#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 0.00 0.33 -4.67 0.00 1.79 -2.10 -3.45 116.57 108.48 3ghg h LYS 29 Ca -0.01 -0.03 -0.34 0.00 -2.18 0.00 0.00 60.65 58.09 3ghg h LYS 29 Cb 1.12 -0.07 -0.11 0.00 -1.58 0.00 0.00 32.23 31.59 3ghg h LYS 29 CO 0.08 0.27 1.90 -0.25 -1.08 0.00 0.00 179.45 180.37 3ghg n ASP 30 N -4.45 -1.35 -2.70 0.86 10.43 -1.24 -4.76 116.55 113.33 3ghg n ASP 30 Ca 0.01 -0.50 -0.27 0.00 2.57 0.00 0.00 54.79 56.60 3ghg n ASP 30 Cb 0.11 -0.50 -0.09 0.00 1.84 0.00 0.00 41.12 42.48 3ghg n ASP 30 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 3ghg n SER 31 N 5.22 7.01 -1.96 -2.24 7.64 -1.26 -4.57 113.62 123.46 3ghg n SER 31 Ca 0.63 -2.66 -0.20 0.00 1.01 0.00 0.00 58.87 57.65 3ghg n SER 31 Cb 0.13 -1.45 0.08 0.00 -1.01 0.00 0.00 64.21 61.96 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 2.65 5.48 -4.21 6.43 8.00 -1.26 -4.91 116.55 128.74 3ghg n ASP 32 Ca 0.59 -3.23 -0.28 0.00 0.71 0.00 0.00 54.79 52.59 3ghg n ASP 32 Cb 0.55 -0.90 -0.16 0.00 -0.02 0.00 0.00 41.12 40.59 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 -2.42 1.91 0.78 1.24 0.52 -1.26 -5.14 118.94 114.56 3ghg s TRP 33 Ca 0.41 -0.43 -0.12 0.00 0.02 0.00 0.00 56.10 55.99 3ghg s TRP 33 Cb 0.33 -1.24 0.06 0.00 -1.15 0.00 0.00 33.47 31.47 3ghg s TRP 33 CO 0.03 -0.09 1.15 -1.25 0.02 0.00 0.00 176.95 176.81 3ghg s PRO 34 N -0.32 2.19 0.36 4.98 0.04 -1.26 -5.02 135.00 135.96 3ghg s PRO 34 Ca 0.04 0.17 -0.26 0.00 0.04 0.00 0.00 61.00 60.99 3ghg s PRO 34 Cb -0.10 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 3ghg s PRO 34 CO 0.00 -1.44 1.06 -0.06 0.04 0.00 0.00 177.00 176.60 3ghg s PHE 35 N -3.51 3.39 0.65 0.56 0.08 -1.26 -5.01 117.98 112.88 3ghg s PHE 35 Ca 0.61 1.67 -0.11 0.00 0.12 0.00 0.00 56.93 59.22 3ghg s PHE 35 Cb -0.11 -3.17 -0.02 0.00 -0.57 0.00 0.00 43.02 39.15 3ghg s PHE 35 CO 0.49 -0.56 1.04 0.00 -0.10 0.00 0.00 175.22 176.10 3ghg n SER 37 N -2.89 0.00 -0.04 0.00 7.64 -1.26 -5.04 113.62 112.03 3ghg n SER 37 Ca 0.06 -0.67 0.01 0.00 1.01 0.00 0.00 58.87 59.28 3ghg n SER 37 Cb 0.54 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.61 3ghg n SER 37 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3ghg n ASP 38 N -2.00 0.91 0.15 6.43 5.68 -1.26 -4.15 116.55 122.31 3ghg n ASP 38 Ca 0.00 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.41 3ghg n ASP 38 Cb 0.00 1.37 0.09 0.00 -1.14 0.00 0.00 41.12 41.45 3ghg n ASP 38 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3ghg h GLU 39 N 0.00 0.00 0.00 0.11 9.09 -2.03 -3.11 114.58 118.64 3ghg h GLU 39 Ca -0.22 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.19 3ghg h GLU 39 Cb 1.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.51 3ghg h GLU 39 CO 0.01 0.00 0.14 -0.25 0.05 0.00 0.00 179.01 178.96 3ghg n ASP 40 N -2.82 0.04 -4.83 3.06 10.43 -1.26 -4.21 116.55 116.96 3ghg n ASP 40 Ca 0.02 0.39 -0.38 0.00 2.57 0.00 0.00 54.79 57.39 3ghg n ASP 40 Cb 0.53 -0.39 -0.06 0.00 1.84 0.00 0.00 41.12 43.04 3ghg n ASP 40 CO 0.00 0.00 0.00 0.86 -1.07 0.00 0.00 177.20 176.99 3ghg s TRP 41 N -2.80 3.71 0.00 1.24 -0.00 -1.18 -1.83 118.94 118.08 3ghg s TRP 41 Ca -0.00 0.97 0.00 0.00 -0.00 0.00 0.00 56.10 57.07 3ghg s TRP 41 Cb 0.00 -2.30 0.00 0.00 -0.00 0.00 0.00 33.47 31.17 3ghg s TRP 41 CO 0.01 0.60 0.00 0.09 -0.00 0.00 0.00 176.95 177.66 3ghg n ASN 42 N 2.00 0.00 -0.09 5.86 3.02 -1.26 -4.83 115.26 119.96 3ghg n ASN 42 Ca -0.14 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.29 3ghg n ASN 42 Cb 0.52 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.65 3ghg n ASN 42 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3ghg n TYR 43 N -2.00 0.00 -4.12 3.10 0.53 -1.23 -4.89 117.16 108.55 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 -0.55 -0.09 0.00 -1.03 0.00 0.00 39.34 37.67 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 -2.74 3.44 0.12 -0.72 3.01 -0.76 -5.12 119.74 116.97 3ghg s LYS 44 Ca -0.28 -0.31 0.03 0.00 -1.01 0.00 0.00 55.97 54.39 3ghg s LYS 44 Cb 0.06 -3.04 -0.04 0.00 -1.01 0.00 0.00 37.83 33.80 3ghg s LYS 44 CO 0.40 0.58 -0.08 0.00 0.51 0.00 0.00 175.35 176.76 3ghg s PRO 46 N -3.76 4.41 0.19 0.00 0.04 -1.26 -4.98 135.00 129.63 3ghg s PRO 46 Ca 0.13 0.98 -0.32 0.00 0.04 0.00 0.00 61.00 61.83 3ghg s PRO 46 Cb 0.04 -3.24 -0.12 0.00 0.04 0.00 0.00 34.50 31.21 3ghg s PRO 46 CO -0.03 0.60 1.70 -1.13 0.04 0.00 0.00 177.00 178.18 3ghg n SER 47 N 1.62 3.80 -0.38 6.66 3.41 -1.26 -4.84 113.62 122.64 3ghg n SER 47 Ca -0.08 1.06 0.35 0.00 -0.26 0.00 0.00 58.87 59.94 3ghg n SER 47 Cb 0.50 -1.54 0.70 0.00 -0.26 0.00 0.00 64.21 63.61 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 6.73 0.38 0.39 5.00 0.00 -1.97 -2.25 103.07 111.35 3ghg h GLY 48 Ca -0.44 -0.05 0.04 0.00 0.00 0.00 0.00 47.33 46.88 3ghg h GLY 48 CO 0.94 -0.07 -0.21 0.00 0.00 0.00 0.00 176.54 177.21 3ghg h ARG 50 N -0.28 0.67 -0.25 0.00 2.43 -1.79 0.66 114.38 115.82 3ghg h ARG 50 Ca 0.09 -0.32 -0.02 0.00 -0.81 0.00 0.00 59.98 58.92 3ghg h ARG 50 Cb 0.41 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 3ghg h ARG 50 CO -0.26 0.92 0.09 0.52 -1.51 0.00 0.00 179.97 179.73 3ghg h MET 51 N 0.57 0.38 -0.84 0.20 2.86 -1.01 0.38 114.93 117.46 3ghg h MET 51 Ca 0.06 -0.07 0.13 0.00 -2.06 0.00 0.00 59.70 57.76 3ghg h MET 51 Cb 0.86 -0.06 -0.09 0.00 0.06 0.00 0.00 31.60 32.37 3ghg h MET 51 CO 0.07 0.43 0.44 -0.22 1.06 0.00 0.00 176.91 178.69 3ghg h LYS 52 N 0.24 0.64 -0.39 1.72 1.63 0.88 1.56 116.57 122.86 3ghg h LYS 52 Ca 0.08 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.79 3ghg h LYS 52 Cb 0.20 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 3ghg h LYS 52 CO -0.01 0.42 0.03 0.78 -3.45 0.00 0.00 179.45 177.23 3ghg h GLY 53 N 0.66 0.64 0.53 5.01 0.00 -0.35 -3.09 103.07 106.47 3ghg h GLY 53 Ca 0.44 -0.37 -0.28 0.00 0.00 0.00 0.00 47.33 47.12 3ghg h GLY 53 CO -0.33 