#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ghg h LYS 29 N 3.02 0.00 -7.28 0.00 3.64 -2.07 -3.45 116.57 110.43 3ghg h LYS 29 Ca 0.08 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.94 3ghg h LYS 29 Cb 1.88 0.00 0.13 0.00 -0.41 0.00 0.00 32.23 33.82 3ghg h LYS 29 CO 0.49 0.22 0.33 0.34 -2.27 0.00 0.00 179.45 178.56 3ghg s ASP 30 N -5.97 4.54 -0.10 4.20 3.68 -1.26 -4.80 116.67 116.96 3ghg s ASP 30 Ca 0.02 1.90 -0.22 0.00 2.13 0.00 0.00 52.55 56.38 3ghg s ASP 30 Cb 0.08 -2.53 -0.26 0.00 -1.45 0.00 0.00 42.92 38.76 3ghg s ASP 30 CO 0.76 -2.01 1.34 -1.20 0.13 0.00 0.00 175.17 174.18 3ghg n SER 31 N -3.28 0.41 -0.96 -0.34 7.64 -1.26 -4.37 113.62 111.46 3ghg n SER 31 Ca 0.10 -1.95 0.08 0.00 1.01 0.00 0.00 58.87 58.10 3ghg n SER 31 Cb 0.53 -0.49 0.24 0.00 -1.01 0.00 0.00 64.21 63.47 3ghg n SER 31 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3ghg n ASP 32 N 8.43 3.62 -4.10 6.43 8.00 -1.26 -5.02 116.55 132.65 3ghg n ASP 32 Ca 0.33 -2.31 -0.16 0.00 0.71 0.00 0.00 54.79 53.36 3ghg n ASP 32 Cb 0.38 -0.40 -0.12 0.00 -0.02 0.00 0.00 41.12 40.97 3ghg n ASP 32 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3ghg s TRP 33 N -1.56 0.93 0.00 1.24 0.52 -1.26 -5.16 118.94 113.64 3ghg s TRP 33 Ca 0.36 -0.44 0.00 0.00 0.02 0.00 0.00 56.10 56.04 3ghg s TRP 33 Cb 0.22 -0.54 0.00 0.00 -1.15 0.00 0.00 33.47 32.00 3ghg s TRP 33 CO 0.18 -0.01 0.00 -2.30 0.02 0.00 0.00 176.95 174.84 3ghg n PRO 34 N 1.56 0.87 -3.84 4.98 -0.02 -1.26 -5.09 135.00 132.20 3ghg n PRO 34 Ca -0.21 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.13 3ghg n PRO 34 Cb 0.55 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.88 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 -0.06 0.06 0.34 6.00 0.08 -1.26 -5.15 117.98 117.99 3ghg s PHE 35 Ca 0.00 0.06 -0.19 0.00 0.12 0.00 0.00 56.93 56.92 3ghg s PHE 35 Cb 0.00 -0.16 -0.10 0.00 -0.57 0.00 0.00 43.02 42.19 3ghg s PHE 35 CO 0.00 -0.05 0.82 0.00 -0.10 0.00 0.00 175.22 175.89 3ghg n SER 37 N -0.13 0.00 -0.09 0.00 3.41 -1.26 -5.03 113.62 110.52 3ghg n SER 37 Ca 0.03 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.48 3ghg n SER 37 Cb 0.53 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.38 3ghg n SER 37 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 3ghg h ASP 38 N 0.00 0.00 0.56 4.04 3.04 -1.98 -3.39 116.42 118.69 3ghg h ASP 38 Ca 0.00 -0.43 0.00 0.00 -3.24 0.00 0.00 57.03 53.36 3ghg h ASP 38 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 3ghg h ASP 38 CO 0.00 1.25 0.00 -1.84 -2.04 0.00 0.00 179.24 176.61 3ghg n GLU 39 N -4.50 0.09 -0.17 4.15 0.00 -1.26 -1.59 120.64 117.36 3ghg n GLU 39 Ca -0.23 0.34 -0.01 0.00 0.00 0.00 0.00 57.16 57.26 3ghg n GLU 39 Cb 0.55 -1.67 0.23 0.00 0.00 0.00 0.00 31.44 30.55 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 0.00 0.81 -4.09 -1.84 3.32 -1.96 -3.42 116.42 109.24 3ghg h ASP 40 Ca 0.00 -0.07 -0.55 0.00 0.02 0.00 0.00 57.03 56.43 3ghg h ASP 40 Cb 0.28 -0.21 0.14 0.00 0.22 0.00 0.00 39.33 39.76 3ghg h ASP 40 CO 0.00 0.67 0.53 0.86 -1.72 0.00 0.00 179.24 179.58 3ghg s TRP 41 N -5.55 2.23 0.00 4.55 -0.00 -0.62 -0.64 118.94 118.91 3ghg s TRP 41 Ca -0.10 1.47 0.00 0.00 -0.00 0.00 0.00 56.10 57.46 3ghg s TRP 41 Cb 0.17 -3.66 0.00 0.00 -0.00 0.00 0.00 33.47 29.98 3ghg s TRP 41 CO 0.79 -2.70 0.00 0.09 -0.00 0.00 0.00 176.95 175.13 3ghg n ASN 42 N -1.56 0.00 -0.11 5.86 3.02 -1.26 -4.56 115.26 116.65 3ghg n ASN 42 Ca 0.14 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.56 3ghg n ASN 42 Cb 0.48 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.61 3ghg n ASN 42 CO 0.00 0.00 0.00 1.88 -2.62 0.00 0.00 177.26 176.52 3ghg h TYR 43 N 0.00 0.95 -3.30 3.10 0.99 -1.76 -3.41 116.97 113.53 3ghg h TYR 43 Ca 0.00 -0.28 -0.64 0.00 2.00 0.00 0.00 58.73 59.81 3ghg h TYR 43 Cb 0.00 -0.20 -0.18 0.00 1.00 0.00 0.00 36.73 37.35 3ghg h TYR 43 CO 0.00 1.06 -0.62 0.15 -0.00 0.00 0.00 178.16 178.74 3ghg s LYS 44 N -4.39 3.57 0.13 4.88 3.01 0.19 -5.12 119.74 121.99 3ghg s LYS 44 Ca -0.12 -0.44 -0.02 0.00 -1.01 0.00 0.00 55.97 54.38 3ghg s LYS 44 Cb 0.10 -2.96 -0.04 0.00 -1.01 0.00 0.00 37.83 33.92 3ghg s LYS 44 CO 0.85 0.38 0.08 0.00 0.51 0.00 0.00 175.35 177.17 3ghg s PRO 46 N -4.03 3.73 0.45 0.00 0.04 -1.26 -5.08 135.00 128.85 3ghg s PRO 46 Ca 0.22 0.24 -0.20 0.00 0.04 0.00 0.00 61.00 61.30 3ghg s PRO 46 Cb 0.07 -2.55 -0.10 0.00 0.04 0.00 0.00 34.50 31.96 3ghg s PRO 46 CO 0.01 0.14 0.97 -1.54 0.04 0.00 0.00 177.00 176.61 3ghg s SER 47 N -2.98 6.81 0.45 6.66 1.04 -1.26 -4.91 113.70 119.51 3ghg s SER 47 Ca 0.47 1.69 0.19 0.00 0.48 0.00 0.00 55.95 58.78 3ghg s SER 47 Cb -0.11 -2.54 1.06 0.00 0.10 0.00 0.00 66.02 64.54 3ghg s SER 47 CO 0.28 -0.45 1.96 1.23 0.98 0.00 0.00 173.24 177.24 3ghg h GLY 48 N 1.66 0.00 0.92 7.32 0.00 -1.98 -1.00 103.07 109.98 3ghg h GLY 48 Ca -0.49 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.83 3ghg h GLY 48 CO 0.61 0.00 0.12 0.00 0.00 0.00 0.00 176.54 177.27 3ghg h ARG 50 N 0.33 0.71 0.43 0.00 2.43 -1.93 -2.68 114.38 113.67 3ghg h ARG 50 Ca 0.10 -0.51 -0.02 0.00 -0.81 0.00 0.00 59.98 58.73 3ghg h ARG 50 Cb 0.18 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3ghg h ARG 50 CO -0.01 1.13 -0.21 0.52 -1.51 0.00 0.00 179.97 179.90 3ghg h MET 51 N 0.52 -0.55 -0.80 0.20 2.86 -1.02 -3.01 114.93 113.12 3ghg h MET 51 Ca -0.02 0.04 0.16 0.00 -2.06 0.00 0.00 59.70 57.82 3ghg h MET 51 Cb 1.26 0.13 -0.15 0.00 0.06 0.00 0.00 31.60 32.89 3ghg h MET 51 CO 0.13 -0.26 -0.19 -0.22 1.06 0.00 0.00 176.91 177.43 3ghg h LYS 52 N -1.01 0.00 -0.00 1.72 1.63 0.64 0.41 116.57 119.96 3ghg h LYS 52 Ca -0.06 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 3ghg h LYS 52 Cb 0.55 -0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.18 3ghg h LYS 52 CO 0.10 0.00 0.04 0.78 -3.45 0.00 0.00 179.45 176.92 3ghg h GLY 53 N 0.00 0.00 0.64 5.01 0.00 -1.50 -0.85 103.07 106.37 3ghg h GLY 53 Ca 0.39 