#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gii h PHE 3 N 0.00 0.47 0.00 0.66 0.04 -1.98 -3.32 116.94 112.80 2gii h PHE 3 Ca 0.00 -0.20 0.00 0.00 2.80 0.00 0.00 57.97 60.57 2gii h PHE 3 Cb 0.00 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.08 2gii h PHE 3 CO 0.00 0.94 -0.87 -0.84 -0.60 0.00 0.00 178.31 176.94 2gii h ILE 4 N 0.24 0.00 -0.62 -0.55 3.07 -2.01 -3.38 117.51 114.26 2gii h ILE 4 Ca -0.02 -0.95 0.11 0.00 1.55 0.00 0.00 64.86 65.54 2gii h ILE 4 Cb 1.27 1.51 -0.08 0.00 -0.27 0.00 0.00 36.82 39.25 2gii h ILE 4 CO 0.12 0.00 0.21 0.50 -1.05 0.00 0.00 178.15 177.93 2gii h LYS 5 N 0.00 0.36 0.00 0.16 1.63 -1.99 -0.07 116.57 116.66 2gii h LYS 5 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2gii h LYS 5 Cb 0.98 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.53 2gii h LYS 5 CO 0.00 0.24 0.03 -0.35 -3.45 0.00 0.00 179.45 175.92 2gii n PRO 6 N -5.03 0.07 -0.21 1.90 -0.04 -1.26 -1.02 135.00 129.41 2gii n PRO 6 Ca 0.09 0.55 0.05 0.00 -0.04 0.00 0.00 63.50 64.15 2gii n PRO 6 Cb 0.31 -1.76 0.06 0.00 -0.04 0.00 0.00 33.50 32.07 2gii n PRO 6 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2gii n ILE 7 N -1.86 0.96 -0.30 0.52 -5.35 -0.29 -4.79 119.36 108.24 2gii n ILE 7 Ca -0.01 -1.13 -0.05 0.00 -0.27 0.00 0.00 62.75 61.29 2gii n ILE 7 Cb 0.05 0.21 0.07 0.00 -1.74 0.00 0.00 39.64 38.23 2gii n ILE 7 CO 0.00 0.00 0.00 0.22 -1.76 0.00 0.00 176.55 175.01 2gii h TYR 8 N 0.00 1.21 -0.99 4.28 3.20 0.66 -2.91 116.97 122.41 2gii h TYR 8 Ca 0.00 -0.07 0.15 0.00 3.14 0.00 0.00 58.73 61.95 2gii h TYR 8 Cb 1.09 -0.37 -0.09 0.00 1.54 0.00 0.00 36.73 38.90 2gii h TYR 8 CO 0.04 0.89 0.61 1.96 -1.64 0.00 0.00 178.16 180.01 2gii h GLN 9 N 1.18 0.86 -0.11 1.82 1.08 -1.87 -0.42 115.11 117.66 2gii h GLN 9 Ca 0.28 -0.05 -0.16 0.00 -1.45 0.00 0.00 58.65 57.26 2gii h GLN 9 Cb 0.15 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.38 2gii h GLN 9 CO -0.03 0.57 -0.63 -0.44 -0.95 0.00 0.00 178.83 177.35 2gii h ASP 10 N 0.89 0.45 -0.32 1.46 3.45 -1.89 -1.92 116.42 118.54 2gii h ASP 10 Ca 0.52 -0.27 -0.05 0.00 0.43 0.00 0.00 57.03 57.67 2gii h ASP 10 Cb 0.64 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 39.27 2gii h ASP 10 CO -0.31 0.97 0.01 0.40 -1.57 0.00 0.00 179.24 178.73 2gii h ILE 11 N 0.29 1.25 -0.04 0.35 2.04 -1.03 -0.10 117.51 120.27 2gii h ILE 11 Ca -0.01 -0.93 0.02 0.00 1.00 0.00 0.00 64.86 64.94 2gii h ILE 11 Cb 1.17 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 38.46 2gii h ILE 11 CO 0.11 0.30 -0.09 -1.13 0.00 0.00 0.00 178.15 177.34 2gii h ASN 12 N 0.36 -0.28 0.10 1.72 -1.24 -1.07 -0.44 115.58 114.72 2gii h ASN 12 Ca 0.09 0.05 0.00 0.00 0.71 0.00 0.00 56.30 57.15 2gii h ASN 12 Cb 0.43 0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.60 2gii h ASN 12 CO 0.01 -0.13 -0.08 0.28 -1.29 0.00 0.00 177.43 176.22 2gii h SER 13 N -0.14 -0.20 0.41 1.15 0.02 -1.16 -0.68 113.55 112.94 2gii h SER 13 Ca 0.05 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 2gii h SER 13 Cb 0.21 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 2gii h SER 13 CO -0.13 -0.12 -0.17 -0.29 -1.14 0.00 0.00 176.83 174.97 2gii h ILE 14 N -0.18 0.72 0.19 3.27 2.10 -0.86 -3.18 117.51 119.57 2gii h ILE 14 Ca -0.00 -0.71 -0.34 0.00 1.08 0.00 0.00 64.86 64.89 2gii h ILE 14 Cb 0.17 1.44 0.01 0.00 -1.09 0.00 0.00 36.82 37.35 2gii h ILE 14 CO -0.01 0.17 -1.67 -0.07 -1.08 0.00 0.00 178.15 175.49 2gii h LEU 15 N 0.00 0.63 -8.91 2.19 3.38 -0.79 -3.41 115.31 108.40 2gii h LEU 15 Ca -0.00 -0.93 -0.57 0.00 0.09 0.00 0.00 57.88 56.47 2gii h LEU 15 Cb 0.42 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2gii h LEU 15 CO 0.02 1.76 1.52 -0.38 0.09 0.00 0.00 178.44 181.46 2gii n ILE 16 N -3.66 0.26 0.00 1.22 5.41 -0.29 -1.24 119.36 121.06 2gii n ILE 16 Ca -0.24 -0.53 0.00 0.00 1.00 0.00 0.00 62.75 62.99 2gii n ILE 16 Cb 1.06 -2.60 0.00 0.00 -0.71 0.00 0.00 39.64 37.39 2gii n ILE 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2gii n GLY 17 N 5.84 1.63 3.68 7.39 0.00 -0.65 -4.97 105.19 118.12 2gii n GLY 17 Ca 0.31 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.89 2gii n GLY 17 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2gii n GLN 18 N -0.07 2.28 -4.08 1.61 1.13 -0.38 -4.65 117.38 113.23 2gii n GLN 18 Ca 0.00 0.82 -0.32 0.00 -1.94 0.00 0.00 57.00 55.56 2gii n GLN 18 Cb 0.00 -2.59 -0.16 0.00 0.11 0.00 0.00 30.24 27.60 2gii n GLN 18 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2gii s LYS 19 N 0.75 2.51 0.36 -1.09 1.02 -1.26 -2.28 119.74 119.75 2gii s LYS 19 Ca 0.76 -1.08 0.10 0.00 0.02 0.00 0.00 55.97 55.77 2gii s LYS 19 Cb -0.63 -2.70 0.67 0.00 -0.52 0.00 0.00 37.83 34.64 2gii s LYS 19 CO 0.38 -0.41 1.83 0.93 -0.92 0.00 0.00 175.35 177.16 2gii h GLU 35 N 7.86 0.17 -5.44 1.68 5.08 -2.03 -3.42 114.58 118.48 2gii h GLU 35 Ca -0.31 -0.06 -0.68 0.00 -1.00 0.00 0.00 59.36 57.32 2gii h GLU 35 Cb 1.09 -0.01 -0.13 0.00 0.50 0.00 0.00 28.75 30.19 2gii h GLU 35 CO 0.53 0.44 1.48 -1.25 -1.00 0.00 0.00 179.01 179.22 2gii s PRO 36 N -4.41 3.82 0.00 2.33 0.04 -1.26 -4.61 135.00 130.92 2gii s PRO 36 Ca -0.04 -1.86 0.30 0.00 0.04 0.00 0.00 61.00 59.43 2gii s PRO 36 Cb 0.15 -5.22 1.50 0.00 0.04 0.00 0.00 34.50 30.97 2gii s PRO 36 CO 0.74 -2.00 2.01 1.19 0.04 0.00 0.00 177.00 178.98 2gii n PHE 37 N 7.38 0.00 -0.36 0.56 3.01 -1.26 -3.49 117.46 123.30 2gii n PHE 37 Ca 0.36 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.88 2gii n PHE 37 Cb 0.47 -0.07 0.22 0.00 -0.01 0.00 0.00 39.48 40.10 2gii n PHE 37 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2gii h GLU 38 N 0.69 1.01 -0.52 -1.08 5.08 -1.95 -0.82 114.58 117.01 2gii h GLU 38 Ca 0.00 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2gii h GLU 38 Cb 0.23 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2gii h GLU 38 CO 0.00 0.67 0.23 1.57 -1.00 0.00 0.00 179.01 180.48 2gii h LYS 39 N 1.04 0.75 -0.07 2.33 2.10 -1.97 -0.34 116.57 120.42 2gii h LYS 39 Ca 0.48 -0.12 -0.06 0.00 -2.00 0.00 0.00 60.65 58.95 2gii h LYS 39 Cb 0.41 -0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 31.59 2gii h LYS 39 CO -0.24 0.64 -0.23 -0.07 -2.00 0.00 0.00 179.45 177.55 2gii h LEU 40 N 0.69 0.11 -0.09 7.07 4.07 -1.43 0.16 115.31 125.89 2gii h LEU 40 Ca 0.18 -0.03 -0.11 0.00 0.08 0.00 0.00 57.88 58.00 2gii h LEU 40 Cb 0.15 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 41.86 2gii h LEU 40 CO -0.02 0.36 -0.38 0.58 -1.08 0.00 0.00 178.44 177.90 2gii h VAL 41 N 0.11 1.39 -0.23 1.22 2.07 -0.84 -2.38 116.25 117.59 2gii h VAL 41 Ca 0.02 -1.73 -0.00 0.00 0.82 0.00 0.00 66.70 65.81 2gii h VAL 41 Cb 0.48 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 32.46 2gii h VAL 41 CO 0.03 0.51 0.14 0.22 0.02 0.00 0.00 177.57 178.49 2gii h TYR 42 N -0.02 0.30 -0.89 1.57 5.03 -0.72 -1.62 116.97 120.62 2gii h TYR 42 Ca -0.02 0.00 0.12 0.00 2.58 0.00 0.00 58.73 61.41 2gii h TYR 42 Cb 1.02 -0.10 -0.08 0.00 1.55 0.00 0.00 36.73 39.11 2gii h TYR 42 CO 0.12 0.22 0.52 0.87 -1.32 0.00 0.00 178.16 178.57 2gii h LYS 43 N 0.29 0.79 0.79 1.82 1.79 -0.71 -1.16 116.57 120.17 2gii h LYS 43 Ca 0.08 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.47 2gii h LYS 43 Cb 0.01 -0.18 0.01 0.00 -1.58 0.00 0.00 32.23 30.49 2gii h LYS 43 CO -0.02 0.52 -0.38 0.35 -1.08 0.00 0.00 179.45 178.85 2gii h PHE 44 N 0.81 -0.98 -0.95 -1.35 3.57 -0.84 -2.72 116.94 114.49 2gii h PHE 44 Ca 0.45 -0.02 0.21 0.00 3.53 0.00 0.00 57.97 62.14 2gii h PHE 44 Cb 0.49 0.32 -0.12 0.00 2.79 0.00 0.00 35.95 39.43 2gii h PHE 44 CO -0.05 -0.61 0.52 -0.07 -2.23 0.00 0.00 178.31 175.87 2gii h LEU 45 N -1.08 0.57 -2.10 0.59 -0.00 -1.05 0.34 115.31 112.58 2gii h LEU 45 Ca -0.11 0.13 0.04 0.00 -0.00 0.00 0.00 57.88 57.94 2gii h LEU 45 Cb 0.81 0.04 -0.00 0.00 -0.00 0.00 0.00 40.66 41.51 2gii h LEU 45 CO 0.18 0.12 0.10 0.11 -0.00 0.00 0.00 178.44 178.95 2gii h LYS 46 N 0.57 0.00 0.00 1.13 6.56 -1.06 0.65 116.57 124.42 2gii h LYS 46 Ca 0.58 0.00 -0.27 0.00 -1.06 0.00 0.00 60.65 59.90 2gii h LYS 46 Cb 1.03 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.65 2gii h LYS 46 CO -0.46 0.00 -1.62 0.93 -2.06 0.00 0.00 179.45 176.24 2gii h GLU 47 N 0.00 0.00 0.00 3.15 5.08 -0.03 -3.23 114.58 119.55 2gii h GLU 47 Ca 0.06 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.26 