#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 6.26 0.33 1.61 1.04 -1.26 -5.10 113.70 116.59 1x4g s SER 2 Ca 0.00 1.23 0.07 0.00 0.48 0.00 0.00 55.95 57.73 1x4g s SER 2 Cb 0.00 -2.38 -0.07 0.00 0.10 0.00 0.00 66.02 63.67 1x4g s SER 2 CO 0.00 -0.74 -0.03 -0.44 0.98 0.00 0.00 173.24 173.00 1x4g s SER 3 N -4.10 3.19 -0.23 7.02 0.01 -1.26 -5.16 113.70 113.17 1x4g s SER 3 Ca 0.52 -1.26 -0.29 0.00 1.31 0.00 0.00 55.95 56.23 1x4g s SER 3 Cb -0.11 -0.25 0.16 0.00 0.21 0.00 0.00 66.02 66.03 1x4g s SER 3 CO 0.49 -0.37 1.18 -0.83 0.41 0.00 0.00 173.24 174.12 1x4g s GLY 4 N -3.55 -0.06 0.74 3.44 0.00 -1.26 -5.15 107.32 101.47 1x4g s GLY 4 Ca 0.33 2.55 -0.16 0.00 0.00 0.00 0.00 44.72 47.43 1x4g s GLY 4 CO 0.15 1.23 0.27 1.44 0.00 0.00 0.00 173.10 176.20 1x4g n SER 5 N 0.89 -2.17 -3.98 1.64 7.64 -1.26 -4.99 113.62 111.38 1x4g n SER 5 Ca -0.07 0.54 -0.28 0.00 1.01 0.00 0.00 58.87 60.07 1x4g n SER 5 Cb 0.58 -1.11 -0.17 0.00 -1.01 0.00 0.00 64.21 62.50 1x4g n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x4g s SER 6 N -1.39 2.28 -0.13 6.43 0.01 -1.26 -5.11 113.70 114.53 1x4g s SER 6 Ca 0.61 -0.37 -0.03 0.00 1.31 0.00 0.00 55.95 57.47 1x4g s SER 6 Cb -0.34 -0.97 0.05 0.00 0.21 0.00 0.00 66.02 64.96 1x4g s SER 6 CO 0.63 -0.05 0.04 -0.83 0.41 0.00 0.00 173.24 173.43 1x4g s GLY 7 N 1.32 0.51 0.02 3.44 0.00 -1.26 -5.03 107.32 106.32 1x4g s GLY 7 Ca -0.01 -0.33 -0.26 0.00 0.00 0.00 0.00 44.72 44.12 1x4g s GLY 7 CO -0.05 1.37 1.32 -0.57 0.00 0.00 0.00 173.10 175.17 1x4g h ASN 8 N 8.32 -0.38 0.00 1.64 -0.73 -2.02 -3.42 115.58 119.00 1x4g h ASN 8 Ca -0.17 -0.14 -0.10 0.00 1.87 0.00 0.00 56.30 57.76 1x4g h ASN 8 Cb 1.13 0.10 -0.02 0.00 0.27 0.00 0.00 38.32 39.80 1x4g h ASN 8 CO 0.28 -0.05 -1.34 0.41 -0.37 0.00 0.00 177.43 176.36 1x4g n THR 9 N -5.17 0.34 -2.96 -3.57 -1.04 -1.26 -5.10 114.28 95.52 1x4g n THR 9 Ca -0.10 -0.09 -0.01 0.00 -2.04 0.00 0.00 64.05 61.81 1x4g n THR 9 Cb 0.26 -1.58 -0.01 0.00 -1.82 0.00 0.00 70.33 67.18 1x4g n THR 9 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1x4g n LYS 10 N -3.27 -2.10 -4.46 -2.82 3.00 -1.26 -4.82 118.16 102.43 1x4g n LYS 10 Ca -0.12 1.83 -0.23 0.00 -0.00 0.00 0.00 58.31 59.78 1x4g n LYS 10 Cb 0.59 -2.28 -0.10 0.00 0.00 0.00 0.00 35.03 33.23 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 -0.50 1.63 -0.02 1.64 0.74 -1.26 -4.74 119.66 117.16 1x4g s GLN 11 Ca -0.07 -1.79 0.04 0.00 0.05 0.00 0.00 55.36 53.59 1x4g s GLN 11 Cb 0.00 -1.52 -0.01 0.00 1.10 0.00 0.00 33.01 32.59 1x4g s GLN 11 CO 0.26 0.19 -0.15 -0.51 -0.55 0.00 0.00 175.29 174.54 1x4g s LEU 12 N -3.49 1.99 0.23 3.68 1.43 -1.26 -5.12 118.68 116.13 1x4g s LEU 12 Ca 0.29 -0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 52.82 1x4g s LEU 12 Cb -0.00 -0.77 -0.09 0.00 0.03 0.00 0.00 46.19 45.35 1x4g s LEU 12 CO 0.13 0.17 1.30 -0.13 0.23 0.00 0.00 176.35 178.06 1x4g s ARG 13 N -0.25 4.39 0.59 1.70 0.52 -1.26 -4.79 118.95 119.85 1x4g s ARG 13 Ca 0.04 2.08 0.29 0.00 -0.52 0.00 0.00 55.73 57.61 1x4g s ARG 13 Cb -0.07 -3.17 1.57 0.00 0.52 0.00 0.00 34.95 33.80 1x4g s ARG 13 CO -0.00 -0.22 2.00 0.35 0.02 0.00 0.00 175.30 177.45 1x4g h PHE 14 N 4.94 0.00 -0.03 -0.53 3.04 -1.98 0.24 116.94 122.62 1x4g h PHE 14 Ca -0.46 0.00 -0.17 0.00 3.98 0.00 0.00 57.97 61.32 1x4g h PHE 14 Cb 1.22 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.71 1x4g h PHE 14 CO 0.61 0.00 -0.75 0.93 -2.02 0.00 0.00 178.31 177.07 1x4g h GLU 15 N 0.00 0.20 0.20 1.11 5.08 -1.94 -1.89 114.58 117.35 1x4g h GLU 15 Ca 0.14 -0.18 -0.31 0.00 -1.00 0.00 0.00 59.36 58.01 1x4g h GLU 15 Cb 0.81 0.04 0.02 0.00 0.50 0.00 0.00 28.75 30.13 1x4g h GLU 15 CO -0.00 0.86 -1.39 -0.44 -1.00 0.00 0.00 179.01 177.04 1x4g h ASP 16 N 0.13 0.68 0.25 1.42 3.32 -0.96 -3.31 116.42 117.94 1x4g h ASP 16 Ca -0.03 -0.72 -0.13 0.00 0.02 0.00 0.00 57.03 56.17 1x4g h ASP 16 Cb 1.33 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.64 1x4g h ASP 16 CO 0.11 1.57 -0.52 0.58 -1.72 0.00 0.00 179.24 179.26 1x4g h VAL 17 N 0.12 1.35 -0.37 -1.35 2.07 -1.24 -2.52 116.25 114.30 1x4g h VAL 17 Ca -0.21 -1.77 -0.24 0.00 0.82 0.00 0.00 66.70 65.30 1x4g h VAL 17 Cb 2.09 1.83 -0.11 0.00 -1.52 0.00 0.00 31.29 33.59 1x4g h VAL 17 CO 0.25 0.53 0.32 0.55 0.02 0.00 0.00 177.57 179.23 1x4g n VAL 18 N -3.95 2.53 0.00 2.57 3.14 -0.71 -3.76 118.33 118.15 1x4g n VAL 18 Ca -0.02 -1.33 0.00 0.00 -2.96 0.00 0.00 64.34 60.03 1x4g n VAL 18 Cb 0.56 -1.32 0.00 0.00 -1.06 0.00 0.00 33.84 32.02 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 0.54 0.00 -0.30 6.55 2.85 -1.17 -4.94 115.26 118.79 1x4g n ASN 19 Ca 0.23 0.00 0.06 0.00 -0.11 0.00 0.00 54.58 54.76 1x4g n ASN 19 Cb 0.59 0.00 0.13 0.00 1.24 0.00 0.00 39.78 41.74 1x4g n ASN 19 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1x4g n GLN 20 N -1.15 -0.08 -4.39 1.20 6.02 -0.96 -4.39 117.38 113.64 1x4g n GLN 20 Ca 0.00 1.32 -0.27 0.00 -0.01 0.00 0.00 57.00 58.04 1x4g n GLN 20 Cb 0.00 -1.98 -0.11 0.00 1.02 0.00 0.00 30.24 29.17 1x4g n GLN 20 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1x4g s SER 21 