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.48 3ghg h GLY 53 CO -0.82 0.00 -1.80 1.04 0.00 0.00 0.00 176.54 174.95 3ghg n LEU 54 N -3.13 0.57 -0.08 3.11 4.77 0.13 -3.32 117.00 119.04 3ghg n LEU 54 Ca -0.03 0.26 -0.11 0.00 -0.03 0.00 0.00 56.01 56.10 3ghg n LEU 54 Cb 0.11 0.21 0.03 0.00 -2.33 0.00 0.00 43.42 41.44 3ghg n LEU 54 CO 0.20 0.30 0.57 0.40 -1.33 0.00 0.00 177.39 177.52 3ghg h ILE 55 N 0.00 1.28 0.02 -0.08 2.04 0.26 -1.84 117.51 119.19 3ghg h ILE 55 Ca -0.29 -1.56 -0.21 0.00 1.00 0.00 0.00 64.86 63.80 3ghg h ILE 55 Cb 1.83 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 39.33 3ghg h ILE 55 CO 0.05 0.51 -1.00 0.44 0.00 0.00 0.00 178.15 178.15 3ghg h ASP 56 N 0.66 0.10 -0.64 1.72 5.19 -1.44 -1.88 116.42 120.13 3ghg h ASP 56 Ca 0.05 -0.10 0.01 0.00 -0.62 0.00 0.00 57.03 56.37 3ghg h ASP 56 Cb 0.95 -0.03 -0.03 0.00 0.18 0.00 0.00 39.33 40.40 3ghg h ASP 56 CO 0.09 1.03 0.43 -0.08 -3.12 0.00 0.00 179.24 177.59 3ghg h GLU 57 N 0.02 0.85 0.18 3.56 4.81 -1.54 0.77 114.58 123.22 3ghg h GLU 57 Ca -0.03 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3ghg h GLU 57 Cb 1.73 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.90 3ghg h GLU 57 CO 0.14 0.56 -0.22 0.28 -0.73 0.00 0.00 179.01 179.03 3ghg h VAL 58 N 0.87 0.00 -0.05 0.32 2.07 -1.19 -2.57 116.25 115.71 3ghg h VAL 58 Ca 0.24 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.77 3ghg h VAL 58 Cb -0.10 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.67 3ghg h VAL 58 CO -0.05 0.00 0.04 0.78 0.02 0.00 0.00 177.57 178.36 3ghg h ASN 59 N -0.41 0.00 -0.25 0.57 2.35 -1.11 0.24 115.58 116.97 3ghg h ASN 59 Ca -0.02 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 3ghg h ASN 59 Cb 0.37 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 3ghg h ASN 59 CO -0.05 0.00 0.01 -0.61 -1.65 0.00 0.00 177.43 175.13 3ghg h GLN 60 N 0.00 0.43 -0.55 0.81 -0.00 -0.87 -2.16 115.11 112.77 3ghg h GLN 60 Ca 0.02 -0.13 0.05 0.00 -0.00 0.00 0.00 58.65 58.59 3ghg h GLN 60 Cb 0.10 -0.04 -0.05 0.00 0.00 0.00 0.00 27.48 27.49 3ghg h GLN 60 CO -0.00 0.59 0.28 -0.44 0.00 0.00 0.00 178.83 179.26 3ghg h ASP 61 N 0.21 0.40 1.12 -0.69 5.19 -0.12 -2.12 116.42 120.41 3ghg h ASP 61 Ca 0.07 0.03 -0.15 0.00 -0.62 0.00 0.00 57.03 56.36 3ghg h ASP 61 Cb 0.39 -0.04 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 3ghg h ASP 61 CO 0.01 0.27 -0.72 -0.26 -3.12 0.00 0.00 179.24 175.42 3ghg h PHE 62 N 0.54 0.00 0.07 4.55 0.04 -1.44 -1.72 116.94 118.97 3ghg h PHE 62 Ca 0.25 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.75 3ghg h PHE 62 Cb 0.16 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.32 3ghg h PHE 62 CO -0.10 0.72 -1.12 1.79 -0.60 0.00 0.00 178.31 179.00 3ghg h THR 63 N 0.00 1.39 0.05 -1.55 1.35 -1.19 -0.24 112.91 112.72 3ghg h THR 63 Ca -0.01 -2.61 -0.23 0.00 -0.55 0.00 0.00 66.41 63.01 3ghg h THR 63 Cb 1.47 2.64 -0.01 0.00 -1.73 0.00 0.00 68.15 70.52 3ghg h THR 63 CO 0.09 0.78 -1.04 -0.55 -0.25 0.00 0.00 175.52 174.56 3ghg h ASN 64 N 0.20 0.27 0.03 5.36 7.08 -1.46 -2.00 115.58 125.06 3ghg h ASN 64 Ca -0.13 -0.26 -0.14 0.00 -3.08 0.00 0.00 56.30 52.70 3ghg h ASN 64 Cb 1.79 -0.09 -0.01 0.00 -2.08 0.00 0.00 38.32 37.93 3ghg h ASN 64 CO 0.20 1.14 -0.45 -0.09 -2.08 0.00 0.00 177.43 176.15 3ghg h ARG 65 N 0.08 0.51 -0.24 4.14 2.43 -1.36 0.11 114.38 120.05 3ghg h ARG 65 Ca -0.07 -0.27 -0.15 0.00 -0.81 0.00 0.00 59.98 58.68 3ghg h ARG 65 Cb 1.73 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 31.29 3ghg h ARG 65 CO 0.16 0.85 -0.48 0.97 -1.51 0.00 0.00 179.97 179.96 3ghg h ILE 66 N 0.41 1.30 -0.78 1.20 6.09 -1.09 -1.13 117.51 123.51 3ghg h ILE 66 Ca 0.03 -1.69 -0.01 0.00 -1.37 0.00 0.00 64.86 61.83 3ghg h ILE 66 Cb 0.95 1.64 -0.04 0.00 0.47 0.00 0.00 36.82 39.84 3ghg h ILE 66 CO 0.08 0.53 0.47 0.78 -3.07 0.00 0.00 178.15 176.94 3ghg h ASN 67 N 0.50 0.94 -0.13 2.19 2.35 -0.97 0.41 115.58 120.88 3ghg h ASN 67 Ca 0.03 -0.07 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 3ghg h ASN 67 Cb 1.02 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 39.14 3ghg h ASN 67 CO 0.10 0.73 -0.19 0.50 -1.65 0.00 0.00 177.43 176.92 3ghg h LYS 68 N 1.07 0.54 -0.04 0.81 3.64 -0.74 -2.09 116.57 119.77 3ghg h LYS 68 Ca 0.28 -0.19 -0.09 0.00 -1.27 0.00 0.00 60.65 59.38 3ghg h LYS 68 Cb -0.03 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 31.75 3ghg h LYS 68 CO -0.05 0.71 -0.33 1.25 -2.27 0.00 0.00 179.45 178.75 3ghg h LEU 69 N 0.49 0.36 -0.17 5.20 7.12 -0.66 -3.14 115.31 124.50 3ghg h LEU 69 Ca 0.08 -0.70 -0.04 0.00 0.13 0.00 0.00 57.88 57.35 3ghg h LEU 69 Cb 0.61 -0.11 -0.00 0.00 -0.53 0.00 0.00 40.66 40.63 3ghg h LEU 69 CO 0.04 1.00 -0.06 0.11 -0.13 0.00 0.00 178.44 179.40 3ghg h LYS 70 N -0.26 0.34 -0.98 1.25 1.57 -1.02 -1.85 116.57 115.63 3ghg h LYS 70 Ca -0.03 -0.14 0.17 0.00 -1.87 0.00 0.00 60.65 58.78 3ghg h LYS 70 Cb 1.02 -0.01 -0.17 0.00 0.08 0.00 0.00 32.23 33.14 3ghg h LYS 70 CO 0.07 0.63 -0.32 -0.97 -0.57 0.00 0.00 179.45 178.29 3ghg h ASN 71 N 0.04 -1.18 0.25 0.86 -0.00 -1.46 -1.60 115.58 112.49 3ghg h ASN 71 Ca 0.04 0.30 -0.33 0.00 -0.00 0.00 0.00 56.30 56.32 3ghg h ASN 71 Cb 0.52 0.68 0.04 0.00 -0.00 0.00 0.00 38.32 39.55 3ghg h ASN 71 CO 0.02 -0.31 -1.43 0.28 -0.00 0.00 0.00 177.43 176.00 3ghg h SER 72 N -0.01 0.83 -0.98 1.15 0.02 -1.59 -3.37 113.55 109.60 3ghg h SER 72 Ca 0.40 -0.92 0.26 0.00 -0.84 0.00 0.00 61.79 60.69 3ghg h SER 72 Cb 0.65 -0.27 -0.13 0.00 0.14 0.00 0.00 62.40 62.79 3ghg h SER 72 CO -0.99 1.69 0.54 0.25 -1.14 0.00 0.00 176.83 177.18 3ghg h LEU 73 N 0.11 0.56 -0.29 5.07 7.12 -0.41 -0.50 115.31 126.97 3ghg h LEU 73 Ca -0.25 0.15 -0.17 0.00 0.13 0.00 0.00 57.88 57.75 3ghg h LEU 73 Cb 2.13 0.08 -0.00 0.00 -0.53 0.00 0.00 40.66 42.34 3ghg h LEU 73 CO 0.27 0.03 -0.47 -0.26 -0.13 0.00 0.00 178.44 177.88 3ghg h PHE 74 N 0.48 1.04 -0.41 1.25 0.04 -1.66 -3.20 116.94 114.49 3ghg h PHE 74 