2gii h GLU 47 Cb 0.25 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 2gii h GLU 47 CO -0.00 0.49 -2.06 0.09 -1.00 0.00 0.00 179.01 176.53 2gii n ASN 48 N -3.04 0.52 -2.78 1.42 4.13 -0.81 -4.58 115.26 110.13 2gii n ASN 48 Ca -0.15 0.00 -0.17 0.00 1.68 0.00 0.00 54.58 55.94 2gii n ASN 48 Cb 1.02 1.44 0.00 0.00 -1.54 0.00 0.00 39.78 40.70 2gii n ASN 48 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2gii n LEU 49 N -2.42 2.32 -0.24 3.41 4.77 0.22 -4.95 117.00 120.11 2gii n LEU 49 Ca -0.16 -4.55 0.13 0.00 -0.03 0.00 0.00 56.01 51.39 2gii n LEU 49 Cb 0.79 0.20 0.41 0.00 -2.33 0.00 0.00 43.42 42.49 2gii n LEU 49 CO 0.40 1.96 1.22 0.28 -1.33 0.00 0.00 177.39 179.92 2gii h SER 50 N 2.91 0.59 1.55 -1.43 0.02 -1.57 -0.90 113.55 114.72 2gii h SER 50 Ca 0.06 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2gii h SER 50 Cb 1.00 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2gii h SER 50 CO 0.61 0.30 0.00 0.44 -1.14 0.00 0.00 176.83 177.04 2gii h ASP 51 N 0.63 0.00 0.00 3.07 5.19 -1.91 -3.33 116.42 120.06 2gii h ASP 51 Ca 0.43 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.84 2gii h ASP 51 Cb 0.75 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.26 2gii h ASP 51 CO -0.18 0.00 -1.42 0.18 -3.12 0.00 0.00 179.24 174.70 2gii n LEU 52 N -2.75 0.08 -4.60 1.55 4.32 -0.68 -4.89 117.00 110.03 2gii n LEU 52 Ca 0.04 -0.07 -0.43 0.00 -0.02 0.00 0.00 56.01 55.53 2gii n LEU 52 Cb 0.43 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.20 2gii n LEU 52 CO 0.30 0.02 0.78 -0.89 -1.22 0.00 0.00 177.39 176.39 2gii s THR 53 N -2.75 4.54 0.07 -5.08 2.01 -0.43 -1.42 115.64 112.58 2gii s THR 53 Ca -0.03 1.16 0.04 0.00 0.31 0.00 0.00 61.69 63.17 2gii s THR 53 Cb 0.08 -4.37 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 2gii s THR 53 CO 0.51 -0.60 -0.11 -0.36 -0.69 0.00 0.00 174.62 173.36 2gii s PHE 54 N 3.58 1.02 0.22 4.92 0.08 0.67 -4.94 117.98 123.53 2gii s PHE 54 Ca 0.39 -0.51 -0.12 0.00 0.12 0.00 0.00 56.93 56.80 2gii s PHE 54 Cb -0.11 -0.58 -0.07 0.00 -0.57 0.00 0.00 43.02 41.68 2gii s PHE 54 CO 0.20 0.00 0.59 0.15 -0.10 0.00 0.00 175.22 176.06 2gii s LYS 55 N -1.92 3.89 0.19 0.44 -0.14 -1.26 0.31 119.74 121.25 2gii s LYS 55 Ca -0.03 0.41 -0.13 0.00 -1.36 0.00 0.00 55.97 54.87 2gii s LYS 55 Cb -0.08 -2.69 0.20 0.00 -1.68 0.00 0.00 37.83 33.57 2gii s LYS 55 CO 0.01 0.33 1.71 0.37 -0.76 0.00 0.00 175.35 177.02 2gii h GLN 56 N 2.77 0.22 -0.01 1.68 4.15 -1.80 -1.51 115.11 120.60 2gii h GLN 56 Ca -0.47 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 58.86 2gii h GLN 56 Cb 1.18 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.81 2gii h GLN 56 CO 0.68 0.14 -0.33 0.10 -1.93 0.00 0.00 178.83 177.49 2gii h TYR 57 N 0.22 0.03 -0.31 3.99 -0.00 -1.88 -2.28 116.97 116.75 2gii h TYR 57 Ca 0.25 -0.01 -0.02 0.00 -0.00 0.00 0.00 58.73 58.96 2gii h TYR 57 Cb 0.34 -0.01 -0.01 0.00 -0.00 0.00 0.00 36.73 37.05 2gii h TYR 57 CO -0.24 0.35 0.11 0.93 -0.00 0.00 0.00 178.16 179.32 2gii h GLU 58 N 0.02 0.47 -0.31 0.10 5.08 -1.69 -1.68 114.58 116.58 2gii h GLU 58 Ca 0.00 -0.09 0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2gii h GLU 58 Cb 0.59 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 2gii h GLU 58 CO 0.04 0.50 0.09 -0.92 -1.00 0.00 0.00 179.01 177.73 2gii h TYR 59 N 0.34 0.17 -0.84 4.33 3.20 -0.83 0.14 116.97 123.47 2gii h TYR 59 Ca 0.10 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.98 2gii h TYR 59 Cb 0.21 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2gii h TYR 59 CO 0.00 0.06 0.52 -0.07 -1.64 0.00 0.00 178.16 177.03 2gii h LEU 60 N 0.22 1.01 0.19 2.82 3.38 -1.31 0.30 115.31 121.92 2gii h LEU 60 Ca 0.14 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2gii h LEU 60 Cb 0.13 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2gii h LEU 60 CO -0.16 0.77 -0.09 0.78 0.09 0.00 0.00 178.44 179.83 2gii h ASN 61 N 1.16 -0.21 -0.91 -0.43 2.35 -0.76 -1.93 115.58 114.85 2gii h ASN 61 Ca 0.30 -0.13 0.03 0.00 -0.55 0.00 0.00 56.30 55.95 2gii h ASN 61 Cb -0.06 0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.31 2gii h ASN 61 CO -0.06 0.01 0.59 0.44 -1.65 0.00 0.00 177.43 176.76 2gii h ASP 62 N -0.43 0.98 0.15 5.81 3.32 -0.54 -1.19 116.42 124.52 2gii h ASP 62 Ca -0.03 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 2gii h ASP 62 Cb 0.33 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2gii h ASP 62 CO 0.04 0.68 -0.17 0.25 -1.72 0.00 0.00 179.24 178.32 2gii h LEU 63 N 1.15 0.05 0.01 1.55 5.85 -0.79 -2.51 115.31 120.61 2gii h LEU 63 Ca 0.36 -0.01 -0.23 0.00 0.84 0.00 0.00 57.88 58.84 2gii h LEU 63 Cb -0.01 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 2gii h LEU 63 CO -0.11 0.22 -1.19 -0.26 -0.34 0.00 0.00 178.44 176.76 2gii h PHE 64 N 0.05 0.02 -0.23 1.25 0.04 -0.51 -3.31 116.94 114.24 2gii h PHE 64 Ca 0.01 -0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.65 2gii h PHE 64 Cb 0.34 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.47 2gii h PHE 64 CO 0.00 1.01 -0.34 0.52 -0.60 0.00 0.00 178.31 178.91 2gii h MET 65 N 0.00 0.50 0.00 1.51 2.86 -0.87 -2.69 114.93 116.25 2gii h MET 65 Ca -0.08 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 2gii h MET 65 Cb 1.84 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.49 2gii h MET 65 CO 0.12 0.77 0.00 1.63 1.06 0.00 0.00 176.91 180.49 2gii n LYS 66 N -4.07 0.03 -3.18 1.72 4.01 -0.98 -3.55 118.16 112.14 2gii n LYS 66 Ca -0.01 0.30 -0.23 0.00 -0.51 0.00 0.00 58.31 57.86 2gii n LYS 66 Cb 0.47 -1.50 -0.06 0.00 -0.51 0.00 0.00 35.03 33.42 2gii n LYS 66 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2gii n ASN 67 N -1.46 -0.30 0.28 4.39 3.02 -1.01 -4.95 115.26 115.23 2gii n ASN 67 Ca 0.03 -2.68 0.18 0.00 -0.03 0.00 0.00 54.58 52.08 2gii n ASN 67 Cb 0.11 -0.36 0.78 0.00 -0.61 0.00 0.00 39.78 39.69 2gii n ASN 67 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 2gii h PRO 68 N 4.34 0.00 0.00 3.52 0.11 -1.61 -2.51 132.00 135.85 2gii h PRO 68 Ca 0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2gii h PRO 68 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 2gii h PRO 68 CO 0.42 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.21 2gii n ALA 69 N -2.07 2.26 -2.80 -0.75 0.00 -1.26 -4.61 120.51 111.27 2gii n ALA 69 Ca -0.00 -0.07 -0.42 0.00 0.00 0.00 0.00 53.44 52.95 2gii n ALA 69 Cb 0.26 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.15 2gii n ALA 69 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2gii s ILE 70 N -3.04 4.77 0.35 0.00 1.09 -0.95 -5.06 121.20 118.37 2gii s ILE 70 Ca 0.12 -0.92 0.09 0.00 -1.10 0.00 0.00 60.65 58.85 2gii s ILE 70 Cb 0.16 -3.72 -0.07 0.00 -1.06 0.00 0.00 42.46 37.77 2gii s ILE 70 CO 0.53 -0.34 -0.08 0.27 -0.10 0.00 0.00 174.94 175.22 2gii s ILE 71 N 1.58 2.18 0.00 2.92 -4.36 -1.26 -4.78 121.20 117.48 2gii s ILE 71 Ca 0.03 -2.17 0.00 0.00 -0.26 0.00 0.00 60.65 58.25 2gii s ILE 71 Cb -0.20 -2.70 0.00 0.00 1.25 0.00 0.00 42.46 40.81 2gii s ILE 71 CO 0.07 -0.17 0.00 0.61 0.24 0.00 0.00 174.94 175.69 2gii n GLY 72 N -0.82 -0.85 0.36 6.27 0.00 -1.26 -4.49 105.19 104.40 2gii n GLY 72 Ca -0.05 -1.39 -0.17 0.00 0.00 0.00 0.00 46.02 44.41 2gii n GLY 72 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2gii h HIS 73 N 0.00 -0.81 -1.02 1.61 2.07 -1.84 -1.67 115.15 113.49 2gii h HIS 73 Ca 0.00 -0.02 0.26 0.00 -2.85 0.00 0.00 60.37 57.76 2gii h HIS 73 Cb 0.00 0.27 -0.08 0.00 2.57 0.00 0.00 27.41 30.17 2gii h HIS 73 CO 0.00 -0.49 0.68 1.05 -3.07 0.00 0.00 177.93 176.10 2gii h GLU 74 N -0.92 0.31 -0.02 5.12 9.09 -1.93 0.38 114.58 126.62 2gii h GLU 74 Ca -0.09 -0.02 -0.10 0.00 0.05 0.00 0.00 59.36 59.20 2gii h GLU 74 Cb 0.68 -0.07 0.01 0.00 -1.65 0.00 0.00 28.75 27.72 2gii h GLU 74 CO 0.15 0.20 -0.40 0.00 0.05 0.00 0.00 179.01 179.01 2gii h ALA 75 N 1.58 0.07 0.00 1.06 0.00 -1.75 -3.16 119.26 117.07 2gii h ALA 75 Ca 0.55 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2gii h ALA 75 Cb 1.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2gii h ALA 75 CO -0.21 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.24 2gii h ARG 76 N -0.27 0.00 -0.00 0.00 3.08 -0.20 -1.17 114.38 115.82 2gii h ARG 76 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2gii h ARG 76 Cb 1.