N -5.20 3.62 0.67 1.08 0.01 -1.26 -5.11 113.70 107.51 1x4g s SER 21 Ca -0.13 -0.80 -0.17 0.00 1.31 0.00 0.00 55.95 56.17 1x4g s SER 21 Cb 0.23 -0.36 -0.06 0.00 0.21 0.00 0.00 66.02 66.04 1x4g s SER 21 CO 0.66 0.12 0.49 -1.20 0.41 0.00 0.00 173.24 173.72 1x4g n SER 22 N 0.23 -1.26 -0.06 2.44 7.64 -1.26 -4.90 113.62 116.45 1x4g n SER 22 Ca -0.12 0.64 -0.10 0.00 1.01 0.00 0.00 58.87 60.30 1x4g n SER 22 Cb 0.56 -1.19 0.05 0.00 -1.01 0.00 0.00 64.21 62.62 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 -0.15 0.74 0.21 1.43 0.13 -1.94 -3.31 132.00 129.11 1x4g h PRO 23 Ca -0.45 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 1x4g h PRO 23 Cb 1.37 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.48 1x4g h PRO 23 CO 0.44 1.00 -0.38 0.87 -0.23 0.00 0.00 178.00 179.71 1x4g h LYS 24 N 0.60 -0.60 -6.64 0.86 6.56 -2.03 -3.38 116.57 111.95 1x4g h LYS 24 Ca 0.05 0.04 -0.56 0.00 -1.06 0.00 0.00 60.65 59.12 1x4g h LYS 24 Cb 0.95 0.14 -0.07 0.00 -0.57 0.00 0.00 32.23 32.67 1x4g h LYS 24 CO 0.09 -0.40 0.89 1.21 -2.06 0.00 0.00 179.45 179.17 1x4g s ASN 25 N -3.92 6.64 -0.33 0.86 2.47 -1.25 -4.96 114.94 114.45 1x4g s ASN 25 Ca -0.12 0.46 0.02 0.00 0.42 0.00 0.00 52.86 53.64 1x4g s ASN 25 Cb 0.04 -2.54 0.09 0.00 -1.45 0.00 0.00 41.25 37.39 1x4g s ASN 25 CO 0.43 -1.21 0.04 0.00 -3.72 0.00 0.00 177.10 172.64 1x4g s THR 27 N 1.01 1.23 -0.25 0.00 2.01 -1.26 -3.04 115.64 115.34 1x4g s THR 27 Ca 0.05 -1.60 0.00 0.00 0.31 0.00 0.00 61.69 60.46 1x4g s THR 27 Cb -0.20 -1.39 0.07 0.00 0.01 0.00 0.00 72.50 70.99 1x4g s THR 27 CO -0.06 -0.38 -0.01 -0.69 -0.69 0.00 0.00 174.62 172.79 1x4g s VAL 28 N -1.94 1.34 -0.23 3.82 1.01 0.14 -2.52 120.40 122.02 1x4g s VAL 28 Ca 0.06 -1.22 -0.22 0.00 0.00 0.00 0.00 61.98 60.59 1x4g s VAL 28 Cb -0.06 -1.72 -0.01 0.00 0.00 0.00 0.00 36.38 34.58 1x4g s VAL 28 CO 0.02 -0.23 0.72 -0.47 0.00 0.00 0.00 175.10 175.14 1x4g s TYR 29 N 1.46 3.32 -0.37 5.22 5.04 0.77 -1.16 117.35 131.64 1x4g s TYR 29 Ca -0.02 0.98 -0.08 0.00 -2.44 0.00 0.00 57.07 55.52 1x4g s TYR 29 Cb -0.18 -2.92 0.05 0.00 0.35 0.00 0.00 41.96 39.25 1x4g s TYR 29 CO -0.09 -0.32 0.17 0.00 -1.34 0.00 0.00 175.55 173.97 1x4g s GLY 31 N 1.59 1.35 0.00 0.00 0.00 0.22 0.97 107.32 111.46 1x4g s GLY 31 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 44.72 43.75 1x4g s GLY 31 CO 0.04 -0.30 0.00 0.61 0.00 0.00 0.00 173.10 173.45 1x4g n GLY 32 N 3.56 1.12 3.76 0.20 0.00 -0.56 0.24 105.19 113.52 1x4g n GLY 32 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 