Ca 0.65 -0.35 0.11 0.00 2.80 0.00 0.00 57.97 61.17 3ghg h PHE 74 Cb 1.29 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 39.22 3ghg h PHE 74 CO -0.04 1.17 0.29 0.93 -0.60 0.00 0.00 178.31 180.06 3ghg h GLU 75 N 0.61 0.03 -0.01 1.51 4.39 -1.25 -1.00 114.58 118.87 3ghg h GLU 75 Ca 0.03 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 3ghg h GLU 75 Cb 1.07 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 3ghg h GLU 75 CO 0.11 0.02 -0.42 0.66 -1.16 0.00 0.00 179.01 178.22 3ghg n TYR 76 N -4.43 0.00 0.06 4.33 4.01 -1.17 -1.35 117.16 118.62 3ghg n TYR 76 Ca 0.07 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.59 3ghg n TYR 76 Cb 0.46 -0.05 -0.15 0.00 -0.31 0.00 0.00 39.34 39.30 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 1.89 0.35 -0.03 -0.72 4.20 -1.20 -2.11 115.11 117.49 3ghg h GLN 77 Ca 0.00 -0.60 -0.13 0.00 0.06 0.00 0.00 58.65 57.98 3ghg h GLN 77 Cb 0.66 0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.65 3ghg h GLN 77 CO 0.00 1.29 -0.60 1.57 -0.67 0.00 0.00 178.83 180.42 3ghg h LYS 78 N -0.16 0.11 -0.21 1.46 2.10 -1.53 -2.88 116.57 115.46 3ghg h LYS 78 Ca -0.26 -0.08 -0.17 0.00 -2.00 0.00 0.00 60.65 58.14 3ghg h LYS 78 Cb 1.88 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 33.21 3ghg h LYS 78 CO 0.15 0.68 -0.57 -0.97 -2.00 0.00 0.00 179.45 176.74 3ghg h ASN 79 N 0.08 0.75 -0.51 7.07 -1.24 -1.30 -2.44 115.58 117.99 3ghg h ASN 79 Ca -0.01 -0.41 -0.04 0.00 0.71 0.00 0.00 56.30 56.55 3ghg h ASN 79 Cb 1.08 -0.22 -0.03 0.00 0.73 0.00 0.00 38.32 39.89 3ghg h ASN 79 CO 0.08 1.16 0.17 -1.13 -1.29 0.00 0.00 177.43 176.42 3ghg h ASN 80 N 0.51 0.77 0.04 1.15 -1.24 -1.41 -2.71 115.58 112.68 3ghg h ASN 80 Ca 0.01 -0.12 -0.10 0.00 0.71 0.00 0.00 56.30 56.80 3ghg h ASN 80 Cb 1.14 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.98 3ghg h ASN 80 CO 0.11 0.73 -0.30 0.50 -1.29 0.00 0.00 177.43 177.19 3ghg h LYS 81 N 0.81 0.40 -0.26 6.67 1.63 -1.40 -2.62 116.57 121.80 3ghg h LYS 81 Ca 0.18 -0.16 -0.06 0.00 -0.85 0.00 0.00 60.65 59.76 3ghg h LYS 81 Cb 0.25 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.85 3ghg h LYS 81 CO -0.01 0.66 -0.08 -0.44 -3.45 0.00 0.00 179.45 176.12 3ghg h ASP 82 N 0.35 0.53 0.00 4.20 3.32 -1.19 -2.74 116.42 120.89 3ghg h ASP 82 Ca 0.05 -0.38 -0.08 0.00 0.02 0.00 0.00 57.03 56.64 3ghg h ASP 82 Cb 0.70 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 3ghg h ASP 82 CO 0.05 0.79 -0.21 0.77 -1.72 0.00 0.00 179.24 178.92 3ghg h SER 83 N 0.27 0.36 -0.20 6.45 4.64 -1.48 -2.56 113.55 121.02 3ghg h SER 83 Ca 0.06 -0.10 -0.05 0.00 -0.47 0.00 0.00 61.79 61.23 3ghg h SER 83 Cb 0.57 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 3ghg h SER 83 CO 0.03 0.58 -0.06 -0.74 -0.87 0.00 0.00 176.83 175.77 3ghg h HIS 84 N 0.33 0.45 -0.15 4.77 -0.00 -1.44 -1.58 115.15 117.52 3ghg h HIS 84 Ca 0.06 -0.10 -0.08 0.00 -0.00 0.00 0.00 60.37 60.24 3ghg h HIS 84 Cb 0.56 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.85 3ghg h HIS 84 CO 0.01 0.65 -0.28 0.66 -0.00 0.00 0.00 177.93 178.98 3ghg h SER 85 N 0.11 0.29 -0.20 3.26 4.64 -1.44 0.34 113.55 120.56 3ghg h SER 85 Ca 0.05 -0.09 -0.04 0.00 -0.47 0.00 0.00 61.79 61.23 3ghg h SER 85 Cb 0.52 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 3ghg h SER 85 CO 0.02 0.57 -0.05 -0.07 -0.87 0.00 0.00 176.83 176.43 3ghg h LEU 86 N 0.26 0.38 -0.54 5.97 -0.00 -1.47 -0.13 115.31 119.77 3ghg h LEU 86 Ca 0.04 -0.37 0.00 0.00 -0.00 0.00 0.00 57.88 57.55 3ghg h LEU 86 Cb 0.64 -0.10 -0.03 0.00 -0.00 0.00 0.00 40.66 41.17 3ghg h LEU 86 CO 0.05 0.66 0.35 0.74 -0.00 0.00 0.00 178.44 180.23 3ghg h THR 87 N 0.10 1.15 -0.28 0.22 2.02 -0.99 0.02 112.91 115.14 3ghg h THR 87 Ca 0.05 -0.31 -0.00 0.00 0.77 0.00 0.00 66.41 66.92 3ghg h THR 87 Cb 0.49 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 3ghg h THR 87 CO 0.02 0.15 0.17 0.74 0.37 0.00 0.00 175.52 176.97 3ghg h THR 88 N 0.73 1.11 0.00 3.16 2.02 -0.33 -2.21 112.91 117.39 3ghg h THR 88 Ca 0.20 -0.26 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 3ghg h THR 88 Cb -0.05 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.12 3ghg h THR 88 CO -0.04 0.10 -0.00 -1.13 0.37 0.00 0.00 175.52 174.82 3ghg h ASN 89 N 0.36 -0.00 0.41 4.18 -1.24 -0.65 -2.67 115.58 115.97 3ghg h ASN 89 Ca 0.10 -0.07 -0.06 0.00 0.71 0.00 0.00 56.30 56.98 3ghg h ASN 89 Cb 0.02 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 3ghg h ASN 89 CO -0.02 0.07 -0.30 0.16 -1.29 0.00 0.00 177.43 176.06 3ghg h ILE 90 N -0.07 1.05 -0.52 2.57 3.07 -1.02 -0.90 117.51 121.69 3ghg h ILE 90 Ca -0.00 -1.07 0.01 0.00 1.55 0.00 0.00 64.86 65.35 3ghg h ILE 90 Cb 0.07 1.60 -0.03 0.00 -0.27 0.00 0.00 36.82 38.20 3ghg h ILE 90 CO 0.00 0.29 0.35 0.24 -1.05 0.00 0.00 178.15 177.98 3ghg h MET 91 N 0.00 0.67 -0.07 0.16 2.86 -1.11 -1.43 114.93 116.01 3ghg h MET 91 Ca -0.00 -0.04 -0.25 0.00 -2.06 0.00 0.00 59.70 57.35 3ghg h MET 91 Cb 0.58 -0.15 0.02 0.00 0.06 0.00 0.00 31.60 32.11 3ghg h MET 91 CO 0.04 0.44 -0.93 0.93 1.06 0.00 0.00 176.91 178.45 3ghg h GLU 92 N 0.69 0.75 -0.19 1.72 4.39 -0.87 -2.48 114.58 118.59 3ghg h GLU 92 Ca 0.20 -0.71 -0.02 0.00 0.34 0.00 0.00 59.36 59.16 3ghg h GLU 92 Cb -0.04 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 3ghg h GLU 92 CO -0.05 1.30 0.05 0.82 -1.16 0.00 0.00 179.01 179.97 3ghg h ILE 93 N 0.47 1.21 0.05 3.13 1.08 -1.03 -2.97 117.51 119.44 3ghg h ILE 93 Ca -0.10 -0.66 -0.29 0.00 -0.39 0.00 0.00 64.86 63.42 3ghg h ILE 93 Cb 1.57 1.28 -0.03 0.00 -3.07 0.00 0.00 36.82 36.57 3ghg h ILE 93 CO 0.19 0.21 -1.54 -0.07 -0.69 0.00 0.00 178.15 176.24 3ghg h LEU 94 N 0.12 0.15 -2.10 1.44 4.07 -1.40 -3.11 115.31 114.49 3ghg h LEU 94 Ca 0.06 -0.25 0.00 0.00 0.08 0.00 0.00 57.88 57.77 3ghg h LEU 94 Cb 0.27 -0.05 -0.00 0.00 1.08 0.00 0.00 40.66 41.96 3ghg h LEU 94 CO 0.00 1.21 0.01 -0.09 -1.08 0.00 0.00 178.44 178.49 3ghg h ARG 95 N 0.03 0.00 -0.12 1.13 