#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4g s SER 2 N 0.00 -0.15 -0.38 1.61 0.01 -1.26 -5.09 113.70 108.43 1x4g s SER 2 Ca 0.00 0.19 0.01 0.00 1.31 0.00 0.00 55.95 57.45 1x4g s SER 2 Cb 0.00 0.37 0.27 0.00 0.21 0.00 0.00 66.02 66.86 1x4g s SER 2 CO 0.00 -0.25 1.13 -0.24 0.41 0.00 0.00 173.24 174.29 1x4g n SER 3 N 2.13 -1.83 -3.48 2.44 2.88 -1.26 -5.13 113.62 109.36 1x4g n SER 3 Ca -0.18 -2.31 -0.17 0.00 -1.33 0.00 0.00 58.87 54.88 1x4g n SER 3 Cb 0.57 1.11 -0.13 0.00 -0.75 0.00 0.00 64.21 65.02 1x4g n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x4g s GLY 4 N -0.74 -0.03 0.00 0.46 0.00 -1.26 -5.13 107.32 100.62 1x4g s GLY 4 Ca 0.28 0.33 0.00 0.00 0.00 0.00 0.00 44.72 45.32 1x4g s GLY 4 CO -0.14 2.19 0.00 -1.26 0.00 0.00 0.00 173.10 173.89 1x4g n SER 5 N 5.32 0.00 -1.46 1.64 2.88 -1.26 -5.17 113.62 115.58 1x4g n SER 5 Ca -0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 1x4g n SER 5 Cb 0.50 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.96 1x4g n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1x4g n SER 6 N 0.88 -7.91 0.00 -3.46 7.64 -1.26 -5.07 113.62 104.44 1x4g n SER 6 Ca 0.00 1.36 0.00 0.00 1.01 0.00 0.00 58.87 61.24 1x4g n SER 6 Cb 0.00 -4.44 0.00 0.00 -1.01 0.00 0.00 64.21 58.76 1x4g n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4g n GLY 7 N -1.50 0.38 3.22 0.23 0.00 -1.26 -5.12 105.19 101.14 1x4g n GLY 7 Ca 0.00 -0.50 -0.38 0.00 0.00 0.00 0.00 46.02 45.15 1x4g n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x4g s ASN 8 N 0.00 5.31 -0.30 1.61 -0.87 -1.26 -5.03 114.94 114.40 1x4g s ASN 8 Ca 0.00 -1.44 -0.00 0.00 -1.57 0.00 0.00 52.86 49.85 1x4g s ASN 8 Cb 0.00 -1.86 0.19 0.00 -0.02 0.00 0.00 41.25 39.56 1x4g s ASN 8 CO 0.00 -0.41 0.61 -0.89 -2.57 0.00 0.00 177.10 173.84 1x4g s THR 9 N 1.33 -0.98 0.00 1.60 2.01 -1.26 -5.02 115.64 113.33 1x4g s THR 9 Ca 0.01 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.01 1x4g s THR 9 Cb -0.21 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.30 1x4g s THR 9 CO 0.00 0.00 0.00 1.17 -0.69 0.00 0.00 174.62 175.10 1x4g n LYS 10 N 5.43 0.00 -3.73 4.92 3.00 -1.26 -5.15 118.16 121.37 1x4g n LYS 10 Ca -0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.08 1x4g n LYS 10 Cb 0.52 -0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.51 1x4g n LYS 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 1x4g s GLN 11 N -1.82 2.41 -0.05 1.64 0.74 -1.26 -4.63 119.66 116.69 1x4g s GLN 11 Ca 0.00 -1.69 0.03 0.00 0.05 0.00 0.00 55.36 53.75 1x4g s GLN 11 Cb 0.00 -2.25 0.01 0.00 1.10 0.00 0.00 33.01 31.87 1x4g s GLN 11 CO 0.00 -0.26 -0.13 -0.51 -0.55 0.00 0.00 175.29 173.84 1x4g s LEU 12 N -4.12 1.76 0.11 3.68 1.43 -1.26 -5.11 118.68 115.17 1x4g s LEU 12 Ca 0.44 -0.28 -0.31 0.00 -1.03 0.00 0.00 54.13 52.95 1x4g s LEU 12 Cb -0.01 -0.79 -0.09 0.00 0.03 0.00 0.00 46.19 45.33 1x4g s LEU 12 CO 0.26 0.08 1.61 -0.13 0.23 0.00 0.00 176.35 178.39 1x4g s ARG 13 N 0.36 4.21 0.18 1.70 1.81 -1.26 -4.77 118.95 121.19 1x4g s ARG 13 Ca -0.08 2.33 -0.13 0.00 -1.72 0.00 0.00 55.73 56.12 1x4g s ARG 13 Cb -0.13 -3.40 0.19 0.00 -0.45 0.00 0.00 34.95 31.15 1x4g s ARG 13 CO 0.02 -0.67 1.72 0.35 -0.68 0.00 0.00 175.30 176.04 1x4g h PHE 14 N 7.64 0.15 -0.82 -0.53 3.57 -1.97 0.89 116.94 125.88 1x4g h PHE 14 Ca -0.43 0.03 0.22 0.00 3.53 0.00 0.00 57.97 61.32 1x4g h PHE 14 Cb 1.20 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.91 1x4g h PHE 14 CO 0.72 -0.01 0.57 0.93 -2.23 0.00 0.00 178.31 178.29 1x4g h GLU 15 N 0.23 0.13 0.00 1.11 5.08 -1.95 0.23 114.58 119.41 1x4g