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 2.48 0.00 -0.61 1.01 -1.25 -4.73 121.20 118.10 1x4g s ILE 33 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 60.65 61.06 1x4g s ILE 33 Cb 0.00 -3.23 0.00 0.00 0.01 0.00 0.00 42.46 39.24 1x4g s ILE 33 CO 0.00 0.04 0.00 0.00 0.00 0.00 0.00 174.94 174.98 1x4g n ALA 34 N -0.19 2.15 -1.20 9.38 0.00 -1.26 -4.03 120.51 125.37 1x4g n ALA 34 Ca 0.05 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.51 1x4g n ALA 34 Cb 0.44 0.02 0.23 0.00 0.00 0.00 0.00 19.45 20.14 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 -1.69 3.29 -2.40 0.00 7.64 -1.26 -4.57 113.62 114.63 1x4g n SER 35 Ca 0.00 -3.37 -0.02 0.00 1.01 0.00 0.00 58.87 56.49 1x4g n SER 35 Cb 0.02 -0.60 0.10 0.00 -1.01 0.00 0.00 64.21 62.72 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 -0.80 1.55 3.43 0.23 0.00 -1.26 -5.10 105.19 103.25 1x4g n GLY 36 Ca 0.29 -0.14 -0.44 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.33 5.15 -0.00 0.99 0.20 -1.26 -4.98 118.68 115.45 1x4g s LEU 37 Ca 0.07 -1.01 0.03 0.00 0.69 0.00 0.00 54.13 53.92 1x4g s LEU 37 Cb 0.36 -2.36 -0.01 0.00 -0.43 0.00 0.00 46.19 43.75 1x4g s LEU 37 CO -0.10 -0.78 -0.10 0.42 -0.29 0.00 0.00 176.35 175.49 1x4g s THR 38 N 2.26 0.82 0.29 3.68 -4.23 -1.26 -4.73 115.64 112.47 1x4g s THR 38 Ca 0.11 -0.49 0.04 0.00 -1.18 0.00 0.00 61.69 60.17 1x4g s THR 38 Cb -0.20 -0.70 0.28 0.00 1.34 0.00 0.00 72.50 73.22 1x4g s THR 38 CO 0.11 0.20 1.71 -0.78 -0.54 0.00 0.00 174.62 175.32 1x4g h ASP 39 N 5.79 0.42 -0.67 3.99 3.58 -1.96 0.29 116.42 127.87 1x4g h ASP 39 Ca -0.32 0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.26 1x4g h ASP 39 Cb 1.18 0.09 -0.03 0.00 1.72 0.00 0.00 39.33 42.29 1x4g h ASP 39 CO 0.49 0.06 0.40 -0.61 -2.88 0.00 0.00 179.24 176.70 1x4g h GLN 40 N 0.47 0.92 0.74 0.28 5.75 -1.97 0.42 115.11 121.73 1x4g h GLN 40 Ca 0.55 -0.08 -0.04 0.00 -0.15 0.00 0.00 58.65 58.93 1x4g h GLN 40 Cb 1.00 -0.19 0.01 0.00 1.07 0.00 0.00 27.48 29.37 1x4g h GLN 40 CO -0.49 0.66 -0.36 1.25 -2.65 0.00 0.00 178.83 177.24 1x4g h LEU 41 N 0.94 -0.85 -0.93 -2.39 5.85 -0.81 0.20 115.31 117.33 1x4g h LEU 41 Ca 0.24 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1x4g h LEU 41 Cb -0.02 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 1x4g h LEU 41 CO -0.04 -0.58 0.46 0.24 -0.34 0.00 0.00 178.44 178.18 1x4g h MET 42 N -1.04 1.22 -0.58 1.25 2.86 -1.33 0.96 114.93 118.27 1x4g h MET 42 Ca -0.10 -0.15 -0.06 0.00 -2.06 0.00 0.00 59.70 57.33 1x4g h MET 42 Cb 0.78 