2.43 -1.53 0.25 114.38 116.56 3ghg h ARG 95 Ca -0.23 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 58.82 3ghg h ARG 95 Cb 1.97 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.51 3ghg h ARG 95 CO 0.11 0.00 -0.47 0.78 -1.51 0.00 0.00 179.97 178.89 3ghg h GLY 96 N 0.00 0.33 2.00 2.80 0.00 -1.56 -3.21 103.07 103.44 3ghg h GLY 96 Ca 0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 3ghg h GLY 96 CO -0.00 0.31 -0.09 -0.55 0.00 0.00 0.00 176.54 176.21 3ghg h ASP 97 N 0.25 0.00 0.08 0.19 5.19 -0.45 -2.67 116.42 119.01 3ghg h ASP 97 Ca 0.01 0.00 -0.37 0.00 -0.62 0.00 0.00 57.03 56.05 3ghg h ASP 97 Cb 0.92 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 40.39 3ghg h ASP 97 CO 0.08 0.09 -2.18 0.49 -3.12 0.00 0.00 179.24 174.59 3ghg n PHE 98 N -3.21 0.77 -0.00 4.55 3.72 -0.92 -0.49 117.46 121.88 3ghg n PHE 98 Ca 0.01 0.16 -0.01 0.00 -0.05 0.00 0.00 57.45 57.56 3ghg n PHE 98 Cb 0.37 -1.10 0.27 0.00 -0.94 0.00 0.00 39.48 38.08 3ghg n PHE 98 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3ghg h SER 99 N 0.04 0.50 0.00 4.37 0.02 -1.65 -0.81 113.55 116.03 3ghg h SER 99 Ca -0.48 -0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 60.28 3ghg h SER 99 Cb 1.98 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 64.38 3ghg h SER 99 CO 0.02 0.61 -0.48 0.28 -1.14 0.00 0.00 176.83 176.12 3ghg h SER 100 N 0.50 0.00 -0.82 3.07 0.02 -1.62 -3.27 113.55 111.43 3ghg h SER 100 Ca 0.10 -0.57 0.06 0.00 -0.84 0.00 0.00 61.79 60.55 3ghg h SER 100 Cb 0.40 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.88 3ghg h SER 100 CO 0.02 1.06 0.50 0.00 -1.14 0.00 0.00 176.83 177.27 3ghg h ALA 101 N -0.43 1.13 -0.49 3.77 0.00 -0.85 -2.06 119.26 120.32 3ghg h ALA 101 Ca -0.12 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.67 3ghg h ALA 101 Cb 0.89 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3ghg h ALA 101 CO -0.07 0.23 -0.18 -0.97 0.00 0.00 0.00 179.25 178.25 3ghg h ASN 102 N 0.91 1.00 0.52 0.00 -1.24 -1.33 -0.39 115.58 115.05 3ghg h ASN 102 Ca 0.36 -0.36 -0.09 0.00 0.71 0.00 0.00 56.30 56.92 3ghg h ASN 102 Cb 0.18 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.95 3ghg h ASN 102 CO -0.18 1.15 -0.44 0.78 -1.29 0.00 0.00 177.43 177.45 3ghg h ASN 103 N 0.85 0.00 0.21 1.15 4.21 -1.55 0.32 115.58 120.78 3ghg h ASN 103 Ca 0.12 0.00 -0.27 0.00 1.21 0.00 0.00 56.30 57.36 3ghg h ASN 103 Cb 0.75 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.97 3ghg h ASN 103 CO 0.06 0.44 -1.11 0.03 -1.29 0.00 0.00 177.43 175.56 3ghg h ARG 104 N 0.00 0.55 0.00 0.81 3.08 -1.25 -2.25 114.38 115.32 3ghg h ARG 104 Ca -0.00 -0.67 0.00 0.00 0.07 0.00 0.00 59.98 59.38 3ghg h ARG 104 Cb 0.82 0.21 0.00 0.00 0.08 0.00 0.00 29.97 31.08 3ghg h ARG 104 CO 0.06 1.27 0.00 -0.44 -1.07 0.00 0.00 179.97 179.79 3ghg h ASP 105 N 0.27 0.00 0.38 7.04 3.32 -0.98 -3.03 116.42 123.42 3ghg h ASP 105 Ca -0.14 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.62 3ghg h ASP 105 Cb 1.77 0.00 0.02 0.00 0.22 0.00 0.00 39.33 41.34 3ghg h ASP 105 CO 0.21 0.00 -1.28 -1.13 -1.72 0.00 0.00 179.24 175.31 3ghg h ASN 106 N 0.00 0.67 0.51 6.45 -0.00 -0.25 -3.26 115.58 119.71 3ghg h ASN 106 Ca 0.00 -0.67 -0.18 0.00 -0.00 0.00 0.00 56.30 55.45 3ghg h ASN 106 Cb 0.59 -0.21 -0.01 0.00 -0.00 0.00 0.00 38.32 38.69 3ghg h ASN 106 CO 0.00 1.50 -0.77 0.71 -0.00 0.00 0.00 177.43 178.87 3ghg h THR 107 N 0.16 1.46 -0.18 -3.57 1.35 -1.40 -3.23 112.91 107.49 3ghg h THR 107 Ca -0.18 -2.39 -0.05 0.00 -0.55 0.00 0.00 66.41 63.24 3ghg h THR 107 Cb 1.98 2.30 -0.00 0.00 -1.73 0.00 0.00 68.15 70.69 3ghg h THR 107 CO 0.23 0.70 -0.10 0.22 -0.25 0.00 0.00 175.52 176.32 3ghg h TYR 108 N 0.13 0.45 -0.20 4.73 5.03 -1.68 -2.78 116.97 122.64 3ghg h TYR 108 Ca -0.03 -0.11 -0.03 0.00 2.58 0.00 0.00 58.73 61.14 3ghg h TYR 108 Cb 1.36 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 39.52 3ghg h TYR 108 CO 0.02 0.70 0.01 -2.95 -1.32 0.00 0.00 178.16 174.62 3ghg h ASN 109 N 0.07 0.26 -0.30 -2.11 7.08 -1.65 0.18 115.58 119.11 3ghg h ASN 109 Ca 0.04 -0.03 -0.06 0.00 -3.08 0.00 0.00 56.30 53.17 3ghg h ASN 109 Cb 0.59 -0.07 -0.01 0.00 -2.08 0.00 0.00 38.32 36.75 3ghg h ASN 109 CO 0.03 0.31 -0.03 0.03 -2.08 0.00 0.00 177.43 175.69 3ghg h ARG 110 N 0.29 0.55 0.67 4.14 2.47 -1.57 -0.30 114.38 120.63 3ghg h ARG 110 Ca 0.07 -0.19 -0.03 0.00 -1.26 0.00 0.00 59.98 58.57 3ghg h ARG 110 Cb 0.18 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 28.47 3ghg h ARG 110 CO 0.00 0.71 -0.32 0.28 0.56 0.00 0.00 179.97 181.20 3ghg h VAL 111 N 0.33 0.20 0.00 2.04 2.07 -1.12 -0.92 116.25 118.85 3ghg h VAL 111 Ca 0.08 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.29 3ghg h VAL 111 Cb 0.48 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 3ghg h VAL 111 CO 0.02 0.02 -0.27 -1.28 0.02 0.00 0.00 177.57 176.08 3ghg h SER 112 N -1.11 0.00 0.37 0.57 0.87 -0.75 1.76 113.55 115.26 3ghg h SER 112 Ca -0.09 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.45 3ghg h SER 112 Cb 0.73 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 3ghg h SER 112 CO 0.15 0.27 -0.18 -0.08 -0.53 0.00 0.00 176.83 176.46 3ghg h GLU 113 N 0.00 -0.48 -0.60 2.24 4.22 -1.12 -1.40 114.58 117.44 3ghg h GLU 113 Ca -0.00 0.03 0.01 0.00 0.08 0.00 0.00 59.36 59.48 3ghg h GLU 113 Cb 0.67 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 3ghg h GLU 113 CO 0.04 -0.25 0.40 0.22 -2.18 0.00 0.00 179.01 177.24 3ghg h ASP 114 N -1.08 0.67 0.28 1.04 -0.00 -0.94 -0.48 116.42 115.92 3ghg h ASP 114 Ca -0.05 -0.02 -0.01 0.00 -0.00 0.00 0.00 57.03 56.95 3ghg h ASP 114 Cb 0.45 -0.17 0.00 0.00 -0.00 0.00 0.00 39.33 39.62 3ghg h ASP 114 CO 0.08 0.48 -0.14 0.25 -0.00 0.00 0.00 179.24 179.92 3ghg h LEU 115 N 0.79 -0.32 -1.76 2.28 6.46 0.26 -2.01 115.31 121.00 3ghg h LEU 115 Ca 0.23 -0.08 0.10 0.00 -0.12 0.00 0.00 57.88 58.01 3ghg h LEU 115 Cb -0.05 0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 