h GLU 15 Ca 0.25 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.53 1x4g h GLU 15 Cb 0.33 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1x4g h GLU 15 CO -0.32 0.09 -0.39 0.22 -1.00 0.00 0.00 179.01 177.60 1x4g h ASP 16 N 0.13 0.00 -0.20 1.42 3.58 -1.32 -3.34 116.42 116.71 1x4g h ASP 16 Ca 0.40 -0.81 0.06 0.00 0.42 0.00 0.00 57.03 57.10 1x4g h ASP 16 Cb 1.37 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.42 1x4g h ASP 16 CO -0.06 1.13 0.15 0.58 -2.88 0.00 0.00 179.24 178.17 1x4g h VAL 17 N -1.00 0.79 -0.22 2.25 2.07 -0.17 0.14 116.25 120.11 1x4g h VAL 17 Ca -0.11 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.33 1x4g h VAL 17 Cb 1.06 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 31.67 1x4g h VAL 17 CO -0.07 0.00 0.11 0.55 0.02 0.00 0.00 177.57 178.18 1x4g n VAL 18 N -4.30 1.25 -1.53 2.57 3.14 0.75 -3.62 118.33 116.58 1x4g n VAL 18 Ca 0.02 -0.45 -0.01 0.00 -2.96 0.00 0.00 64.34 60.94 1x4g n VAL 18 Cb 0.29 -0.71 -0.01 0.00 -1.06 0.00 0.00 33.84 32.35 1x4g n VAL 18 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1x4g n ASN 19 N 0.11 -0.16 -0.05 6.55 2.85 -0.08 -4.84 115.26 119.63 1x4g n ASN 19 Ca 0.12 -0.36 -0.22 0.00 -0.11 0.00 0.00 54.58 54.02 1x4g n ASN 19 Cb 0.69 0.05 -0.13 0.00 1.24 0.00 0.00 39.78 41.63 1x4g n ASN 19 CO 0.00 0.00 0.00 1.56 -2.11 0.00 0.00 177.26 176.71 1x4g h GLN 20 N 0.00 0.14 -0.55 1.20 4.20 -1.29 -3.39 115.11 115.42 1x4g h GLN 20 Ca -0.09 -0.24 -0.38 0.00 0.06 0.00 0.00 58.65 58.00 1x4g h GLN 20 Cb 0.60 0.09 -0.27 0.00 0.30 0.00 0.00 27.48 28.20 1x4g h GLN 20 CO -0.05 1.11 -0.42 -1.13 -0.67 0.00 0.00 178.83 177.68 1x4g n SER 21 N -3.97 4.10 -1.64 1.46 3.41 -1.26 -5.08 113.62 110.65 1x4g n SER 21 Ca -0.32 -3.80 0.00 0.00 -0.26 0.00 0.00 58.87 54.50 1x4g n SER 21 Cb 0.87 -0.51 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1x4g n SER 21 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1x4g n SER 22 N -0.90 -8.84 -0.09 4.04 7.64 -1.26 -4.27 113.62 109.94 1x4g n SER 22 Ca 0.39 1.77 -0.12 0.00 1.01 0.00 0.00 58.87 61.93 1x4g n SER 22 Cb 0.90 -5.26 0.01 0.00 -1.01 0.00 0.00 64.21 58.85 1x4g n SER 22 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1x4g h PRO 23 N 0.60 0.85 -1.10 1.43 0.13 -1.94 -3.13 132.00 128.84 1x4g h PRO 23 Ca 0.00 -0.45 0.32 0.00 -0.87 0.00 0.00 66.00 65.00 1x4g h PRO 23 Cb 0.73 0.02 -0.12 0.00 0.13 0.00 0.00 31.00 31.76 1x4g h PRO 23 CO 0.00 1.09 0.69 1.57 -0.23 0.00 0.00 178.00 181.11 1x4g h LYS 24 N 0.69 0.30 -4.99 0.86 2.10 -2.02 -3.35 116.57 110.17 1x4g h LYS 24 Ca 0.05 -0.02 -0.66 0.00 -2.00 0.00 0.00 60.65 58.03 1x4g h LYS 24 Cb 0.97 -0.07 -0.28 0.00 -0.90 0.00 0.00 32.23 31.95 1x4g h LYS 24 CO 0.09 0.20 -0.73 1.21 -2.00 0.00 0.00 179.45 178.22 1x4g s ASN 25 N -4.97 4.26 -0.31 7.07 2.47 -1.18 -5.07 114.94 117.21 1x4g s ASN 25 Ca -0.09 -0.45 0.02 0.00 0.42 0.00 0.00 52.86 52.76 1x4g s ASN 25 Cb 0.28 -1.72 0.09 0.00 -1.45 0.00 0.00 41.25 38.44 1x4g s ASN 25 CO 0.80 -0.03 0.02 0.00 -3.72 0.00 0.00 177.10 174.17 1x4g s THR 27 N 1.15 1.26 -0.23 0.00 2.01 -1.26 -2.82 115.64 115.75 1x4g s THR 27 Ca 0.05 -1.72 -0.01 0.00 0.31 0.00 0.00 61.69 60.32 1x4g s THR 27 Cb -0.19 -1.51 0.07 0.00 0.01 0.00 0.00 72.50 70.88 1x4g s THR 27 CO -0.11 -0.45 0.02 -0.69 -0.69 0.00 0.00 174.62 172.70 1x4g s VAL 28 N -2.23 0.88 -0.29 3.82 1.01 0.14 -3.27 120.40 120.45 1x4g s VAL 28 Ca 0.09 -0.92 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 1x4g s VAL 28 Cb -0.04 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1x4g s VAL 28 CO 0.02 -0.28 0.56 -0.47 0.00 0.00 0.00 175.10 174.94 1x4g s TYR 29 N 1.68 3.23 -0.35 5.22 6.14 0.39 -1.71 117.35 131.96 1x4g s TYR 29 Ca -0.00 0.55 -0.09 0.00 0.64 0.00 0.00 57.07 58.17 1x4g s TYR 29 Cb -0.18 -2.86 0.03 0.00 0.42 0.00 0.00 41.96 39.37 1x4g s TYR 29 CO -0.11 -0.40 0.15 0.00 0.64 0.00 0.00 175.55 175.83 1x4g s GLY 31 N 1.50 1.14 0.00 0.00 0.00 0.18 0.82 107.32 110.96 1x4g s GLY 31 Ca 0.01 -0.89 0.00 0.00 0.00 0.00 0.00 44.72 43.84 1x4g s GLY 31 CO 0.05 -0.52 0.00 0.61 0.00 0.00 0.00 173.10 173.24 1x4g n GLY 32 N 3.03 2.17 3.73 0.20 0.00 -0.68 0.24 105.19 113.89 1x4g n GLY 32 Ca -0.18 -0.25 -0.37 0.00 0.00 0.00 0.00 46.02 45.22 1x4g n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x4g s ILE 33 N 0.00 2.01 0.00 -0.61 1.01 -1.26 -4.78 121.20 117.56 1x4g s ILE 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.65 1x4g s ILE 33 Cb 0.00 -3.00 0.00 0.00 0.01 0.00 0.00 42.46 39.47 1x4g s ILE 33 CO 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 174.94 174.94 1x4g n ALA 34 N -1.72 1.01 -1.19 9.38 0.00 -1.26 -4.05 120.51 122.68 1x4g n ALA 34 Ca 0.15 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.61 1x4g n ALA 34 Cb 0.47 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.15 1x4g n ALA 34 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1x4g n SER 35 N -1.34 3.33 -1.59 0.00 7.64 -1.26 -4.56 113.62 115.84 1x4g n SER 35 Ca 0.00 -3.35 -0.04 0.00 1.01 0.00 0.00 58.87 56.50 1x4g n SER 35 Cb 0.00 -0.60 0.02 0.00 -1.01 0.00 0.00 64.21 62.62 1x4g n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4g n GLY 36 N -0.79 0.79 3.50 0.23 0.00 -1.26 -5.10 105.19 102.56 1x4g n GLY 36 Ca 0.28 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1x4g n GLY 36 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x4g s LEU 37 N -1.49 4.64 -0.03 0.99 0.20 -1.26 -4.92 118.68 116.81 1x4g s LEU 37 Ca 0.03 -0.48 -0.01 0.00 0.69 0.00 0.00 54.13 54.36 1x4g s LEU 37 Cb 0.16 -2.61 0.03 0.00 -0.43 0.00 0.00 46.19 43.34 1x4g s LEU 37 CO -0.05 -0.74 0.07 0.42 -0.29 0.00 0.00 176.35 175.77 1x4g s THR 38 N 2.62 -0.04 0.46 3.68 -4.23 -1.26 -4.78 115.64 112.09 1x4g s THR 38 Ca 0.19 0.15 0.38 0.00 -1.18 0.00 0.00 61.69 61.24 1x4g s THR 38 Cb -0.15 -0.13 0.58 0.00 1.34 0.00 0.00 72.50 74.14 1x4g s THR 38 CO 0.17 0.06 1.47 -0.67 -0.54 0.00 0.00 174.62 175.11 1x4g n ASP 39 N 3.91 0.11 -0.10 3.99 2.03 -1.26 0.18 116.55 125.41 1x4g n ASP 39 Ca -0.24 1.13 -0.11 0.00 0.52 0.00 0.00 54.79 56.10 1x4g n ASP 39 Cb 0.53 -0.56 -0.03 0.00 -0.72 0.00 0.00 41.12 40.33 1x4g n ASP 39 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 1x4g h GLN 40 N 0.00 0.49 0.26 -0.67 5.75 -1.97 0.65 115.11 119.62 1x4g h GLN 40 Ca 0.85 -0.15 0.00 0.00 -0.15 0.00 0.00 58.65 59.21 1x4g h GLN 40 Cb 3.08 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 31.56 1x4g h GLN 40 CO -0.24 0.63 -0.26 1.25 -2.65 0.00 0.00 178.83 177.56 1x4g h LEU 41 N 0.29 -0.69 -0.13 -2.39 5.85 0.15 0.47 115.31 118.86 1x4g h LEU 41 Ca 0.08 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1x4g h LEU 41 Cb 0.40 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1x4g h LEU 41 CO 0.01 -0.37 0.06 0.24 -0.34 0.00 0.00 178.44 178.04 1x4g h MET 42 N -0.55 0.18 -0.64 1.25 2.86 -1.51 0.21 114.93 116.74 1x4g h MET 42 Ca -0.01 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1x4g h MET 42 Cb 0.51 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.10 1x4g h MET 42 CO -0.06 0.23 0.42 -0.09 1.06 0.00 0.00 176.91 178.48 1x4g h ARG 43 N 0.08 0.77 0.01 1.72 2.43 -0.71 0.23 114.38 118.92 1x4g h ARG 43 Ca 0.04 