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.16 2gii h ARG 76 CO 0.08 0.00 -0.02 0.66 -1.07 0.00 0.00 179.97 179.62 2gii n TYR 77 N -2.99 0.00 -0.02 3.04 4.02 0.12 -3.04 117.16 118.29 2gii n TYR 77 Ca 0.01 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.81 2gii n TYR 77 Cb 0.30 -0.36 -0.14 0.00 -0.02 0.00 0.00 39.34 39.12 2gii n TYR 77 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 2gii h LYS 78 N 0.03 0.01 0.00 -0.72 1.63 -1.18 -3.36 116.57 112.98 2gii h LYS 78 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2gii h LYS 78 Cb 0.37 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.01 2gii h LYS 78 CO 0.00 0.53 0.10 1.28 -3.45 0.00 0.00 179.45 177.91 2gii n LEU 79 N -3.07 0.40 0.08 5.20 4.77 -1.17 -1.07 117.00 122.14 2gii n LEU 79 Ca -0.17 0.64 -0.06 0.00 -0.03 0.00 0.00 56.01 56.39 2gii n LEU 79 Cb 1.05 -0.67 -0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2gii n LEU 79 CO 0.45 -0.78 0.22 -0.26 -1.33 0.00 0.00 177.39 175.69 2gii h PHE 80 N 0.00 0.05 -3.37 -1.77 -1.00 -1.76 -3.47 116.94 105.61 2gii h PHE 80 Ca 0.00 -0.03 -0.32 0.00 2.81 0.00 0.00 57.97 60.43 2gii h PHE 80 Cb 0.20 -0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.74 2gii h PHE 80 CO 0.00 0.93 -0.40 -1.71 -1.61 0.00 0.00 178.31 175.51 2gii n ASN 81 N -3.49 -4.73 -3.53 2.17 5.15 -0.23 -4.90 115.26 105.69 2gii n ASN 81 Ca -0.01 0.12 -0.00 0.00 -0.60 0.00 0.00 54.58 54.09 2gii n ASN 81 Cb 0.86 -3.99 -0.04 0.00 -0.53 0.00 0.00 39.78 36.07 2gii n ASN 81 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2gii s SER 82 N -2.05 -0.82 0.42 1.20 0.15 -1.26 -5.04 113.70 106.29 2gii s SER 82 Ca 0.00 1.15 0.29 0.00 0.70 0.00 0.00 55.95 58.09 2gii s SER 82 Cb 0.00 1.87 1.16 0.00 -1.71 0.00 0.00 66.02 67.33 2gii s SER 82 CO 0.00 -0.16 1.85 1.55 1.20 0.00 0.00 173.24 177.68 2gii h PRO 83 N 7.56 0.00 0.16 5.44 0.13 -1.96 0.40 132.00 143.74 2gii h PRO 83 Ca -0.18 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.62 2gii h PRO 83 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2gii h PRO 83 CO 0.10 0.00 -1.68 1.15 -0.23 0.00 0.00 178.00 177.34 2gii h THR 84 N 0.00 0.93 -0.43 1.56 2.02 -1.96 -3.01 112.91 112.02 2gii h THR 84 Ca 0.00 -2.46 -0.04 0.00 0.77 0.00 0.00 66.41 64.67 2gii h THR 84 Cb 0.48 2.73 -0.02 0.00 -1.74 0.00 0.00 68.15 69.60 2gii h THR 84 CO 0.00 0.82 0.09 0.25 0.37 0.00 0.00 175.52 177.05 2gii h LEU 85 N -0.02 0.65 -0.75 2.58 5.85 -1.91 -1.48 115.31 120.23 2gii h LEU 85 Ca -0.34 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.18 2gii h LEU 85 Cb 1.99 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.80 2gii h LEU 85 CO 0.13 0.73 0.46 0.25 -0.34 0.00 0.00 178.44 179.67 2gii h LEU 86 N 0.55 0.73 -0.23 2.25 5.85 -1.04 0.97 115.31 124.40 2gii h LEU 86 Ca 0.13 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 2gii h LEU 86 Cb 0.33 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2gii h LEU 86 CO 0.00 0.49 0.12 0.15 -0.34 0.00 0.00 178.44 178.86 2gii h PHE 87 N 0.87 0.31 0.00 1.25 3.57 -1.32 -1.36 116.94 120.26 2gii h PHE 87 Ca 0.32 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.69 2gii h PHE 87 Cb 0.10 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 2gii h PHE 87 CO -0.05 0.29 -0.53 -0.07 -2.23 0.00 0.00 178.31 175.72 2gii h LEU 88 N 0.25 0.00 0.00 0.59 3.38 -0.90 -3.40 115.31 115.23 2gii h LEU 88 Ca 0.08 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.80 2gii h LEU 88 Cb 0.08 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2gii h LEU 88 CO -0.01 0.53 -1.93 0.18 0.09 0.00 0.00 178.44 177.31 2gii n LEU 89 N -3.36 2.65 -4.62 1.67 4.77 0.30 -4.42 117.00 114.00 2gii n LEU 89 Ca 0.01 -0.03 -0.39 0.00 -0.03 0.00 0.00 56.01 55.57 2gii n LEU 89 Cb 0.69 -0.55 0.04 0.00 -2.33 0.00 0.00 43.42 41.26 2gii n LEU 89 CO 0.40 0.69 0.57 -0.24 -1.33 0.00 0.00 177.39 177.49 2gii n SER 90 N -3.12 1.02 -3.52 -1.43 2.88 -0.52 -4.97 113.62 103.96 2gii n SER 90 Ca -0.30 0.89 -0.14 0.00 -1.33 0.00 0.00 58.87 58.00 2gii n SER 90 Cb 0.79 -1.39 0.07 0.00 -0.75 0.00 0.00 64.21 62.94 2gii n SER 90 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2gii n ARG 91 N -0.59 0.18 -1.13 -1.46 5.12 -1.26 -4.98 116.66 112.54 2gii n ARG 91 Ca 0.12 -1.62 -0.33 0.00 -1.93 0.00 0.00 57.85 54.09 2gii n ARG 91 Cb 0.45 -0.40 0.12 0.00 -1.16 0.00 0.00 32.46 31.47 2gii n ARG 91 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2gii s GLY 92 N -4.01 2.00 0.18 -0.13 0.00 -1.26 -4.75 107.32 99.35 2gii s GLY 92 Ca 0.40 0.68 -0.13 0.00 0.00 0.00 0.00 44.72 45.66 2gii s GLY 92 CO 0.26 1.08 1.74 0.50 0.00 0.00 0.00 173.10 176.69 2gii h LYS 93 N -1.01 0.31 -0.46 2.90 1.57 -1.99 0.05 116.57 117.94 2gii h LYS 93 Ca -0.45 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.28 2gii h LYS 93 Cb 1.28 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 2gii h LYS 93 CO 0.47 0.21 0.20 0.00 -0.57 0.00 0.00 179.45 179.75 2gii h ALA 94 N 1.32 0.60 -0.51 3.86 0.00 -1.99 -1.74 119.26 120.80 2gii h ALA 94 Ca 0.22 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2gii h ALA 94 Cb 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2gii h ALA 94 CO -0.24 0.19 -0.04 0.00 0.00 0.00 0.00 179.25 179.16 2gii h ALA 95 N 1.04 0.97 -0.18 0.00 0.00 -1.81 -0.47 119.26 118.81 2gii h ALA 95 Ca 0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 2gii h ALA 95 Cb 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2gii h ALA 95 CO -0.01 0.62 0.05 1.15 0.00 0.00 0.00 179.25 181.06 2gii h THR 96 N 0.81 1.19 -0.16 0.00 2.02 -0.80 -1.92 112.91 114.05 2gii h THR 96 Ca 0.14 -0.59 -0.07 0.00 0.77 0.00 0.00 66.41 66.66 2gii h THR 96 Cb 0.54 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 2gii h THR 96 CO 0.03 0.18 -0.22 -0.33 0.37 0.00 0.00 175.52 175.55 2gii h GLU 97 N 0.11 0.28 -0.07 6.66 3.07 -1.19 -2.34 114.58 121.10 2gii h GLU 97 Ca 0.06 -0.09 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 2gii h GLU 97 Cb 0.23 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 2gii h GLU 97 CO -0.00 0.50 0.00 0.09 -1.40 0.00 0.00 179.01 178.19 2gii n ASN 98 N -4.18 1.03 -4.77 1.42 4.13 -0.19 -4.68 115.26 108.02 2gii n ASN 98 Ca -0.01 -1.50 -0.39 0.00 1.68 0.00 0.00 54.58 54.36 2gii n ASN 98 Cb 0.35 -0.04 -0.03 0.00 -1.54 0.00 0.00 39.78 38.51 2gii n ASN 98 CO 0.00 0.00 0.00 0.86 0.28 0.00 0.00 177.26 178.40 2gii s TRP 99 N -1.92 3.35 0.17 3.10 -0.00 -0.74 -4.77 118.94 118.13 2gii s TRP 99 Ca 0.35 1.63 -0.22 0.00 -0.00 0.00 0.00 56.10 57.86 2gii s TRP 99 Cb 0.18 -3.32 0.06 0.00 -0.00 0.00 0.00 33.47 30.39 2gii s TRP 99 CO 0.28 -0.88 0.58 -1.54 -0.00 0.00 0.00 176.95 175.40 2gii s SER 100 N -1.02 -0.50 0.59 5.86 1.04 -0.46 -4.93 113.70 114.28 2gii s SER 100 Ca 0.50 -0.10 0.28 0.00 0.48 0.00 0.00 55.95 57.12 2gii s SER 100 Cb -0.31 0.59 1.65 0.00 0.10 0.00 0.00 66.02 68.05 2gii s SER 100 CO 0.39 -0.99 2.10 -0.29 0.98 0.00 0.00 173.24 175.44 2gii h ILE 101 N 2.05 0.49 0.17 -1.02 6.09 -1.99 -0.47 117.51 122.84 2gii h ILE 101 Ca -0.33 0.00 -0.33 0.00 -1.37 0.00 0.00 64.86 62.83 2gii h ILE 101 Cb 1.30 0.84 0.01 0.00 0.47 0.00 0.00 36.82 39.44 2gii h ILE 101 CO 0.38 0.00 -1.60 -0.33 -3.07 0.00 0.00 178.15 173.53 2gii h GLU 102 N 0.00 0.36 -3.27 2.19 3.07 -1.97 -3.40 114.58 111.56 2gii h GLU 102 Ca 0.09 -0.62 -0.65 0.00 -0.50 0.00 0.00 59.36 57.68 2gii h GLU 102 Cb 0.49 0.23 -0.40 0.00 -0.84 0.00 0.00 28.75 28.23 2gii h GLU 102 CO -0.00 1.26 -0.47 1.21 -1.40 0.00 0.00 179.01 179.61 2gii s ASN 103 N -7.22 4.96 0.85 1.42 2.47 -0.20 -5.09 114.94 112.12 2gii s ASN 103 Ca -0.12 -3.48 -0.09 0.00 0.42 0.00 0.00 52.86 49.60 2gii s ASN 103 Cb 0.06 -1.72 0.17 0.00 -1.45 0.00 0.00 41.25 38.31 2gii s ASN 103 CO 0.87 -0.18 1.17 -0.76 -3.72 0.00 0.00 177.10 174.48 2gii s LEU 104 N -0.95 2.84 0.17 3.21 1.43 -1.09 -1.35 118.68 122.93 2gii s LEU 104 Ca 0.22 -0.05 -0.15 0.00 -1.03 0.00 0.00 54.13 53.12 2gii s LEU 104 Cb -0.13 -2.13 -0.07 0.00 0.03 0.00 0.00 46.19 43.89 2gii s LEU 104 CO -0.10 -2.33 0.59 -0.36 0.23 0.00 0.00 176.35 174.38 2gii s PHE 105 N -3.54 3.61 0.47 0.29 2.99 -1.26 -4.96 117.98 115.57 2gii s PHE 105 Ca 0.70 1.13 0.03 0.00 0.00 0.00 0.00 56.93 58.79 2gii s PHE 105 Cb -0.04 -2.42 -0.03 0.00 0.00 0.00 0.00 43.02 40.53 2gii s PHE 105 CO 0.49 0.40 0.03 -1.21 -0.00 0.00 0.00 175.22 174.93 2gii s GLU 106 