39.93 3ghg h LEU 115 CO -0.05 -0.12 0.35 -0.09 -0.62 0.00 0.00 178.44 177.90 3ghg h ARG 116 N -0.51 0.26 -0.51 1.25 2.43 -0.60 -0.89 114.38 115.81 3ghg h ARG 116 Ca -0.04 -0.02 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 3ghg h ARG 116 Cb 0.38 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 3ghg h ARG 116 CO 0.06 0.17 -0.09 0.66 -1.51 0.00 0.00 179.97 179.27 3ghg h SER 117 N 0.27 0.96 0.61 -3.80 4.64 -0.89 -2.43 113.55 112.92 3ghg h SER 117 Ca 0.24 -0.35 -0.08 0.00 -0.47 0.00 0.00 61.79 61.12 3ghg h SER 117 Cb 0.57 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.39 3ghg h SER 117 CO -0.05 1.08 -0.39 0.03 -0.87 0.00 0.00 176.83 176.63 3ghg h ARG 118 N 0.82 0.00 0.51 4.77 3.08 -0.45 -2.77 114.38 120.34 3ghg h ARG 118 Ca 0.13 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 3ghg h ARG 118 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 3ghg h ARG 118 CO 0.04 0.39 -0.24 0.82 -1.07 0.00 0.00 179.97 179.92 3ghg h ILE 119 N 0.00 0.00 -0.86 2.04 1.08 -1.25 -2.76 117.51 115.77 3ghg h ILE 119 Ca -0.00 -0.48 0.19 0.00 -0.39 0.00 0.00 64.86 64.18 3ghg h ILE 119 Cb 0.81 0.00 -0.16 0.00 -3.07 0.00 0.00 36.82 34.40 3ghg h ILE 119 CO 0.05 0.00 -0.12 -0.08 -0.69 0.00 0.00 178.15 177.31 3ghg h GLU 120 N -1.16 0.03 -0.11 2.37 4.22 -1.45 0.31 114.58 118.78 3ghg h GLU 120 Ca -0.07 -0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.33 3ghg h GLU 120 Cb 0.52 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 3ghg h GLU 120 CO 0.11 0.02 -0.12 0.28 -2.18 0.00 0.00 179.01 177.12 3ghg h VAL 121 N 0.03 1.15 -0.10 0.32 2.07 -1.57 -1.32 116.25 116.83 3ghg h VAL 121 Ca 0.45 -0.68 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 3ghg h VAL 121 Cb 0.76 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 3ghg h VAL 121 CO -0.84 0.21 -0.40 0.25 0.02 0.00 0.00 177.57 176.81 3ghg h LEU 122 N 0.17 0.23 -0.42 2.57 7.12 -0.12 -3.28 115.31 121.58 3ghg h LEU 122 Ca 0.04 -0.09 -0.07 0.00 0.13 0.00 0.00 57.88 57.89 3ghg h LEU 122 Cb 0.33 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 40.38 3ghg h LEU 122 CO 0.02 0.61 -0.32 0.11 -0.13 0.00 0.00 178.44 178.73 3ghg h LYS 123 N 0.19 0.00 0.00 1.25 6.56 -0.30 -1.94 116.57 122.33 3ghg h LYS 123 Ca 0.02 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.57 3ghg h LYS 123 Cb 0.79 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.45 3ghg h LYS 123 CO 0.06 0.32 -0.19 0.00 -2.06 0.00 0.00 179.45 177.58 3ghg h ARG 124 N 0.00 0.00 0.05 3.15 3.08 -1.59 -0.29 114.38 118.78 3ghg h ARG 124 Ca -0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3ghg h ARG 124 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 3ghg h ARG 124 CO 0.04 0.19 -0.02 0.87 -1.07 0.00 0.00 179.97 179.98 3ghg h LYS 125 N 0.00 -0.06 0.00 0.04 1.57 -1.52 -3.12 116.57 113.48 3ghg h LYS 125 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3ghg h LYS 125 Cb 0.34 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 3ghg h LYS 125 CO 0.02 0.55 -0.07 -0.24 -0.57 0.00 0.00 179.45 179.14 3ghg h VAL 126 N -0.92 0.99 -0.05 0.50 3.04 -1.30 -2.04 116.25 116.46 3ghg h VAL 126 Ca -0.01 -0.23 -0.19 0.00 -1.01 0.00 0.00 66.70 65.26 3ghg h VAL 126 Cb 0.63 1.13 -0.01 0.00 -2.01 0.00 0.00 31.29 31.03 3ghg h VAL 126 CO 0.01 0.07 -0.77 -0.29 -1.01 0.00 0.00 177.57 175.57 3ghg h ILE 127 N 0.00 1.40 -0.40 3.17 6.09 -1.17 -2.74 117.51 123.86 3ghg h ILE 127 Ca -0.00 -2.25 -0.03 0.00 -1.37 0.00 0.00 64.86 61.21 3ghg h ILE 127 Cb 0.12 2.21 -0.02 0.00 0.47 0.00 0.00 36.82 39.60 3ghg h ILE 127 CO 0.01 0.67 0.12 -0.08 -3.07 0.00 0.00 178.15 175.80 3ghg h GLU 128 N 0.23 0.58 0.00 2.19 4.81 -1.31 -2.49 114.58 118.60 3ghg h GLU 128 Ca -0.04 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 3ghg h GLU 128 Cb 1.36 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.64 3ghg h GLU 128 CO 0.13 0.52 -0.00 0.87 -0.73 0.00 0.00 179.01 179.80 3ghg h LYS 129 N 0.57 -0.00 -0.43 1.92 1.79 -1.36 -2.16 116.57 116.90 3ghg h LYS 129 Ca 0.14 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.70 3ghg h LYS 129 Cb 0.18 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 3ghg h LYS 129 CO -0.01 0.73 0.29 -0.24 -1.08 0.00 0.00 179.45 179.15 3ghg h VAL 130 N -0.75 0.88 0.04 0.50 3.04 -1.51 0.06 116.25 118.50 3ghg h VAL 130 Ca -0.00 -0.06 -0.00 0.00 -1.01 0.00 0.00 66.70 65.63 3ghg h VAL 130 Cb 0.74 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 30.70 3ghg h VAL 130 CO 0.00 0.03 -0.02 -0.61 -1.01 0.00 0.00 177.57 175.96 3ghg h GLN 131 N 0.18 -0.05 -0.76 4.17 5.75 -1.37 -2.11 115.11 120.93 3ghg h GLN 131 Ca 0.20 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 58.79 3ghg h GLN 131 Cb 0.54 0.01 -0.07 0.00 1.07 0.00 0.00 27.48 29.04 3ghg h GLN 131 CO -0.03 0.09 0.42 0.45 -2.65 0.00 0.00 178.83 177.11 3ghg h HIS 132 N -0.18 0.76 -0.50 3.99 3.86 -0.36 0.19 115.15 122.90 3ghg h HIS 132 Ca -0.01 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.25 3ghg h HIS 132 Cb 0.17 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 3ghg h HIS 132 CO -0.03 0.31 0.31 0.82 0.86 0.00 0.00 177.93 180.20 3ghg h ILE 133 N 0.72 1.08 -0.47 2.45 5.03 -1.07 0.37 117.51 125.61 3ghg h ILE 133 Ca 0.36 -0.22 -0.06 0.00 -0.12 0.00 0.00 64.86 64.83 3ghg h ILE 133 Cb 0.33 0.40 -0.02 0.00 -3.03 0.00 0.00 36.82 34.50 3ghg h ILE 133 CO -0.24 0.11 0.04 1.56 -0.68 0.00 0.00 178.15 178.95 3ghg h GLN 134 N 0.63 0.76 0.00 2.37 4.20 -0.64 2.01 115.11 124.44 3ghg h GLN 134 Ca 0.19 -0.18 -0.07 0.00 0.06 0.00 0.00 58.65 58.65 3ghg h GLN 134 Cb -0.02 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 3ghg h GLN 134 CO -0.07 0.74 -0.33 1.25 -0.67 0.00 0.00 178.83 179.74 3ghg h LEU 135 N 0.72 0.00 0.00 1.46 6.46 0.20 -2.36 115.31 121.78 3ghg h LEU 135 Ca 0.15 0.00 -0.14 0.00 -0.12 0.00 0.00 57.88 57.77 3ghg h LEU 135 Cb 0.38 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.29 3ghg h LEU 135 CO 