#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b6i s ASN 2 N 0.00 0.76 0.31 6.12 2.20 -1.26 -5.04 114.94 118.03 1b6i s ASN 2 Ca 0.00 -1.44 0.04 0.00 -0.94 0.00 0.00 52.86 50.53 1b6i s ASN 2 Cb 0.00 0.72 0.66 0.00 -2.00 0.00 0.00 41.25 40.63 1b6i s ASN 2 CO 0.00 -1.42 1.83 -0.29 -2.94 0.00 0.00 177.10 174.29 1b6i h ILE 3 N 2.06 0.86 -0.31 0.54 6.09 -1.97 0.23 117.51 125.00 1b6i h ILE 3 Ca -0.29 -0.30 -0.09 0.00 -1.37 0.00 0.00 64.86 62.81 1b6i h ILE 3 Cb 1.24 -0.09 -0.01 0.00 0.47 0.00 0.00 36.82 38.43 1b6i h ILE 3 CO 0.39 0.16 -0.15 -0.26 -3.07 0.00 0.00 178.15 175.23 1b6i h PHE 4 N 0.87 0.75 -0.31 2.19 0.04 -1.98 -0.36 116.94 118.13 1b6i h PHE 4 Ca 0.50 -0.18 -0.05 0.00 2.80 0.00 0.00 57.97 61.03 1b6i h PHE 4 Cb 0.63 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.60 1b6i h PHE 4 CO -0.00 0.87 -0.02 0.93 -0.60 0.00 0.00 178.31 179.49 1b6i h GLU 5 N 0.41 0.55 -0.01 1.51 5.08 -1.85 0.65 114.58 120.92 1b6i h GLU 5 Ca 0.07 -0.19 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1b6i h GLU 5 Cb 0.67 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.83 1b6i h GLU 5 CO 0.04 0.71 -0.26 1.98 -1.00 0.00 0.00 179.01 180.48 1b6i h MET 6 N 0.34 -0.38 -0.21 2.33 4.05 -0.84 -2.25 114.93 117.97 1b6i h MET 6 Ca 0.08 0.03 -0.09 0.00 -0.28 0.00 0.00 59.70 59.44 1b6i h MET 6 Cb 0.47 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.34 1b6i h MET 6 CO 0.02 -0.25 -0.26 -0.07 0.23 0.00 0.00 176.91 176.57 1b6i h LEU 7 N -0.39 0.41 -1.19 3.39 3.38 -0.97 -1.69 115.31 118.24 1b6i h LEU 7 Ca 0.07 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1b6i h LEU 7 Cb 0.48 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1b6i h LEU 7 CO -0.24 0.67 0.35 -0.09 0.09 0.00 0.00 178.44 179.23 1b6i h ARG 8 N 0.36 0.91 -0.16 1.13 9.65 -0.58 -0.40 114.38 125.28 1b6i h ARG 8 Ca 0.05 -0.10 -0.02 0.00 -1.10 0.00 0.00 59.98 58.81 1b6i h ARG 8 Cb 0.66 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.05 1b6i h ARG 8 CO 0.05 0.67 0.02 0.82 2.80 0.00 0.00 179.97 184.33 1b6i h ILE 9 N 0.91 1.23 -0.52 1.20 2.04 -1.06 -1.25 117.51 120.07 1b6i h ILE 9 Ca 0.23 -0.76 -0.10 0.00 1.00 0.00 0.00 64.86 65.23 1b6i h ILE 9 Cb 0.04 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1b6i h ILE 9 CO -0.04 0.23 -0.06 0.44 0.00 0.00 0.00 178.15 178.72 1b6i h ASP 10 N 0.05 0.91 0.00 1.72 3.32 -1.03 -3.34 116.42 118.05 1b6i h ASP 10 Ca 0.05 -0.27 -0.13 0.00 0.02 0.00 0.00 57.03 56.71 1b6i h ASP 10 Cb 0.33 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1b6i h ASP 10 CO 0.00 1.00 -2.12 -0.62 -1.72 0.00 0.00 179.24 175.79 1b6i n GLU 11 N -4.17 0.68 -0.06 3.56 -0.58 -0.19 -5.07 120.64 114.82 1b6i n GLU 11 Ca 0.02 -0.13 0.01 0.00 -0.42 0.00 0.00 57.16 56.64 1b6i n GLU 11 Cb 0.36 -1.51 -0.00 0.00 -0.57 0.00 0.00 31.44 29.71 1b6i n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1b6i n GLY 12 N 1.44 -1.70 2.75 0.62 0.00 -0.47 -4.39 105.19 103.44 1b6i n GLY 12 Ca -0.14 -1.27 -0.22 0.00 0.00 0.00 0.00 46.02 44.39 1b6i n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1b6i s LEU 13 N 0.00 0.54 -0.02 0.99 2.96 -1.26 -4.28 118.68 117.61 1b6i s LEU 13 Ca 0.00 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1b6i s LEU 13 Cb 0.00 -0.35 0.00 0.00 0.50 0.00 0.00 46.19 46.34 1b6i s LEU 13 CO 0.00 -0.20 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.62 1b6i s ARG 14 N 1.92 0.89 0.00 1.98 1.81 -0.86 -5.00 118.95 119.70 1b6i s ARG 14 Ca 0.04 -0.30 0.26 0.00 -1.72 0.00 0.00 55.73 54.01 1b6i s ARG 14 Cb -0.12 -0.84 0.62 0.00 -0.45 0.00 0.00 34.95 34.16 1b6i s ARG 14 CO -0.04 0.13 1.49 1.28 -0.68 0.00 0.00 175.30 177.48 1b6i n LEU 15 N 3.21 1.81 -4.28 2.53 4.77 -1.26 -1.01 117.00 122.77 1b6i n LEU 15 Ca -0.17 -0.60 -0.25 0.00 -0.03 0.00 0.00 56.01 54.96 1b6i n LEU 15 Cb 0.55 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.48 1b6i n LEU 15 CO 0.25 0.31 -0.52 -0.75 -1.33 0.00 0.00 177.39 175.35 1b6i s LYS 16 N -2.19 1.29 0.23 3.23 2.47 -1.26 -1.08 119.74 122.43 1b6i s LYS 16 Ca 0.30 -1.06 -0.32 0.00 -1.56 0.00 0.00 55.97 53.33 1b6i s LYS 16 Cb 0.20 -1.49 -0.14 0.00 -1.46 0.00 0.00 37.83 34.94 1b6i s LYS 16 CO 0.41 0.37 1.43 -0.89 0.16 0.00 0.00 175.35 176.82 1b6i n ILE 17 N 1.48 0.80 -4.19 5.43 5.41 -1.11 -4.75 119.36 122.44 1b6i n ILE 17 Ca -0.18 -0.20 -0.13 0.00 1.00 0.00 0.00 62.75 63.24 1b6i n ILE 17 Cb 0.53 -1.46 -0.09 0.00 -0.71 0.00 0.00 39.64 37.91 1b6i n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1b6i s TYR 18 N 0.08 1.20 -0.16 1.39 1.13 0.87 -4.95 117.35 116.91 1b6i s TYR 18 Ca 0.70 -1.37 -0.10 0.00 -1.41 0.00 0.00 57.07 54.89 1b6i s TYR 18 Cb -0.66 -0.50 -0.05 0.00 -1.10 0.00 0.00 41.96 39.65 1b6i s TYR 18 CO 0.48 -0.74 0.18 0.15 -2.51 0.00 0.00 175.55 173.10 1b6i s LYS 19 N -3.96 3.99 0.19 -3.49 1.02 -1.26 -0.45 119.74 115.79 1b6i s LYS 19 Ca 0.37 -0.11 -0.03 0.00 0.02 0.00 0.00 55.97 56.23 1b6i s LYS 19 Cb 0.05 -3.35 0.04 0.00 -0.52 0.00 0.00 37.83 34.05 1b6i s LYS 19 CO 0.15 0.43 0.26 -0.40 -0.92 0.00 0.00 175.35 174.87 1b6i n ASP 20 N 3.05 0.08 0.24 2.83 5.68 -0.21 -4.81 116.55 123.41 1b6i n ASP 20 Ca -0.16 -1.13 0.13 0.00 -0.50 0.00 0.00 54.79 53.13 1b6i n ASP 20 Cb 0.53 -0.19 0.77 0.00 -1.14 0.00 0.00 41.12 41.09 1b6i n ASP 20 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1b6i n GLU 22 N -4.16 0.67 -0.47 0.00 -0.58 -1.26 -4.94 120.64 109.90 1b6i n GLU 22 Ca -0.01 -0.34 0.00 0.00 -0.42 0.00 0.00 57.16 56.39 1b6i n GLU 22 Cb 0.18 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.56 1b6i n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1b6i