N -2.00 2.08 0.00 0.44 2.02 -1.26 -4.87 118.70 115.11 2gii s GLU 106 Ca 0.39 -2.29 0.00 0.00 0.02 0.00 0.00 54.97 53.10 2gii s GLU 106 Cb -0.15 -1.36 0.00 0.00 0.10 0.00 0.00 34.13 32.72 2gii s GLU 106 CO 0.19 -0.32 0.00 -0.85 0.02 0.00 0.00 175.26 174.31 2gii n GLU 107 N -1.12 0.00 -1.42 1.61 -0.00 -1.26 -4.84 120.64 113.61 2gii n GLU 107 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.02 2gii n GLU 107 Cb 0.67 -0.01 0.00 0.00 -0.00 0.00 0.00 31.44 32.10 2gii n GLU 107 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2gii n LYS 108 N 0.00 0.00 -0.04 3.44 4.76 -1.26 -4.71 118.16 120.36 2gii n LYS 108 Ca 0.00 0.47 0.14 0.00 -2.87 0.00 0.00 58.31 56.05 2gii n LYS 108 Cb 0.00 -0.95 0.57 0.00 -1.84 0.00 0.00 35.03 32.81 2gii n LYS 108 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 2gii h GLN 109 N 0.00 0.25 0.00 1.97 7.50 -2.01 -1.30 115.11 121.53 2gii h GLN 109 Ca 0.00 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.13 2gii h GLN 109 Cb 0.00 -0.06 0.00 0.00 0.05 0.00 0.00 27.48 27.47 2gii h GLN 109 CO 0.00 0.17 0.00 0.09 -1.50 0.00 0.00 178.83 177.59 2gii n ASN 110 N -4.45 0.00 -4.72 1.46 4.13 -1.26 -4.74 115.26 105.68 2gii n ASN 110 Ca 0.09 -0.35 -0.42 0.00 1.68 0.00 0.00 54.58 55.58 2gii n ASN 110 Cb 0.42 -0.04 -0.03 0.00 -1.54 0.00 0.00 39.78 38.59 2gii n ASN 110 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 2gii s ASP 111 N -2.09 6.87 0.07 6.41 -0.00 -0.49 -4.94 116.67 122.50 2gii s ASP 111 Ca 0.20 2.34 -0.19 0.00 -0.00 0.00 0.00 52.55 54.90 2gii s ASP 111 Cb 0.09 -2.60 -0.06 0.00 -0.00 0.00 0.00 42.92 40.36 2gii s ASP 111 CO 0.17 -0.59 1.31 0.74 -0.00 0.00 0.00 175.17 176.80 2gii h THR 112 N 4.04 0.00 -3.05 -1.27 2.02 -1.85 -3.42 112.91 109.39 2gii h THR 112 Ca -0.43 0.00 -0.60 0.00 0.77 0.00 0.00 66.41 66.15 2gii h THR 112 Cb 1.21 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.58 2gii h THR 112 CO 0.82 0.00 -0.37 0.00 0.37 0.00 0.00 175.52 176.35 2gii s ALA 113 N -4.80 3.85 0.03 6.16 0.00 -1.26 -4.94 121.76 120.79 2gii s ALA 113 Ca -0.08 -0.62 0.01 0.00 0.00 0.00 0.00 51.96 51.27 2gii s ALA 113 Cb 0.05 -2.05 -0.26 0.00 0.00 0.00 0.00 23.12 20.86 2gii s ALA 113 CO 0.35 0.70 0.96 -0.44 0.00 0.00 0.00 175.76 177.32 2gii h ASP 114 N 3.18 0.26 -3.47 0.00 3.45 -1.58 -3.41 116.42 114.83 2gii h ASP 114 Ca -0.47 -0.34 -0.28 0.00 0.43 0.00 0.00 57.03 56.37 2gii h ASP 114 Cb 1.17 -0.08 -0.33 0.00 -0.56 0.00 0.00 39.33 39.53 2gii h ASP 114 CO 0.72 1.28 -0.68 -0.63 -1.57 0.00 0.00 179.24 178.36 2gii s ILE 115 N -2.64 -0.06 -0.19 0.35 1.01 0.17 -4.55 121.20 115.28 2gii s ILE 115 Ca -0.06 0.21 -0.05 0.00 0.00 0.00 0.00 60.65 60.75 2gii s ILE 115 Cb 0.08 -0.15 -0.03 0.00 0.01 0.00 0.00 42.46 42.37 2gii s ILE 115 CO 0.85 0.09 0.01 -0.22 0.00 0.00 0.00 174.94 175.66 2gii s LEU 116 N 1.16 3.35 -0.21 2.97 0.20 0.15 -1.17 118.68 125.13 2gii s LEU 116 Ca -0.09 -0.15 -0.03 0.00 0.69 0.00 0.00 54.13 54.56 2gii s LEU 116 Cb -0.12 -1.85 -0.01 0.00 -0.43 0.00 0.00 46.19 43.78 2gii s LEU 116 CO -0.04 0.09 -0.06 -0.76 -0.29 0.00 0.00 176.35 175.29 2gii s LEU 117 N 0.83 2.84 0.13 -0.68 2.01 -0.89 -0.24 118.68 122.69 2gii s LEU 117 Ca 0.01 -0.39 0.09 0.00 0.01 0.00 0.00 54.13 53.85 2gii s LEU 117 Cb -0.14 -1.71 -0.04 0.00 0.01 0.00 0.00 46.19 44.31 2gii s LEU 117 CO 0.02 0.00 -0.22 -0.69 1.01 0.00 0.00 176.35 176.48 2gii s VAL 118 N 1.34 1.90 -0.30 -1.59 1.01 -0.51 -0.97 120.40 121.28 2gii s VAL 118 Ca 0.04 -1.72 -0.16 0.00 0.00 0.00 0.00 61.98 60.14 2gii s VAL 118 Cb -0.14 -1.76 0.21 0.00 0.00 0.00 0.00 36.38 34.68 2gii s VAL 118 CO -0.03 -0.10 1.25 -0.54 0.00 0.00 0.00 175.10 175.68 2gii s LYS 119 N -2.22 0.06 -1.20 2.72 1.02 -0.93 -4.39 119.74 114.80 2gii s LYS 119 Ca 0.11 0.11 -0.01 0.00 0.02 0.00 0.00 55.97 56.20 2gii s LYS 119 Cb -0.09 0.02 0.01 0.00 -0.52 0.00 0.00 37.83 37.25 2gii s LYS 119 CO 0.06 -0.01 0.10 -0.40 -0.92 0.00 0.00 175.35 174.17 2gii n ASP 120 N 3.30 -4.27 -1.03 2.83 5.75 -1.26 -0.13 116.55 121.75 2gii n ASP 120 Ca -0.16 0.06 -0.12 0.00 -0.01 0.00 0.00 54.79 54.56 2gii n ASP 120 Cb 0.56 -3.59 -0.04 0.00 -1.03 0.00 0.00 41.12 37.02 2gii n ASP 120 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 2gii n GLN 121 N -3.03 -0.87 -4.28 0.11 0.00 -1.26 -5.01 117.38 103.05 2gii n GLN 121 Ca -0.14 0.85 -0.35 0.00 -0.00 0.00 0.00 57.00 57.36 2gii n GLN 121 Cb 0.61 -4.89 -0.10 0.00 0.00 0.00 0.00 30.24 25.86 2gii n GLN 121 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 2gii s PHE 122 N -2.48 3.18 -0.05 3.69 0.08 0.82 -4.90 117.98 118.32 2gii s PHE 122 Ca 0.00 0.11 0.06 0.00 0.12 0.00 0.00 56.93 57.22 2gii s PHE 122 Cb 0.00 -1.88 -0.01 0.00 -0.57 0.00 0.00 43.02 40.56 2gii s PHE 122 CO 0.00 0.34 -0.24 0.71 -0.10 0.00 0.00 175.22 175.93 2gii s TYR 123 N -0.45 2.33 -0.33 0.36 1.51 0.24 -2.19 117.35 118.83 2gii s TYR 123 Ca 0.08 -0.68 -0.02 0.00 -1.01 0.00 0.00 57.07 55.44 2gii s TYR 123 Cb -0.12 -1.53 0.06 0.00 -0.11 0.00 0.00 41.96 40.26 2gii s TYR 123 CO 0.02 -0.20 0.05 -2.00 -1.11 0.00 0.00 175.55 172.31 2gii s GLU 124 N -0.15 2.36 -0.87 -0.62 2.12 -0.15 -0.16 118.70 121.23 2gii s GLU 124 Ca -0.03 -1.37 -0.22 0.00 0.36 0.00 0.00 54.97 53.71 2gii s GLU 124 Cb -0.13 -3.29 0.07 0.00 0.26 0.00 0.00 34.13 31.04 2gii s GLU 124 CO 0.03 -0.71 1.23 -0.51 -0.54 0.00 0.00 175.26 174.76 2gii s LEU 125 N 1.24 4.04 -0.17 2.70 2.01 0.19 -2.09 118.68 126.60 2gii s LEU 125 Ca -0.02 -1.34 -0.12 0.00 0.01 0.00 0.00 54.13 52.66 2gii s LEU 125 Cb -0.20 -2.49 -0.05 0.00 0.01 0.00 0.00 46.19 43.46 2gii s LEU 125 CO -0.01 -1.43 0.22 -0.22 1.01 0.00 0.00 176.35 175.91 2gii s LEU 126 N 4.30 4.24 0.01 1.79 2.96 -0.32 -1.18 118.68 130.49 2gii s LEU 126 Ca 0.36 0.40 0.06 0.00 -0.22 0.00 0.00 54.13 54.72 2gii s LEU 126 Cb -0.06 -2.24 -0.03 0.00 0.50 0.00 0.00 46.19 44.35 2gii s LEU 126 CO -0.01 0.16 -0.16 -1.81 -1.32 0.00 0.00 176.35 173.21 2gii s ASP 127 N 0.30 3.95 -0.19 3.68 1.11 -0.18 -0.66 116.67 124.70 2gii s ASP 127 Ca 0.13 -0.33 -0.02 0.00 0.18 0.00 0.00 52.55 52.51 2gii s ASP 127 Cb -0.12 -0.72 -0.00 0.00 1.07 0.00 0.00 42.92 43.14 2gii s ASP 127 CO 0.02 0.28 -0.10 -0.69 1.18 0.00 0.00 175.17 175.85 2gii s VAL 128 N -0.89 2.95 0.11 -1.27 1.01 -1.26 -1.26 120.40 119.80 2gii s VAL 128 Ca 0.14 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.54 2gii s VAL 128 Cb -0.11 -2.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2gii s VAL 128 CO 0.04 0.48 -0.10 -0.54 0.00 0.00 0.00 175.10 174.98 2gii s LYS 129 N 1.17 2.12 -0.00 2.72 -0.14 -0.16 -4.98 119.74 120.46 2gii s LYS 129 Ca 0.02 -1.03 0.03 0.00 -1.36 0.00 0.00 55.97 53.62 2gii s LYS 129 Cb -0.14 -2.30 -0.01 0.00 -1.68 0.00 0.00 37.83 33.70 2gii s LYS 129 CO -0.04 0.51 -0.09 0.95 -0.76 0.00 0.00 175.35 175.92 2gii s THR 130 N -1.22 0.70 0.11 2.17 -4.23 -1.26 -1.13 115.64 110.78 2gii s THR 130 Ca 0.21 -0.41 0.09 0.00 -1.18 0.00 0.00 61.69 60.40 2gii s THR 130 Cb -0.11 -0.59 -0.04 0.00 1.34 0.00 0.00 72.50 73.10 2gii s THR 130 CO 0.14 0.17 -0.22 -0.60 -0.54 0.00 0.00 174.62 173.57 2gii s ARG 131 N -0.27 1.16 -0.87 3.99 3.52 -1.03 -4.95 118.95 120.51 2gii s ARG 131 Ca 0.03 -1.19 -0.08 0.00 -0.13 0.00 0.00 55.73 54.36 2gii s ARG 131 Cb -0.04 -1.46 0.22 0.00 -1.56 0.00 0.00 34.95 32.11 2gii s ARG 131 CO -0.00 0.34 0.78 1.21 -0.81 0.00 0.00 175.30 176.82 2gii s ASN 132 N -1.93 6.40 0.32 -2.12 3.04 -1.26 -1.54 114.94 117.84 2gii s ASN 132 Ca 0.08 -3.17 0.17 0.00 0.04 0.00 0.00 52.86 49.98 2gii s ASN 132 Cb -0.10 -2.07 1.13 0.00 -1.54 0.00 0.00 41.25 38.68 2gii s ASN 132 CO 0.04 -0.37 1.37 -0.38 -3.04 0.00 0.00 177.10 174.72 2gii n ILE 133 N 3.20 -0.36 -0.22 -5.21 2.08 -0.56 -0.15 119.36 118.14 2gii n ILE 133 Ca 0.17 1.77 -0.00 0.00 0.56 0.00 0.00 62.75 65.24 2gii n ILE 133 Cb 0.41 -2.85 0.07 0.00 -0.75 0.00 0.00 39.64 36.52 2gii n ILE 133 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 2gii h SER 134 N 0.00 -0.59 -4.19 4.38 0.02 -1.92 -3.42 113.55 107.83 2gii h SER 134 Ca 0.72 0.19 -0.51 0.00 -0.84 0.00 0.00 61.79 61.36 2gii h SER 134 Cb 1.89 0.40 0.16 0.00 0.14 0.00 0.00 62.40 64.99 2gii h SER 134 CO -0.68 -0.21 0.25 -0.54 -1.14 0.00 0.00 176.83 174.51 2gii s LYS 135 N -6.23 1.43 -0.11 3.45 3.01 0.79 -4.96 119.74 117.11 2gii s LYS 135 Ca -0.14 1.24 -0.30 0.00 -1.01 0.00 0.00 55.97 