0.01 0.33 -0.75 -0.07 -0.62 0.00 0.00 178.44 177.35 3ghg h LEU 136 N 0.00 0.00 -0.79 2.25 -0.00 0.50 -2.53 115.31 114.74 3ghg h LEU 136 Ca -0.00 -0.66 0.22 0.00 -0.00 0.00 0.00 57.88 57.44 3ghg h LEU 136 Cb 0.60 0.00 -0.15 0.00 -0.00 0.00 0.00 40.66 41.11 3ghg h LEU 136 CO 0.04 1.27 0.04 0.00 -0.00 0.00 0.00 178.44 179.79 3ghg n GLN 137 N -4.51 -0.06 0.13 1.13 6.02 0.68 0.15 117.38 120.91 3ghg n GLN 137 Ca -0.23 1.18 -0.05 0.00 -0.01 0.00 0.00 57.00 57.89 3ghg n GLN 137 Cb 0.58 -1.88 -0.03 0.00 1.02 0.00 0.00 30.24 29.93 3ghg n GLN 137 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 3ghg h LYS 138 N 0.00 -0.34 -1.48 -1.09 1.63 -1.57 -2.94 116.57 110.79 3ghg h LYS 138 Ca 0.49 0.02 0.47 0.00 -0.85 0.00 0.00 60.65 60.78 3ghg h LYS 138 Cb 1.03 0.08 -0.11 0.00 -0.60 0.00 0.00 32.23 32.62 3ghg h LYS 138 CO -0.74 -0.22 1.00 -0.91 -3.45 0.00 0.00 179.45 175.13 3ghg h ASN 139 N -0.47 0.16 0.79 4.20 2.35 0.16 0.48 115.58 123.25 3ghg h ASN 139 Ca -0.04 0.10 -0.18 0.00 -0.55 0.00 0.00 56.30 55.63 3ghg h ASN 139 Cb 0.27 0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.70 3ghg h ASN 139 CO 0.06 -0.14 -1.31 -0.37 -1.65 0.00 0.00 177.43 174.02 3ghg h VAL 140 N 0.05 0.64 0.00 2.81 -1.51 -0.64 -2.34 116.25 115.26 3ghg h VAL 140 Ca 0.84 -2.18 -0.05 0.00 -1.23 0.00 0.00 66.70 64.08 3ghg h VAL 140 Cb 2.89 2.17 -0.01 0.00 -2.13 0.00 0.00 31.29 34.21 3ghg h VAL 140 CO -0.30 0.37 -0.26 -0.09 -1.23 0.00 0.00 177.57 176.06 3ghg h ARG 141 N 0.00 0.00 0.36 5.19 2.43 0.10 0.52 114.38 122.98 3ghg h ARG 141 Ca -0.15 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.00 3ghg h ARG 141 Cb 1.62 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.18 3ghg h ARG 141 CO 0.06 0.26 -0.17 0.00 -1.51 0.00 0.00 179.97 178.60 3ghg h ALA 142 N 1.74 -0.48 0.59 2.80 0.00 -1.19 -2.98 119.26 119.74 3ghg h ALA 142 Ca -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 3ghg h ALA 142 Cb 0.65 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.63 3ghg h ALA 142 CO 0.03 -0.60 -0.29 0.37 0.00 0.00 0.00 179.25 178.76 3ghg h GLN 143 N -0.82 -0.77 -0.37 0.00 4.15 -1.26 -2.87 115.11 113.15 3ghg h GLN 143 Ca -0.05 0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.46 3ghg h GLN 143 Cb 0.53 0.18 -0.04 0.00 0.21 0.00 0.00 27.48 28.35 3ghg h GLN 143 CO 0.08 -0.51 -0.22 -0.11 -1.93 0.00 0.00 178.83 176.14 3ghg n LEU 144 N -4.18 -0.39 -0.34 -2.39 7.94 0.18 0.17 117.00 117.99 3ghg n LEU 144 Ca -0.10 1.06 0.15 0.00 -1.11 0.00 0.00 56.01 56.00 3ghg n LEU 144 Cb 0.32 -0.28 0.36 0.00 0.53 0.00 0.00 43.42 44.35 3ghg n LEU 144 CO 0.24 -0.74 1.20 1.62 -1.11 0.00 0.00 177.39 178.60 3ghg h VAL 145 N 0.00 0.68 -0.14 1.96 3.04 -1.62 -1.20 116.25 118.99 3ghg h VAL 145 Ca 0.06 -0.24 -0.06 0.00 -1.01 0.00 0.00 66.70 65.46 3ghg h VAL 145 Cb 0.15 -0.06 -0.01 0.00 -2.01 0.00 0.00 31.29 29.36 3ghg h VAL 145 CO -0.35 0.13 -0.17 -0.78 -1.01 0.00 0.00 177.57 175.39 3ghg h ASP 146 N 0.69 0.21 0.00 3.17 3.58 0.20 -0.44 116.42 123.83 3ghg h ASP 146 Ca 0.57 -0.05 -0.13 0.00 0.42 0.00 0.00 57.03 57.84 3ghg h ASP 146 Cb 0.99 -0.06 0.01 0.00 1.72 0.00 0.00 39.33 41.99 3ghg h ASP 146 CO -0.35 0.40 -0.51 0.24 -2.88 0.00 0.00 179.24 176.14 3ghg h MET 147 N 0.21 0.34 -0.72 0.28 2.86 -0.22 0.21 114.93 117.89 3ghg h MET 147 Ca 0.04 -0.37 0.13 0.00 -2.06 0.00 0.00 59.70 57.43 3ghg h MET 147 Cb 0.43 0.11 -0.13 0.00 0.06 0.00 0.00 31.60 32.06 3ghg h MET 147 CO 0.03 1.06 -0.32 -0.22 1.06 0.00 0.00 176.91 178.52 3ghg h LYS 148 N -0.22 -0.09 -0.49 1.72 3.64 -0.99 1.94 116.57 122.08 3ghg h LYS 148 Ca -0.06 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 3ghg h LYS 148 Cb 1.24 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 3ghg h LYS 148 CO 0.10 -0.06 0.20 0.00 -2.27 0.00 0.00 179.45 177.42 3ghg h ARG 149 N -0.09 0.73 0.00 1.90 3.08 -0.95 -0.89 114.38 118.15 3ghg h ARG 149 Ca 0.29 -0.13 -0.13 0.00 0.07 0.00 0.00 59.98 60.08 3ghg h ARG 149 Cb 0.57 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 3ghg h ARG 149 CO -0.77 0.64 -0.61 1.25 -1.07 0.00 0.00 179.97 179.41 3ghg h LEU 150 N 0.65 0.00 -0.37 3.04 5.85 0.50 -0.61 115.31 124.38 3ghg h LEU 150 Ca 0.16 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.82 3ghg h LEU 150 Cb 0.18 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 3ghg h LEU 150 CO -0.02 0.61 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.58 3ghg h GLU 151 N 0.00 0.67 -0.18 1.25 4.57 0.33 -2.21 114.58 119.01 3ghg h GLU 151 Ca -0.01 -0.23 -0.09 0.00 -1.18 0.00 0.00 59.36 57.85 3ghg h GLU 151 Cb 1.15 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.69 3ghg h GLU 151 CO 0.08 0.80 -0.24 0.28 -1.18 0.00 0.00 179.01 178.75 3ghg h VAL 152 N 0.48 1.34 -1.20 0.32 2.07 -1.14 -1.89 116.25 116.22 3ghg h VAL 152 Ca 0.10 -1.45 0.36 0.00 0.82 0.00 0.00 66.70 66.53 3ghg h VAL 152 Cb 0.52 1.86 -0.11 0.00 -1.52 0.00 0.00 31.29 32.04 3ghg h VAL 152 CO 0.03 0.44 0.78 -0.78 0.02 0.00 0.00 177.57 178.06 3ghg h ASP 153 N 0.13 0.31 0.07 0.57 3.58 -1.13 0.13 116.42 120.08 3ghg h ASP 153 Ca 0.02 0.10 -0.21 0.00 0.42 0.00 0.00 57.03 57.36 3ghg h ASP 153 Cb 0.81 0.07 0.02 0.00 1.72 0.00 0.00 39.33 41.95 3ghg h ASP 153 CO 0.06 -0.05 -0.87 0.40 -2.88 0.00 0.00 179.24 175.89 3ghg h ILE 154 N 0.21 1.40 -0.36 2.25 5.03 -1.22 -2.72 117.51 122.09 3ghg h ILE 154 Ca 0.71 -2.31 0.04 0.00 -0.12 0.00 0.00 64.86 63.18 3ghg h ILE 154 Cb 2.12 2.75 -0.02 0.00 -3.03 0.00 0.00 36.82 38.65 3ghg h ILE 154 CO -0.33 0.68 0.24 -0.78 -0.68 0.00 0.00 178.15 177.28 3ghg h ASP 155 N -0.02 0.28 0.00 1.72 1.82 0.07 0.15 116.42 120.42 3ghg h ASP 155 Ca -0.13 -0.00 -0.05 0.00 -0.39 0.00 0.00 57.03 56.46 3ghg h ASP 155 Cb 1.59 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 41.53 3ghg h ASP 155 CO 0.17 0.19 -0.44 0.40 -1.61 0.00 0.00 179.24 177.95 3ghg h ILE 156 N 0.32 0.59 -0.88 2.25 2.04 -1.44 -2.88 117.51 117.50 3ghg h ILE 156 Ca 0.15 -1.56 0.23 0.00 