0.35 -1.45 1.41 0.00 0.00 0.00 176.54 176.52 3ghg h LEU 54 N 0.57 0.36 -1.36 3.11 3.38 0.85 -3.02 115.31 119.21 3ghg h LEU 54 Ca 0.12 -0.84 0.32 0.00 0.09 0.00 0.00 57.88 57.57 3ghg h LEU 54 Cb 0.32 -0.12 -0.11 0.00 0.09 0.00 0.00 40.66 40.84 3ghg h LEU 54 CO 0.01 1.63 0.71 0.40 0.09 0.00 0.00 178.44 181.28 3ghg h ILE 55 N -0.31 0.40 0.12 1.22 2.04 0.21 -1.49 117.51 119.70 3ghg h ILE 55 Ca -0.31 -0.10 -0.24 0.00 1.00 0.00 0.00 64.86 65.20 3ghg h ILE 55 Cb 1.76 0.07 0.01 0.00 -0.74 0.00 0.00 36.82 37.91 3ghg h ILE 55 CO 0.05 0.06 -1.18 0.44 0.00 0.00 0.00 178.15 177.51 3ghg h ASP 56 N 0.30 0.41 -0.47 1.72 3.45 -1.66 -3.19 116.42 116.97 3ghg h ASP 56 Ca 0.66 -0.88 0.13 0.00 0.43 0.00 0.00 57.03 57.37 3ghg h ASP 56 Cb 1.81 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 40.43 3ghg h ASP 56 CO -0.35 1.53 0.34 -0.08 -1.57 0.00 0.00 179.24 179.11 3ghg h GLU 57 N -0.34 0.03 0.00 3.56 4.81 -1.15 0.28 114.58 121.77 3ghg h GLU 57 Ca -0.24 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.99 3ghg h GLU 57 Cb 1.71 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.08 3ghg h GLU 57 CO 0.09 0.02 -0.00 -0.24 -0.73 0.00 0.00 179.01 178.15 3ghg h VAL 58 N 0.03 1.29 0.00 0.32 3.04 -1.58 -2.72 116.25 116.64 3ghg h VAL 58 Ca 0.22 -1.95 -0.00 0.00 -1.01 0.00 0.00 66.70 63.96 3ghg h VAL 58 Cb 0.85 2.42 -0.00 0.00 -2.01 0.00 0.00 31.29 32.56 3ghg h VAL 58 CO -0.01 0.43 -0.00 0.78 -1.01 0.00 0.00 177.57 177.76 3ghg h ASN 59 N -0.99 0.00 0.05 3.17 2.35 -1.35 -1.18 115.58 117.62 3ghg h ASN 59 Ca -0.00 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.54 3ghg h ASN 59 Cb 0.71 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.07 3ghg h ASN 59 CO 0.00 0.00 -1.08 -0.61 -1.65 0.00 0.00 177.43 174.09 3ghg h GLN 60 N 0.00 0.11 0.00 0.81 -0.00 -0.60 -3.25 115.11 112.18 3ghg h GLN 60 Ca -0.00 -0.19 0.00 0.00 -0.00 0.00 0.00 58.65 58.46 3ghg h GLN 60 Cb 0.13 0.07 0.00 0.00 0.00 0.00 0.00 27.48 27.68 3ghg h GLN 60 CO 0.00 1.09 0.00 -0.25 0.00 0.00 0.00 178.83 179.67 3ghg n ASP 61 N -4.23 0.53 0.18 -0.69 8.00 -1.01 -0.28 116.55 119.04 3ghg n ASP 61 Ca -0.25 0.63 0.12 0.00 0.71 0.00 0.00 54.79 56.01 3ghg n ASP 61 Cb 0.74 -0.74 0.18 0.00 -0.02 0.00 0.00 41.12 41.27 3ghg n ASP 61 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 3ghg h PHE 62 N 0.00 0.00 0.00 1.24 0.05 -1.37 -2.55 116.94 114.30 3ghg h PHE 62 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 3ghg h PHE 62 Cb 0.34 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.29 3ghg h PHE 62 CO 0.00 0.00 -1.40 0.25 -0.18 0.00 0.00 178.31 176.98 3ghg n THR 63 N -2.86 0.36 0.12 -1.55 -2.24 0.61 -1.96 114.28 106.76 3ghg n THR 63 Ca 0.04 -0.52 -0.22 0.00 -2.27 0.00 0.00 64.05 61.07 3ghg n THR 63 Cb 0.51 -0.18 -0.14 0.00 -2.10 0.00 0.00 70.33 68.42 3ghg n THR 63 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3ghg h ASN 64 N 0.00 0.81 0.12 3.42 4.21 -0.84 -2.84 115.58 120.46 3ghg h ASN 64 Ca 0.00 -0.81 -0.01 0.00 1.21 0.00 0.00 56.30 56.70 3ghg h ASN 64 Cb 0.99 -0.26 0.00 0.00 -1.12 0.00 0.00 38.32 37.93 3ghg h ASN 64 CO 0.00 1.62 -0.06 -0.09 -1.29 0.00 0.00 177.43 177.61 3ghg h ARG 65 N 0.21 -0.16 -0.51 0.81 2.43 -1.60 -2.92 114.38 112.64 3ghg h ARG 65 Ca -0.21 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.03 3ghg h ARG 65 Cb 2.02 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 31.57 3ghg h ARG 65 CO 0.25 0.10 0.34 0.97 -1.51 0.00 0.00 179.97 180.12 3ghg h ILE 66 N -0.41 0.98 -0.09 1.20 6.09 -1.51 -0.81 117.51 122.97 3ghg h ILE 66 Ca -0.02 -0.16 -0.15 0.00 -1.37 0.00 0.00 64.86 63.16 3ghg h ILE 66 Cb 0.33 0.48 -0.01 0.00 0.47 0.00 0.00 36.82 38.09 3ghg h ILE 66 CO 0.03 0.08 -0.61 0.78 -3.07 0.00 0.00 178.15 175.36 3ghg h ASN 67 N 0.46 0.34 1.74 2.19 2.35 -1.47 0.23 115.58 121.41 3ghg h ASN 67 Ca 0.22 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.76 3ghg h ASN 67 Cb 0.29 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.56 3ghg h ASN 67 CO -0.06 0.86 -0.27 0.50 -1.65 0.00 0.00 177.43 176.82 3ghg h LYS 68 N 0.22 0.00 0.10 0.81 3.64 -1.21 -2.42 116.57 117.70 3ghg h LYS 68 Ca -0.01 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3ghg h LYS 68 Cb 1.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 3ghg h LYS 68 CO 0.10 0.07 -0.05 1.25 -2.27 0.00 0.00 179.45 178.55 3ghg h LEU 69 N 0.00 -0.11 -0.36 5.20 7.12 -1.02 -3.30 115.31 122.84 3ghg h LEU 69 Ca -0.00 -0.35 0.06 0.00 0.13 0.00 0.00 57.88 57.72 3ghg h LEU 69 Cb 1.07 0.03 -0.05 0.00 -0.53 0.00 0.00 40.66 41.17 3ghg h LEU 69 CO 0.01 0.52 0.04 0.11 -0.13 0.00 0.00 178.44 178.98 3ghg h LYS 70 N -0.97 0.14 0.00 1.25 1.57 -0.66 -1.71 116.57 116.19 3ghg h LYS 70 Ca -0.01 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3ghg h LYS 70 Cb 0.45 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3ghg h LYS 70 CO 0.02 0.09 0.00 0.27 -0.57 0.00 0.00 179.45 179.26 3ghg n ASN 71 N -5.14 0.48 -0.01 0.86 2.04 -0.91 -0.62 115.26 111.96 3ghg n ASN 71 Ca 0.02 0.71 -0.20 0.00 -0.44 0.00 0.00 54.58 54.67 3ghg n ASN 71 Cb 0.18 -0.78 -0.14 0.00 -2.53 0.00 0.00 39.78 36.51 3ghg n ASN 71 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 3ghg n SER 72 N -2.13 2.04 -0.10 0.53 7.64 -0.81 -3.98 113.62 116.82 3ghg n SER 72 Ca -0.01 0.18 0.15 0.00 1.01 0.00 0.00 58.87 60.20 3ghg n SER 72 Cb 0.05 -0.76 0.54 0.00 -1.01 0.00 0.00 64.21 63.03 3ghg n SER 72 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 3ghg h LEU 73 N 0.06 0.30 0.00 -3.43 7.12 0.00 -0.59 115.31 118.77 3ghg h LEU 73 Ca -0.44 0.01 0.00 0.00 0.13 0.00 0.00 57.88 57.58 3ghg h LEU 73 Cb 2.02 -0.05 0.00 0.00 -0.53 0.00 0.00 40.66 42.10 3ghg h LEU 73 CO 0.07 0.17 -0.75 -0.26 -0.13 0.00 0.00 178.44 177.54 3ghg h PHE 74 N 0.32 0.00 -0.07 1.25 0.04 -1.65 -3.00 116.94 113.83 3ghg h PHE 74 Ca 0.31 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.07 3ghg