n GLY 23 N 1.35 0.76 3.87 0.62 0.00 0.23 -5.06 105.19 106.96 1b6i n GLY 23 Ca 0.12 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1b6i n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b6i s TYR 24 N -2.00 3.56 0.13 1.61 2.02 -1.26 -4.64 117.35 116.78 1b6i s TYR 24 Ca 0.00 0.75 -0.31 0.00 -0.37 0.00 0.00 57.07 57.14 1b6i s TYR 24 Cb 0.00 -2.13 -0.09 0.00 -0.40 0.00 0.00 41.96 39.34 1b6i s TYR 24 CO 0.00 0.50 1.46 0.71 -1.57 0.00 0.00 175.55 176.65 1b6i s TYR 25 N -1.44 3.16 0.14 2.71 2.02 -1.18 -1.04 117.35 121.72 1b6i s TYR 25 Ca 0.34 0.82 -0.03 0.00 -0.37 0.00 0.00 57.07 57.83 1b6i s TYR 25 Cb -0.14 -3.78 -0.03 0.00 -0.40 0.00 0.00 41.96 37.61 1b6i s TYR 25 CO 0.19 -2.79 0.12 0.99 -1.57 0.00 0.00 175.55 172.48 1b6i s THR 26 N 1.17 0.09 0.23 -0.71 2.01 0.41 0.88 115.64 119.71 1b6i s THR 26 Ca 0.67 -1.79 -0.17 0.00 0.31 0.00 0.00 61.69 60.71 1b6i s THR 26 Cb -0.39 -2.02 0.01 0.00 0.01 0.00 0.00 72.50 70.11 1b6i s THR 26 CO 0.31 -0.40 0.55 -0.51 -0.69 0.00 0.00 174.62 173.88 1b6i s ILE 27 N -4.04 0.01 0.00 1.82 2.07 -0.70 -0.09 121.20 120.28 1b6i s ILE 27 Ca 0.23 -1.07 0.00 0.00 -1.41 0.00 0.00 60.65 58.41 1b6i s ILE 27 Cb 0.06 -1.91 0.00 0.00 0.13 0.00 0.00 42.46 40.74 1b6i s ILE 27 CO 0.02 -0.05 0.00 0.61 -1.91 0.00 0.00 174.94 173.61 1b6i n GLY 28 N -0.38 3.24 3.15 1.50 0.00 -0.18 -0.08 105.19 112.43 1b6i n GLY 28 Ca -0.05 -0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.37 1b6i n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1b6i n ILE 29 N 0.00 4.91 -1.57 -0.61 5.41 -1.26 -2.03 119.36 124.20 1b6i n ILE 29 Ca 0.00 -5.53 -0.13 0.00 1.00 0.00 0.00 62.75 58.10 1b6i n ILE 29 Cb 0.00 -2.32 -0.04 0.00 -0.71 0.00 0.00 39.64 36.57 1b6i n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b6i n GLY 30 N 2.13 0.99 3.55 7.39 0.00 -1.24 -4.89 105.19 113.12 1b6i n GLY 30 Ca 0.27 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1b6i n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1b6i s HIS 31 N -2.50 2.59 0.12 1.61 5.04 0.89 -4.89 115.29 118.15 1b6i s HIS 31 Ca 0.00 0.11 -0.31 0.00 -1.54 0.00 0.00 55.06 53.32 1b6i s HIS 31 Cb 0.00 -4.40 -0.09 0.00 0.04 0.00 0.00 32.58 28.12 1b6i s HIS 31 CO 0.00 -1.64 1.64 -1.17 -2.34 0.00 0.00 174.74 171.23 1b6i s LEU 32 N 4.78 4.37 -0.21 8.88 2.96 -1.26 -1.72 118.68 136.48 1b6i s LEU 32 Ca 0.36 2.59 -0.18 0.00 -0.22 0.00 0.00 54.13 56.68 1b6i s LEU 32 Cb -0.10 -3.58 -0.15 0.00 0.50 0.00 0.00 46.19 42.87 1b6i s LEU 32 CO 0.20 -0.88 0.02 0.18 -1.32 0.00 0.00 176.35 174.55 1b6i n LEU 33 N 4.85 1.87 -3.55 -0.68 4.77 0.25 -4.95 117.00 119.57 1b6i n LEU 33 Ca 0.15 0.43 -0.17 0.00 -0.03 0.00 0.00 56.01 56.39 1b6i n LEU 33 Cb 0.39 -0.92 -0.06 0.00 -2.33 0.00 0.00 43.42 40.50 1b6i n LEU 33 CO 0.63 0.20 0.41 0.28 -1.33 0.00 0.00 177.39 177.57 1b6i s THR 34 N -2.39 0.00 -0.40 -5.08 -1.32 -1.14 -4.96 115.64 100.36 1b6i s THR 34 Ca -0.29 -0.03 0.23 0.00 -1.21 0.00 0.00 61.69 60.39 1b6i s THR 34 Cb 0.07 -0.97 0.19 0.00 -1.51 0.00 0.00 72.50 70.28 1b6i s THR 34 CO 0.51 -0.02 1.39 0.11 -2.21 0.00 0.00 174.62 174.41 1b6i h LYS 35 N 3.23 0.00 -7.18 7.08 1.57 -1.96 -3.13 116.57 116.18 1b6i h LYS 35 Ca -0.27 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 57.99 1b6i h LYS 35 Cb 1.14 0.00 0.12 0.00 0.08 0.00 0.00 32.23 33.58 1b6i h LYS 35 CO 0.36 0.00 0.39 -1.54 -0.57 0.00 0.00 179.45 178.09 1b6i s SER 36 N -5.66 4.78 0.24 0.86 1.04 -1.26 -4.86 113.70 108.83 1b6i s SER 36 Ca 0.04 2.17 0.23 0.00 0.48 0.00 0.00 55.95 58.88 1b6i s SER 36 Cb 0.08 -2.57 0.95 0.00 0.10 0.00 0.00 66.02 64.57 1b6i s SER 36 CO 0.71 -1.86 1.70 -0.81 0.98 0.00 0.00 173.24 173.96 1b6i n PRO 37 N -2.42 0.18 -2.65 4.02 -0.04 -1.26 -4.66 135.00 128.16 1b6i n PRO 37 Ca 0.12 0.40 -0.43 0.00 -0.04 0.00 0.00 63.50 63.55 1b6i n PRO 37 Cb 0.51 -1.84 -0.02 0.00 -0.04 0.00 0.00 33.50 32.11 1b6i n PRO 37 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1b6i s SER 38 N -4.15 7.15 0.45 3.54 0.15 -1.26 -4.91 113.70 114.66 1b6i s SER 38 Ca 0.05 1.47 0.19 0.00 0.70 0.00 0.00 55.95 58.35 1b6i s SER 38 Cb 0.09 -2.55 1.05 0.00 -1.71 0.00 0.00 66.02 62.90 1b6i s SER 38 CO 0.39 -0.59 1.95 0.25 1.20 0.00 0.00 173.24 176.44 1b6i h LEU 39 N 8.87 0.00 0.07 3.45 5.85 -2.00 -2.11 115.31 129.44 1b6i h LEU 39 Ca -0.24 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 1b6i h LEU 39 Cb 1.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1b6i h LEU 39 CO 0.93 0.23 -0.03 0.78 -0.34 0.00 0.00 178.44 180.01 1b6i h ASN 40 N 0.00 -0.07 -0.78 1.25 2.35 -1.98 -0.24 115.58 116.11 1b6i h ASN 40 Ca -0.00 -0.27 0.18 0.00 -0.55 0.00 0.00 56.30 55.66 1b6i h ASN 40 Cb 0.47 0.02 -0.14 0.00 0.05 0.00 0.00 38.32 38.72 1b6i h ASN 40 CO 0.03 0.23 -0.03 0.00 -1.65 0.00 0.00 177.43 176.01 1b6i h ALA 41 N 0.53 0.77 -0.36 -0.83 0.00 -1.85 0.16 119.26 117.67 1b6i h ALA 41 Ca -0.01 0.26 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1b6i h ALA 41 Cb 0.34 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1b6i h ALA 41 CO 0.01 -0.43 0.16 0.00 0.00 0.00 0.00 179.25 179.00 1b6i h ALA 42 N 1.74 0.46 -0.75 0.00 0.00 -1.08 0.68 119.26 120.31 1b6i h ALA 42 Ca 0.42 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1b6i h ALA 42 Cb 0.74 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1b6i h ALA 42 CO -0.71 0.04 0.39 0.87 0.00 0.00 0.00 179.25 179.84 1b6i h LYS 43 N 0.44 1.06 -0.03 0.00 1.57 0.41 -0.21 116.57 119.80 1b6i h LYS 43 Ca 0.12 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1b6i h LYS 43 Cb 0.14 