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 58.97 1x4g h ARG 43 Cb 0.11 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1x4g h ARG 43 CO -0.01 0.51 -0.91 0.37 -1.51 0.00 0.00 179.97 178.42 1x4g h GLN 44 N 0.79 0.04 0.02 0.20 4.15 0.28 0.51 115.11 121.11 1x4g h GLN 44 Ca 0.25 -0.05 -0.25 0.00 0.77 0.00 0.00 58.65 59.37 1x4g h GLN 44 Cb 0.02 0.02 0.01 0.00 0.21 0.00 0.00 27.48 27.73 1x4g h GLN 44 CO -0.06 0.92 -1.02 1.15 -1.93 0.00 0.00 178.83 177.88 1x4g h THR 45 N 0.02 1.37 0.00 2.39 2.02 0.36 -3.28 112.91 115.78 1x4g h THR 45 Ca -0.02 -2.45 0.00 0.00 0.77 0.00 0.00 66.41 64.71 1x4g h THR 45 Cb 1.59 2.48 0.00 0.00 -1.74 0.00 0.00 68.15 70.48 1x4g h THR 45 CO 0.12 0.74 -1.08 0.49 0.37 0.00 0.00 175.52 176.16 1x4g n PHE 46 N -3.76 0.13 -0.15 3.16 3.72 0.74 -4.27 117.46 117.04 1x4g n PHE 46 Ca -0.09 0.04 -0.14 0.00 -0.05 0.00 0.00 57.45 57.22 1x4g n PHE 46 Cb 0.88 -0.30 -0.10 0.00 -0.94 0.00 0.00 39.48 39.02 1x4g n PHE 46 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1x4g h SER 47 N 0.00 -1.85 -0.25 4.37 0.87 -0.03 -1.73 113.55 114.94 1x4g h SER 47 Ca 0.00 0.24 -0.10 0.00 -1.23 0.00 0.00 61.79 60.70 1x4g h SER 47 Cb 0.67 0.76 -0.00 0.00 -0.44 0.00 0.00 62.40 63.39 1x4g h SER 47 CO 0.00 -0.39 -0.24 1.55 -0.53 0.00 0.00 176.83 177.22 1x4g h PRO 48 N -0.38 0.60 -0.13 2.24 0.13 -1.78 -3.00 132.00 129.69 1x4g h PRO 48 Ca 0.07 -0.32 0.04 0.00 -0.87 0.00 0.00 66.00 64.93 1x4g h PRO 48 Cb 0.58 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 1x4g h PRO 48 CO -0.60 0.91 0.56 0.74 -0.23 0.00 0.00 178.00 179.39 1x4g h PHE 49 N 0.31 0.00 0.00 1.56 0.04 -1.63 -3.45 116.94 113.77 1x4g h PHE 49 Ca 0.04 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.81 1x4g h PHE 49 Cb 0.80 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.95 1x4g h PHE 49 CO 0.08 0.00 0.00 0.41 -0.60 0.00 0.00 178.31 178.20 1x4g n GLY 50 N -1.36 -0.22 3.89 -1.45 0.00 -0.69 -4.71 105.19 100.65 1x4g n GLY 50 Ca 0.02 -1.21 -0.34 0.00 0.00 0.00 0.00 46.02 44.48 1x4g n GLY 50 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x4g s GLN 51 N -2.00 3.52 -0.06 1.61 -0.21 -1.26 -4.34 119.66 116.92 1x4g s GLN 51 Ca 0.00 -0.17 0.05 0.00 0.02 0.00 0.00 55.36 55.26 1x4g s GLN 51 Cb 0.00 -3.08 -0.02 0.00 1.00 0.00 0.00 33.01 30.91 1x4g s GLN 51 CO 0.00 0.66 -0.21 0.42 -2.12 0.00 0.00 175.29 174.04 1x4g s ILE 52 N -1.31 2.43 -0.11 1.08 1.01 -1.26 -4.07 121.20 118.96 1x4g s ILE 52 Ca 0.27 -0.94 -0.00 0.00 0.00 0.00 0.00 60.65 59.98 1x4g s ILE 52 Cb -0.13 -1.91 -0.25 0.00 0.01 0.00 0.00 42.46 40.18 1x4g s ILE 52 CO 0.17 0.57 0.40 0.23 0.00 0.00 0.00 174.94 176.31 1x4g n MET 53 N 2.79 0.72 -3.59 2.79 2.81 -0.05 -4.99 117.12 117.60 1x4g n MET 53 Ca -0.17 0.26 -0.14 0.00 -1.81 0.00 0.00 57.70 55.84 1x4g n MET 53 Cb 0.52 -1.72 -0.05 0.00 -0.71 0.00 0.00 33.22 31.26 1x4g n MET 53 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1x4g s GLU 54 N -2.56 1.02 -0.02 0.03 2.12 -1.25 -5.01 118.70 113.01 1x4g s GLU 54 Ca -0.18 -0.23 0.00 0.00 0.36 0.00 0.00 54.97 54.92 1x4g s GLU 54 Cb 0.07 0.46 0.03 0.00 0.26 0.00 0.00 34.13 34.95 1x4g s GLU 54 CO 0.78 -0.36 0.01 0.42 -0.54 0.00 0.00 175.26 175.57 1x4g s ILE 55 N -2.38 0.08 -0.21 -3.70 1.01 -1.26 -2.85 121.20 111.89 1x4g s ILE 55 Ca -0.06 0.13 -0.01 0.00 0.00 0.00 0.00 60.65 60.71 1x4g s ILE 55 Cb -0.01 -0.18 0.06 0.00 0.01 0.00 0.00 42.46 42.34 1x4g s ILE 55 CO -0.01 0.12 -0.01 -0.13 0.00 0.00 0.00 174.94 174.90 1x4g s ARG 56 N 0.98 1.12 -0.14 2.79 1.81 -0.83 -4.96 118.95 119.73 1x4g s ARG 56 Ca -0.09 -0.66 -0.10 