h PHE 74 Cb 0.75 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.90 3ghg h PHE 74 CO -0.00 0.00 0.02 0.93 -0.60 0.00 0.00 178.31 178.66 3ghg h GLU 75 N 0.00 0.12 -0.00 1.51 4.39 -1.24 -0.36 114.58 119.00 3ghg h GLU 75 Ca 0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 3ghg h GLU 75 Cb 0.92 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 3ghg h GLU 75 CO 0.00 0.29 -0.09 0.66 -1.16 0.00 0.00 179.01 178.71 3ghg n TYR 76 N -4.91 0.00 0.65 4.33 4.01 -1.02 0.17 117.16 120.38 3ghg n TYR 76 Ca -0.06 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.79 3ghg n TYR 76 Cb 0.14 -0.42 0.12 0.00 -0.31 0.00 0.00 39.34 38.87 3ghg n TYR 76 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 3ghg n GLN 77 N -1.45 0.24 -0.08 -0.72 7.27 -1.13 -2.11 117.38 119.40 3ghg n GLN 77 Ca 0.08 0.03 -0.11 0.00 0.07 0.00 0.00 57.00 57.07 3ghg n GLN 77 Cb 0.33 -1.61 -0.15 0.00 2.41 0.00 0.00 30.24 31.21 3ghg n GLN 77 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 3ghg n LYS 78 N -1.94 0.67 0.21 3.69 5.02 -0.15 -3.94 118.16 121.72 3ghg n LYS 78 Ca 0.03 0.10 0.06 0.00 -2.02 0.00 0.00 58.31 56.49 3ghg n LYS 78 Cb 0.42 -1.60 0.45 0.00 -0.02 0.00 0.00 35.03 34.27 3ghg n LYS 78 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 3ghg h ASN 79 N 0.00 0.00 0.17 4.39 -1.24 0.16 -3.01 115.58 116.06 3ghg h ASN 79 Ca -0.48 0.00 0.01 0.00 0.71 0.00 0.00 56.30 56.54 3ghg h ASN 79 Cb 2.14 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 41.16 3ghg h ASN 79 CO 0.03 0.31 -0.25 -1.13 -1.29 0.00 0.00 177.43 175.10 3ghg h ASN 80 N 0.00 -0.69 -0.93 1.15 -0.73 -1.59 -1.68 115.58 111.12 3ghg h ASN 80 Ca -0.00 0.07 0.11 0.00 1.87 0.00 0.00 56.30 58.35 3ghg h ASN 80 Cb 0.66 0.25 -0.07 0.00 0.27 0.00 0.00 38.32 39.43 3ghg h ASN 80 CO 0.04 -0.35 0.59 0.50 -0.37 0.00 0.00 177.43 177.85 3ghg h LYS 81 N -0.49 0.89 0.18 6.67 1.63 -1.65 -2.12 116.57 121.68 3ghg h LYS 81 Ca 0.01 -0.05 -0.28 0.00 -0.85 0.00 0.00 60.65 59.48 3ghg h LYS 81 Cb 0.48 -0.20 0.02 0.00 -0.60 0.00 0.00 32.23 31.93 3ghg h LYS 81 CO -0.11 0.59 -1.29 -0.44 -3.45 0.00 0.00 179.45 174.75 3ghg h ASP 82 N 0.91 0.59 0.83 4.20 5.19 -1.55 -3.29 116.42 123.31 3ghg h ASP 82 Ca 0.44 -0.92 -0.13 0.00 -0.62 0.00 0.00 57.03 55.79 3ghg h ASP 82 Cb 0.44 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.74 3ghg h ASP 82 CO -0.20 1.60 -0.64 -1.28 -3.12 0.00 0.00 179.24 175.60 3ghg h SER 83 N -0.13 0.00 1.30 6.45 0.87 -1.14 -0.19 113.55 120.71 3ghg h SER 83 Ca -0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 3ghg h SER 83 Cb 1.90 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.86 3ghg h SER 83 CO 0.17 0.64 0.00 0.45 -0.53 0.00 0.00 176.83 177.56 3ghg h HIS 84 N 0.00 0.00 0.19 2.24 3.86 -1.55 0.01 115.15 119.89 3ghg h HIS 84 Ca -0.01 0.00 -0.31 0.00 -1.16 0.00 0.00 60.37 58.90 3ghg h HIS 84 Cb 1.23 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.71 3ghg h HIS 84 CO 0.00 0.00 -1.46 1.03 0.86 0.00 0.00 177.93 178.36 3ghg h SER 85 N 0.00 0.62 1.03 2.45 0.87 -1.49 -3.15 113.55 113.88 3ghg h SER 85 Ca 0.00 -0.92 -0.06 0.00 -1.23 0.00 0.00 61.79 59.58 3ghg h SER 85 Cb 0.65 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 3ghg h SER 85 CO 0.00 1.68 -0.28 0.25 -0.53 0.00 0.00 176.83 177.95 3ghg h LEU 86 N -0.04 0.00 0.16 2.23 5.85 -0.96 -0.58 115.31 121.98 3ghg h LEU 86 Ca -0.28 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.22 3ghg h LEU 86 Cb 1.99 0.00 0.03 0.00 0.37 0.00 0.00 40.66 43.04 3ghg h LEU 86 CO 0.18 0.28 -0.96 0.74 -0.34 0.00 0.00 178.44 178.34 3ghg h THR 87 N 0.00 1.46 0.00 1.05 2.02 -1.14 -1.23 112.91 115.07 3ghg h THR 87 Ca -0.00 -2.56 0.00 0.00 0.77 0.00 0.00 66.41 64.62 3ghg h THR 87 Cb 0.86 3.15 0.00 0.00 -1.74 0.00 0.00 68.15 70.43 3ghg h THR 87 CO 0.04 0.74 0.00 0.74 0.37 0.00 0.00 175.52 177.40 3ghg h THR 88 N -0.24 0.00 0.24 3.16 2.02 -1.59 0.57 112.91 117.06 3ghg h THR 88 Ca -0.17 -0.60 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 3ghg h THR 88 Cb 1.75 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 69.75 3ghg h THR 88 CO 0.18 0.00 -0.11 -1.13 0.37 0.00 0.00 175.52 174.83 3ghg h ASN 89 N 0.00 -0.27 0.44 4.18 -1.24 -1.09 -1.84 115.58 115.75 3ghg h ASN 89 Ca 0.00 -0.26 0.00 0.00 0.71 0.00 0.00 56.30 56.75 3ghg h ASN 89 Cb 0.62 0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.73 3ghg h ASN 89 CO 0.00 0.22 0.00 2.30 -1.29 0.00 0.00 177.43 178.66 3ghg n ILE 90 N -5.01 1.05 0.15 2.57 -5.35 -0.47 -2.33 119.36 109.98 3ghg n ILE 90 Ca -0.08 0.26 -0.07 0.00 -0.27 0.00 0.00 62.75 62.59 3ghg n ILE 90 Cb 0.26 -1.04 -0.03 0.00 -1.74 0.00 0.00 39.64 37.09 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 -0.45 0.00 6.28 4.05 -0.84 -3.33 114.93 120.65 3ghg h MET 91 Ca 0.00 0.03 -0.02 0.00 -0.28 0.00 0.00 59.70 59.43 3ghg h MET 91 Cb 0.22 0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.12 3ghg h MET 91 CO 0.00 -0.30 -0.11 0.93 0.23 0.00 0.00 176.91 177.66 3ghg h GLU 92 N -1.04 0.00 0.00 0.39 4.39 -1.04 2.80 114.58 120.07 3ghg h GLU 92 Ca -0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.65 3ghg h GLU 92 Cb 0.