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 1b6i h LYS 43 CO -0.01 0.80 -0.10 0.66 -0.57 0.00 0.00 179.45 180.23 1b6i h SER 44 N 1.05 -0.28 -0.49 0.86 4.64 -0.09 -0.47 113.55 118.76 1b6i h SER 44 Ca 0.26 0.05 0.06 0.00 -0.47 0.00 0.00 61.79 61.69 1b6i h SER 44 Cb 0.07 0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 62.23 1b6i h SER 44 CO -0.04 -0.14 0.20 -0.33 -0.87 0.00 0.00 176.83 175.66 1b6i h GLU 45 N -0.15 0.39 -0.42 4.77 4.39 -0.29 -1.79 114.58 121.48 1b6i h GLU 45 Ca 0.05 -0.02 0.05 0.00 0.34 0.00 0.00 59.36 59.78 1b6i h GLU 45 Cb 0.21 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 28.73 1b6i h GLU 45 CO -0.12 0.26 0.14 1.25 -1.16 0.00 0.00 179.01 179.38 1b6i h LEU 46 N 0.40 0.14 -0.51 1.33 5.85 -0.57 -0.13 115.31 121.82 1b6i h LEU 46 Ca 0.23 0.05 0.04 0.00 0.84 0.00 0.00 57.88 59.04 1b6i h LEU 46 Cb 0.20 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1b6i h LEU 46 CO -0.20 0.11 0.27 0.44 -0.34 0.00 0.00 178.44 178.72 1b6i h ASP 47 N 0.30 0.40 -0.68 1.25 3.32 -0.59 -0.45 116.42 119.97 1b6i h ASP 47 Ca 0.20 0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.23 1b6i h ASP 47 Cb 0.19 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1b6i h ASP 47 CO -0.21 0.28 0.29 0.50 -1.72 0.00 0.00 179.24 178.38 1b6i h LYS 48 N 0.53 1.01 -0.76 3.56 3.64 -0.93 0.51 116.57 124.12 1b6i h LYS 48 Ca 0.22 -0.17 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1b6i h LYS 48 Cb 0.11 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1b6i h LYS 48 CO -0.14 0.83 0.26 0.00 -2.27 0.00 0.00 179.45 178.12 1b6i h ALA 49 N 1.13 0.99 0.00 5.00 0.00 -0.62 -3.15 119.26 122.62 1b6i h ALA 49 Ca 0.23 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1b6i h ALA 49 Cb 0.19 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1b6i h ALA 49 CO -0.02 0.66 -1.16 0.82 0.00 0.00 0.00 179.25 179.55 1b6i h ILE 50 N 1.13 0.43 -0.47 0.00 1.08 -1.02 -3.49 117.51 115.17 1b6i h ILE 50 Ca 0.25 -1.79 -0.06 0.00 -0.39 0.00 0.00 64.86 62.87 1b6i h ILE 50 Cb 0.28 1.97 -0.00 0.00 -3.07 0.00 0.00 36.82 36.01 1b6i h ILE 50 CO -0.01 0.25 -0.08 0.61 -0.69 0.00 0.00 178.15 178.23 1b6i n GLY 51 N 1.32 0.27 3.63 5.37 0.00 0.17 -5.04 105.19 110.93 1b6i n GLY 51 Ca -0.06 -0.76 -0.09 0.00 0.00 0.00 0.00 46.02 45.11 1b6i n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1b6i s ARG 52 N -4.19 1.53 -0.51 1.61 1.70 -1.00 -5.04 118.95 113.04 1b6i s ARG 52 Ca 0.00 -0.79 -0.24 0.00 -0.47 0.00 0.00 55.73 54.23 1b6i s ARG 52 Cb -0.00 0.58 0.03 0.00 -0.57 0.00 0.00 34.95 35.00 1b6i s ARG 52 CO 0.00 -0.68 0.91 1.21 -1.08 0.00 0.00 175.30 175.67 1b6i s ASN 53 N -2.85 6.40 0.00 -2.89 2.47 -1.26 -4.44 114.94 112.37 1b6i s ASN 53 Ca 0.07 -0.18 0.22 0.00 0.42 0.00 0.00 52.86 53.39 1b6i s ASN 53 Cb -0.03 -2.43 -0.20 0.00 -1.45 0.00 0.00 41.25 37.13 1b6i s ASN 53 CO -0.02 -1.13 0.77 0.35 -3.72 0.00 0.00 177.10 173.36 1b6i n THR 54 N 6.25 0.05 -3.57 -5.21 -2.24 -1.26 -4.95 114.28 103.35 1b6i n THR 54 Ca 0.03 -0.25 -0.26 0.00 -2.27 0.00 0.00 64.05 61.29 1b6i n THR 54 Cb 0.48 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 1b6i n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1b6i n ASN 55 N -1.91 -4.08 0.00 3.42 2.85 -1.26 -1.90 115.26 112.38 1b6i n ASN 55 Ca 0.00 -0.55 0.00 0.00 -0.11 0.00 0.00 54.58 53.93 1b6i n ASN 55 Cb 0.45 -3.33 0.00 0.00 1.24 0.00 0.00 39.78 38.14 1b6i n ASN 55 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1b6i n GLY 56 N -1.34 0.23 3.33 8.20 0.00 -1.26 -4.98 105.19 109.38 1b6i n GLY 56 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1b6i n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b6i s VAL 57 N -1.50 2.10 0.23 1.61 1.01 -0.80 -2.74 120.40 120.31 1b6i s VAL 57 Ca 0.00 -1.33 0.03 0.00 0.00 0.00 0.00 61.98 60.68 1b6i s VAL 57 Cb 0.00 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1b6i s VAL 57 CO 0.00 0.40 0.01 0.27 0.00 0.00 0.00 175.10 175.78 1b6i s ILE 58 N -0.76 0.93 0.48 2.22 -4.36 -0.24 -4.80 121.20 114.66 1b6i s ILE 58 Ca 0.11 -2.02 -0.02 0.00 -0.26 0.00 0.00 60.65 58.46 1b6i s ILE 58 Cb -0.10 -2.36 -0.01 0.00 1.25 0.00 0.00 42.46 41.23 1b6i s ILE 58 CO 0.01 -0.29 0.74 0.42 0.24 0.00 0.00 174.94 176.06 1b6i s THR 59 N -3.49 4.29 0.22 8.37 -4.23 -1.26 -4.82 115.64 114.72 1b6i s THR 59 Ca 0.29 -0.20 -0.08 0.00 -1.18 0.00 0.00 61.69 60.52 1b6i s THR 59 Cb 0.06 -3.62 0.17 0.00 1.34 0.00 0.00 72.50 70.45 1b6i s THR 59 CO 0.09 -0.52 1.73 0.50 -0.54 0.00 0.00 174.62 175.88 1b6i h LYS 60 N 0.27 0.37 -0.52 3.99 3.64 -1.98 0.38 116.57 122.71 1b6i h LYS 60 Ca -0.47 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 58.93 1b6i h LYS 60 Cb 1.24 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.93 1b6i h LYS 60 CO 0.60 0.25 0.27 -0.44 -2.27 0.00 0.00 179.45 177.86 1b6i h ASP 61 N 0.38 0.40 -0.76 4.20 3.32 -1.99 0.43 116.42 122.41 1b6i h ASP 61 Ca 0.34 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.36 1b6i h ASP 61 Cb 0.48 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 1b6i h ASP 61 CO -0.36 0.28 0.24 -0.33 -1.72 0.00 0.00 179.24 177.35 1b6i h GLU 62 N 0.53 1.17 -0.82 3.56 5.08 -1.46 -1.14 114.58 121.51 1b6i h GLU 62 Ca 0.23 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 1b6i h GLU 62 Cb 0.12 -0.17 -0.05 0.00 0.50 0.00 0.00 28.75 29.16 1b6i h GLU 62 CO -0.15 0.99 0.53 0.00 -1.00 0.00 0.00 179.01 179.38 1b6i h ALA 63 N 1.13 1.08 0.00 3.43 0.00 0.77 -2.59 119.26 123.08 1b6i h ALA 63 Ca 0.24 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 1b6i h ALA 63 Cb 0.30 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1b6i h ALA 63 CO -0.01 0.37 -0.60 0.93 0.00 0.00 0.00 179.25 179.94 1b6i h GLU 64 N 1.04 0.00 -0.19 0.00 5.08 -0.59 -1.77 114.58 118.15 1b6i h GLU 64 Ca 0.32 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.66 1b6i h GLU 64 Cb -0.