55.76 2gii s LYS 135 Cb 0.20 -1.80 -0.03 0.00 -1.01 0.00 0.00 37.83 35.19 2gii s LYS 135 CO 0.74 -2.25 1.29 0.45 0.51 0.00 0.00 175.35 176.10 2gii s SER 136 N -3.07 6.94 -0.35 2.83 0.15 -1.26 -4.92 113.70 114.01 2gii s SER 136 Ca 0.64 1.81 -0.43 0.00 0.70 0.00 0.00 55.95 58.67 2gii s SER 136 Cb -0.20 -2.54 -0.19 0.00 -1.71 0.00 0.00 66.02 61.38 2gii s SER 136 CO 0.57 -0.73 1.38 0.00 1.20 0.00 0.00 173.24 175.67 2gii n ALA 137 N 6.18 -1.83 -3.47 5.45 0.00 -1.26 -4.95 120.51 120.62 2gii n ALA 137 Ca 0.13 0.49 -0.21 0.00 0.00 0.00 0.00 53.44 53.86 2gii n ALA 137 Cb 0.45 -1.77 -0.12 0.00 0.00 0.00 0.00 19.45 18.01 2gii n ALA 137 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 2gii s PHE 138 N 2.11 -0.16 -0.25 0.00 5.99 -1.26 -5.12 117.98 119.29 2gii s PHE 138 Ca 0.95 -0.28 -0.39 0.00 0.00 0.00 0.00 56.93 57.22 2gii s PHE 138 Cb -1.36 -0.57 -0.15 0.00 0.00 0.00 0.00 43.02 40.95 2gii s PHE 138 CO 0.71 -0.79 1.79 0.00 -0.00 0.00 0.00 175.22 176.93 2gii n ALA 139 N 5.29 0.06 -2.01 11.12 0.00 -1.26 -4.93 120.51 128.77 2gii n ALA 139 Ca -0.04 0.36 -0.30 0.00 0.00 0.00 0.00 53.44 53.46 2gii n ALA 139 Cb 0.46 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.63 2gii n ALA 139 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2gii s PRO 140 N 3.74 3.60 0.02 0.00 0.04 -1.26 -4.70 135.00 136.45 2gii s PRO 140 Ca 0.98 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.28 2gii s PRO 140 Cb -0.99 -2.19 -0.08 0.00 0.04 0.00 0.00 34.50 31.28 2gii s PRO 140 CO 0.63 -0.42 1.82 -0.80 0.04 0.00 0.00 177.00 178.27 2gii s ASN 141 N -4.07 6.54 -0.20 6.66 -0.87 -1.26 -3.35 114.94 118.39 2gii s ASN 141 Ca 0.53 2.51 -0.10 0.00 -1.57 0.00 0.00 52.86 54.23 2gii s ASN 141 Cb -0.11 -2.54 -0.20 0.00 -0.02 0.00 0.00 41.25 38.39 2gii s ASN 141 CO 0.49 -0.99 0.06 -0.38 -2.57 0.00 0.00 177.10 173.72 2gii n ILE 142 N 5.37 1.61 -3.57 0.60 2.08 0.97 -5.00 119.36 121.42 2gii n ILE 142 Ca 0.18 -0.43 -0.06 0.00 0.56 0.00 0.00 62.75 63.00 2gii n ILE 142 Cb 0.41 -1.77 -0.03 0.00 -0.75 0.00 0.00 39.64 37.50 2gii n ILE 142 CO 0.00 0.00 0.00 -0.51 0.56 0.00 0.00 176.55 176.60 2gii s ILE 143 N -2.49 0.00 0.13 1.39 2.07 -1.21 -4.98 121.20 116.10 2gii s ILE 143 Ca -0.30 0.00 -0.31 0.00 -1.41 0.00 0.00 60.65 58.63 2gii s ILE 143 Cb 0.08 -1.00 -0.09 0.00 0.13 0.00 0.00 42.46 41.59 2gii s ILE 143 CO 0.64 0.00 1.49 -0.55 -1.91 0.00 0.00 174.94 174.61 2gii s SER 144 N -1.97 6.70 0.39 4.50 0.15 -1.26 0.11 113.70 122.31 2gii s SER 144 Ca 0.06 2.46 0.20 0.00 0.70 0.00 0.00 55.95 59.37 2gii s SER 144 Cb -0.01 -2.59 0.71 0.00 -1.71 0.00 0.00 66.02 62.42 2gii s SER 144 CO -0.05 -0.75 1.74 0.00 1.20 0.00 0.00 173.24 175.38 2gii h ALA 145 N 6.98 0.99 0.04 5.45 0.00 -0.52 -1.32 119.26 130.87 2gii h ALA 145 Ca -0.42 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.18 2gii h ALA 145 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2gii h ALA 145 CO 0.89 0.42 -0.02 -0.92 0.00 0.00 0.00 179.25 179.63 2gii h TYR 146 N 0.00 -0.04 -0.69 0.00 3.20 -1.91 -1.32 116.97 116.21 2gii h TYR 146 Ca -0.00 -0.00 0.12 0.00 3.14 0.00 0.00 58.73 61.99 2gii h TYR 146 Cb 0.88 0.01 -0.09 0.00 1.54 0.00 0.00 36.73 39.08 2gii h TYR 146 CO 0.00 0.63 0.25 -0.22 -1.64 0.00 0.00 178.16 177.18 2gii h LYS 147 N -0.84 0.39 -0.85 1.82 1.63 -1.90 0.34 116.57 117.16 2gii h LYS 147 Ca -0.00 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 2gii h LYS 147 Cb 0.70 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 32.20 2gii h LYS 147 CO 0.01 0.26 0.46 1.25 -3.45 0.00 0.00 179.45 177.98 2gii h LEU 148 N 0.40 1.05 0.55 5.20 5.85 -1.26 0.10 115.31 127.20 2gii h LEU 148 Ca 0.37 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 2gii h LEU 148 Cb 0.53 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2gii h LEU 148 CO -0.38 0.84 -0.37 0.00 -0.34 0.00 0.00 178.44 178.19 2gii h ALA 149 N 1.33 -1.15 -0.72 1.25 0.00 0.79 -0.04 119.26 120.72 2gii h ALA 149 Ca 0.30 -0.18 0.16 0.00 0.00 0.00 0.00 54.91 55.19 2gii h ALA 149 Cb 0.02 0.52 -0.11 0.00 0.00 0.00 0.00 17.79 18.22 2gii h ALA 149 CO -0.05 -1.13 0.15 1.96 0.00 0.00 0.00 179.25 180.18 2gii h GLN 150 N -0.87 0.24 -0.72 0.00 4.20 -0.73 0.12 115.11 117.34 2gii h GLN 150 Ca -0.07 -0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.70 2gii h GLN 150 Cb 0.71 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.37 2gii h GLN 150 CO 0.05 0.16 0.40 1.15 -0.67 0.00 0.00 178.83 179.91 2gii h THR 151 N 0.24 0.92 0.00 -0.54 2.02 -0.42 -0.96 112.91 114.17 2gii h THR 151 Ca 0.40 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 67.28 2gii h THR 151 Cb 0.68 0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 2gii h THR 151 CO -0.52 0.13 -0.31 0.00 0.37 0.00 0.00 175.52 175.19 2gii h ALA 153 N 1.69 0.69 -0.18 0.00 0.00 0.05 -3.16 119.26 118.37 2gii h ALA 153 Ca -0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 54.91 54.13 2gii h ALA 153 Cb 0.61 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 2gii h ALA 153 CO 0.04 0.92 -0.22 0.87 0.00 0.00 0.00 179.25 180.86 2gii h LYS 154 N 0.04 0.46 -0.86 0.00 1.79 -0.86 -1.75 116.57 115.39 2gii h LYS 154 Ca -0.02 -0.26 0.16 0.00 -2.18 0.00 0.00 60.65 58.35 2gii h LYS 154 Cb 1.37 0.02 -0.07 0.00 -1.58 0.00 0.00 32.23 31.97 2gii h LYS 154 CO 0.11 0.84 0.56 0.52 -1.08 0.00 0.00 179.45 180.40 2gii h MET 155 N 0.11 0.54 0.07 3.15 2.86 -1.46 -1.67 114.93 118.53 2gii h MET 155 Ca 0.02 -0.03 -0.17 0.00 -2.06 0.00 0.00 59.70 57.46 2gii h MET 155 Cb 0.78 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.32 2gii h MET 155 CO 0.05 0.36 -0.83 0.82 1.06 0.00 0.00 176.91 178.37 2gii h ILE 156 N 0.56 1.35 -0.25 -1.22 2.04 -1.50 0.18 117.51 118.67 2gii h ILE 156 Ca 0.44 -2.38 0.07 0.00 1.00 0.00 0.00 64.86 63.99 2gii h ILE 156 Cb 0.87 2.95 -0.01 0.00 -0.74 0.00 0.00 36.82 39.89 2gii h ILE 156 CO -0.18 0.61 0.18 0.44 0.00 0.00 0.00 178.15 179.20 2gii h ASP 157 N -0.64 0.02 -0.00 1.72 3.45 -1.11 -2.58 116.42 117.27 2gii h ASP 157 Ca -0.18 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.28 2gii h ASP 157 Cb 1.43 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.20 2gii h ASP 157 CO 0.02 0.01 -0.44 0.59 -1.57 0.00 0.00 179.24 177.86 2gii n ASN 158 N -4.47 0.91 -2.95 6.45 4.13 -0.65 -5.02 115.26 113.66 2gii n ASN 158 Ca 0.03 -0.96 -0.19 0.00 1.68 0.00 0.00 54.58 55.14 2gii n ASN 158 Cb 0.32 0.78 0.06 0.00 -1.54 0.00 0.00 39.78 39.39 2gii n ASN 158 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 2gii n LYS 159 N -0.82 -6.18 -3.41 3.52 0.00 0.40 -4.97 118.16 106.69 2gii n LYS 159 Ca 0.04 0.69 -0.44 0.00 -0.00 0.00 0.00 58.31 58.59 2gii n LYS 159 Cb 0.22 -5.26 -0.03 0.00 -0.00 0.00 0.00 35.03 29.96 2gii n LYS 159 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 2gii s GLU 160 N -5.99 3.66 0.00 -1.58 2.02 0.14 -4.82 118.70 112.12 2gii s GLU 160 Ca 0.45 -2.81 0.14 0.00 0.02 0.00 0.00 54.97 52.77 2gii s GLU 160 Cb -0.20 -4.35 0.21 0.00 0.10 0.00 0.00 34.13 29.90 2gii s GLU 160 CO 0.56 -1.26 1.09 1.19 0.02 0.00 0.00 175.26 176.86 2gii n PHE 161 N 3.32 0.21 -2.63 1.61 3.72 -1.26 -4.58 117.46 117.85 2gii n PHE 161 Ca 0.17 -0.17 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 2gii n PHE 161 Cb 0.42 -0.01 0.02 0.00 -0.94 0.00 0.00 39.48 38.98 2gii n PHE 161 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2gii n ASP 162 N 0.82 2.09 -0.00 4.37 8.00 -1.26 -4.78 116.55 125.78 2gii n ASP 162 Ca 0.11 -2.89 -0.03 0.00 0.71 0.00 0.00 54.79 52.68 2gii n ASP 162 Cb 0.40 -0.51 -0.01 0.00 -0.02 0.00 0.00 41.12 40.98 2gii n ASP 162 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2gii n LEU 163 N -0.16 0.49 -4.21 0.64 7.94 -1.26 -4.94 117.00 115.51 2gii n LEU 163 Ca 0.15 0.07 -0.12 0.00 -1.11 0.00 0.00 56.01 55.00 2gii n LEU 163 Cb 0.79 -0.17 -0.10 0.00 0.53 0.00 0.00 43.42 44.46 2gii n LEU 163 CO 0.28 -0.13 -0.34 0.72 -1.11 0.00 0.00 177.39 176.81 2gii s PHE 164 N -2.07 1.08 0.01 1.96 -0.12 -1.25 0.80 117.98 118.38 2gii s PHE 164 Ca -0.04 -1.03 0.03 0.00 -0.05 0.00 0.00 56.93 55.83 2gii s PHE 164 Cb 0.01 -0.62 -0.01 0.00 -0.63 0.00 0.00 43.02 41.78 2gii s PHE 164 CO 0.06 -0.25 -0.09 -0.51 -0.05 0.00 0.00 175.22 174.38 2gii s ASP 165 N -3.12 1.09 -0.43 1.98 1.01 0.77 -4.93 116.67 113.04 2gii s ASP 165 Ca 0.21 -0.29 -0.09 0.00 0.71 