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 3ghg h GLU 92 CO 0.08 0.11 0.00 -0.84 -1.16 0.00 0.00 179.01 177.20 3ghg h ILE 93 N 0.00 0.00 0.00 3.13 3.07 -1.65 -3.38 117.51 118.68 3ghg h ILE 93 Ca -0.00 -0.83 0.00 0.00 1.55 0.00 0.00 64.86 65.57 3ghg h ILE 93 Cb 0.47 1.83 0.00 0.00 -0.27 0.00 0.00 36.82 38.85 3ghg h ILE 93 CO 0.01 0.00 -0.08 0.18 -1.05 0.00 0.00 178.15 177.21 3ghg n LEU 94 N -3.04 0.17 0.11 0.16 4.77 -0.70 -4.24 117.00 114.24 3ghg n LEU 94 Ca 0.03 -0.34 0.04 0.00 -0.03 0.00 0.00 56.01 55.70 3ghg n LEU 94 Cb 0.46 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 3ghg n LEU 94 CO 0.32 0.09 0.24 -0.09 -1.33 0.00 0.00 177.39 176.61 3ghg h ARG 95 N 0.00 0.00 0.00 3.23 9.65 0.48 -3.37 114.38 124.37 3ghg h ARG 95 Ca 0.00 0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 58.78 3ghg h ARG 95 Cb 1.03 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.59 3ghg h ARG 95 CO 0.00 0.33 -1.63 0.41 2.80 0.00 0.00 179.97 181.88 3ghg n GLY 96 N 1.26 -0.52 0.34 2.80 0.00 -1.26 -4.71 105.19 103.09 3ghg n GLY 96 Ca -0.01 -0.23 0.06 0.00 0.00 0.00 0.00 46.02 45.84 3ghg n GLY 96 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3ghg h ASP 97 N 0.00 -0.86 0.31 1.61 -0.00 -1.74 2.12 116.42 117.86 3ghg h ASP 97 Ca -0.15 0.28 0.00 0.00 -0.00 0.00 0.00 57.03 57.17 3ghg h ASP 97 Cb 1.10 0.58 0.00 0.00 -0.00 0.00 0.00 39.33 41.01 3ghg h ASP 97 CO 0.01 -0.31 0.00 0.49 -0.00 0.00 0.00 179.24 179.42 3ghg n PHE 98 N -5.60 0.00 0.79 0.28 3.72 -1.26 -0.12 117.46 115.28 3ghg n PHE 98 Ca 0.15 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.66 3ghg n PHE 98 Cb 0.49 -0.19 0.03 0.00 -0.94 0.00 0.00 39.48 38.86 3ghg n PHE 98 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3ghg n SER 99 N -1.19 0.68 0.06 4.37 7.64 0.68 -3.99 113.62 121.88 3ghg n SER 99 Ca 0.14 -0.46 0.11 0.00 1.01 0.00 0.00 58.87 59.67 3ghg n SER 99 Cb 0.16 0.77 -0.04 0.00 -1.01 0.00 0.00 64.21 64.09 3ghg n SER 99 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3ghg n SER 100 N -1.71 0.59 0.07 6.43 3.41 0.74 -3.37 113.62 119.79 3ghg n SER 100 Ca 0.03 0.19 -0.10 0.00 -0.26 0.00 0.00 58.87 58.73 3ghg n SER 100 Cb 0.38 0.91 0.00 0.00 -0.26 0.00 0.00 64.21 65.25 3ghg n SER 100 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ghg h ALA 101 N 2.05 0.52 -0.15 7.33 0.00 -0.69 -0.90 119.26 127.43 3ghg h ALA 101 Ca 0.00 -0.68 -0.17 0.00 0.00 0.00 0.00 54.91 54.06 3ghg h ALA 101 Cb 0.97 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 3ghg h ALA 101 CO 0.00 0.84 -0.62 -2.95 0.00 0.00 0.00 179.25 176.52 3ghg h ASN 102 N 0.18 0.59 0.32 0.00 7.08 -1.70 -2.95 115.58 119.09 3ghg h ASN 102 Ca -0.05 -0.34 -0.08 0.00 -3.08 0.00 0.00 56.30 52.75 3ghg h ASN 102 Cb 1.45 -0.17 -0.01 0.00 -2.08 0.00 0.00 38.32 37.51 3ghg h ASN 102 CO 0.14 1.07 -0.36 0.78 -2.08 0.00 0.00 177.43 176.97 3ghg h ASN 103 N 0.38 0.07 -0.32 6.14 -0.26 -1.56 -2.52 115.58 117.51 3ghg h ASN 103 Ca -0.01 -0.02 0.02 0.00 -0.56 0.00 0.00 56.30 55.73 3ghg h ASN 103 Cb 1.18 -0.02 -0.02 0.00 -1.06 0.00 0.00 38.32 38.41 3ghg h ASN 103 CO 0.11 0.43 0.22 -0.09 -1.06 0.00 0.00 177.43 177.04 3ghg h ARG 104 N 0.06 0.34 0.00 0.81 2.43 -0.99 -1.87 114.38 115.16 3ghg h ARG 104 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3ghg h ARG 104 Cb 0.67 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.14 3ghg h ARG 104 CO 0.05 0.23 -0.03 -0.44 -1.51 0.00 0.00 179.97 178.26 3ghg h ASP 105 N 0.35 0.00 -0.94 -3.80 5.19 -1.37 -3.37 116.42 112.48 3ghg h ASP 105 Ca 0.13 -0.00 0.18 0.00 -0.62 0.00 0.00 57.03 56.71 3ghg h ASP 105 Cb 0.09 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 39.42 3ghg h ASP 105 CO -0.03 0.00 -0.28 0.59 -3.12 0.00 0.00 179.24 176.40 3ghg n ASN 106 N -3.00 -0.43 0.03 6.45 4.13 -0.70 0.34 115.26 122.08 3ghg n ASN 106 Ca 0.04 1.63 -0.08 0.00 1.68 0.00 0.00 54.58 57.85 3ghg n ASN 106 Cb 0.52 -0.46 0.07 0.00 -1.54 0.00 0.00 39.78 38.38 3ghg n ASN 106 CO 0.00 0.00 0.00 0.74 0.28 0.00 0.00 177.26 178.28 3ghg h THR 107 N 0.00 1.33 0.00 3.41 2.02 -1.77 -3.10 112.91 114.81 3ghg h THR 107 Ca 0.41 -1.83 -0.11 0.00 0.77 0.00 0.00 66.41 65.66 3ghg h THR 107 Cb 0.65 1.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.86 3ghg h THR 107 CO -0.96 0.56 -0.50 0.22 0.37 0.00 0.00 175.52 175.20 3ghg h TYR 108 N 0.36 0.00 0.03 3.16 5.03 0.17 -0.62 116.97 125.11 3ghg h TYR 108 Ca 0.00 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.31 3ghg h TYR 108 Cb 1.09 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.37 3ghg h TYR 108 CO 0.04 0.50 -0.02 -0.91 -1.32 0.00 0.00 178.16 176.46 3ghg h ASN 109 N 0.00 -0.04 0.00 -2.11 -0.26 0.59 -3.30 115.58 110.46 3ghg h ASN 109 Ca -0.01 -0.23 -0.05 0.00 -0.56 0.00 0.00 56.30 55.45 3ghg h ASN 109 Cb 0.90 0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 38.16 3ghg h ASN 109 CO 0.07 0.21 -1.02 0.54 -1.06 0.00 0.00 177.43 176.17 3ghg n ARG 110 N -4.99 0.45 0.26 0.81 1.74 -1.21 -3.44 116.66 110.27 3ghg n ARG 110 Ca -0.08 0.18 0.18 0.00 -0.77 0.00 0.00 57.85 57.36 3ghg n ARG 110 Cb 0.15 -1.28 0.91 0.00 -1.02 0.00 0.00 32.46 31.22 3ghg n ARG 110 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3ghg h VAL 111 N -0.83 0.28 0.00 1.55 2.07 -1.35 0.23 116.25 118.20 3ghg h VAL 111 Ca -0.07 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.29 3ghg h VAL 111 Cb 0.92 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 3ghg h VAL 111 CO -0.05 0.00 -0.84 0.77 0.02 0.00 0.00 177.57 177.48 3ghg h SER 112 N 0.00 0.01 0.81 0.57 4.64 -1.58 -3.37 113.55 114.63 3ghg h SER 112 Ca 0.05 -0.69 -0.04 0.00 -0.47 0.00 0.00 61.79 60.64 3ghg h SER 112 Cb 0.41 -0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.50 3ghg h SER 112 CO -0.00 1.33 -0.39 -0.08 -0.87 0.00 0.00 176.83 176.82 3ghg h GLU 113 N -0.98 -1.04 -0.96 4.77 4.22 -0.67 -0.44 114.58 119.48 3ghg h GLU 113 Ca -0.23 0.07 0.14 0.00 0.08 0.00 0.00 59.36 59.42 3ghg h GLU 113 Cb 1.22 0.24 -0.09 0.00 0.50 0.00 0.00 28.75 30.61 3ghg h GLU 113 CO -0.13 -0.68 0.58 -0.44 -2.18 0.00 0.00 179.01 176.16 3ghg h ASP 114 N -1.20 0.81 -0.45 1.04 3.32 -1.22 -0.25 116.42 118.46 3ghg h ASP 114 Ca -0.11 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.03 3ghg h ASP 114 Cb 0.84 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.27 3ghg h ASP 114 CO 0.18 0.40 0.25 -0.07 -1.72 0.00 0.00 179.24 178.28 3ghg h LEU 115 N 0.87 0.40 -1.57 1.55 3.38 -1.66 -1.67 115.31 116.61 3ghg h LEU 115 Ca 0.50 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.57 3ghg h LEU 115 Cb 0.58 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 3ghg h