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1b6i h GLU 64 CO -0.10 0.60 0.04 -0.22 -1.00 0.00 0.00 179.01 178.33 1b6i h LYS 65 N 0.00 0.31 -0.80 2.33 3.64 -0.95 0.78 116.57 121.89 1b6i h LYS 65 Ca -0.01 -0.08 0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1b6i h LYS 65 Cb 1.07 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.80 1b6i h LYS 65 CO 0.08 0.45 0.50 -0.07 -2.27 0.00 0.00 179.45 178.14 1b6i h LEU 66 N 0.12 0.81 -0.11 5.20 3.38 -1.33 -1.17 115.31 122.21 1b6i h LEU 66 Ca 0.06 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1b6i h LEU 66 Cb 0.28 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1b6i h LEU 66 CO 0.00 0.54 0.04 0.15 0.09 0.00 0.00 178.44 179.26 1b6i h PHE 67 N 0.95 0.17 -0.75 1.13 3.57 -0.97 0.17 116.94 121.20 1b6i h PHE 67 Ca 0.33 -0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.92 1b6i h PHE 67 Cb 0.08 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.69 1b6i h PHE 67 CO -0.04 0.29 0.39 -0.91 -2.23 0.00 0.00 178.31 175.81 1b6i h ASN 68 N 0.00 0.51 -0.60 0.41 2.35 -0.57 0.42 115.58 118.10 1b6i h ASN 68 Ca 0.04 0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.77 1b6i h ASN 68 Cb 0.20 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 1b6i h ASN 68 CO -0.00 0.28 0.10 1.56 -1.65 0.00 0.00 177.43 177.71 1b6i h GLN 69 N 0.64 1.03 -0.51 0.81 4.20 -0.84 -1.62 115.11 118.82 1b6i h GLN 69 Ca 0.37 -0.26 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 1b6i h GLN 69 Cb 0.41 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.04 1b6i h GLN 69 CO -0.28 0.95 -0.09 -0.44 -0.67 0.00 0.00 178.83 178.29 1b6i h ASP 70 N 0.96 0.93 -0.29 1.46 3.32 0.45 -0.97 116.42 122.29 1b6i h ASP 70 Ca 0.19 -0.29 -0.08 0.00 0.02 0.00 0.00 57.03 56.87 1b6i h ASP 70 Cb 0.42 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1b6i h ASP 70 CO 0.01 1.04 -0.13 0.58 -1.72 0.00 0.00 179.24 179.02 1b6i h VAL 71 N 0.84 1.29 -0.41 -1.35 2.07 -0.03 -2.56 116.25 116.11 1b6i h VAL 71 Ca 0.14 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1b6i h VAL 71 Cb 0.63 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.86 1b6i h VAL 71 CO 0.04 0.39 0.21 -0.78 0.02 0.00 0.00 177.57 177.45 1b6i h ASP 72 N 0.34 0.49 -0.01 0.57 3.58 -1.22 -1.62 116.42 118.56 1b6i h ASP 72 Ca 0.06 -0.03 -0.15 0.00 0.42 0.00 0.00 57.03 57.34 1b6i h ASP 72 Cb 0.65 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 1b6i h ASP 72 CO 0.04 0.41 -0.47 0.00 -2.88 0.00 0.00 179.24 176.34 1b6i h ALA 73 N 1.67 0.78 -0.17 -0.78 0.00 -1.07 -2.32 119.26 117.37 1b6i h ALA 73 Ca 0.15 -0.47 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1b6i h ALA 73 Cb 0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1b6i h ALA 73 CO -0.02 0.67 -0.08 0.00 0.00 0.00 0.00 179.25 179.82 1b6i h ALA 74 N 1.04 0.24 -0.32 0.00 0.00 -0.92 0.16 119.26 119.46 1b6i h ALA 74 Ca 0.02 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.72 1b6i h ALA 74 Cb 0.99 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 1b6i h ALA 74 CO 0.09 0.05 -0.02 0.28 0.00 0.00 0.00 179.25 179.64 1b6i h VAL 75 N 0.03 0.74 -0.25 0.00 2.07 -1.18 -0.78 116.25 116.88 1b6i h VAL 75 Ca 0.04 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.47 1b6i h VAL 75 Cb 0.55 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1b6i h VAL 75 CO 0.02 0.01 -0.14 0.03 0.02 0.00 0.00 177.57 177.51 1b6i h ARG 76 N 0.06 0.42 -0.38 1.57 3.08 -1.32 0.24 114.38 118.07 1b6i h ARG 76 Ca 0.15 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 1b6i h ARG 76 Cb 0.22 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1b6i h ARG 76 CO -0.28 0.57 0.06 0.78 -1.07 0.00 0.00 179.97 180.03 1b6i h GLY 77 N 0.91 0.67 0.43 0.04 0.00 -0.07 0.32 103.07 105.36 1b6i h GLY 77 Ca 0.07 -0.45 0.02 0.00 0.00 0.00 0.00 47.33 46.98 1b6i h GLY 77 CO 0.03 0.41 -0.32 -2.22 0.00 0.00 0.00 176.54 174.45 1b6i h ILE 78 N 0.47 0.32 0.00 2.60 2.04 -0.55 -1.76 117.51 120.63 1b6i h ILE 78 Ca 0.11 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.97 1b6i h ILE 78 Cb 0.36 0.32 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1b6i h ILE 78 CO 0.01 0.00 -0.01 -0.07 0.00 0.00 0.00 178.15 178.07 1b6i h LEU 79 N -0.53 0.00 -1.97 1.44 3.38 0.28 -0.88 115.31 117.02 1b6i h LEU 79 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1b6i h LEU 79 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1b6i h LEU 79 CO -0.19 0.01 0.00 0.54 0.09 0.00 0.00 178.44 178.89 1b6i n ARG 80 N -3.23 2.24 -3.57 1.13 1.74 0.03 -4.84 116.66 110.15 1b6i n ARG 80 Ca -0.02 -1.94 -0.37 0.00 -0.77 0.00 0.00 57.85 54.74 1b6i n ARG 80 Cb 0.13 -1.45 -0.09 0.00 -1.02 0.00 0.00 32.46 30.03 1b6i n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1b6i s ASN 81 N -1.82 6.24 0.35 0.55 3.84 -0.34 -4.99 114.94 118.76 1b6i s ASN 81 Ca 0.29 0.26 0.04 0.00 0.21 0.00 0.00 52.86 53.66 1b6i s ASN 81 Cb 0.20 -2.15 0.64 0.00 -0.55 0.00 0.00 41.25 39.38 1b6i s ASN 81 CO 0.29 0.03 1.94 0.00 -2.79 0.00 0.00 177.10 176.57 1b6i h ALA 82 N 7.39 1.46 0.19 1.71 0.00 -1.91 0.47 119.26 128.57 1b6i h ALA 82 Ca -0.38 -0.13 -0.30 0.00 0.00 0.00 0.00 54.91 54.11 1b6i h ALA 82 Cb 1.17 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 18.80 1b6i h ALA 82 CO 0.68 0.41 -1.28 0.87 0.00 0.00 0.00 179.25 179.94 1b6i h LYS 83 N 0.64 0.53 0.07 