0.00 0.00 52.55 53.09 2gii s ASP 165 Cb 0.06 -0.08 0.09 0.00 1.01 0.00 0.00 42.92 44.00 2gii s ASP 165 CO 0.01 0.03 0.27 -0.63 0.21 0.00 0.00 175.17 175.06 2gii s ILE 166 N -0.56 4.19 0.28 0.77 1.01 -1.26 0.53 121.20 126.16 2gii s ILE 166 Ca 0.00 -1.49 0.10 0.00 0.00 0.00 0.00 60.65 59.26 2gii s ILE 166 Cb -0.05 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.76 2gii s ILE 166 CO 0.00 -0.56 -0.03 0.20 0.00 0.00 0.00 174.94 174.55 2gii s ASN 167 N 2.21 4.36 0.00 3.58 0.01 -0.33 -1.15 114.94 123.64 2gii s ASN 167 Ca 0.04 -0.74 0.04 0.00 -0.71 0.00 0.00 52.86 51.48 2gii s ASN 167 Cb -0.24 -0.72 -0.01 0.00 0.41 0.00 0.00 41.25 40.69 2gii s ASN 167 CO 0.01 -0.03 -0.12 -0.31 -1.51 0.00 0.00 177.10 175.14 2gii s TYR 168 N -2.38 1.08 -0.08 2.20 2.02 -0.40 -1.01 117.35 118.79 2gii s TYR 168 Ca 0.32 -0.23 0.02 0.00 -0.37 0.00 0.00 57.07 56.81 2gii s TYR 168 Cb -0.05 -0.68 0.01 0.00 -0.40 0.00 0.00 41.96 40.84 2gii s TYR 168 CO 0.19 -0.01 -0.15 -1.17 -1.57 0.00 0.00 175.55 172.84 2gii s LEU 169 N -0.47 1.74 -0.07 -1.29 2.96 -0.39 -1.88 118.68 119.29 2gii s LEU 169 Ca 0.04 -0.38 0.02 0.00 -0.22 0.00 0.00 54.13 53.59 2gii s LEU 169 Cb -0.05 -1.00 -0.02 0.00 0.50 0.00 0.00 46.19 45.61 2gii s LEU 169 CO -0.00 0.05 -0.12 -0.70 -1.32 0.00 0.00 176.35 174.26 2gii s GLU 170 N 0.69 2.76 -0.24 1.98 2.12 0.56 -0.99 118.70 125.59 2gii s GLU 170 Ca -0.13 -0.65 0.02 0.00 0.36 0.00 0.00 54.97 54.56 2gii s GLU 170 Cb -0.16 -2.50 0.06 0.00 0.26 0.00 0.00 34.13 31.79 2gii s GLU 170 CO 0.03 0.55 -0.08 0.08 -0.54 0.00 0.00 175.26 175.30 2gii s VAL 171 N -0.52 1.81 -0.06 3.70 1.01 -0.28 -1.15 120.40 124.90 2gii s VAL 171 Ca 0.07 -1.36 -0.22 0.00 0.00 0.00 0.00 61.98 60.47 2gii s VAL 171 Cb -0.12 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 2gii s VAL 171 CO 0.02 -0.03 0.64 -1.81 0.00 0.00 0.00 175.10 173.91 2gii s ASP 172 N 1.27 6.93 0.31 3.32 1.01 0.11 -2.45 116.67 127.17 2gii s ASP 172 Ca -0.06 1.12 0.03 0.00 0.71 0.00 0.00 52.55 54.34 2gii s ASP 172 Cb -0.19 -2.38 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 2gii s ASP 172 CO -0.06 -0.05 0.15 -1.66 0.21 0.00 0.00 175.17 173.76 2gii s TRP 173 N 0.57 1.63 0.30 4.23 1.48 -0.59 0.25 118.94 126.81 2gii s TRP 173 Ca 0.34 -1.35 -0.16 0.00 -1.06 0.00 0.00 56.10 53.87 2gii s TRP 173 Cb -0.17 -0.90 0.02 0.00 -1.16 0.00 0.00 33.47 31.26 2gii s TRP 173 CO 0.16 -0.49 0.66 -1.83 -4.06 0.00 0.00 176.95 171.40 2gii s GLU 174 N -3.81 1.84 -0.25 3.25 -1.05 -0.91 -1.49 118.70 116.29 2gii s GLU 174 Ca 0.35 -1.21 -0.16 0.00 -0.15 0.00 0.00 54.97 53.80 2gii s GLU 174 Cb 0.05 0.57 -0.04 0.00 -0.44 0.00 0.00 34.13 34.27 2gii s GLU 174 CO 0.17 -0.83 0.40 -0.48 0.95 0.00 0.00 175.26 175.48 2gii s LEU 175 N -3.00 4.06 -0.18 1.83 2.34 -1.26 -1.36 118.68 121.11 2gii s LEU 175 Ca 0.16 0.37 -0.08 0.00 0.06 0.00 0.00 54.13 54.65 2gii s LEU 175 Cb -0.04 -2.48 -0.04 0.00 -0.56 0.00 0.00 46.19 43.07 2gii s LEU 175 CO 0.09 -0.18 0.08 -0.76 -1.06 0.00 0.00 176.35 174.52 2gii s LEU 180 N 1.95 3.92 -0.09 1.48 1.43 -1.26 -5.18 118.68 120.93 2gii s LEU 180 Ca 0.17 0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.45 2gii s LEU 180 Cb -0.16 -1.99 -0.00 0.00 0.03 0.00 0.00 46.19 44.07 2gii s LEU 180 CO 0.09 0.20 -0.23 0.54 0.23 0.00 0.00 176.35 177.18 2gii s VAL 181 N 0.24 1.99 0.02 -1.59 0.11 -0.46 -4.23 120.40 116.47 2gii s VAL 181 Ca 0.05 -0.99 -0.30 0.00 -2.93 0.00 0.00 61.98 57.80 2gii s VAL 181 Cb -0.12 -1.71 -0.05 0.00 -1.53 0.00 0.00 36.38 32.97 2gii s VAL 181 CO -0.00 0.55 1.19 0.00 -3.33 0.00 0.00 175.10 173.51 2gii n VAL 183 N 4.19 1.22 -3.81 0.00 0.24 0.14 -1.63 118.33 118.69 2gii n VAL 183 Ca 0.10 -0.73 -0.04 0.00 -2.04 0.00 0.00 64.34 61.62 2gii n VAL 183 Cb 0.46 -0.58 -0.00 0.00 -1.47 0.00 0.00 33.84 32.25 2gii n VAL 183 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2gii s SER 184 N -5.25 -0.11 0.17 -1.34 1.04 -1.14 -4.88 113.70 102.18 2gii s SER 184 Ca -0.10 -0.58 -0.08 0.00 0.48 0.00 0.00 55.95 55.67 2gii s SER 184 Cb 0.05 0.55 -0.01 0.00 0.10 0.00 0.00 66.02 66.71 2gii s SER 184 CO 0.71 -1.05 0.26 0.42 0.98 0.00 0.00 173.24 174.56 2gii s THR 185 N -2.90 0.06 0.03 2.02 -4.23 -1.26 0.04 115.64 109.41 2gii s THR 185 Ca 0.15 -1.48 -0.06 0.00 -1.18 0.00 0.00 61.69 59.12 2gii s THR 185 Cb -0.02 -1.92 -0.01 0.00 1.34 0.00 0.00 72.50 71.89 2gii s THR 185 CO 0.05 -0.29 0.11 -0.44 -0.54 0.00 0.00 174.62 173.51 2gii s SER 186 N -2.99 0.13 -0.08 3.99 0.01 -0.30 -4.95 113.70 109.51 2gii s SER 186 Ca 0.19 -0.44 -0.03 0.00 1.31 0.00 0.00 55.95 56.98 2gii s SER 186 Cb 0.04 0.23 0.04 0.00 0.21 0.00 0.00 66.02 66.54 2gii s SER 186 CO 0.01 -0.48 0.14 0.12 0.41 0.00 0.00 173.24 173.45 2gii s PHE 187 N -2.30 -0.14 0.14 2.43 5.36 -1.26 -0.33 117.98 121.88 2gii s PHE 187 Ca -0.07 0.54 0.00 0.00 -0.96 0.00 0.00 56.93 56.44 2gii s PHE 187 Cb -0.03 -0.28 -0.04 0.00 -0.34 0.00 0.00 43.02 42.33 2gii s PHE 187 CO -0.03 -0.25 0.03 0.00 -1.46 0.00 0.00 175.22 173.51 2gii s ALA 188 N 2.17 1.03 -0.07 11.12 0.00 -0.79 -5.02 121.76 130.20 2gii s ALA 188 Ca 0.02 -1.50 0.04 0.00 0.00 0.00 0.00 51.96 50.52 2gii s ALA 188 Cb -0.12 0.70 0.00 0.00 0.00 0.00 0.00 23.12 23.70 2gii s ALA 188 CO -0.05 -0.41 -0.19 -1.21 0.00 0.00 0.00 175.76 173.90 2gii s GLU 189 N -3.99 2.26 0.10 0.00 2.02 -1.26 -1.27 118.70 116.56 2gii s GLU 189 Ca 0.23 -0.68 -0.23 0.00 0.02 0.00 0.00 54.97 54.31 2gii s GLU 189 Cb 0.07 -1.83 -0.13 0.00 0.10 0.00 0.00 34.13 32.35 2gii s GLU 189 CO 0.02 0.18 1.73 1.25 0.02 0.00 0.00 175.26 178.46 2gii h LEU 190 N 6.58 -0.05 0.00 1.80 5.85 -1.51 -2.73 115.31 125.26 2gii h LEU 190 Ca -0.28 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.46 2gii h LEU 190 Cb 1.20 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2gii h LEU 190 CO 0.47 -0.02 0.00 0.49 -0.34 0.00 0.00 178.44 179.04 2gii n PHE 191 N -5.12 0.00 0.16 1.25 0.99 -1.26 -1.15 117.46 112.32 2gii n PHE 191 Ca -0.06 0.00 0.04 0.00 -0.00 0.00 0.00 57.45 57.43 2gii n PHE 191 Cb 0.05 0.00 0.06 0.00 -1.00 0.00 0.00 39.48 38.60 2gii n PHE 191 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2gii n LYS 192 N -0.80 1.17 -3.98 -1.08 5.02 -1.03 -4.87 118.16 112.59 2gii n LYS 192 Ca 0.04 -1.32 -0.23 0.00 -2.02 0.00 0.00 58.31 54.78 2gii n LYS 192 Cb 0.02 -1.17 -0.03 0.00 -0.02 0.00 0.00 35.03 33.84 2gii n LYS 192 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2gii s SER 193 N -0.79 6.20 -0.36 4.39 1.04 -0.30 -1.59 113.70 122.29 2gii s SER 193 Ca 0.12 0.06 -0.29 0.00 0.48 0.00 0.00 55.95 56.32 2gii s SER 193 Cb 0.07 -1.81 0.00 0.00 0.10 0.00 0.00 66.02 64.39 2gii s SER 193 CO 0.10 -0.02 1.43 -0.70 0.98 0.00 0.00 173.24 175.03 2gii s GLU 194 N -3.69 3.66 0.58 4.02 2.56 -1.26 -4.61 118.70 119.96 2gii s GLU 194 Ca 0.34 1.11 0.28 0.00 0.00 0.00 0.00 54.97 56.70 2gii s GLU 194 Cb -0.10 -4.00 1.52 0.00 2.00 0.00 0.00 34.13 33.56 2gii s GLU 194 CO 0.28 -1.45 1.98 -1.00 -0.56 0.00 0.00 175.26 174.51 2gii h PRO 195 N 10.50 0.00 0.00 4.30 0.13 -1.91 0.03 132.00 145.04 2gii h PRO 195 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2gii h PRO 195 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2gii h PRO 195 CO 1.06 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.70 2gii n SER 196 N -3.85 0.00 -0.00 1.44 3.41 -1.26 -3.18 113.62 110.18 2gii n SER 196 Ca 0.06 0.43 0.11 0.00 -0.26 0.00 0.00 58.87 59.21 2gii n SER 196 Cb 0.55 -0.47 -0.14 0.00 -0.26 0.00 0.00 64.21 63.89 2gii n SER 196 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2gii n GLU 197 N -1.47 0.46 -1.67 4.33 4.71 -0.01 -4.95 120.64 122.04 2gii n GLU 197 Ca 0.07 -0.12 -0.48 0.00 -0.01 0.00 0.00 57.16 56.61 2gii n GLU 197 Cb 0.28 -1.53 -0.05 0.00 -1.01 0.00 0.00 31.44 29.13 2gii n GLU 197 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2gii n LEU 198 N -2.06 3.01 -4.63 -4.62 4.32 -1.19 -4.92 117.00 106.91 2gii n LEU 198 Ca -0.01 1.05 -0.41 0.00 -0.02 0.00 0.00 56.01 56.61 2gii n LEU 198 Cb 0.50 -1.36 -0.06 0.00 -1.62 0.00 0.00 43.42 40.89 2gii n LEU 198 CO 0.45 -0.30 0.50 -0.47 -1.22 0.00 0.00 177.39 176.35 2gii s TYR 199 N 2.26 3.28 -0.42 -1.77 5.04 -1.26 -5.02 117.35 119.47 2gii s TYR 199 Ca 0.86 0.91 -0.12 0.00 -2.44 0.00 0.00 57.07 56.28 2gii s TYR 199 Cb -0.75 -2.96 0.06 0.00 0.35 0.00 0.00 41.96 38.66 2gii s