LEU 115 CO -0.30 0.29 0.42 0.03 0.09 0.00 0.00 178.44 178.97 3ghg h ARG 116 N 0.51 0.47 -0.06 1.13 3.08 0.68 0.34 114.38 120.54 3ghg h ARG 116 Ca 0.18 -0.03 -0.17 0.00 0.07 0.00 0.00 59.98 60.03 3ghg h ARG 116 Cb 0.04 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3ghg h ARG 116 CO -0.10 0.31 -0.71 0.66 -1.07 0.00 0.00 179.97 179.07 3ghg h SER 117 N 0.49 0.35 -0.25 7.04 4.64 -1.02 -2.62 113.55 122.18 3ghg h SER 117 Ca 0.29 -0.23 -0.15 0.00 -0.47 0.00 0.00 61.79 61.23 3ghg h SER 117 Cb 0.49 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3ghg h SER 117 CO -0.09 0.95 -0.42 0.03 -0.87 0.00 0.00 176.83 176.43 3ghg h ARG 118 N 0.20 0.72 -0.86 4.77 3.08 0.28 0.34 114.38 122.92 3ghg h ARG 118 Ca -0.02 -0.45 0.00 0.00 0.07 0.00 0.00 59.98 59.58 3ghg h ARG 118 Cb 1.27 0.05 -0.04 0.00 0.08 0.00 0.00 29.97 31.33 3ghg h ARG 118 CO 0.11 1.07 0.55 0.82 -1.07 0.00 0.00 179.97 181.45 3ghg h ILE 119 N 0.45 1.23 0.22 2.04 1.08 -0.55 -1.23 117.51 120.74 3ghg h ILE 119 Ca 0.02 -0.44 -0.01 0.00 -0.39 0.00 0.00 64.86 64.04 3ghg h ILE 119 Cb 1.02 -0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.76 3ghg h ILE 119 CO 0.10 0.22 -0.10 -0.08 -0.69 0.00 0.00 178.15 177.60 3ghg h GLU 120 N 1.17 -0.28 0.00 2.37 4.22 -1.38 -3.18 114.58 117.51 3ghg h GLU 120 Ca 0.31 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.77 3ghg h GLU 120 Cb -0.11 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.21 3ghg h GLU 120 CO -0.06 0.09 0.13 0.28 -2.18 0.00 0.00 179.01 177.27 3ghg h VAL 121 N -0.90 0.00 -0.83 0.32 2.07 -0.89 0.78 116.25 116.80 3ghg h VAL 121 Ca -0.03 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.52 3ghg h VAL 121 Cb 0.50 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3ghg h VAL 121 CO 0.05 0.00 0.54 0.25 0.02 0.00 0.00 177.57 178.43 3ghg h LEU 122 N 0.00 0.90 -0.30 2.57 7.12 -1.20 -3.27 115.31 121.13 3ghg h LEU 122 Ca 0.00 -0.01 -0.19 0.00 0.13 0.00 0.00 57.88 57.81 3ghg h LEU 122 Cb 0.26 -0.21 0.00 0.00 -0.53 0.00 0.00 40.66 40.18 3ghg h LEU 122 CO 0.00 0.62 -0.54 0.11 -0.13 0.00 0.00 178.44 178.50 3ghg h LYS 123 N 1.05 0.89 -1.04 1.25 1.57 0.54 -0.74 116.57 120.09 3ghg h LYS 123 Ca 0.33 -0.56 0.29 0.00 -1.87 0.00 0.00 60.65 58.83 3ghg h LYS 123 Cb -0.02 0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.30 3ghg h LYS 123 CO -0.11 1.20 0.72 0.00 -0.57 0.00 0.00 179.45 180.69 3ghg h ARG 124 N 0.68 0.16 0.00 3.15 3.08 -1.59 0.38 114.38 120.24 3ghg h ARG 124 Ca 0.02 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3ghg h ARG 124 Cb 1.15 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 3ghg h ARG 124 CO 0.12 0.11 -0.27 0.87 -1.07 0.00 0.00 179.97 179.73 3ghg h LYS 125 N 0.17 0.00 0.00 0.04 1.57 -1.62 -3.37 116.57 113.36 3ghg h LYS 125 Ca 0.53 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.31 3ghg h LYS 125 Cb 1.78 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.09 3ghg h LYS 125 CO -0.12 0.74 0.00 1.55 -0.57 0.00 0.00 179.45 181.05 3ghg n VAL 126 N -4.61 1.00 0.10 0.50 3.14 0.04 -0.47 118.33 118.03 3ghg n VAL 126 Ca -0.12 0.58 -0.18 0.00 -2.96 0.00 0.00 64.34 61.66 3ghg n VAL 126 Cb 0.41 -1.55 -0.14 0.00 -1.06 0.00 0.00 33.84 31.49 3ghg n VAL 126 CO 0.00 0.00 0.00 -0.29 -6.46 0.00 0.00 176.83 170.08 3ghg h ILE 127 N 0.00 1.39 -0.13 1.55 6.09 -0.55 -2.73 117.51 123.13 3ghg h ILE 127 Ca 0.00 -2.95 0.04 0.00 -1.37 0.00 0.00 64.86 60.58 3ghg h ILE 127 Cb 0.11 2.93 -0.05 0.00 0.47 0.00 0.00 36.82 40.28 3ghg h ILE 127 CO 0.00 0.87 -0.18 -0.33 -3.07 0.00 0.00 178.15 175.44 3ghg h GLU 128 N 0.09 -0.22 -0.30 2.19 4.39 -0.93 0.45 114.58 120.24 3ghg h GLU 128 Ca -0.18 0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.43 3ghg h GLU 128 Cb 2.02 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 30.70 3ghg h GLU 128 CO 0.21 -0.15 -0.24 0.87 -1.16 0.00 0.00 179.01 178.54 3ghg h LYS 129 N -0.23 0.59 -0.05 2.33 6.56 -1.52 0.33 116.57 124.59 3ghg h LYS 129 Ca 0.10 -0.23 -0.03 0.00 -1.06 0.00 0.00 60.65 59.42 3ghg h LYS 129 Cb 0.37 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 3ghg h LYS 129 CO -0.26 0.79 -0.10 0.28 -2.06 0.00 0.00 179.45 178.10 3ghg h VAL 130 N 0.52 1.43 -0.12 0.50 2.07 -1.38 -3.17 116.25 116.10 3ghg h VAL 130 Ca 0.07 -1.42 0.02 0.00 0.82 0.00 0.00 66.70 66.19 3ghg h VAL 130 Cb 0.70 2.26 -0.03 0.00 -1.52 0.00 0.00 31.29 32.69 3ghg h VAL 130 CO 0.05 0.39 -0.24 -0.61 0.02 0.00 0.00 177.57 177.18 3ghg h GLN 131 N -0.36 -0.20 -1.07 1.57 5.75 0.73 0.01 115.11 121.53 3ghg h GLN 131 Ca 0.00 0.01 0.29 0.00 -0.15 0.00 0.00 58.65 58.81 3ghg h GLN 131 Cb 0.68 0.05 -0.11 0.00 1.07 0.00 0.00 27.48 29.16 3ghg h GLN 131 CO 0.02 -0.14 0.67 0.45 -2.65 0.00 0.00 178.83 177.18 3ghg h HIS 132 N -0.21 0.74 0.00 3.99 3.86 -1.09 0.48 115.15 122.91 3ghg h HIS 132 Ca 0.02 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.18 3ghg h HIS 132 Cb 0.28 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 3ghg h HIS 132 CO -0.59 -0.00 -0.37 0.82 0.86 0.00 0.00 177.93 178.65 3ghg h ILE 133 N 0.38 1.02 -0.01 2.45 5.03 -0.99 0.57 117.51 125.96 3ghg h ILE 133 Ca 0.65 -1.40 -0.16 0.00 -0.12 0.00 0.00 64.86 63.84 3ghg h ILE 133 Cb 1.61 1.81 -0.02 0.00 -3.03 0.00 0.00 36.82 37.19 3ghg h ILE 133 CO -0.38 0.36 -0.72 1.56 -0.68 0.00 0.00 178.15 178.29 3ghg h GLN 134 N 0.00 0.06 -0.13 2.37 4.20 0.82 0.15 115.11 122.58 3ghg h GLN 134 Ca -0.00 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 3ghg h GLN 134 Cb 0.78 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.58 3ghg h GLN 134 CO 0.05 0.75 -0.40 1.25 -0.67 0.00 0.00 178.83 179.82 3ghg h LEU 135 N 0.04 0.57 -0.81 1.46 6.46 -1.00 -2.70 115.31 119.32 3ghg h LEU 135 Ca -0.01 -0.60 -0.11 0.00 -0.12 0.00 0.00 57.88 57.03 3ghg h LEU 135 Cb 1.27 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 41.03 3ghg h LEU 135 CO 0.10 1.07 -0.33 -0.07 -0.62 0.00 0.00 