0.00 -1.72 0.00 0.00 55.73 53.16 1x4g s ARG 56 Cb -0.13 -2.29 -0.05 0.00 -0.45 0.00 0.00 34.95 32.04 1x4g s ARG 56 CO -0.02 -0.60 0.20 0.14 -0.68 0.00 0.00 175.30 174.34 1x4g s VAL 57 N 1.65 5.38 -0.56 3.52 -7.23 -1.26 0.60 120.40 122.49 1x4g s VAL 57 Ca -0.03 0.35 0.04 0.00 -1.81 0.00 0.00 61.98 60.53 1x4g s VAL 57 Cb -0.18 -3.50 0.16 0.00 0.56 0.00 0.00 36.38 33.42 1x4g s VAL 57 CO -0.07 0.52 0.38 -0.36 -0.31 0.00 0.00 175.10 175.26 1x4g s PHE 58 N -0.36 2.64 -1.81 2.82 0.08 0.19 -4.93 117.98 116.62 1x4g s PHE 58 Ca 0.14 -2.90 0.15 0.00 0.12 0.00 0.00 56.93 54.44 1x4g s PHE 58 Cb -0.12 -2.15 0.88 0.00 -0.57 0.00 0.00 43.02 41.05 1x4g s PHE 58 CO 0.03 -0.68 1.37 -0.35 -0.10 0.00 0.00 175.22 175.50 1x4g n PRO 59 N 2.62 0.40 -0.06 0.24 -0.04 -1.26 -0.83 135.00 136.06 1x4g n PRO 59 Ca 0.18 0.05 -0.09 0.00 -0.04 0.00 0.00 63.50 63.60 1x4g n PRO 59 Cb 0.37 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.18 1x4g n PRO 59 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1x4g n GLU 60 N -1.10 0.66 -0.11 0.54 0.28 -1.26 -4.46 120.64 115.20 1x4g n GLU 60 Ca 0.10 0.16 -0.12 0.00 -0.16 0.00 0.00 57.16 57.14 1x4g n GLU 60 Cb 0.08 -1.67 -0.15 0.00 1.43 0.00 0.00 31.44 31.13 1x4g n GLU 60 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1x4g n LYS 61 N -2.91 0.71 0.00 3.44 4.01 -0.98 -5.03 118.16 117.40 1x4g n LYS 61 Ca -0.24 0.04 0.00 0.00 -0.51 0.00 0.00 58.31 57.59 1x4g n LYS 61 Cb 1.10 -1.51 0.00 0.00 -0.51 0.00 0.00 35.03 34.11 1x4g n LYS 61 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1x4g n GLY 62 N 1.92 1.21 3.75 0.72 0.00 -0.01 -5.02 105.19 107.76 1x4g n GLY 62 Ca -0.36 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1x4g n GLY 62 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1x4g s TYR 63 N -2.00 0.26 0.28 1.61 1.13 -1.10 -1.69 117.35 115.85 1x4g s TYR 63 Ca 0.00 -0.83 -0.12 0.00 -1.41 0.00 0.00 57.07 54.70 1x4g s TYR 63 Cb 0.00 0.65 0.01 0.00 -1.10 0.00 0.00 41.96 41.52 1x4g s TYR 63 CO 0.00 -1.45 0.54 0.45 -2.51 0.00 0.00 175.55 172.58 1x4g s SER 64 N -3.08 0.07 0.09 -0.18 0.15 0.24 -0.64 113.70 110.35 1x4g s SER 64 Ca 0.18 -1.01 0.07 0.00 0.70 0.00 0.00 55.95 55.89 1x4g s SER 64 Cb -0.04 0.65 -0.03 0.00 -1.71 0.00 0.00 66.02 64.88 1x4g s SER 64 CO 0.12 -1.25 -0.18 -0.36 1.20 0.00 0.00 173.24 172.77 1x4g s PHE 65 N -3.65 1.54 -0.29 3.44 0.08 0.20 -1.91 117.98 117.39 1x4g s PHE 65 Ca 0.22 -0.45 -0.03 0.00 0.12 0.00 0.00 56.93 56.79 1x4g s PHE 65 Cb -0.02 -0.84 0.17 0.00 -0.57 0.00 0.00 43.02 41.76 1x4g s PHE 65 CO 0.11 0.15 0.58 0.08 -0.10 0.00 0.00 175.22 176.03 1x4g s VAL 66 N -1.31 -0.94 -0.14 -0.44 1.01 -0.69 -1.96 120.40 115.93 1x4g s VAL 66 Ca 0.04 -0.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.94 1x4g s VAL 66 Cb -0.09 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1x4g s VAL 66 CO 0.03 -0.01 0.14 -0.13 0.00 0.00 0.00 175.10 175.13 1x4g s ARG 67 N 2.82 3.62 0.23 2.72 3.00 -1.13 0.24 118.95 130.44 1x4g s ARG 67 Ca 0.14 -0.14 0.08 0.00 0.00 0.00 0.00 55.73 55.80 1x4g s ARG 67 Cb -0.14 -3.24 -0.04 0.00 0.00 0.00 0.00 34.95 31.52 1x4g s ARG 67 CO -0.20 0.67 0.07 -0.06 0.00 0.00 0.00 175.30 175.78 1x4g s PHE 68 N -0.71 2.91 -0.03 -0.53 0.40 -1.13 -0.87 117.98 118.02 1x4g s PHE 68 Ca 0.14 -0.14 0.28 0.00 -0.60 0.00 0.00 56.93 56.60 1x4g s PHE 68 Cb -0.12 -1.34 0.94 0.00 0.51 0.00 0.00 43.02 43.01 1x4g s PHE 68 CO 0.03 0.55 1.83 1.03 0.70 0.00 0.00 175.22 179.36 1x4g h SER 69 N 2.05 0.00 -4.37 1.36 0.87 -1.90 -3.44 113.55 108.12 1x4g h SER 69 Ca -0.47 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 