0.00 1.79 -1.94 -3.40 116.57 114.27 1b6i h LYS 83 Ca 0.16 -0.82 -0.15 0.00 -2.18 0.00 0.00 60.65 57.65 1b6i h LYS 83 Cb 0.14 0.29 0.02 0.00 -1.58 0.00 0.00 32.23 31.10 1b6i h LYS 83 CO -0.02 1.38 -0.63 -0.07 -1.08 0.00 0.00 179.45 179.04 1b6i h LEU 84 N 0.10 0.43 -0.54 2.94 4.07 -1.74 -3.37 115.31 117.20 1b6i h LEU 84 Ca -0.21 -0.88 0.11 0.00 0.08 0.00 0.00 57.88 56.97 1b6i h LEU 84 Cb 1.98 -0.14 -0.11 0.00 1.08 0.00 0.00 40.66 43.48 1b6i h LEU 84 CO 0.24 1.26 -0.22 0.50 -1.08 0.00 0.00 178.44 179.14 1b6i h LYS 85 N -0.35 -0.09 -0.47 1.13 3.64 -0.89 -1.94 116.57 117.59 1b6i h LYS 85 Ca -0.10 0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1b6i h LYS 85 Cb 1.43 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.24 1b6i h LYS 85 CO 0.12 -0.06 0.31 -1.00 -2.27 0.00 0.00 179.45 176.55 1b6i h PRO 86 N -0.10 0.56 0.08 1.90 0.13 -1.78 0.30 132.00 133.08 1b6i h PRO 86 Ca 0.25 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1b6i h PRO 86 Cb 0.48 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 31.49 1b6i h PRO 86 CO -0.60 0.37 -0.04 0.28 -0.23 0.00 0.00 178.00 177.78 1b6i h VAL 87 N 0.57 1.18 -0.86 1.56 2.07 -1.53 -2.41 116.25 116.84 1b6i h VAL 87 Ca 0.18 -1.07 0.09 0.00 0.82 0.00 0.00 66.70 66.72 1b6i h VAL 87 Cb 0.03 1.86 -0.07 0.00 -1.52 0.00 0.00 31.29 31.58 1b6i h VAL 87 CO -0.04 0.26 0.51 0.22 0.02 0.00 0.00 177.57 178.53 1b6i h TYR 88 N -0.61 0.93 0.00 1.57 5.03 -1.03 -1.59 116.97 121.28 1b6i h TYR 88 Ca -0.01 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.30 1b6i h TYR 88 Cb 0.50 -0.29 -0.00 0.00 1.55 0.00 0.00 36.73 38.49 1b6i h TYR 88 CO 0.08 0.41 -0.15 -0.44 -1.32 0.00 0.00 178.16 176.74 1b6i h ASP 89 N 0.87 0.00 0.96 -2.11 3.32 -0.90 -2.32 116.42 116.25 1b6i h ASP 89 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 1b6i h ASP 89 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1b6i h ASP 89 CO -0.23 0.15 -0.14 -1.54 -1.72 0.00 0.00 179.24 175.76 1b6i n SER 90 N -4.18 0.26 -4.96 6.45 3.41 -0.61 -4.93 113.62 109.06 1b6i n SER 90 Ca -0.02 0.34 -0.22 0.00 -0.26 0.00 0.00 58.87 58.70 1b6i n SER 90 Cb 0.22 -0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 63.80 1b6i n SER 90 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1b6i s LEU 91 N -3.30 4.26 0.91 1.04 1.43 -0.87 -5.03 118.68 117.12 1b6i s LEU 91 Ca 0.12 0.16 -0.13 0.00 -1.03 0.00 0.00 54.13 53.26 1b6i s LEU 91 Cb 0.17 -2.96 0.14 0.00 0.03 0.00 0.00 46.19 43.57 1b6i s LEU 91 CO 0.59 -0.10 1.16 1.51 0.23 0.00 0.00 176.35 179.74 1b6i s ASP 92 N -3.89 3.51 0.29 2.29 1.47 -1.26 -4.75 116.67 114.32 1b6i s ASP 92 Ca 0.35 0.85 -0.01 0.00 1.18 0.00 0.00 52.55 54.93 1b6i s ASP 92 Cb -0.09 -1.35 0.47 0.00 -0.34 0.00 0.00 42.92 41.61 1b6i s ASP 92 CO 0.30 -2.54 1.91 0.00 0.68 0.00 0.00 175.17 175.53 1b6i h ALA 93 N -1.49 1.46 -0.15 2.11 0.00 -1.97 0.66 119.26 119.88 1b6i h ALA 93 Ca -0.49 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 1b6i h ALA 93 Cb 1.32 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1b6i h ALA 93 CO 0.59 0.42 -0.09 0.28 0.00 0.00 0.00 179.25 180.46 1b6i h VAL 94 N 1.10 1.32 0.00 0.00 2.07 -1.93 -2.89 116.25 115.93 1b6i h VAL 94 Ca 0.39 -1.16 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 1b6i h VAL 94 Cb 0.12 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1b6i h VAL 94 CO -0.14 0.34 -0.33 0.03 0.02 0.00 0.00 177.57 177.49 1b6i h ARG 95 N -0.03 0.00 -0.49 1.57 3.08 -1.77 -1.31 114.38 115.43 1b6i h ARG 95 Ca 0.03 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.10 1b6i h ARG 95 Cb 0.57 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 1b6i h ARG 95 CO 0.02 0.33 0.31 0.00 -1.07 0.00 0.00 179.97 179.57 1b6i h ARG 96 N 0.00 0.60 -0.96 0.04 3.08 -0.84 -2.19 114.38 114.12 1b6i h ARG 96 Ca -0.00 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.04 1b6i h ARG 96 Cb 0.60 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.45 1b6i h ARG 96 CO 0.04 0.40 0.63 0.00 -1.07 0.00 0.00 179.97 179.97 1b6i h ALA 97 N 1.20 1.26 -0.58 0.04 0.00 -1.03 -0.42 119.26 119.73 1b6i h ALA 97 Ca 0.19 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1b6i h ALA 97 Cb -0.02 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 1b6i h ALA 97 CO -0.07 0.52 0.28 0.00 0.00 0.00 0.00 179.25 179.99 1b6i h ALA 98 N 1.39 1.41 -0.09 0.00 0.00 -0.97 0.45 119.26 121.46 1b6i h ALA 98 Ca 0.38 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 1b6i h ALA 98 Cb -0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1b6i h ALA 98 CO -0.12 0.47 -0.64 1.25 0.00 0.00 0.00 179.25 180.21 1b6i h LEU 99 N 0.81 0.38 -0.57 0.00 5.85 -0.75 -2.70 115.31 118.33 1b6i h LEU 99 Ca 0.20 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.66 1b6i h LEU 99 Cb 0.07 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 1b6i h LEU 99 CO -0.03 0.92 0.22 0.40 -0.34 0.00 0.00 178.44 179.62 1b6i h ILE 100 N 0.24 1.23 -0.66 4.05 2.04 -0.41 -2.00 117.51 122.00 1b6i h ILE 100 Ca -0.01 -0.71 0.10 0.00 1.00 0.00 0.00 64.86 65.24 1b6i h ILE 100 Cb 1.18 0.62 -0.08 0.00 -0.74 0.00 0.00 36.82 37.80 1b6i h ILE 100 CO 0.11 0.27 0.27 -1.13 0.00 0.00 0.00 178.15 177.67 1b6i h ASN 101 N 0.79 0.28 -0.33 1.72 -0.73 -0.77 0.71 115.58 117.26 1b6i h ASN 101 Ca 0.19 0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.43 1b6i h ASN 101 Cb 0.21 0.05 -0.01 0.00 0.27 0.00 0.00 38.32 38.83 1b6i h ASN 101 CO -0.01 0.15 0.16 0.24 -0.37 0.00 0.00 177.43 177.59 1b6i h MET 102 N 0.46 0.48 -0.65 6.67 2.86 -1.17 -2.35 114.93 121.21 1b6i h MET 102 Ca 0.34 