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1x4g h MET 42 CO 0.17 0.90 0.13 -0.09 1.06 0.00 0.00 176.91 179.08 1x4g h ARG 43 N 1.22 0.91 -0.04 1.72 2.43 -0.79 0.45 114.38 120.28 1x4g h ARG 43 Ca 0.30 -0.20 -0.25 0.00 -0.81 0.00 0.00 59.98 59.02 1x4g h ARG 43 Cb 0.05 -0.13 0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1x4g h ARG 43 CO -0.05 0.82 -0.95 0.37 -1.51 0.00 0.00 179.97 178.66 1x4g h GLN 44 N 0.87 0.72 -0.43 0.20 -0.00 -0.10 0.62 115.11 117.00 1x4g h GLN 44 Ca 0.19 -0.72 -0.08 0.00 -0.00 0.00 0.00 58.65 58.04 1x4g h GLN 44 Cb 0.33 0.19 -0.01 0.00 0.00 0.00 0.00 27.48 27.99 1x4g h GLN 44 CO 0.00 1.30 -0.02 1.15 0.00 0.00 0.00 178.83 181.26 1x4g h THR 45 N 0.42 1.26 0.00 2.39 2.02 -0.65 -3.03 112.91 115.33 1x4g h THR 45 Ca -0.11 -1.08 0.00 0.00 0.77 0.00 0.00 66.41 66.00 1x4g h THR 45 Cb 1.60 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 69.11 1x4g h THR 45 CO 0.19 0.37 -0.73 -0.26 0.37 0.00 0.00 175.52 175.45 1x4g h PHE 46 N 0.61 0.00 -0.51 3.16 0.04 -0.98 -3.37 116.94 115.90 1x4g h PHE 46 Ca 0.12 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.94 1x4g h PHE 46 Cb 0.52 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 38.59 1x4g h PHE 46 CO 0.04 0.00 -0.53 1.03 -0.60 0.00 0.00 178.31 178.25 1x4g h SER 47 N 0.00 -1.82 -0.17 2.17 0.87 0.39 -1.65 113.55 113.34 1x4g h SER 47 Ca 0.00 0.25 -0.07 0.00 -1.23 0.00 0.00 61.79 60.74 1x4g h SER 47 Cb 0.76 0.76 -0.00 0.00 -0.44 0.00 0.00 62.40 63.48 1x4g h SER 47 CO 0.00 -0.34 -0.17 1.55 -0.53 0.00 0.00 176.83 177.34 1x4g h PRO 48 N -0.29 0.42 -0.12 2.24 0.13 -1.76 -3.02 132.00 129.62 1x4g h PRO 48 Ca 0.09 -0.22 0.03 0.00 -0.87 0.00 0.00 66.00 65.03 1x4g h PRO 48 Cb 0.52 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.65 1x4g h PRO 48 CO -0.64 0.78 0.65 0.74 -0.23 0.00 0.00 178.00 179.31 1x4g h PHE 49 N 0.07 0.00 0.00 1.56 0.04 -1.61 -3.45 116.94 113.56 1x4g h PHE 49 Ca 0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.80 1x4g h PHE 49 Cb 0.70 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.85 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 -1.38 -0.93 3.80 -1.45 0.00 -0.66 -4.66 105.19 99.91 1x4g n GLY 50 Ca 0.01 -1.37 -0.37 0.00 0.00 0.00 0.00 46.02 44.30 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 4.34 -0.05 1.61 -0.21 -1.26 -4.27 119.66 117.83 1x4g s GLN 51 Ca 0.00 0.96 0.06 0.00 0.02 0.00 0.00 55.36 56.39 1x4g s GLN 51 Cb 0.00 -2.97 -0.02 0.00 1.00 0.00 0.00 33.01 31.02 1x4g s GLN 51 CO 0.00 0.43 -0.22 0.42 -2.12 0.00 0.00 175.29 173.81 