59.74 1x4g h SER 69 Cb 1.23 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 63.04 1x4g h SER 69 CO 0.60 0.08 -0.62 0.42 -0.53 0.00 0.00 176.83 176.79 1x4g s THR 70 N -3.52 0.63 -0.05 2.23 -4.23 -1.26 -5.06 115.64 104.39 1x4g s THR 70 Ca 0.03 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.67 1x4g s THR 70 Cb 0.08 -2.62 -0.17 0.00 1.34 0.00 0.00 72.50 71.13 1x4g s THR 70 CO 0.61 -0.03 0.91 -0.74 -0.54 0.00 0.00 174.62 174.83 1x4g h HIS 71 N 2.37 0.00 0.42 3.99 2.76 -1.88 -3.32 115.15 119.49 1x4g h HIS 71 Ca -0.38 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 57.77 1x4g h HIS 71 Cb 1.24 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.21 1x4g h HIS 71 CO 0.47 0.82 -0.20 0.93 -1.30 0.00 0.00 177.93 178.66 1x4g h GLU 72 N 0.00 -0.54 -0.70 5.26 5.08 -1.97 -0.16 114.58 121.55 1x4g h GLU 72 Ca -0.17 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.38 1x4g h GLU 72 Cb 1.77 0.12 -0.10 0.00 0.50 0.00 0.00 28.75 31.04 1x4g h GLU 72 CO 0.08 -0.23 0.16 0.66 -1.00 0.00 0.00 179.01 178.68 1x4g h SER 73 N -0.88 0.01 -0.07 1.42 4.64 -1.87 0.13 113.55 116.93 1x4g h SER 73 Ca -0.06 0.14 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 1x4g h SER 73 Cb 0.56 0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 1x4g h SER 73 CO 0.09 -0.02 -0.32 0.00 -0.87 0.00 0.00 176.83 175.71 1x4g h ALA 74 N 1.58 0.97 -0.40 5.18 0.00 -1.65 -2.24 119.26 122.69 1x4g h ALA 74 Ca 0.39 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1x4g h ALA 74 Cb 0.64 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1x4g h ALA 74 CO -0.48 0.61 -0.04 0.00 0.00 0.00 0.00 179.25 179.33 1x4g h ALA 75 N 1.19 1.18 -0.13 0.00 0.00 0.11 -0.59 119.26 121.02 1x4g h ALA 75 Ca 0.06 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.55 1x4g h ALA 75 Cb 0.78 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.41 1x4g h ALA 75 CO 0.06 0.53 -0.53 0.45 0.00 0.00 0.00 179.25 179.77 1x4g h HIS 76 N 0.63 0.79 -0.49 0.00 3.86 -0.78 -1.75 115.15 117.41 1x4g h HIS 76 Ca 0.12 -0.33 -0.09 0.00 -1.16 0.00 0.00 60.37 58.91 1x4g h HIS 76 Cb 0.45 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 1x4g h HIS 76 CO 0.02 1.12 -0.04 0.00 0.86 0.00 0.00 177.93 179.88 1x4g h ALA 77 N 0.51 0.99 0.21 2.45 0.00 -1.27 -2.78 119.26 119.39 1x4g h ALA 77 Ca -0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1x4g h ALA 77 Cb 1.16 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1x4g h ALA 77 CO 0.11 0.61 -0.10 0.82 0.00 0.00 0.00 179.25 180.69 1x4g h ILE 78 N 0.78 0.00 -1.60 0.00 2.04 -1.13 0.20 117.51 117.81 1x4g h ILE 78 Ca 0.14 -0.26 0.50 0.00 1.00 0.00 0.00 64.86 66.25 1x4g h ILE 78 Cb 0.53 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.51 1x4g h ILE 78 CO 0.03 0.00 1.10 -0.37 0.00 0.00 0.00 178.15 178.91 1x4g h VAL 79 N -0.54 0.05 0.00 1.67 -1.51 -1.41 0.63 116.25 115.14 1x4g h VAL 79 Ca -0.03 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.43 1x4g h VAL 79 Cb 0.22 0.03 0.00 0.00 -2.13 0.00 0.00 31.29 29.41 1x4g h VAL 79 CO 0.05 0.00 0.00 -0.24 -1.23 0.00 0.00 177.57 176.15 1x4g n SER 80 N -4.38 0.00 0.23 4.19 2.88 -1.05 -4.10 113.62 111.40 1x4g n SER 80 Ca 0.41 0.33 0.11 0.00 -1.33 0.00 0.00 58.87 58.39 1x4g n SER 80 Cb 1.71 -0.47 0.40 0.00 -0.75 0.00 0.00 64.21 65.10 1x4g n SER 80 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1x4g h VAL 81 N 0.00 0.04 -0.60 2.46 2.07 -0.09 -3.35 116.25 116.77 1x4g h VAL 81 Ca 0.00 0.00 -0.26 0.00 0.82 0.00 0.00 66.70 67.26 1x4g h VAL 81 Cb 0.00 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 