178.44 178.59 3ghg h LEU 136 N 0.09 0.52 -0.37 2.25 -0.00 -0.81 0.31 115.31 117.31 3ghg h LEU 136 Ca -0.01 -0.21 0.08 0.00 -0.00 0.00 0.00 57.88 57.74 3ghg h LEU 136 Cb 1.02 -0.15 -0.07 0.00 -0.00 0.00 0.00 40.66 41.46 3ghg h LEU 136 CO 0.08 0.82 -0.10 1.56 -0.00 0.00 0.00 178.44 180.80 3ghg h GLN 137 N 0.43 -0.02 0.23 1.13 4.20 -0.96 0.35 115.11 120.47 3ghg h GLN 137 Ca 0.05 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 3ghg h GLN 137 Cb 0.79 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.57 3ghg h GLN 137 CO 0.06 -0.01 -0.11 -0.22 -0.67 0.00 0.00 178.83 177.88 3ghg h LYS 138 N -0.02 -0.29 -0.81 1.46 1.63 -1.04 -0.73 116.57 116.76 3ghg h LYS 138 Ca 0.18 0.02 0.15 0.00 -0.85 0.00 0.00 60.65 60.15 3ghg h LYS 138 Cb 0.29 0.07 -0.15 0.00 -0.60 0.00 0.00 32.23 31.84 3ghg h LYS 138 CO -0.39 0.08 -0.24 0.09 -3.45 0.00 0.00 179.45 175.54 3ghg n ASN 139 N -5.03 -0.37 0.06 4.20 3.02 0.10 -1.72 115.26 115.52 3ghg n ASN 139 Ca -0.09 1.40 -0.20 0.00 -0.03 0.00 0.00 54.58 55.66 3ghg n ASN 139 Cb 0.26 -0.39 -0.11 0.00 -0.61 0.00 0.00 39.78 38.93 3ghg n ASN 139 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 3ghg h VAL 140 N 0.00 1.29 -0.69 2.41 -1.51 -0.85 -2.22 116.25 114.69 3ghg h VAL 140 Ca 0.35 -2.34 0.12 0.00 -1.23 0.00 0.00 66.70 63.61 3ghg h VAL 140 Cb 0.56 2.49 -0.13 0.00 -2.13 0.00 0.00 31.29 32.08 3ghg h VAL 140 CO -0.82 0.72 -0.30 -0.09 -1.23 0.00 0.00 177.57 175.85 3ghg h ARG 141 N 0.35 -0.09 -0.22 5.19 2.43 -0.25 0.31 114.38 122.10 3ghg h ARG 141 Ca -0.15 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.05 3ghg h ARG 141 Cb 1.77 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 31.31 3ghg h ARG 141 CO 0.21 -0.06 -0.16 0.00 -1.51 0.00 0.00 179.97 178.46 3ghg h ALA 142 N 1.27 -0.24 -0.99 2.80 0.00 -1.29 -2.19 119.26 118.62 3ghg h ALA 142 Ca 0.28 0.02 0.28 0.00 0.00 0.00 0.00 54.91 55.50 3ghg h ALA 142 Cb 0.56 1.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.31 3ghg h ALA 142 CO -0.74 -0.34 0.71 0.37 0.00 0.00 0.00 179.25 179.24 3ghg h GLN 143 N -0.04 0.03 0.17 0.00 4.15 -0.29 -1.49 115.11 117.65 3ghg h GLN 143 Ca 0.04 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 3ghg h GLN 143 Cb 0.13 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.81 3ghg h GLN 143 CO -0.22 0.02 -0.08 1.25 -1.93 0.00 0.00 178.83 177.87 3ghg h LEU 144 N 0.04 -0.19 -0.83 -2.39 5.85 0.10 -3.05 115.31 114.83 3ghg h LEU 144 Ca 0.48 0.01 0.21 0.00 0.84 0.00 0.00 57.88 59.41 3ghg h LEU 144 Cb 1.85 0.05 -0.14 0.00 0.37 0.00 0.00 40.66 42.78 3ghg h LEU 144 CO -0.03 0.17 0.06 1.62 -0.34 0.00 0.00 178.44 179.92 3ghg h VAL 145 N -0.84 0.27 -0.75 1.05 3.04 -1.04 0.65 116.25 118.63 3ghg h VAL 145 Ca -0.02 -0.04 0.16 0.00 -1.01 0.00 0.00 66.70 65.79 3ghg h VAL 145 Cb 0.17 0.15 -0.14 0.00 -2.01 0.00 0.00 31.29 29.47 3ghg h VAL 145 CO 0.04 0.02 -0.06 -0.78 -1.01 0.00 0.00 177.57 175.77 3ghg h ASP 146 N 0.11 -0.47 0.07 3.17 3.58 -1.35 0.59 116.42 122.11 3ghg h ASP 146 Ca 0.48 0.21 -0.00 0.00 0.42 0.00 0.00 57.03 58.13 3ghg h ASP 146 Cb 0.91 0.39 0.00 0.00 1.72 0.00 0.00 39.33 42.34 3ghg h ASP 146 CO -0.72 -0.21 -0.03 0.24 -2.88 0.00 0.00 179.24 175.64 3ghg h MET 147 N 0.06 -0.08 -0.95 0.28 2.86 -0.78 0.96 114.93 117.28 3ghg h MET 147 Ca 0.39 0.01 0.12 0.00 -2.06 0.00 0.00 59.70 58.16 3ghg h MET 147 Cb 0.67 0.02 -0.14 0.00 0.06 0.00 0.00 31.60 32.21 3ghg h MET 147 CO -0.70 0.42 -0.45 1.17 1.06 0.00 0.00 176.91 178.40 3ghg n LYS 148 N -4.88 -0.31 0.03 1.72 4.81 -0.76 0.28 118.16 119.05 3ghg n LYS 148 Ca -0.09 1.44 -0.04 0.00 -0.87 0.00 0.00 58.31 58.76 3ghg n LYS 148 Cb 0.27 -2.13 -0.02 0.00 0.02 0.00 0.00 35.03 33.17 3ghg n LYS 148 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3ghg h ARG 149 N 0.00 -0.16 -0.92 1.64 3.08 0.47 -0.70 114.38 117.78 3ghg h ARG 149 Ca 0.25 0.01 0.15 0.00 0.07 0.00 0.00 59.98 60.47 3ghg h ARG 149 Cb 0.49 0.04 -0.08 0.00 0.08 0.00 0.00 29.97 30.50 3ghg h ARG 149 CO -0.92 -0.11 0.59 1.25 -1.07 0.00 0.00 179.97 179.72 3ghg h LEU 150 N -0.17 0.68 -0.17 3.04 5.85 0.26 0.79 115.31 125.59 3ghg h LEU 150 Ca -0.00 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3ghg h LEU 150 Cb 0.16 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3ghg h LEU 150 CO -0.06 0.33 0.05 -0.08 -0.34 0.00 0.00 178.44 178.34 3ghg h GLU 151 N 0.71 0.27 -0.39 1.25 4.57 0.41 0.77 114.58 122.17 3ghg h GLU 151 Ca 0.47 -0.06 -0.12 0.00 -1.18 0.00 0.00 59.36 58.48 3ghg h GLU 151 Cb 0.76 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.30 3ghg h GLU 151 CO -0.23 0.39 -0.23 -0.24 -1.18 0.00 0.00 179.01 177.52 3ghg h VAL 152 N 0.10 1.27 0.00 0.32 3.04 0.34 -2.34 116.25 118.98 3ghg h VAL 152 Ca 0.06 -1.34 -0.04 0.00 -1.01 0.00 0.00 66.70 64.36 3ghg h VAL 152 Cb 0.23 1.22 -0.01 0.00 -2.01 0.00 0.00 31.29 30.72 3ghg h VAL 152 CO -0.00 0.45 -0.20 -0.78 -1.01 0.00 0.00 177.57 176.03 3ghg h ASP 153 N 0.67 0.00 0.08 3.17 3.58 0.10 -1.05 116.42 122.98 3ghg h ASP 153 Ca 0.09 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.30 3ghg h ASP 153 Cb 0.74 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.80 3ghg h ASP 153 CO 0.06 0.20 -0.92 0.40 -2.88 0.00 0.00 179.24 176.09 3ghg h ILE 154 N 0.00 1.32 -0.79 2.25 2.04 0.72 -3.15 117.51 119.90 3ghg h ILE 154 Ca -0.00 -2.22 -0.04 0.00 1.00 0.00 0.00 64.86 63.60 3ghg h ILE 154 Cb 0.56 2.27 -0.04 0.00 -0.74 0.00 0.00 36.82 38.87 3ghg h ILE 154 CO 0.03 0.68 0.35 -0.78 0.00 0.00 0.00 178.15 178.43 3ghg h ASP 155 N 0.38 1.06 -0.05 1.72 -0.00 -0.69 0.49 116.42 119.33 3ghg h ASP 155 Ca -0.09 -0.15 0.00 0.00 -0.00 0.00 0.00 57.03 56.79 3ghg h ASP 155 Cb 1.56 -0.27 -0.00 0.00 -0.00 0.00 0.00 39.33 40.61 3ghg h ASP 155 CO 0.18 0.92 0.02 0.40 -0.00 0.00 0.00 179.24 180.76 3ghg h ILE 156 N 1.13 1.00 -0.20 2.25 2.04 -1.39 -2.09 117.51 120.25 3ghg h ILE 156 Ca 0.27 