TYR 199 CO 0.46 -0.38 0.28 0.42 -1.34 0.00 0.00 175.55 174.98 2gii s ILE 200 N 2.67 4.65 -0.77 3.14 1.01 -1.26 -1.48 121.20 129.15 2gii s ILE 200 Ca 0.30 -1.09 -0.19 0.00 0.00 0.00 0.00 60.65 59.66 2gii s ILE 200 Cb -0.15 -3.73 0.12 0.00 0.01 0.00 0.00 42.46 38.71 2gii s ILE 200 CO 0.09 -0.42 0.95 0.21 0.00 0.00 0.00 174.94 175.77 2gii s ASN 201 N 2.01 6.42 0.32 3.58 3.84 -1.10 -4.92 114.94 125.08 2gii s ASN 201 Ca 0.03 -1.70 0.03 0.00 0.21 0.00 0.00 52.86 51.43 2gii s ASN 201 Cb -0.22 -2.36 0.61 0.00 -0.55 0.00 0.00 41.25 38.73 2gii s ASN 201 CO 0.05 -1.12 1.91 -0.50 -2.79 0.00 0.00 177.10 174.65 2gii h TRP 202 N 9.00 0.96 -0.20 0.43 4.06 -1.89 -2.36 115.95 125.96 2gii h TRP 202 Ca -0.07 0.03 -0.10 0.00 2.06 0.00 0.00 58.89 60.81 2gii h TRP 202 Cb 1.05 -0.31 -0.01 0.00 -1.00 0.00 0.00 29.16 28.88 2gii h TRP 202 CO 1.02 0.48 -0.32 0.00 -3.56 0.00 0.00 178.44 176.06 2gii h ALA 203 N 1.54 1.08 -0.23 1.49 0.00 -1.97 -2.10 119.26 119.07 2gii h ALA 203 Ca 0.38 -0.38 -0.63 0.00 0.00 0.00 0.00 54.91 54.29 2gii h ALA 203 Cb 0.28 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2gii h ALA 203 CO -0.15 0.57 2.78 0.00 0.00 0.00 0.00 179.25 182.45 2gii n ALA 204 N -2.48 7.16 -3.34 0.00 0.00 -0.90 -4.57 120.51 116.37 2gii n ALA 204 Ca -0.01 -3.50 -0.24 0.00 0.00 0.00 0.00 53.44 49.69 2gii n ALA 204 Cb 0.44 -3.01 0.04 0.00 0.00 0.00 0.00 19.45 16.93 2gii n ALA 204 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gii n ALA 205 N 2.73 -1.12 -4.01 0.00 0.00 -1.24 -2.34 120.51 114.54 2gii n ALA 205 Ca 0.68 0.30 -0.33 0.00 0.00 0.00 0.00 53.44 54.09 2gii n ALA 205 Cb 0.32 -4.37 -0.01 0.00 0.00 0.00 0.00 19.45 15.40 2gii n ALA 205 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2gii n MET 206 N -4.39 -3.94 -3.90 0.00 0.00 -0.79 -4.69 117.12 99.41 2gii n MET 206 Ca -0.05 0.46 -0.36 0.00 0.00 0.00 0.00 57.70 57.75 2gii n MET 206 Cb 0.58 -5.24 -0.07 0.00 0.00 0.00 0.00 33.22 28.49 2gii n MET 206 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 2gii s GLN 207 N -6.71 3.66 0.30 0.03 -1.52 -0.99 0.20 119.66 114.64 2gii s GLN 207 Ca 0.68 -0.21 -0.29 0.00 -1.95 0.00 0.00 55.36 53.59 2gii s GLN 207 Cb -0.36 -3.21 -0.10 0.00 -0.22 0.00 0.00 33.01 29.11 2gii s GLN 207 CO 0.84 0.58 1.34 0.42 -0.25 0.00 0.00 175.29 178.22 2gii s ILE 208 N -0.48 2.73 -0.05 1.08 1.01 0.12 -2.72 121.20 122.88 2gii s ILE 208 Ca 0.12 0.69 0.03 0.00 0.00 0.00 0.00 60.65 61.48 2gii s ILE 208 Cb -0.12 -3.44 0.01 0.00 0.01 0.00 0.00 42.46 38.92 2gii s ILE 208 CO 0.02 0.15 -0.12 -1.10 0.00 0.00 0.00 174.94 173.88 2gii s GLN 209 N -1.34 1.53 0.04 2.79 -0.21 -0.55 -0.02 119.66 121.89 2gii s GLN 209 Ca 0.52 -0.43 -0.28 0.00 0.02 0.00 0.00 55.36 55.19 2gii s GLN 209 Cb -0.40 -1.31 0.10 0.00 1.00 0.00 0.00 33.01 32.40 2gii s GLN 209 CO 0.50 0.10 1.08 -0.59 -2.12 0.00 0.00 175.29 174.25 2gii s PHE 210 N 0.41 -0.14 -0.18 0.91 -0.12 -1.21 -4.40 117.98 113.24 2gii s PHE 210 Ca -0.09 -0.05 -0.08 0.00 -0.05 0.00 0.00 56.93 56.65 2gii s PHE 210 Cb -0.13 0.58 -0.04 0.00 -0.63 0.00 0.00 43.02 42.80 2gii s PHE 210 CO 0.02 -0.55 0.08 -1.01 -0.05 0.00 0.00 175.22 173.72 2gii s HIS 211 N -2.90 3.30 0.25 3.49 3.76 -1.26 -4.15 115.29 117.77 2gii s HIS 211 Ca 0.11 0.15 -0.07 0.00 -0.15 0.00 0.00 55.06 55.11 2gii s HIS 211 Cb 0.01 -2.09 0.44 0.00 1.11 0.00 0.00 32.58 32.05 2gii s HIS 211 CO -0.02 0.20 1.64 0.28 -0.85 0.00 0.00 174.74 175.99 2gii h VAL 212 N 4.80 0.36 -0.10 -0.90 2.07 -1.97 0.22 116.25 120.73 2gii h VAL 212 Ca -0.38 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.12 2gii h VAL 212 Cb 1.16 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2gii h VAL 212 CO 0.72 0.02 0.12 0.08 0.02 0.00 0.00 177.57 178.53 2gii h ARG 213 N 0.12 0.00 -0.17 1.57 0.11 -1.94 -1.34 114.38 112.73 2gii h ARG 213 Ca 0.41 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.49 2gii h ARG 213 Cb 0.73 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.81 2gii h ARG 213 CO -0.64 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.18 2gii n ASP 214 N -3.70 3.03 -4.69 0.08 10.43 0.74 -4.96 116.55 117.47 2gii n ASP 214 Ca -0.01 -1.96 -0.42 0.00 2.57 0.00 0.00 54.79 54.98 2gii n ASP 214 Cb 0.22 -0.10 -0.03 0.00 1.84 0.00 0.00 41.12 43.06 2gii n ASP 214 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 2gii s LEU 215 N -1.80 4.31 0.26 0.64 2.96 -0.51 -4.93 118.68 119.61 2gii s LEU 215 Ca 0.33 2.07 -0.30 0.00 -0.22 0.00 0.00 54.13 56.01 2gii s LEU 215 Cb 0.21 -3.56 -0.10 0.00 0.50 0.00 0.00 46.19 43.24 2gii s LEU 215 CO 0.31 -0.69 1.37 -0.62 -1.32 0.00 0.00 176.35 175.40 2gii s ASP 216 N 1.79 6.75 -0.26 3.68 2.15 -1.26 -4.97 116.67 124.54 2gii s ASP 216 Ca 0.63 2.60 0.12 0.00 0.43 0.00 0.00 52.55 56.33 2gii s ASP 216 Cb -0.30 -2.63 0.47 0.00 -0.30 0.00 0.00 42.92 40.16 2gii s ASP 216 CO 0.26 -0.61 1.17 0.00 -0.17 0.00 0.00 175.17 175.82 2gii n GLN 217 N 2.03 2.82 -0.46 4.34 1.13 -1.25 -3.32 117.38 122.68 2gii n GLN 217 Ca 0.05 -3.84 0.06 0.00 -1.94 0.00 0.00 57.00 51.33 2gii n GLN 217 Cb 0.41 -1.97 0.23 0.00 0.11 0.00 0.00 30.24 29.02 2gii n GLN 217 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2gii n GLY 218 N -0.68 4.39 3.70 1.08 0.00 -0.70 -4.82 105.19 108.15 2gii n GLY 218 Ca 0.31 -1.10 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 2gii n GLY 218 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2gii s PHE 219 N -2.94 2.46 -0.18 1.61 5.36 -0.62 -4.89 117.98 118.77 2gii s PHE 219 Ca 0.41 0.19 0.15 0.00 -0.96 0.00 0.00 56.93 56.72 2gii s PHE 219 Cb 0.35 -4.11 -0.24 0.00 -0.34 0.00 0.00 43.02 38.68 2gii s PHE 219 CO 0.06 -4.41 0.14 0.09 -1.46 0.00 0.00 175.22 169.63 2gii n ASN 220 N 5.12 0.35 -2.80 6.13 4.13 -1.26 -4.94 115.26 121.99 2gii n ASN 220 Ca 0.17 0.06 0.00 0.00 1.68 0.00 0.00 54.58 56.48 2gii n ASN 220 Cb 0.38 0.67 0.00 0.00 -1.54 0.00 0.00 39.78 39.29 2gii n ASN 220 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gii n GLY 221 N 1.77 -2.73 3.95 7.41 0.00 -1.26 -5.05 105.19 109.28 2gii n GLY 221 Ca -0.32 -1.38 -0.23 0.00 0.00 0.00 0.00 46.02 44.09 2gii n GLY 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gii s THR 222 N -0.83 2.48 0.47 2.61 -4.23 -1.26 -4.92 115.64 109.96 2gii s THR 222 Ca 0.00 -0.49 0.29 0.00 -1.18 0.00 0.00 61.69 60.31 2gii s THR 222 Cb 0.00 -2.99 0.32 0.00 1.34 0.00 0.00 72.50 71.17 2gii s THR 222 CO 0.00 0.00 2.14 -0.09 -0.54 0.00 0.00 174.62 176.13 2gii h ARG 223 N -0.24 0.00 0.14 3.99 9.65 -1.94 -0.96 114.38 125.03 2gii h ARG 223 Ca -0.43 0.00 -0.30 0.00 -1.10 0.00 0.00 59.98 58.15 2gii h ARG 223 Cb 1.31 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 29.91 2gii h ARG 223 CO 0.56 0.08 -1.27 1.49 2.80 0.00 0.00 179.97 183.62 2gii h GLU 224 N 0.00 0.49 -0.03 0.20 4.81 -1.93 -2.41 114.58 115.70 2gii h GLU 224 Ca -0.00 -0.72 -0.00 0.00 -0.13 0.00 0.00 59.36 58.51 2gii h GLU 224 Cb 0.23 0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 2gii h GLU 224 CO 0.01 1.33 0.02 0.93 -0.73 0.00 0.00 179.01 180.56 2gii h GLU 225 N 0.19 0.04 -0.30 1.92 5.08 -1.70 -0.93 114.58 118.87 2gii h GLU 225 Ca -0.18 -0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.24 2gii h GLU 225 Cb 1.96 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 31.12 2gii h GLU 225 CO 0.23 0.09 -0.26 2.35 -1.00 0.00 0.00 179.01 180.42 2gii h TRP 226 N -0.02 -0.71 -0.26 4.33 7.01 -1.24 0.74 115.95 125.80 2gii h TRP 226 Ca 0.01 0.04 0.06 0.00 2.11 0.00 0.00 58.89 61.11 2gii h TRP 226 Cb 0.06 0.36 -0.06 0.00 -2.10 0.00 0.00 29.16 27.41 2gii h TRP 226 CO -0.06 -0.34 -0.15 0.00 -2.79 0.00 0.00 178.44 175.11 2gii h ALA 227 N 0.81 0.05 0.21 2.65 0.00 -1.15 0.49 119.26 122.32 2gii h ALA 227 Ca 0.15 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 2gii h ALA 227 Cb 0.49 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2gii h ALA 227 CO -0.44 -0.56 -0.10 1.57 0.00 0.00 0.00 179.25 179.72 2gii h LYS 228 N -0.12 -0.27 -0.91 0.00 2.10 -0.13 -2.50 116.57 114.73 2gii h LYS 228 Ca 0.14 0.02 0.11 0.00 -2.00 0.00 0.00 60.65 58.92 2gii h LYS 228 Cb 0.33 0.06 -0.07 0.00 -0.90 0.00 0.00 32.23 31.66 2gii h LYS 228 CO -0.33 -0.11 0.59 1.03 -2.00 0.00 0.00 179.45 178.62 2gii h SER 229 N -0.37 0.79 -0.35 7.07 0.87 0.98 -1.62 113.55 120.92 2gii h SER 229 Ca -0.03 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 