1x4g h VAL 81 CO 0.00 0.00 0.72 0.21 0.02 0.00 0.00 177.57 178.52 1x4g s ASN 82 N -3.74 4.93 0.00 0.57 2.47 0.22 -1.56 114.94 117.82 1x4g s ASN 82 Ca -0.02 -0.85 0.00 0.00 0.42 0.00 0.00 52.86 52.41 1x4g s ASN 82 Cb 0.06 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.30 1x4g s ASN 82 CO 0.21 -3.00 0.00 0.61 -3.72 0.00 0.00 177.10 171.19 1x4g n GLY 83 N 6.58 1.02 3.90 1.21 0.00 -1.25 -4.68 105.19 111.98 1x4g n GLY 83 Ca 0.42 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.16 1x4g n GLY 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x4g s THR 84 N -1.90 4.25 -0.26 2.61 -4.23 -0.60 -4.94 115.64 110.57 1x4g s THR 84 Ca 0.00 0.24 0.03 0.00 -1.18 0.00 0.00 61.69 60.78 1x4g s THR 84 Cb 0.00 -3.67 0.06 0.00 1.34 0.00 0.00 72.50 70.23 1x4g s THR 84 CO 0.00 -0.72 -0.11 -0.89 -0.54 0.00 0.00 174.62 172.36 1x4g s THR 85 N -2.96 2.12 -0.25 3.99 2.01 -1.26 -1.63 115.64 117.66 1x4g s THR 85 Ca 0.52 -1.61 -0.10 0.00 0.31 0.00 0.00 61.69 60.82 1x4g s THR 85 Cb -0.11 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.12 1x4g s THR 85 CO 0.47 -0.03 0.14 -0.63 -0.69 0.00 0.00 174.62 173.88 1x4g s ILE 86 N 1.12 5.04 -1.46 1.82 1.01 0.28 -4.41 121.20 124.61 1x4g s ILE 86 Ca -0.09 0.07 -0.10 0.00 0.00 0.00 0.00 60.65 60.54 1x4g s ILE 86 Cb -0.20 -3.37 0.05 0.00 0.01 0.00 0.00 42.46 38.95 1x4g s ILE 86 CO -0.05 0.31 0.78 -0.62 0.00 0.00 0.00 174.94 175.36 1x4g n GLU 87 N 4.70 -5.12 -1.06 2.79 -0.58 -1.26 -0.12 120.64 120.00 1x4g n GLU 87 Ca -0.15 0.68 -0.02 0.00 -0.42 0.00 0.00 57.16 57.25 1x4g n GLU 87 Cb 0.52 -5.54 -0.01 0.00 -0.57 0.00 0.00 31.44 25.84 1x4g n GLU 87 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x4g n GLY 88 N -1.55 0.51 3.12 0.62 0.00 -1.26 -5.00 105.19 101.63 1x4g n GLY 88 Ca -0.02 -0.24 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 1x4g n GLY 88 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1x4g s HIS 89 N -1.86 2.84 -0.31 1.61 3.76 0.83 -5.08 115.29 117.08 1x4g s HIS 89 Ca 0.00 -1.70 -0.28 0.00 -0.15 0.00 0.00 55.06 52.93 1x4g s HIS 89 Cb 0.00 -1.93 -0.03 0.00 1.11 0.00 0.00 32.58 31.73 1x4g s HIS 89 CO 0.00 -0.81 1.99 0.54 -0.85 0.00 0.00 174.74 175.61 1x4g s VAL 90 N 1.28 3.27 0.35 -0.90 0.11 -1.26 -0.56 120.40 122.69 1x4g s VAL 90 Ca 0.03 0.27 -0.19 0.00 -2.93 0.00 0.00 61.98 59.16 1x4g s VAL 90 Cb -0.14 -3.39 -0.10 0.00 -1.53 0.00 0.00 36.38 31.22 1x4g s VAL 90 CO -0.12 -0.27 0.84 0.68 -3.33 0.00 0.00 175.10 172.90 1x4g s VAL 91 N 7.84 4.50 -0.23 2.04 -7.23 -0.65 -4.19 120.40 122.49 1x4g s VAL 91 Ca 0.88 1.30 0.02 0.00 -1.81 0.00 0.00 61.98 62.36 1x4g s VAL 91 Cb -0.25 -3.69 0.05 0.00 0.56 0.00 0.00 36.38 33.05 1x4g s VAL 91 CO 0.33 -0.15 -0.12 -0.54 -0.31 0.00 0.00 175.10 174.31 1x4g s LYS 92 N -2.81 2.33 -0.30 4.82 1.02 0.66 -3.82 119.74 121.63 1x4g s LYS 92 Ca 0.55 -1.12 -0.13 0.00 0.02 0.00 0.00 55.97 55.29 1x4g s LYS 92 Cb -0.12 -2.72 -0.03 0.00 -0.52 0.00 0.00 37.83 34.44 1x4g s LYS 92 CO 0.17 -0.47 0.28 0.00 -0.92 0.00 0.00 175.35 174.41 1x4g n TYR 94 N 5.20 -0.09 -3.09 0.00 4.01 -0.02 -4.75 117.16 118.42 1x4g n TYR 94 Ca -0.11 -2.58 -0.45 0.00 -0.16 0.00 0.00 57.90 54.59 1x4g n TYR 94 Cb 0.51 0.07 -0.02 0.00 -0.31 0.00 0.00 39.34 39.58 1x4g n TYR 94 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1x4g s TRP 95 N -3.11 3.38 0.00 -0.72 0.52 -1.26 -0.46 118.94 117.29 1x4g s TRP 95 Ca 0.25 -1.63 0.00 0.00 0.02 0.00 0.00 56.10 54.74 1x4g s TRP 95 Cb 0.01 -4.10 0.00 0.00 -1.15 0.00 0.00 33.47 28.23 1x4g s TRP 95 CO 0.17 -1.29 0.00 0.41 0.02 0.00 0.00 176.95 