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 66.09 3ghg h ILE 156 Cb 0.17 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 3ghg h ILE 156 CO -0.03 0.01 0.05 0.11 0.00 0.00 0.00 178.15 178.29 3ghg h LYS 157 N 0.05 0.31 -0.22 2.37 1.79 -1.02 0.21 116.57 120.06 3ghg h LYS 157 Ca 0.02 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 3ghg h LYS 157 Cb 0.00 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.60 3ghg h LYS 157 CO -0.01 0.44 0.15 0.82 -1.08 0.00 0.00 179.45 179.76 3ghg h ILE 158 N 0.13 1.06 -0.52 1.86 2.04 -0.14 -2.31 117.51 119.63 3ghg h ILE 158 Ca 0.06 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 3ghg h ILE 158 Cb 0.26 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 3ghg h ILE 158 CO 0.00 0.06 0.18 -0.09 0.00 0.00 0.00 178.15 178.30 3ghg h ARG 159 N 0.30 0.76 -0.34 2.37 2.43 -0.99 -1.00 114.38 117.91 3ghg h ARG 159 Ca 0.08 -0.12 0.10 0.00 -0.81 0.00 0.00 59.98 59.23 3ghg h ARG 159 Cb -0.03 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 3ghg h ARG 159 CO -0.02 0.65 0.36 1.03 -1.51 0.00 0.00 179.97 180.48 3ghg h SER 160 N 0.75 0.00 0.42 -3.80 0.87 -0.04 -1.29 113.55 110.46 3ghg h SER 160 Ca 0.18 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 3ghg h SER 160 Cb 0.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 3ghg h SER 160 CO -0.01 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.29 3ghg h ARG 162 N 0.00 0.50 -0.04 0.00 2.43 -1.38 -1.83 114.38 114.06 3ghg h ARG 162 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3ghg h ARG 162 Cb 0.21 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 3ghg h ARG 162 CO 0.00 0.33 0.00 0.41 -1.51 0.00 0.00 179.97 179.20 3ghg n GLY 163 N -1.31 -0.79 0.53 2.80 0.00 -1.24 -4.29 105.19 100.90 3ghg n GLY 163 Ca 0.11 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.48 1.27 -4.91 1.61 7.64 -0.90 -5.09 113.62 112.75 3ghg n SER 164 Ca 0.08 0.00 -0.20 0.00 1.01 0.00 0.00 58.87 59.75 3ghg n SER 164 Cb 0.07 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.25 3ghg n SER 164 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ghg n SER 166 N -1.50 0.00 -4.86 0.00 3.41 -1.26 -4.64 113.62 104.77 3ghg n SER 166 Ca -0.01 0.49 -0.31 0.00 -0.26 0.00 0.00 58.87 58.78 3ghg n SER 166 Cb 0.59 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 64.30 3ghg n SER 166 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3ghg s ARG 167 N -1.22 3.87 -0.05 4.33 3.52 -1.26 -4.96 118.95 123.18 3ghg s ARG 167 Ca 0.00 0.66 0.01 0.00 -0.13 0.00 0.00 55.73 56.28 3ghg s ARG 167 Cb 0.00 -2.31 0.02 0.00 -1.56 0.00 0.00 34.95 31.10 3ghg s ARG 167 CO 0.00 -0.09 -0.07 0.00 -0.81 0.00 0.00 175.30 174.33 3ghg s ALA 168 N -2.41 0.86 0.05 6.12 0.00 -1.26 -4.87 121.76 120.25 3ghg s ALA 168 Ca 0.54 -0.17 -0.30 0.00 0.00 0.00 0.00 51.96 52.03 3ghg s ALA 168 Cb -0.10 -0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.47 3ghg s ALA 168 CO 0.29 0.02 1.82 -1.17 0.00 0.00 0.00 175.76 176.73 3ghg s LEU 169 N 0.84 4.39 0.11 0.00 2.96 -1.26 -4.92 118.68 120.79 3ghg s LEU 169 Ca -0.12 2.58 -0.30 0.00 -0.22 0.00 0.00 54.13 56.07 3ghg s LEU 169 Cb -0.15 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.94 3ghg s LEU 169 CO 0.01 -0.99 0.96 0.00 -1.32 0.00 0.00 176.35 175.02 3ghg s ALA 170 N 3.60 3.24 -0.21 5.97 0.00 -1.26 -4.85 121.76 128.26 3ghg s ALA 170 Ca 0.81 0.58 -0.28 0.00 0.00 0.00 0.00 51.96 53.07 3ghg s ALA 170 Cb -0.41 -3.28 0.12 0.00 0.00 0.00 0.00 23.12 19.55 3ghg s ALA 170 CO 0.36 -0.03 0.99 -0.98 0.00 0.00 0.00 175.76 176.10 3ghg s ARG 171 N 0.02 0.59 -0.08 0.00 1.70 -1.26 -5.16 118.95 114.76 3ghg s ARG 171 Ca 0.47 0.36 -0.01 0.00 -0.47 0.00 0.00 55.73 56.09 3ghg s ARG 171 Cb -0.23 0.28 -0.03 0.00 -0.57 0.00 0.00 34.95 34.40 3ghg s ARG 171 CO 0.30 -0.14 -0.03 -1.21 -1.08 0.00 0.00 175.30 173.14 3ghg s GLU 172 N -0.51 2.89 -0.34 3.89 8.01 -1.26 -5.10 118.70 126.27 3ghg s GLU 172 Ca -0.00 -0.48 -0.14 0.00 0.01 0.00 0.00 54.97 54.36 3ghg s GLU 172 Cb -0.02 -2.70 -0.01 0.00 -4.31 0.00 0.00 34.13 27.08 3ghg s GLU 172 CO -0.01 0.67 0.32 0.08 0.01 0.00 0.00 175.26 176.33 3ghg s VAL 173 N -0.81 5.21 -1.21 2.63 1.01 -1.26 -5.00 120.40 120.97 3ghg s VAL 173 Ca 0.12 -0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.99 3ghg s VAL 173 Cb -0.11 -3.78 0.21 0.00 0.00 0.00 0.00 36.38 32.70 3ghg s VAL 173 CO 0.02 -0.06 1.84 -0.67 0.00 0.00 0.00 175.10 176.23 3ghg n ASP 174 N 5.28 6.10 0.22 3.32 4.64 -1.26 -4.68 116.55 130.17 3ghg n ASP 174 Ca -0.10 -3.25 0.08 0.00 -1.38 0.00 0.00 54.79 50.13 3ghg n ASP 174 Cb 0.49 -1.38 0.52 0.00 -1.04 0.00 0.00 41.12 39.72 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 6.53 0.00 -0.93 -2.67 -0.00 -2.00 -2.17 115.31 114.07 3ghg h LEU 175 Ca 0.39 0.00 0.20 0.00 -0.00 0.00 0.00 57.88 58.47 3ghg h LEU 175 Cb 0.55 0.00 -0.18 0.00 -0.00 0.00 0.00 40.66 41.03 3ghg h LEU 175 CO 1.49 0.25 -0.20 1.17 -0.00 0.00 0.00 178.44 181.15 3ghg n LYS 176 N -3.76 -0.08 0.25 0.17 3.00 -1.26 -0.31 118.16 116.16 3ghg n LYS 176 Ca -0.01 1.44 -0.16 0.00 -0.00 0.00 0.00 58.31 59.58 3ghg n LYS 176 Cb 0.35 -2.18 -0.08 0.00 0.00 0.00 0.00 35.03 33.13 3ghg n LYS 176 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 3ghg h ASP 177 N 0.00 -0.61 -0.78 3.14 3.58 -1.79 -2.79 116.42 117.17 3ghg h ASP 177 Ca 0.46 0.03 0.17 0.00 0.42 0.00 0.00 57.03 58.11 3ghg h ASP 177 Cb 0.75 0.17 -0.11 0.00 1.72 0.00 0.00 39.33 41.87 3ghg h ASP 177 CO -0.95 -0.40 0.27 1.88 -2.88 0.00 0.00 179.24 177.16 3ghg h TYR 178 N -0.63 0.44 0.15 0.28 -1.99 -0.75 -1.15 116.97 113.31 3ghg h TYR 178 Ca -0.05 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 3ghg h TYR 178 Cb 0.51 -0.07 0.00 0.00 2.00 0.00 0.00 36.73 39.17 3ghg h TYR 178 CO -0.08 -0.03 -0.07 0.93 -0.00 0.00 0.00 178.16 178.91 3ghg h GLU 179 N 0.36 -0.19 -0.29 4.88 4.39 -0.59 -1.49 114.58 121.65 3ghg h GLU 179 Ca 0.45 0.01 