -1.33 0.00 0.00 177.39 176.58 3ghg n LEU 194 N 0.00 -1.73 0.09 2.23 7.94 -1.26 -4.93 117.00 119.34 3ghg n LEU 194 Ca 0.00 -1.09 -0.23 0.00 -1.11 0.00 0.00 56.01 53.58 3ghg n LEU 194 Cb 0.61 -2.01 -0.15 0.00 0.53 0.00 0.00 43.42 42.40 3ghg n LEU 194 CO 0.00 0.39 -0.24 1.55 -1.11 0.00 0.00 177.39 177.98 3ghg h PRO 195 N -1.70 0.42 -0.27 1.96 0.14 -1.95 -3.41 132.00 127.19 3ghg h PRO 195 Ca -0.63 -0.72 -0.14 0.00 0.14 0.00 0.00 66.00 64.65 3ghg h PRO 195 Cb 1.38 0.27 -0.01 0.00 0.14 0.00 0.00 31.00 32.78 3ghg h PRO 195 CO 0.69 1.34 -0.42 0.77 0.14 0.00 0.00 178.00 180.53 3ghg h SER 196 N -0.05 0.71 -2.82 1.44 0.02 -2.04 -3.41 113.55 107.40 3ghg h SER 196 Ca -0.25 -0.33 -0.60 0.00 -0.84 0.00 0.00 61.79 59.77 3ghg h SER 196 Cb 1.97 -0.20 -0.39 0.00 0.14 0.00 0.00 62.40 63.92 3ghg h SER 196 CO 0.20 1.04 -0.83 -0.13 -1.14 0.00 0.00 176.83 175.97 3ghg s ARG 197 N -4.25 1.12 -0.17 3.45 1.81 -1.26 -4.81 118.95 114.85 3ghg s ARG 197 Ca -0.08 -2.05 -0.20 0.00 -1.72 0.00 0.00 55.73 51.68 3ghg s ARG 197 Cb 0.12 -1.90 -0.23 0.00 -0.45 0.00 0.00 34.95 32.49 3ghg s ARG 197 CO 0.84 -1.27 0.39 0.38 -0.68 0.00 0.00 175.30 174.96 3ghg h ASP 198 N 6.24 0.13 0.00 0.23 2.03 -1.87 -3.49 116.42 119.69 3ghg h ASP 198 Ca 0.13 -0.70 0.00 0.00 -0.73 0.00 0.00 57.03 55.73 3ghg h ASP 198 Cb 0.91 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.37 3ghg h ASP 198 CO 0.42 1.49 0.00 -1.14 -1.03 0.00 0.00 179.24 178.98 3ghg n ARG 199 N -4.25 0.00 -0.21 4.15 0.63 -1.26 -4.73 116.66 110.99 3ghg n ARG 199 Ca -0.27 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.66 3ghg n ARG 199 Cb 0.74 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.65 3ghg n ARG 199 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 3ghg n GLN 200 N 0.00 0.00 -0.06 -0.14 7.27 -1.26 -5.00 117.38 118.18 3ghg n GLN 200 Ca 0.00 0.09 -0.07 0.00 0.07 0.00 0.00 57.00 57.09 3ghg n GLN 200 Cb 0.00 -0.77 -0.09 0.00 2.41 0.00 0.00 30.24 31.79 3ghg n GLN 200 CO 0.00 0.00 0.00 -2.39 0.07 0.00 0.00 177.06 174.74 3ghg n HIS 201 N -2.15 0.00 -0.05 3.69 1.44 -1.26 -4.85 115.22 112.04 3ghg n HIS 201 Ca 0.00 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.57 3ghg n HIS 201 Cb 0.01 -0.58 -0.08 0.00 0.12 0.00 0.00 29.99 29.46 3ghg n HIS 201 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 3ghg h LEU 202 N 0.00 0.39-10.10 2.39 3.38 -1.99 -3.44 115.31 105.94 3ghg h LEU 202 Ca -0.33 -0.53 -0.53 0.00 0.09 0.00 0.00 57.88 56.59 3ghg h LEU 202 Cb 1.67 -0.11 0.11 0.00 0.09 0.00 0.00 40.66 42.42 3ghg h LEU 202 CO -0.00 0.84 0.47 -2.84 0.09 