1.00 0.00 0.00 64.86 64.69 3ghg h ILE 156 Cb 0.21 1.23 -0.13 0.00 -0.74 0.00 0.00 36.82 37.39 3ghg h ILE 156 CO -0.03 0.20 0.32 0.11 0.00 0.00 0.00 178.15 178.75 3ghg h LYS 157 N -1.00 0.29 0.33 2.37 1.57 -1.39 2.25 116.57 121.00 3ghg h LYS 157 Ca -0.08 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 3ghg h LYS 157 Cb 0.66 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.91 3ghg h LYS 157 CO -0.05 0.19 -0.16 0.82 -0.57 0.00 0.00 179.45 179.68 3ghg h ILE 158 N 0.30 0.69 0.00 1.86 2.04 -0.87 -2.85 117.51 118.68 3ghg h ILE 158 Ca 0.56 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 66.15 3ghg h ILE 158 Cb 1.10 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 3ghg h ILE 158 CO -0.59 0.05 -0.08 -0.09 0.00 0.00 0.00 178.15 177.44 3ghg h ARG 159 N -0.59 0.00 0.00 2.37 2.43 -0.47 -0.35 114.38 117.77 3ghg h ARG 159 Ca -0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3ghg h ARG 159 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 3ghg h ARG 159 CO 0.08 0.08 0.28 1.03 -1.51 0.00 0.00 179.97 179.93 3ghg h SER 160 N 0.00 0.00 0.19 -3.80 0.87 0.38 -2.87 113.55 108.32 3ghg h SER 160 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3ghg h SER 160 Cb 0.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 3ghg h SER 160 CO 0.01 0.00 -0.65 0.00 -0.53 0.00 0.00 176.83 175.66 3ghg h ARG 162 N 0.57 0.00 -0.58 0.00 2.43 -1.65 -0.69 114.38 114.47 3ghg h ARG 162 Ca 0.00 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.84 3ghg h ARG 162 Cb 0.54 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 29.90 3ghg h ARG 162 CO 0.00 0.00 0.08 0.41 -1.51 0.00 0.00 179.97 178.95 3ghg n GLY 163 N -1.30 5.06 0.00 2.80 0.00 -1.26 -4.51 105.19 105.99 3ghg n GLY 163 Ca -0.01 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.08 0.00 -4.21 1.61 7.64 -0.38 -5.14 113.62 112.06 3ghg n SER 164 Ca 0.42 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 60.16 3ghg n SER 164 Cb 1.12 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 64.22 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 3.23 -1.38 -3.75 0.00 4.64 -1.92 -3.42 113.55 110.95 3ghg h SER 166 Ca -0.37 0.28 -0.17 0.00 -0.47 0.00 0.00 61.79 61.06 3ghg h SER 166 Cb 1.19 0.70 -0.26 0.00 -0.31 0.00 0.00 62.40 63.71 3ghg h SER 166 CO 0.58 -0.30 -0.44 -0.60 -0.87 0.00 0.00 176.83 175.20 3ghg s ARG 167 N -5.94 0.28 -0.03 4.77 3.52 -1.26 -5.11 118.95 115.18 3ghg s ARG 167 Ca -0.14 0.38 0.07 0.00 -0.13 0.00 0.00 55.73 55.90 3ghg s ARG 167 Cb 0.18 0.10 -0.02 0.00 -1.56 0.00 0.00 34.95 33.65 3ghg s ARG 167 CO 0.70 -0.05 -0.24 0.00 -0.81 0.00 0.00 175.30 174.89 3ghg s ALA 168 N 0.31 2.23 0.07 6.12 0.00 -1.26 -4.94 121.76 124.29 3ghg s ALA 168 Ca -0.01 -1.08 -0.31 0.00 0.00 0.00 0.00 51.96 50.55 3ghg s ALA 168 Cb -0.03 -0.64 -0.07 0.00 0.00 0.00 0.00 23.12 22.38 3ghg s ALA 168 CO -0.01 0.51 1.39 -1.17 0.00 0.00 0.00 175.76 176.47 3ghg s LEU 169 N -0.52 4.35 -1.01 0.00 0.20 -1.26 -4.94 118.68 115.51 3ghg s LEU 169 Ca 0.07 2.24 -0.23 0.00 0.69 0.00 0.00 54.13 56.90 3ghg s LEU 169 Cb -0.11 -3.58 0.06 0.00 -0.43 0.00 0.00 46.19 42.13 3ghg s LEU 169 CO 0.00 -0.67 1.42 0.00 -0.29 0.00 0.00 176.35 176.82 3ghg s ALA 170 N 1.56 2.78 -0.04 5.97 0.00 -1.26 -4.92 121.76 125.85 3ghg s ALA 170 Ca 0.64 -2.31 0.01 0.00 0.00 0.00 0.00 51.96 50.30 3ghg s ALA 170 Cb -0.35 -4.48 0.02 0.00 0.00 0.00 0.00 23.12 18.31 3ghg s ALA 170 CO 0.29 -3.56 -0.05 -0.98 0.00 0.00 0.00 175.76 171.47 3ghg s ARG 171 N 4.75 0.84 0.45 0.00 1.70 -1.26 -5.15 118.95 120.27 3ghg s ARG 171 Ca 0.45 -0.12 0.08 0.00 -0.47 0.00 0.00 55.73 55.67 3ghg s ARG 171 Cb -0.00 -0.83 0.01 0.00 -0.57 0.00 0.00 34.95 33.55 3ghg s ARG 171 CO -0.10 -0.07 0.49 -1.21 -1.08 0.00 0.00 175.30 173.34 3ghg s GLU 172 N 0.85 2.57 0.06 3.89 8.01 -1.26 -5.06 118.70 127.77 3ghg s GLU 172 Ca -0.12 -1.51 0.03 0.00 0.01 0.00 0.00 54.97 53.39 3ghg s GLU 172 Cb -0.14 -2.50 -0.04 0.00 -4.31 0.00 0.00 34.13 27.13 3ghg s GLU 172 CO 0.00 -0.35 0.05 0.08 0.01 0.00 0.00 175.26 175.06 3ghg s VAL 173 N -2.49 4.40 -0.81 2.63 1.01 -1.26 -5.03 120.40 118.85 3ghg s VAL 173 Ca 0.51 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.74 3ghg s VAL 173 Cb -0.06 -3.08 0.35 0.00 0.00 0.00 0.00 36.38 33.59 3ghg s VAL 173 CO 0.30 0.18 1.68 -0.67 0.00 0.00 0.00 175.10 176.60 3ghg n ASP 174 N 0.67 6.65 -0.24 3.32 4.64 -1.26 -4.77 116.55 125.56 3ghg n ASP 174 Ca -0.10 -3.76 -0.00 0.00 -1.38 0.00 0.00 54.79 49.55 3ghg n ASP 174 Cb 0.52 -0.94 0.12 0.00 -1.04 0.00 0.00 41.12 39.78 3ghg n ASP 174 CO 0.00 0.00 0.00 0.17 -0.82 0.00 0.00 177.20 176.55 3ghg h LEU 175 N 3.30 0.54 -0.27 -2.67 -0.00 -2.00 -2.79 115.31 111.42 3ghg h LEU 175 Ca 0.46 0.04 0.02 0.00 -0.00 0.00 0.00 57.88 58.41 3ghg h LEU 175 Cb 0.32 -0.06 -0.03 0.00 -0.00 0.00 0.00 40.66 40.88 3ghg h LEU 175 CO 1.19 0.34 -0.17 0.50 -0.00 0.00 0.00 178.44 180.30 3ghg h LYS 176 N 0.68 -0.01 -0.99 0.17 1.63 -1.99 0.83 116.57 116.88 3ghg h LYS 176 Ca 0.32 0.00 0.05 0.00 -0.85 0.00 0.00 60.65 60.17 3ghg h LYS 176 Cb 0.25 0.00 -0.06 0.00 -0.60 0.00 0.00 32.23 31.82 3ghg h LYS 176 CO -0.21 -0.01 0.65 0.22 -3.45 0.00 0.00 179.45 176.65 3ghg h ASP 177 N -0.01 1.06 -0.25 4.20 3.58 -1.93 -1.29 116.42 121.78 3ghg h ASP 177 Ca 0.04 -0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.51 3ghg h ASP 177 Cb 0.12 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 3ghg h ASP 177 CO -0.26 0.71 0.11 1.88 -2.88 0.00 0.00 179.24 178.80 3ghg h TYR 178 N 1.22 0.20 0.00 0.28 -1.99 -1.11 -0.21 116.97 115.36 3ghg h TYR 178 Ca 0.41 0.01 -0.03 0.00 2.00 0.00 0.00 58.73 61.12 3ghg h TYR 178 Cb 0.06 -0.05 -0.00 0.00 2.00 0.00 0.00 36.73 38.74 3ghg h TYR 178 CO -0.00 0.11 -0.13 0.93 -0.00 0.00 0.00 178.16 179.07 3ghg h GLU 179 N 0.24 0.00 0.16 4.88 4.39 0.23 0.34 114.58 124.81 3ghg h GLU 179 Ca 0.11 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 3ghg h GLU 179 