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.88 1b6i h MET 102 Cb 0.43 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 1b6i h MET 102 CO -0.32 0.44 0.32 0.28 1.06 0.00 0.00 176.91 178.69 1b6i h VAL 103 N 0.39 1.22 -0.91 -2.22 2.07 -0.67 0.22 116.25 116.35 1b6i h VAL 103 Ca 0.11 -0.61 0.06 0.00 0.82 0.00 0.00 66.70 67.08 1b6i h VAL 103 Cb 0.13 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.25 1b6i h VAL 103 CO -0.01 0.25 0.58 0.15 0.02 0.00 0.00 177.57 178.56 1b6i h PHE 104 N 0.90 1.07 0.06 1.57 3.04 -0.65 0.60 116.94 123.52 1b6i h PHE 104 Ca 0.22 0.03 -0.12 0.00 3.98 0.00 0.00 57.97 62.09 1b6i h PHE 104 Cb 0.11 -0.35 0.01 0.00 2.56 0.00 0.00 35.95 38.28 1b6i h PHE 104 CO 0.00 0.55 -0.49 0.37 -2.02 0.00 0.00 178.31 176.72 1b6i h GLN 105 N 1.05 0.22 -0.01 1.11 4.15 -1.11 -3.40 115.11 117.13 1b6i h GLN 105 Ca 0.39 -0.32 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1b6i h GLN 105 Cb 0.16 0.11 0.00 0.00 0.21 0.00 0.00 27.48 27.96 1b6i h GLN 105 CO -0.17 1.10 -0.03 0.00 -1.93 0.00 0.00 178.83 177.80 1b6i n MET 106 N -4.32 0.51 0.00 1.69 0.00 0.04 -5.11 117.12 109.93 1b6i n MET 106 Ca -0.12 -0.76 0.00 0.00 0.00 0.00 0.00 57.70 56.82 1b6i n MET 106 Cb 0.66 -1.07 0.00 0.00 0.00 0.00 0.00 33.22 32.81 1b6i n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1b6i n GLY 107 N 0.44 -2.05 0.27 3.17 0.00 0.20 -3.83 105.19 103.40 1b6i n GLY 107 Ca 0.03 -1.46 -0.01 0.00 0.00 0.00 0.00 46.02 44.59 1b6i n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1b6i h GLU 108 N 0.00 0.72 0.15 1.61 4.81 -1.93 -1.57 114.58 118.37 1b6i h GLU 108 Ca 0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1b6i h GLU 108 Cb 0.00 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.22 1b6i h GLU 108 CO 0.00 0.48 -0.07 1.15 -0.73 0.00 0.00 179.01 179.83 1b6i h THR 109 N 0.74 0.98 -0.37 0.32 2.02 -1.97 0.13 112.91 114.75 1b6i h THR 109 Ca 0.32 -0.59 0.06 0.00 0.77 0.00 0.00 66.41 66.97 1b6i h THR 109 Cb 0.20 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.89 1b6i h THR 109 CO -0.19 0.14 0.02 1.23 0.37 0.00 0.00 175.52 177.09 1b6i h GLY 110 N -0.49 0.39 0.99 2.16 0.00 -1.61 -2.04 103.07 102.46 1b6i h GLY 110 Ca -0.02 0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 1b6i h GLY 110 CO 0.03 -0.07 0.15 -2.08 0.00 0.00 0.00 176.54 174.57 1b6i h VAL 111 N 0.13 1.24 -0.11 4.60 2.07 -1.26 -2.15 116.25 120.77 1b6i h VAL 111 Ca 0.18 -0.83 0.03 0.00 0.82 0.00 0.00 66.70 66.90 1b6i h VAL 111 Cb 0.24 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 1b6i h VAL 111 CO -0.28 0.31 0.23 0.00 0.02 0.00 0.00 177.57 177.85 1b6i h ALA 112 N 1.02 1.53 0.00 1.67 0.00 -0.11 0.18 119.26 123.56 1b6i h ALA 112 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1b6i h ALA 112 Cb 0.31 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1b6i h ALA 112 CO -0.00 -0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.36 1b6i n GLY 113 N -1.29 -0.92 2.79 0.00 0.00 -0.81 -4.05 105.19 100.91 1b6i n GLY 113 Ca 0.00 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 1b6i n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1b6i n PHE 114 N -1.29 2.86 -0.17 1.61 3.01 0.05 -4.79 117.46 118.73 1b6i n PHE 114 Ca 0.09 -2.42 -0.11 0.00 1.01 0.00 0.00 57.45 56.01 1b6i n PHE 114 Cb 0.15 -1.21 -0.07 0.00 -0.01 0.00 0.00 39.48 38.34 1b6i n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1b6i h THR 115 N 2.10 0.04 -0.65 4.37 2.02 -1.82 0.17 112.91 119.15 1b6i h THR 115 Ca 0.56 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.78 1b6i h THR 115 Cb 0.16 0.04 -0.05 0.00 -1.74 0.00 0.00 68.15 66.57 1b6i h THR 115 CO 1.32 0.00 0.38 0.78 0.37 0.00 0.00 175.52 178.37 1b6i h ASN 116 N -0.32 0.58 -0.33 4.18 2.35 -1.95 -1.00 115.58 119.10 1b6i h ASN 116 Ca 0.12 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.84 1b6i h ASN 116 Cb 0.58 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 1b6i h ASN 116 CO -0.64 0.39 0.01 0.28 -1.65 0.00 0.00 177.43 175.82 1b6i h SER 117 N 0.72 0.56 -0.75 5.81 0.02 -1.64 -1.20 113.55 117.07 1b6i h SER 117 Ca 0.28 -0.30 0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1b6i h SER 117 Cb 0.11 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 1b6i h SER 117 CO -0.15 0.73 0.49 -0.07 -1.14 0.00 0.00 176.83 176.69 1b6i h LEU 118 N 0.38 0.82 -0.94 5.07 3.38 -0.51 0.81 115.31 124.32 1b6i h LEU 118 Ca 0.09 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1b6i h LEU 118 Cb 0.44 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1b6i h LEU 118 CO 0.02 0.58 -0.07 -0.09 0.09 0.00 0.00 178.44 178.97 1b6i h ARG 119 N 0.97 0.70 -0.45 1.13 2.43 -0.86 -1.95 114.38 116.36 1b6i h ARG 119 Ca 0.29 -0.20 -0.08 0.00 -0.81 0.00 0.00 59.98 59.17 1b6i h ARG 119 Cb -0.06 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 1b6i h ARG 119 CO -0.08 0.76 -0.06 0.52 -1.51 0.00 0.00 179.97 179.60 1b6i h MET 120 N 0.65 0.78 -0.79 0.20 2.86 -0.60 -2.37 114.93 115.65 1b6i h MET 120 Ca 0.12 -0.23 -0.04 0.00 -2.06 0.00 0.00 59.70 57.48 1b6i h MET 120 Cb 0.50 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.05 1b6i h MET 120 CO 0.03 0.83 0.32 -0.07 1.06 0.00 0.00 176.91 179.07 1b6i h LEU 121 N 0.72 1.09 -2.33 1.22 3.38 -0.24 -1.94 115.31 117.20 1b6i h LEU 121 Ca 0.13 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1b6i h LEU 121 Cb 0.52 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1b6i h LEU 121 CO 0.03 0.96 0.08 1.56 0.09 0.00 0.00 178.44 181.16 1b6i h GLN 122 N 1.15 0.00 -0.71 1.13 4.20 -0.87 -1.22 115.11 118.79 1b6i h GLN 122 