2gii h SER 229 Cb 0.29 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2gii h SER 229 CO 0.05 0.44 0.06 0.22 -0.53 0.00 0.00 176.83 177.07 2gii h TYR 230 N 0.85 0.61 -0.44 2.24 3.20 0.15 -2.34 116.97 121.25 2gii h TYR 230 Ca 0.44 -0.08 0.05 0.00 3.14 0.00 0.00 58.73 62.27 2gii h TYR 230 Cb 0.51 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 2gii h TYR 230 CO -0.00 0.63 0.18 -0.07 -1.64 0.00 0.00 178.16 177.27 2gii h LEU 231 N 0.42 0.23 -0.72 2.82 3.38 -0.88 0.33 115.31 120.89 2gii h LEU 231 Ca 0.11 0.04 0.10 0.00 0.09 0.00 0.00 57.88 58.22 2gii h LEU 231 Cb 0.35 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.03 2gii h LEU 231 CO 0.01 0.17 0.35 0.11 0.09 0.00 0.00 178.44 179.17 2gii h LYS 232 N 0.37 0.57 -0.30 1.13 1.57 -1.13 0.29 116.57 119.07 2gii h LYS 232 Ca 0.20 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.91 2gii h LYS 232 Cb 0.16 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2gii h LYS 232 CO -0.18 0.37 0.04 1.25 -0.57 0.00 0.00 179.45 180.37 2gii h HIS 233 N 0.58 0.54 0.27 -1.35 -0.00 -0.66 0.10 115.15 114.64 2gii h HIS 233 Ca 0.36 -0.08 -0.01 0.00 -0.00 0.00 0.00 60.37 60.64 2gii h HIS 233 Cb 0.41 -0.15 0.00 0.00 -0.00 0.00 0.00 27.41 27.68 2gii h HIS 233 CO -0.11 0.60 -0.13 0.35 -0.00 0.00 0.00 177.93 178.64 2gii h PHE 234 N 0.33 -0.33 -0.53 5.26 3.04 0.55 -0.33 116.94 124.92 2gii h PHE 234 Ca 0.09 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.08 2gii h PHE 234 Cb 0.36 0.11 -0.05 0.00 2.56 0.00 0.00 35.95 38.93 2gii h PHE 234 CO 0.02 -0.14 0.26 0.28 -2.02 0.00 0.00 178.31 176.72 2gii h VAL 235 N -0.46 0.94 -0.66 1.41 2.07 -0.44 -0.18 116.25 118.92 2gii h VAL 235 Ca -0.04 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2gii h VAL 235 Cb 0.35 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2gii h VAL 235 CO 0.06 0.09 0.39 0.74 0.02 0.00 0.00 177.57 178.87 2gii h THR 236 N 0.50 1.19 -0.23 2.57 2.02 -0.77 -1.93 112.91 116.28 2gii h THR 236 Ca 0.24 -0.45 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 2gii h THR 236 Cb 0.16 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.86 2gii h THR 236 CO -0.17 0.20 -0.29 1.56 0.37 0.00 0.00 175.52 177.19 2gii h GLN 237 N 0.90 0.45 -0.19 6.66 1.08 -0.54 -1.81 115.11 121.66 2gii h GLN 237 Ca 0.24 -0.18 -0.10 0.00 -1.45 0.00 0.00 58.65 57.16 2gii h GLN 237 Cb -0.01 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.38 2gii h GLN 237 CO -0.04 0.70 -0.32 0.00 -0.95 0.00 0.00 178.83 178.21 2gii h ALA 238 N 1.30 1.11 0.07 3.87 0.00 -0.66 -0.69 119.26 124.26 2gii h ALA 238 Ca 0.05 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 2gii h ALA 238 Cb 0.70 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2gii h ALA 238 CO 0.05 0.56 -0.03 0.93 0.00 0.00 0.00 179.25 180.77 2gii h GLU 239 N 0.33 -0.09 -0.36 0.00 5.08 -1.01 -2.10 114.58 116.43 2gii h GLU 239 Ca 0.04 0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 2gii h GLU 239 Cb 0.73 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.95 2gii h GLU 239 CO 0.06 0.32 0.09 1.96 -1.00 0.00 0.00 179.01 180.43 2gii h GLN 240 N -0.51 0.21 -0.86 2.33 1.08 -1.24 -2.71 115.11 113.40 2gii h GLN 240 Ca -0.01 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 2gii h GLN 240 Cb 0.44 -0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.79 2gii h GLN 240 CO 0.02 0.14 0.43 -0.09 -0.95 0.00 0.00 178.83 178.37 2gii h ARG 241 N 0.21 1.22 -0.58 1.46 9.65 -1.13 0.13 114.38 125.34 2gii h ARG 241 Ca 0.17 -0.17 0.06 0.00 -1.10 0.00 0.00 59.98 58.94 2gii h ARG 241 Cb 0.18 -0.23 -0.05 0.00 -1.39 0.00 0.00 29.97 28.48 2gii h ARG 241 CO -0.21 0.93 0.29 0.00 2.80 0.00 0.00 179.97 183.78 2gii h ALA 242 N 1.25 0.76 -0.14 2.80 0.00 -1.07 -0.50 119.26 122.36 2gii h ALA 242 Ca 0.30 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.20 2gii h ALA 242 Cb 0.09 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2gii h ALA 242 CO -0.04 -0.06 -0.06 0.82 0.00 0.00 0.00 179.25 179.92 2gii h ILE 243 N 0.55 1.31 0.00 0.00 1.08 -1.15 -3.01 117.51 116.29 2gii h ILE 243 Ca 0.26 -1.06 -0.01 0.00 -0.39 0.00 0.00 64.86 63.66 2gii h ILE 243 Cb 0.19 1.72 -0.00 0.00 -3.07 0.00 0.00 36.82 35.66 2gii h ILE 243 CO -0.19 0.31 -0.02 0.28 -0.69 0.00 0.00 178.15 177.84 2gii h SER 244 N -0.04 0.00 -0.26 1.72 0.02 -0.41 -1.45 113.55 113.13 2gii h SER 244 Ca 0.03 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.87 2gii h SER 244 Cb 0.51 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2gii h SER 244 CO 0.02 0.02 -0.22 0.24 -1.14 0.00 0.00 176.83 175.76 2gii h MET 245 N 0.00 0.73 -0.08 3.45 2.86 -0.95 0.40 114.93 121.35 2gii h MET 245 Ca -0.00 -0.29 -0.13 0.00 -2.06 0.00 0.00 59.70 57.22 2gii h MET 245 Cb 0.15 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 2gii h MET 245 CO 0.00 0.89 -0.55 0.82 1.06 0.00 0.00 176.91 179.14 2gii h ILE 246 N 0.64 1.37 0.23 -1.22 5.03 -1.34 0.60 117.51 122.82 2gii h ILE 246 Ca 0.09 -1.85 -0.01 0.00 -0.12 0.00 0.00 64.86 62.97 2gii h ILE 246 Cb 0.71 1.91 0.00 0.00 -3.03 0.00 0.00 36.82 36.42 2gii h ILE 246 CO 0.05 0.55 -0.11 -0.78 -0.68 0.00 0.00 178.15 177.18 2gii h ASP 247 N 0.18 -0.27 0.43 1.72 -0.00 -0.73 0.26 116.42 118.01 2gii h ASP 247 Ca 0.00 -0.16 -0.30 0.00 -0.00 0.00 0.00 57.03 56.57 2gii h ASP 247 Cb 1.02 0.07 -0.05 0.00 -0.00 0.00 0.00 39.33 40.37 2gii h ASP 247 CO 0.08 0.01 -1.78 0.29 -0.00 0.00 0.00 179.24 177.85 2gii n LYS 248 N -5.12 0.65 -0.03 0.28 5.02 0.13 -4.23 118.16 114.86 2gii n LYS 248 Ca -0.09 0.28 0.05 0.00 -2.02 0.00 0.00 58.31 56.53 2gii n LYS 248 Cb 0.22 -1.77 0.06 0.00 -0.02 0.00 0.00 35.03 33.52 2gii n LYS 248 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2gii n PHE 249 N -3.06 0.08 0.05 2.13 3.72 0.21 -4.69 117.46 115.90 2gii n PHE 249 Ca -0.19 -0.10 0.00 0.00 -0.05 0.00 0.00 57.45 57.11 2gii n PHE 249 Cb 1.06 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.59 2gii n PHE 249 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 2gii n VAL 250 N 0.55 0.90 0.25 -4.37 0.31 -1.05 -4.82 118.33 110.10 2gii n VAL 250 Ca 0.07 0.30 -0.16 0.00 -0.01 0.00 0.00 64.34 64.54 2gii n VAL 250 Cb 0.29 -1.46 -0.08 0.00 -0.91 0.00 0.00 33.84 31.67 2gii n VAL 250 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2gii h LYS 251 N 0.00 -0.74 -0.03 5.55 6.56 -1.12 -2.49 116.57 124.30 2gii h LYS 251 Ca 0.00 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 2gii h LYS 251 Cb 0.17 0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 2gii h LYS 251 CO 0.00 -0.49 0.00 -0.35 -2.06 0.00 0.00 179.45 176.55 2gii n PRO 252 N -5.47 0.14 0.00 3.15 -0.04 -1.26 -1.57 135.00 129.96 2gii n PRO 252 Ca -0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 2gii n PRO 252 Cb 0.37 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.81 2gii n PRO 252 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2gii n PHE 253 N -0.30 0.00 -0.28 0.54 0.99 -0.96 -4.77 117.46 112.69 2gii n PHE 253 Ca 0.00 -0.04 -0.05 0.00 -0.00 0.00 0.00 57.45 57.36 2gii n PHE 253 Cb 0.01 -0.00 0.06 0.00 -1.00 0.00 0.00 39.48 38.54 2gii n PHE 253 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 2gii h LYS 254 N 0.00 1.06 -0.49 -1.08 1.79 -1.07 -3.24 116.57 113.54 2gii h LYS 254 Ca 0.00 -0.13 0.04 0.00 -2.18 0.00 0.00 60.65 58.39 2gii h LYS 254 Cb 0.57 -0.21 -0.06 0.00 -1.58 0.00 0.00 32.23 30.95 2gii h LYS 254 CO 0.00 0.79 -0.29 1.63 -1.08 0.00 0.00 179.45 180.49 2gii n LYS 255 N -4.45 -0.22 0.00 3.15 5.02 -1.26 -1.31 118.16 119.09 2gii n LYS 255 Ca 0.07 0.90 0.09 0.00 -2.02 0.00 0.00 58.31 57.35 2gii n LYS 255 Cb 0.09 -1.32 0.51 0.00 -0.02 0.00 0.00 35.03 34.29 2gii n LYS 255 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2gii n TYR 256 N -4.30 0.00 -3.06 2.13 4.01 -1.22 -4.47 117.16 110.25 2gii n TYR 256 Ca 0.01 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.31 2gii n TYR 256 Cb 0.13 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2gii n TYR 256 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 2gii n ILE 257 N -1.13 4.72 -1.71 -0.72 5.41 -0.43 -5.21 119.36 120.29 2gii n ILE 257 Ca 0.12 -5.33 0.00 0.00 1.00 0.00 0.00 62.75 58.54 2gii n ILE 257 Cb 0.10 -2.39 0.00 0.00 -0.71 0.00 0.00 39.64 36.64 2gii n ILE 257 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73