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3ghg h GLU 179 CO -0.09 0.13 -0.08 -0.44 -1.16 0.00 0.00 179.01 177.37 3ghg h ASP 180 N 0.00 -0.18 -0.13 1.42 3.32 -0.83 0.09 116.42 120.12 3ghg h ASP 180 Ca -0.00 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.09 3ghg h ASP 180 Cb 0.29 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 3ghg h ASP 180 CO 0.02 0.05 0.29 1.56 -1.72 0.00 0.00 179.24 179.44 3ghg h GLN 181 N -0.57 0.00 -0.00 3.56 1.08 -0.92 1.31 115.11 119.58 3ghg h GLN 181 Ca -0.02 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 3ghg h GLN 181 Cb 0.16 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 3ghg h GLN 181 CO 0.04 0.00 -0.00 0.37 -0.95 0.00 0.00 178.83 178.28 3ghg h GLN 182 N 0.00 0.00 -0.04 1.46 4.15 -0.37 -3.05 115.11 117.26 3ghg h GLN 182 Ca 0.06 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 3ghg h GLN 182 Cb 0.64 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.33 3ghg h GLN 182 CO -0.00 0.69 -0.01 -0.22 -1.93 0.00 0.00 178.83 177.36 3ghg h LYS 183 N -0.68 0.09 -0.78 1.69 3.64 0.27 -0.81 116.57 119.99 3ghg h LYS 183 Ca -0.00 -0.03 0.14 0.00 -1.27 0.00 0.00 60.65 59.48 3ghg h LYS 183 Cb 0.69 -0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 32.42 3ghg h LYS 183 CO 0.00 0.44 0.35 0.37 -2.27 0.00 0.00 179.45 178.35 3ghg h GLN 184 N -0.27 0.50 -0.31 1.90 4.15 0.11 0.25 115.11 121.44 3ghg h GLN 184 Ca 0.01 -0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 3ghg h GLN 184 Cb 0.41 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.98 3ghg h GLN 184 CO 0.00 0.33 -0.23 1.25 -1.93 0.00 0.00 178.83 178.26 3ghg h LEU 185 N 0.52 0.75 -1.64 -2.39 7.12 -1.47 -3.12 115.31 115.07 3ghg h LEU 185 Ca 0.42 -0.44 -0.00 0.00 0.13 0.00 0.00 57.88 57.99 3ghg h LEU 185 Cb 0.61 -0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 40.53 3ghg h LEU 185 CO -0.37 1.03 -0.01 -0.08 -0.13 0.00 0.00 178.44 178.88 3ghg h GLU 186 N 0.47 0.00 -0.56 1.25 4.57 0.14 -0.82 114.58 119.63 3ghg h GLU 186 Ca 0.06 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.29 3ghg h GLU 186 Cb 0.79 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.33 3ghg h GLU 186 CO 0.06 0.01 0.29 0.37 -1.18 0.00 0.00 179.01 178.57 3ghg h GLN 187 N 0.00 0.55 0.08 1.92 4.15 -0.51 -3.35 115.11 117.95 3ghg h GLN 187 Ca -0.00 -0.03 -0.26 0.00 0.77 0.00 0.00 58.65 59.13 3ghg h GLN 187 Cb 0.46 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 3ghg h GLN 187 CO 0.00 0.36 -1.37 0.28 -1.93 0.00 0.00 178.83 176.17 3ghg h VAL 188 N 0.57 0.98 0.00 2.39 2.07 -1.26 -3.45 116.25 117.55 3ghg h VAL 188 Ca 0.25 -2.32 0.00 0.00 0.82 0.00 0.00 66.70 65.44 3ghg h VAL 188 Cb 0.14 2.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3ghg h VAL 188 CO -0.16 0.62 0.00 -0.38 0.02 0.00 0.00 177.57 177.66 3ghg n ILE 189 N -4.04 0.00 -1.62 4.57 5.41 -0.84 -2.68 119.36 120.15 3ghg n ILE 189 Ca -0.27 0.59 -0.36 0.00 1.00 0.00 0.00 62.75 63.71 3ghg n ILE 189 Cb 0.83 -0.82 0.06 0.00 -0.71 0.00 0.00 39.64 39.00 3ghg n ILE 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3ghg n ALA 190 N -1.53 6.30 -0.08 -1.39 0.00 -1.26 -4.48 120.51 118.06 3ghg n ALA 190 Ca 0.00 -3.76 -0.10 0.00 0.00 0.00 0.00 53.44 49.58 3ghg n ALA 190 Cb 0.00 -1.74 -0.03 0.00 0.00 0.00 0.00 19.45 17.68 3ghg n ALA 190 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ghg n LYS 191 N -0.76 0.50 -3.40 0.00 5.02 -1.09 -4.99 118.16 113.44 3ghg n LYS 191 Ca 0.58 0.20 -0.39 0.00 -2.02 0.00 0.00 58.31 56.68 3ghg n LYS 191 Cb 0.52 -1.37 -0.09 0.00 -0.02 0.00 0.00 35.03 34.07 3ghg n LYS 191 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ghg s ASP 192 N -6.05 6.27 0.00 4.39 -0.00 -1.26 -4.91 116.67 115.11 3ghg s ASP 192 Ca -0.28 0.31 0.00 0.00 -0.00 0.00 0.00 52.55 52.58 3ghg s ASP 192 Cb 0.05 -2.21 0.00 0.00 -0.00 0.00 0.00 42.92 40.76 3ghg s ASP 192 CO 0.40 -0.16 0.00 0.18 -0.00 0.00 0.00 175.17 175.59 3ghg n LEU 193 N 5.19 0.00 -2.70 1.23 4.77 -1.26 -5.05 117.00 119.18 3ghg n LEU 193 Ca -0.09 -0.05 -0.07 0.00 -0.03 0.00 0.00 56.01 55.77 3ghg n LEU 193 Cb 0.51 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.63 3ghg n LEU 193 CO 0.37 0.00 0.09 0.18 -1.33 0.00 0.00 177.39 176.71 3ghg n LEU 194 N -0.32 -4.86 0.00 2.23 4.32 -1.26 -5.03 117.00 112.08 3ghg n LEU 194 Ca 0.00 -0.36 -0.10 0.00 -0.02 0.00 0.00 56.01 55.53 3ghg n LEU 194 Cb 0.00 -2.50 0.01 0.00 -1.62 0.00 0.00 43.42 39.31 3ghg n LEU 194 CO 0.00 -0.20 0.08 -0.81 -1.22 0.00 0.00 177.39 175.24 3ghg n PRO 195 N -2.36 1.02 0.00 3.23 -0.04 -1.26 -4.84 135.00 130.75 3ghg n PRO 195 Ca -0.03 -1.37 0.00 0.00 -0.04 0.00 0.00 63.50 62.06 3ghg n PRO 195 Cb 0.56 0.04 0.00 0.00 -0.04 0.00 0.00 33.50 34.06 3ghg n PRO 195 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3ghg n SER 196 N -2.28 0.00 -2.46 3.54 7.64 -1.26 -4.31 113.62 114.49 3ghg n SER 196 Ca 0.02 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.64 3ghg n SER 196 Cb 0.25 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.41 3ghg n SER 196 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3ghg n ARG 197 N 0.00 2.37 0.16 1.43 5.12 -1.26 -4.60 116.66 119.89 3ghg n ARG 197 Ca 0.00 -2.35 0.12 0.00 -1.93 0.00 0.00 57.85 53.69 3ghg n ARG 197 Cb 0.00 -2.11 0.18 0.00 -1.16 0.00 0.00 32.46 29.37 3ghg n ARG 197 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 3ghg h ASP 198 N 2.86 0.00 -4.97 0.55 3.32 -1.89 -3.46 116.42 112.83 3ghg h ASP 198 Ca 0.40 -0.02 -0.17 0.00 0.02 0.00 0.00 57.03 57.25 3ghg h ASP 198 Cb 0.71 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.09 3ghg h ASP 198 CO 0.90 0.01 -0.69 -0.60 -1.72 0.00 0.00 179.24 177.14 3ghg s ARG 199 N -3.21 0.60 0.00 3.56 3.52 -1.26 -5.18 118.95 116.98 3ghg s ARG 199 Ca 0.06 -1.08 0.01 0.00 -0.13 0.00 0.00 55.73 54.59 3ghg s ARG 199 Cb 0.08 0.03 0.01 0.00 -1.56 0.00 0.00 34.95 33.50 3ghg s ARG 199 CO 0.68 -0.06 0.53 1.04 -0.81 0.00 0.00 175.30 176.69