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1b6i h GLN 122 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1b6i h GLN 122 CO -0.02 0.00 0.00 1.04 -0.67 0.00 0.00 178.83 179.18 1b6i n GLN 123 N -3.90 2.72 -2.68 1.46 6.02 -0.76 -4.95 117.38 115.30 1b6i n GLN 123 Ca -0.01 -2.64 -0.16 0.00 -0.01 0.00 0.00 57.00 54.18 1b6i n GLN 123 Cb 0.18 -1.56 0.02 0.00 1.02 0.00 0.00 30.24 29.89 1b6i n GLN 123 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1b6i n ARG 125 N -2.99 4.16 -0.23 0.00 1.74 -1.04 -4.87 116.66 113.43 1b6i n ARG 125 Ca -0.11 -4.61 0.04 0.00 -0.77 0.00 0.00 57.85 52.40 1b6i n ARG 125 Cb 0.60 -2.44 0.15 0.00 -1.02 0.00 0.00 32.46 29.75 1b6i n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1b6i h TRP 126 N 4.90 0.17 -0.13 -1.55 -0.00 -1.88 0.28 115.95 117.73 1b6i h TRP 126 Ca 0.24 0.04 -0.20 0.00 -0.00 0.00 0.00 58.89 58.97 1b6i h TRP 126 Cb 0.58 0.03 0.00 0.00 -0.00 0.00 0.00 29.16 29.77 1b6i h TRP 126 CO 0.99 -0.11 -0.73 -0.44 -0.00 0.00 0.00 178.44 178.15 1b6i h ASP 127 N 0.22 0.74 -0.29 -3.49 3.32 -1.89 -1.64 116.42 113.39 1b6i h ASP 127 Ca 0.38 -0.48 -0.13 0.00 0.02 0.00 0.00 57.03 56.83 1b6i h ASP 127 Cb 0.64 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1b6i h ASP 127 CO -0.51 1.25 -0.30 -0.33 -1.72 0.00 0.00 179.24 177.63 1b6i h GLU 128 N 0.44 0.80 -0.89 3.56 5.08 -1.73 -2.56 114.58 119.27 1b6i h GLU 128 Ca -0.04 -0.36 0.04 0.00 -1.00 0.00 0.00 59.36 58.00 1b6i h GLU 128 Cb 1.33 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.51 1b6i h GLU 128 CO 0.14 0.99 0.57 0.00 -1.00 0.00 0.00 179.01 179.71 1b6i h ALA 129 N 0.98 1.20 -0.69 3.43 0.00 -0.32 -1.20 119.26 122.66 1b6i h ALA 129 Ca 0.08 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1b6i h ALA 129 Cb 0.83 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1b6i h ALA 129 CO 0.07 0.39 0.14 0.00 0.00 0.00 0.00 179.25 179.85 1b6i h ALA 130 N 1.39 0.91 -0.33 0.00 0.00 -0.93 0.12 119.26 120.42 1b6i h ALA 130 Ca 0.37 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1b6i h ALA 130 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1b6i h ALA 130 CO -0.14 0.66 0.12 0.28 0.00 0.00 0.00 179.25 180.18 1b6i h VAL 131 N 1.05 1.19 -0.50 0.00 2.07 -1.32 -2.58 116.25 116.17 1b6i h VAL 131 Ca 0.21 -0.60 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 1b6i h VAL 131 Cb 0.41 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1b6i h VAL 131 CO 0.01 0.21 0.25 -1.13 0.02 0.00 0.00 177.57 176.92 1b6i h ASN 132 N 0.39 0.64 -0.95 0.57 -0.73 -0.74 -3.11 115.58 111.65 1b6i h ASN 132 Ca 0.11 -0.12 0.10 0.00 1.87 0.00 0.00 56.30 58.26 1b6i h ASN 132 Cb 0.20 -0.16 -0.07 0.00 0.27 0.00 0.00 38.32 38.56 1b6i h ASN 132 CO -0.01 0.58 0.61 -0.07 -0.37 0.00 0.00 177.43 178.17 1b6i h LEU 133 N 0.66 0.88 -2.36 0.34 3.38 -0.61 -1.57 115.31 116.03 1b6i h LEU 133 Ca 0.17 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1b6i h LEU 133 Cb 0.10 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1b6i h LEU 133 CO -0.02 0.50 0.00 0.00 0.09 0.00 0.00 178.44 179.01 1b6i h ALA 134 N 1.54 1.00 -0.79 1.53 0.00 -1.39 -3.32 119.26 117.82 1b6i h ALA 134 Ca 0.45 0.00 -0.75 0.00 0.00 0.00 0.00 54.91 54.61 1b6i h ALA 134 Cb 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.08 1b6i h ALA 134 CO -0.21 0.00 2.18 1.63 0.00 0.00 0.00 179.25 182.85 1b6i n LYS 135 N -3.07 3.58 -3.61 0.00 5.02 -0.59 -4.59 118.16 114.91 1b6i n LYS 135 Ca -0.02 -3.41 -0.15 0.00 -2.02 0.00 0.00 58.31 52.72 1b6i n LYS 135 Cb 0.16 -2.95 -0.06 0.00 -0.02 0.00 0.00 35.03 32.16 1b6i n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1b6i s SER 136 N 1.08 -0.42 0.26 4.39 1.04 -1.25 -5.01 113.70 113.79 1b6i s SER 136 Ca 0.41 0.26 -0.01 0.00 0.48 0.00 0.00 55.95 57.09 1b6i s SER 136 Cb 0.11 0.46 0.55 0.00 0.10 0.00 0.00 66.02 67.24 1b6i s SER 136 CO -0.01 -0.63 1.74 -0.09 0.98 0.00 0.00 173.24 175.22 1b6i h ARG 137 N 3.07 0.49 -0.16 4.02 2.43 -1.92 -1.06 114.38 121.25 1b6i h ARG 137 Ca -0.30 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 58.89 1b6i h ARG 137 Cb 1.19 -0.11 -0.07 0.00 -0.42 0.00 0.00 29.97 30.56 1b6i h ARG 137 CO 0.41 0.33 -0.35 2.35 -1.51 0.00 0.00 179.97 181.19 1b6i h TRP 138 N 0.51 -0.98 -0.65 2.20 7.01 -1.94 0.37 115.95 122.46 1b6i h TRP 138 Ca 0.47 0.04 -0.02 0.00 2.11 0.00 0.00 58.89 61.49 1b6i h TRP 138 Cb 0.74 0.46 -0.03 0.00 -2.10 0.00 0.00 29.16 28.22 1b6i h TRP 138 CO -0.13 -0.42 0.33 -0.92 -2.79 0.00 0.00 178.44 174.51 1b6i h TYR 139 N -0.41 0.92 0.00 2.65 3.20 -1.72 -2.39 116.97 119.23 1b6i h TYR 139 Ca 0.10 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.88 1b6i h TYR 139 Cb 0.57 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 1b6i h TYR 139 CO -0.45 0.68 -0.25 -0.91 -1.64 0.00 0.00 178.16 175.60 1b6i h ASN 140 N 0.90 0.00 0.14 -2.11 2.35 -0.40 -2.77 115.58 113.68 1b6i h ASN 140 Ca 0.23 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.64 1b6i h ASN 140 Cb 0.09 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1b6i h ASN 140 CO -0.03 0.25 -1.76 1.56 -1.65 0.00 0.00 177.43 175.80 1b6i h GLN 141 N 0.00 0.29 -2.17 0.81 1.08 -0.19 -3.42 115.11 111.51 1b6i h GLN 141 Ca -0.00 -0.50 -0.59 0.00 -1.45 0.00 0.00 58.65 56.11 1b6i h GLN 141 Cb 0.92 0.18 -0.41 0.00 -0.05 0.00 0.00 27.48 28.12 1b6i h GLN 141 CO 0.03 1.24 -0.70 0.25 -0.95 0.00 0.00 178.83 178.70 1b6i n THR 142 N -3.67 1.93 -0.18 -0.54 -2.24 -0.91 -5.00 114.28 103.68 1b6i n THR 142 Ca -0.28 -5.07 -0.07 0.00 -2.27 0.00 0.00 64.05 56.35 1b6i n THR 142 Cb 1.01 -1.92 0.02 0.00 -2.10 0.00 0.00 70.33 67.33 1b6i