0.00 0.00 178.44 177.00 3ghg s PRO 203 N -4.12 2.98 0.09 1.13 0.02 -1.26 -5.08 135.00 128.77 3ghg s PRO 203 Ca -0.14 1.81 0.01 0.00 0.02 0.00 0.00 61.00 62.70 3ghg s PRO 203 Cb 0.05 -1.93 -0.04 0.00 0.02 0.00 0.00 34.50 32.59 3ghg s PRO 203 CO 0.76 -1.19 -0.04 -0.48 -0.33 0.00 0.00 177.00 175.72 3ghg s LEU 204 N -4.07 2.41 0.33 -5.54 2.34 -1.26 -5.12 118.68 107.77 3ghg s LEU 204 Ca 0.77 -1.03 -0.20 0.00 0.06 0.00 0.00 54.13 53.73 3ghg s LEU 204 Cb -0.30 0.05 -0.10 0.00 -0.56 0.00 0.00 46.19 45.29 3ghg s LEU 204 CO 0.33 -0.54 0.83 -0.51 -1.06 0.00 0.00 176.35 175.40 3ghg s ILE 205 N -3.76 4.48 -1.16 1.48 2.07 -1.26 -4.99 121.20 118.07 3ghg s ILE 205 Ca 0.12 1.34 0.13 0.00 -1.41 0.00 0.00 60.65 60.84 3ghg s ILE 205 Cb 0.06 -3.74 0.56 0.00 0.13 0.00 0.00 42.46 39.47 3ghg s ILE 205 CO -0.05 -0.07 1.42 0.29 -1.91 0.00 0.00 174.94 174.62 3ghg n LYS 206 N -0.02 3.17 0.21 3.50 5.02 -1.26 -4.32 118.16 124.46 3ghg n LYS 206 Ca 0.03 -2.19 0.08 0.00 -2.02 0.00 0.00 58.31 54.20 3ghg n LYS 206 Cb 0.52 -1.78 0.41 0.00 -0.02 0.00 0.00 35.03 34.16 3ghg n LYS 206 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 3ghg h MET 207 N 3.11 0.00 0.14 1.97 4.05 -1.98 1.70 114.93 123.92 3ghg h MET 207 Ca 0.00 0.00 -0.29 0.00 -0.28 0.00 0.00 59.70 59.13 3ghg h MET 207 Cb 1.21 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 32.03 3ghg h MET 207 CO 0.20 0.30 -1.26 0.87 0.23 0.00 0.00 176.91 177.25 3ghg h LYS 208 N 0.00 0.49 -0.27 0.39 1.57 -2.02 -3.32 116.57 113.42 3ghg h LYS 208 Ca -0.00 -0.71 -0.11 0.00 -1.87 0.00 0.00 60.65 57.96 3ghg h LYS 208 Cb 0.79 0.25 -0.01 0.00 0.08 0.00 0.00 32.23 33.33 3ghg h LYS 208 CO 0.04 1.32 -0.28 -1.35 -0.57 0.00 0.00 179.45 178.60 3ghg h PRO 209 N 0.19 0.53 0.00 3.15 0.11 -1.77 -3.38 132.00 130.84 3ghg h PRO 209 Ca -0.18 -0.22 -0.09 0.00 0.11 0.00 0.00 66.00 65.63 3ghg h PRO 209 Cb 1.94 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 33.01 3ghg h PRO 209 CO 0.23 0.76 -0.42 -0.24 -0.21 0.00 0.00 178.00 178.12 3ghg h VAL 210 N 0.46 1.29 0.00 3.15 3.04 0.24 -2.54 116.25 121.90 3ghg h VAL 210 Ca 0.06 -1.46 -0.11 0.00 -1.01 0.00 0.00 66.70 64.19 3ghg h VAL 210 Cb 0.73 1.79 -0.02 0.00 -2.01 0.00 0.00 31.29 31.78 3ghg h VAL 210 CO 0.06 0.41 -0.51 1.55 -1.01 0.00 0.00 177.57 178.07 3ghg h PRO 211 N 0.00 0.00 0.00 4.17 0.13 -1.74 -3.51 132.00 131.06 3ghg h PRO 211 Ca -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3ghg h PRO 211 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 3ghg h PRO 211 CO 0.05 0.51 0.00 -0.40 -0.23 0.00 0.00 178.00 177.94