176.26 1x4g n GLY 96 N 4.89 0.00 2.75 0.98 0.00 -1.20 -4.88 105.19 107.73 1x4g n GLY 96 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 1x4g n GLY 96 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1x4g n LYS 97 N 0.00 -3.30 -3.72 1.61 4.81 -1.26 -5.00 118.16 111.29 1x4g n LYS 97 Ca 0.00 2.67 -0.09 0.00 -0.87 0.00 0.00 58.31 60.03 1x4g n LYS 97 Cb 0.00 -5.32 -0.02 0.00 0.02 0.00 0.00 35.03 29.71 1x4g n LYS 97 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1x4g s GLU 98 N -1.75 1.62 -0.11 1.64 -1.05 -1.26 -5.14 118.70 112.65 1x4g s GLU 98 Ca 0.03 -0.83 -0.30 0.00 -0.15 0.00 0.00 54.97 53.73 1x4g s GLU 98 Cb -0.01 0.60 0.08 0.00 -0.44 0.00 0.00 34.13 34.36 1x4g s GLU 98 CO 0.77 -0.73 0.75 -1.12 0.95 0.00 0.00 175.26 175.87 1x4g s SER 99 N -2.87 -0.62 0.36 0.83 0.01 -1.26 -5.04 113.70 105.10 1x4g s SER 99 Ca 0.08 0.79 0.15 0.00 1.31 0.00 0.00 55.95 58.28 1x4g s SER 99 Cb -0.04 0.66 0.66 0.00 0.21 0.00 0.00 66.02 67.52 1x4g s SER 99 CO 0.01 -0.49 1.76 1.55 0.41 0.00 0.00 173.24 176.47 1x4g h PRO 100 N 3.30 0.00 -3.48 12.44 0.13 -2.08 -3.36 132.00 138.95 1x4g h PRO 100 Ca -0.26 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 64.14 1x4g h PRO 100 Cb 1.15 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.95 1x4g h PRO 100 CO 0.31 0.42 -0.01 0.34 -0.23 0.00 0.00 178.00 178.84 1x4g s ASP 101 N -6.73 6.22 -0.45 1.44 -1.08 -1.26 -5.01 116.67 109.80 1x4g s ASP 101 Ca -0.02 -3.40 -0.11 0.00 -0.52 0.00 0.00 52.55 48.51 1x4g s ASP 101 Cb 0.13 -2.00 0.09 0.00 -1.46 0.00 0.00 42.92 39.68 1x4g s ASP 101 CO 0.72 -0.29 0.32 -0.04 0.52 0.00 0.00 175.17 176.39 1x4g s MET 102 N -0.89 2.66 0.07 4.34 -1.94 -1.26 -5.07 119.30 117.21 1x4g s MET 102 Ca 0.25 -1.53 0.03 0.00 -1.71 0.00 0.00 55.69 52.73 1x4g s MET 102 Cb -0.11 -3.90 -0.04 0.00 2.01 0.00 0.00 34.83 32.79 1x4g s MET 102 CO -0.09 -1.05 0.05 -0.08 -0.01 0.00 0.00 175.02 173.84 1x4g s THR 103 N 1.46 4.37 -0.03 2.05 -1.32 -1.26 -5.11 115.64 115.80 1x4g s THR 103 Ca 0.04 -0.79 -0.31 0.00 -1.21 0.00 0.00 61.69 59.42 1x4g s THR 103 Cb -0.24 -3.08 0.12 0.00 -1.51 0.00 0.00 72.50 67.79 1x4g s THR 103 CO 0.02 0.16 1.28 -0.55 -2.21 0.00 0.00 174.62 173.32 1x4g s SER 104 N -2.25 -0.07 0.00 8.08 0.15 -1.26 -5.18 113.70 113.17 1x4g s SER 104 Ca 0.27 -0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1x4g s SER 104 Cb -0.12 0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 1x4g s SER 104 CO 0.19 -0.30 0.00 0.61 1.20 0.00 0.00 173.24 174.94 1x4g n GLY 105 N -0.46 3.41 3.77 9.45 0.00 -1.26 -5.09 105.19 115.01 1x4g n GLY 105 Ca -0.08 -1.66 -0.34 0.00 0.00 0.00 0.00 46.02 43.94 1x4g n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x4g s PRO 106 N -4.40 3.08 -0.03 1.61 0.04 -1.26 -5.07 135.00 128.97 1x4g s PRO 106 Ca 0.00 1.50 -0.02 0.00 0.04 0.00 0.00 61.00 62.52 1x4g s PRO 106 Cb 0.00 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.58 1x4g s PRO 106 CO 0.00 -1.05 0.08 -1.54 0.04 0.00 0.00 177.00 174.54 1x4g s SER 107 N -2.17 -0.07 0.00 6.66 1.04 -1.26 -5.02 113.70 112.88 1x4g s SER 107 Ca 0.70 0.17 0.00 0.00 0.48 0.00 0.00 55.95 57.29 1x4g s SER 107 Cb -0.22 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.03 1x4g s SER 107 CO 0.34 -0.06 0.00 -1.20 0.98 0.00 0.00 173.24 173.30 1x4g n SER 108 N 3.40 0.00 0.00 7.02 7.64 -1.26 -5.35 113.62 125.08 1x4g n SER 108 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.71 1x4g n SER 108 Cb 0.57 0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.84 1x4g n SER 108 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64