n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1b6i h PRO 143 N 3.94 0.70 -0.48 -0.78 0.13 -1.70 -0.48 132.00 133.33 1b6i h PRO 143 Ca 0.17 -0.06 -0.09 0.00 -0.87 0.00 0.00 66.00 65.15 1b6i h PRO 143 Cb 0.68 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1b6i h PRO 143 CO 0.77 0.49 -0.06 -0.91 -0.23 0.00 0.00 178.00 178.06 1b6i h ASN 144 N 0.70 0.82 0.46 1.44 2.35 -1.94 0.12 115.58 119.53 1b6i h ASN 144 Ca 0.19 -0.23 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 1b6i h ASN 144 Cb -0.03 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.12 1b6i h ASN 144 CO -0.04 0.92 -0.22 -0.09 -1.65 0.00 0.00 177.43 176.36 1b6i h ARG 145 N 0.77 -0.60 -0.88 0.81 9.65 -1.95 -2.86 114.38 119.32 1b6i h ARG 145 Ca 0.14 0.04 0.21 0.00 -1.10 0.00 0.00 59.98 59.27 1b6i h ARG 145 Cb 0.55 0.14 -0.12 0.00 -1.39 0.00 0.00 29.97 29.14 1b6i h ARG 145 CO 0.03 -0.30 0.38 0.00 2.80 0.00 0.00 179.97 182.88 1b6i h ALA 146 N -0.80 1.39 -0.99 2.80 0.00 -1.02 -0.28 119.26 120.37 1b6i h ALA 146 Ca -0.06 0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.10 1b6i h ALA 146 Cb 0.57 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.44 1b6i h ALA 146 CO 0.10 -0.33 0.63 0.87 0.00 0.00 0.00 179.25 180.52 1b6i h LYS 147 N 0.40 1.03 0.16 0.00 1.57 -0.72 -0.89 116.57 118.12 1b6i h LYS 147 Ca 0.55 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.26 1b6i h LYS 147 Cb 1.02 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1b6i h LYS 147 CO -0.52 0.68 -0.08 0.00 -0.57 0.00 0.00 179.45 178.96 1b6i h ARG 148 N 1.07 -0.21 -0.37 3.15 3.08 -0.83 -0.77 114.38 119.49 1b6i h ARG 148 Ca 0.45 0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.47 1b6i h ARG 148 Cb 0.32 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.40 1b6i h ARG 148 CO -0.21 -0.09 0.04 0.28 -1.07 0.00 0.00 179.97 178.93 1b6i h VAL 149 N -0.28 1.25 -0.58 2.04 2.07 -0.96 -2.28 116.25 117.50 1b6i h VAL 149 Ca -0.02 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.61 1b6i h VAL 149 Cb 0.22 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1b6i h VAL 149 CO 0.04 0.30 0.39 0.40 0.02 0.00 0.00 177.57 178.71 1b6i h ILE 150 N 0.46 1.15 -0.31 4.57 2.04 -1.18 -1.40 117.51 122.84 1b6i h ILE 150 Ca 0.11 -0.27 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1b6i h ILE 150 Cb 0.39 0.29 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1b6i h ILE 150 CO 0.01 0.14 0.16 0.74 0.00 0.00 0.00 178.15 179.20 1b6i h THR 151 N 0.79 1.11 -0.49 -0.27 2.02 -0.99 0.10 112.91 115.18 1b6i h THR 151 Ca 0.21 -0.30 -0.09 0.00 0.77 0.00 0.00 66.41 67.00 1b6i h THR 151 Cb -0.09 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 1b6i h THR 151 CO -0.05 0.12 -0.06 0.74 0.37 0.00 0.00 175.52 176.65 1b6i h THR 152 N 0.43 1.26 -0.52 3.16 2.02 -0.84 0.10 112.91 118.53 1b6i h THR 152 Ca 0.11 -1.13 -0.12 0.00 0.77 0.00 0.00 66.41 66.05 1b6i h THR 152 Cb 0.04 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 1b6i h THR 152 CO -0.02 0.39 -0.13 -0.26 0.37 0.00 0.00 175.52 175.88 1b6i h PHE 153 N 0.78 1.12 -0.11 3.16 0.04 -0.41 -1.49 116.94 120.03 1b6i h PHE 153 Ca 0.14 -0.24 -0.01 0.00 2.80 0.00 0.00 57.97 60.66 1b6i h PHE 153 Cb 0.55 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 38.42 1b6i h PHE 153 CO 0.03 1.05 0.02 -0.09 -0.60 0.00 0.00 178.31 178.72 1b6i h ARG 154 N 0.88 0.18 0.00 1.51 2.43 -0.67 -3.36 114.38 115.35 1b6i h ARG 154 Ca 0.13 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1b6i h ARG 154 Cb 0.69 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.22 1b6i h ARG 154 CO 0.05 0.36 -1.75 0.25 -1.51 0.00 0.00 179.97 177.37 1b6i n THR 155 N -4.86 0.22 -1.86 0.20 -2.24 0.32 -4.81 114.28 101.26 1b6i n THR 155 Ca -0.06 -0.53 -0.19 0.00 -2.27 0.00 0.00 64.05 61.01 1b6i n THR 155 Cb 0.16 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.22 1b6i n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b6i n GLY 156 N 1.26 0.96 3.61 3.38 0.00 -0.56 -5.00 105.19 108.83 1b6i n GLY 156 Ca -0.04 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 1b6i n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b6i s THR 157 N -2.79 1.29 -0.70 2.61 -4.23 -1.26 -4.78 115.64 105.78 1b6i s THR 157 Ca 0.00 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.67 1b6i s THR 157 Cb 0.00 -2.57 0.75 0.00 1.34 0.00 0.00 72.50 72.03 1b6i s THR 157 CO 0.00 0.00 1.67 0.79 -0.54 0.00 0.00 174.62 176.54 1b6i n TRP 158 N -0.99 1.71 0.11 3.99 5.03 -1.26 -4.66 117.44 121.37 1b6i n TRP 158 Ca -0.09 -0.68 0.19 0.00 3.03 0.00 0.00 57.50 59.95 1b6i n TRP 158 Cb 0.67 -0.36 0.76 0.00 -1.03 0.00 0.00 31.31 31.34 1b6i n TRP 158 CO 0.00 0.00 0.00 -0.44 -0.03 0.00 0.00 177.69 177.22 1b6i h ASP 159 N 3.92 0.00 1.50 -0.99 3.32 -1.97 0.28 116.42 122.48 1b6i h ASP 159 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1b6i h ASP 159 Cb 1.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.22 1b6i h ASP 159 CO 0.34 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.86 1b6i h ALA 160 N 1.67 1.00 -0.00 3.45 0.00 -1.90 -2.20 119.26 121.28 1b6i h ALA 160 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1b6i h ALA 160 Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1b6i h ALA 160 CO -0.00 0.00 -0.77 0.66 0.00 0.00 0.00 179.25 179.14 1b6i n TYR 161 N -2.83 0.00 0.42 0.00 4.02 0.90 -5.00 117.16 114.68 1b6i n TYR 161 Ca 0.03 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.97 1b6i n TYR 161 Cb 0.42 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.78 1b6i n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48