0.07 0.00 0.34 0.00 0.00 59.36 60.23 3ghg h GLU 179 Cb 0.76 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 29.39 3ghg h GLU 179 CO -0.48 -0.02 -0.15 -0.44 -1.16 0.00 0.00 179.01 176.76 3ghg h ASP 180 N -0.33 -0.51 -0.01 1.42 3.32 -1.20 0.91 116.42 120.03 3ghg h ASP 180 Ca -0.02 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3ghg h ASP 180 Cb 0.26 0.28 -0.00 0.00 0.22 0.00 0.00 39.33 40.08 3ghg h ASP 180 CO 0.03 -0.19 0.04 1.56 -1.72 0.00 0.00 179.24 178.96 3ghg h GLN 181 N -0.11 0.00 0.00 3.56 4.20 -1.02 1.19 115.11 122.92 3ghg h GLN 181 Ca 0.15 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.77 3ghg h GLN 181 Cb 0.35 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 3ghg h GLN 181 CO -0.37 0.00 -0.77 1.96 -0.67 0.00 0.00 178.83 178.98 3ghg h GLN 182 N 0.00 0.00 -0.99 1.46 4.20 0.13 -2.97 115.11 116.94 3ghg h GLN 182 Ca 0.00 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.83 3ghg h GLN 182 Cb 0.08 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.78 3ghg h GLN 182 CO -0.00 0.45 0.63 -0.22 -0.67 0.00 0.00 178.83 179.02 3ghg h LYS 183 N -1.00 0.95 0.05 1.46 3.64 0.96 0.67 116.57 123.30 3ghg h LYS 183 Ca -0.15 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.17 3ghg h LYS 183 Cb 0.83 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 3ghg h LYS 183 CO -0.09 0.63 -0.02 0.37 -2.27 0.00 0.00 179.45 178.07 3ghg h GLN 184 N 0.98 -0.06 -0.34 1.90 4.15 0.13 -3.22 115.11 118.64 3ghg h GLN 184 Ca 0.48 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.91 3ghg h GLN 184 Cb 0.47 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.16 3ghg h GLN 184 CO -0.24 0.20 0.22 1.25 -1.93 0.00 0.00 178.83 178.32 3ghg h LEU 185 N -0.32 0.40 -1.16 -2.39 7.12 -0.89 -2.97 115.31 115.10 3ghg h LEU 185 Ca -0.01 -0.03 0.00 0.00 0.13 0.00 0.00 57.88 57.97 3ghg h LEU 185 Cb 0.29 -0.10 -0.04 0.00 -0.53 0.00 0.00 40.66 40.28 3ghg h LEU 185 CO 0.01 0.31 0.50 -0.33 -0.13 0.00 0.00 178.44 178.80 3ghg h GLU 186 N 0.45 1.07 -0.64 1.25 4.39 0.15 0.18 114.58 121.44 3ghg h GLU 186 Ca 0.12 -0.08 0.19 0.00 0.34 0.00 0.00 59.36 59.93 3ghg h GLU 186 Cb -0.02 -0.23 -0.12 0.00 -0.10 0.00 0.00 28.75 28.28 3ghg h GLU 186 CO -0.03 0.73 0.07 0.94 -1.16 0.00 0.00 179.01 179.57 3ghg n GLN 187 N -4.39 -0.05 -0.03 2.33 7.27 -1.12 -2.95 117.38 118.43 3ghg n GLN 187 Ca 0.09 0.94 -0.11 0.00 0.07 0.00 0.00 57.00 57.99 3ghg n GLN 187 Cb 0.05 -1.53 -0.14 0.00 2.41 0.00 0.00 30.24 31.03 3ghg n GLN 187 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3ghg n VAL 188 N -4.77 1.60 0.08 1.69 0.31 0.62 -4.39 118.33 113.48 3ghg n VAL 188 Ca 0.17 -0.78 -0.10 0.00 -0.01 0.00 0.00 64.34 63.62 3ghg n VAL 188 Cb 0.55 -1.08 -0.05 0.00 -0.91 0.00 0.00 33.84 32.35 3ghg n VAL 188 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3ghg h ILE 189 N 0.01 1.53 0.00 2.52 2.04 -1.41 -3.34 117.51 118.87 3ghg h ILE 189 Ca -0.36 -2.83 0.00 0.00 1.00 0.00 0.00 64.86 62.67 3ghg h ILE 189 Cb 2.05 2.61 0.00 0.00 -0.74 0.00 0.00 36.82 40.74 3ghg h ILE 189 CO 0.07 0.82 0.00 0.00 0.00 0.00 0.00 178.15 179.04 3ghg n ALA 190 N -2.46 2.28 -0.05 1.87 0.00 -1.22 -3.89 120.51 117.05 3ghg n ALA 190 Ca -0.04 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 3ghg n ALA 190 Cb 0.87 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 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 -0.41 0.36 -2.94 0.00 5.02 -1.25 -5.02 118.16 113.91 3ghg n LYS 191 Ca 0.00 0.15 -0.43 0.00 -2.02 0.00 0.00 58.31 56.00 3ghg n LYS 191 Cb 0.03 -1.13 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 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 -6.09 6.28 0.00 4.39 -0.00 -1.25 -4.71 116.67 115.28 3ghg s ASP 192 Ca -0.21 -0.63 0.00 0.00 -0.00 0.00 0.00 52.55 51.71 3ghg s ASP 192 Cb 0.04 -2.39 0.00 0.00 -0.00 0.00 0.00 42.92 40.57 3ghg s ASP 192 CO 0.29 -1.16 0.00 0.18 -0.00 0.00 0.00 175.17 174.48 3ghg n LEU 193 N 7.11 0.37 -2.95 1.23 4.77 -1.26 -5.01 117.00 121.26 3ghg n LEU 193 Ca -0.02 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.87 3ghg n LEU 193 Cb 0.46 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.60 3ghg n LEU 193 CO 0.61 0.06 0.10 0.18 -1.33 0.00 0.00 177.39 177.01 3ghg n LEU 194 N -1.68 -5.38 0.00 2.23 4.32 -1.26 -5.05 117.00 110.18 3ghg n LEU 194 Ca 0.00 -0.46 0.00 0.00 -0.02 0.00 0.00 56.01 55.53 3ghg n LEU 194 Cb 0.35 -2.86 0.00 0.00 -1.62 0.00 0.00 43.42 39.29 3ghg n LEU 194 CO 0.00 -0.20 0.00 -0.81 -1.22 0.00 0.00 177.39 175.16 3ghg n PRO 195 N -2.62 0.00 -0.16 3.23 -0.04 -1.26 -4.74 135.00 129.41 3ghg n PRO 195 Ca -0.04 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.40 3ghg n PRO 195 Cb 0.57 -0.25 0.01 0.00 -0.04 0.00 0.00 33.50 33.80 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 -0.86 -0.30 -4.57 3.54 7.64 -1.26 -3.45 113.62 114.37 3ghg n SER 196 Ca 0.00 0.72 -0.41 0.00 1.01 0.00 0.00 58.87 60.19 3ghg n SER 196 Cb 0.00 -0.15 -0.02 0.00 -1.01 0.00 0.00 64.21 63.03 3ghg n SER 196 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3ghg s ARG 197 N -5.35 3.65 -0.23 1.43 3.00 -1.26 -4.70 118.95 115.48 3ghg s ARG 197 Ca -0.05 -1.34 0.08 0.00 0.00 0.00 0.00 55.73 54.41 3ghg s ARG 197 Cb 0.08 -5.40 -0.20 0.00 0.00 0.00 0.00 34.95 29.43 3ghg s ARG 197 CO 0.28 -2.29 -0.11 -0.25 0.00 0.00 0.00 175.30 172.94 3ghg n ASP 198 N 9.01 1.20 -3.95 0.23 8.00 -1.22 -5.05 116.55 124.76 3ghg n ASP 198 Ca 0.38 -0.08 -0.16 0.00 0.71 0.00 0.00 54.79 55.64 3ghg n ASP 198 Cb 0.49 0.16 -0.14 0.00 -0.02 0.00 0.00 41.12 41.61 3ghg n ASP 198 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ghg s ARG 199 N -2.50 0.42 0.00 -1.24 1.70 -1.26 -5.22 118.95 110.85 3ghg s ARG 199 Ca -0.25 -0.18 0.00 0.00 -0.47 0.00 0.00 55.73 54.83 3ghg s ARG 199 Cb 0.08 -0.41 0.00 0.00 -0.57 0.00 0.00 34.95 34.04 3ghg s ARG 199 CO 0.69 0.10 0.00 1.04 -1.08 0.00 0.00 175.30 176.05