1x4g s ILE 52 N -1.43 2.40 -0.21 1.08 1.01 -1.26 -3.81 121.20 118.97 1x4g s ILE 52 Ca 0.41 -0.96 -0.17 0.00 0.00 0.00 0.00 60.65 59.94 1x4g s ILE 52 Cb -0.18 -1.89 -0.13 0.00 0.01 0.00 0.00 42.46 40.27 1x4g s ILE 52 CO 0.22 0.58 -0.09 0.23 0.00 0.00 0.00 174.94 175.87 1x4g n MET 53 N 2.64 0.55 -3.82 2.79 2.81 -0.66 -4.95 117.12 116.47 1x4g n MET 53 Ca -0.17 0.43 -0.12 0.00 -1.81 0.00 0.00 57.70 56.03 1x4g n MET 53 Cb 0.52 -1.63 -0.12 0.00 -0.71 0.00 0.00 33.22 31.29 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 -2.45 0.29 -0.03 0.03 2.12 -1.25 -5.04 118.70 112.36 1x4g s GLU 54 Ca -0.29 0.10 0.05 0.00 0.36 0.00 0.00 54.97 55.18 1x4g s GLU 54 Cb 0.08 0.13 -0.01 0.00 0.26 0.00 0.00 34.13 34.59 1x4g s GLU 54 CO 0.47 -0.05 -0.18 0.42 -0.54 0.00 0.00 175.26 175.38 1x4g s ILE 55 N -0.27 1.49 -0.22 -3.70 1.01 -1.26 -2.57 121.20 115.67 1x4g s ILE 55 Ca -0.04 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 1x4g s ILE 55 Cb -0.03 -1.26 0.06 0.00 0.01 0.00 0.00 42.46 41.25 1x4g s ILE 55 CO 0.01 0.42 0.01 -0.13 0.00 0.00 0.00 174.94 175.25 1x4g s ARG 56 N -0.18 0.97 -0.19 2.79 1.81 0.54 -4.95 118.95 119.74 1x4g s ARG 56 Ca 0.01 -0.67 -0.13 0.00 -1.72 0.00 0.00 55.73 53.22 1x4g s ARG 56 Cb -0.10 -2.26 -0.05 0.00 -0.45 0.00 0.00 34.95 32.10 1x4g s ARG 56 CO 0.01 -0.66 0.26 0.14 -0.68 0.00 0.00 175.30 174.37 1x4g s VAL 57 N 1.68 5.31 -0.70 3.52 -7.23 -1.26 0.82 120.40 122.54 1x4g s VAL 57 Ca -0.01 0.45 0.03 0.00 -1.81 0.00 0.00 61.98 60.63 1x4g s VAL 57 Cb -0.18 -3.60 0.17 0.00 0.56 0.00 0.00 36.38 33.33 1x4g s VAL 57 CO -0.09 0.35 0.51 -0.36 -0.31 0.00 0.00 175.10 175.20 1x4g s PHE 58 N 0.79 3.55 -1.48 2.82 0.40 0.63 -4.90 117.98 119.78 1x4g s PHE 58 Ca 0.14 -3.18 0.15 0.00 -0.60 0.00 0.00 56.93 53.43 1x4g s PHE 58 Cb -0.13 -2.90 0.76 0.00 0.51 0.00 0.00 43.02 41.26 1x4g s PHE 58 CO 0.04 -0.65 1.40 -0.35 0.70 0.00 0.00 175.22 176.36 1x4g n PRO 59 N 2.41 0.23 0.03 0.24 -0.04 -1.26 -0.40 135.00 136.21 1x4g n PRO 59 Ca 0.16 0.13 0.02 0.00 -0.04 0.00 0.00 63.50 63.77 1x4g n PRO 59 Cb 0.35 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.23 1x4g n PRO 59 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1x4g n GLU 60 N -1.26 0.63 -0.07 0.54 4.07 -1.26 -4.41 120.64 118.88 1x4g n GLU 60 Ca 0.07 0.14 -0.08 0.00 -0.06 0.00 0.00 57.16 57.24 1x4g n GLU 60 Cb 0.11 -1.76 -0.09 0.00 -0.06 0.00 0.00 31.44 29.64 1x4g n GLU 60 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1x4g n LYS 61 N -2.78 1.34 0.00 5.31 4.76 -0.93 -5.03 118.16 120.83 1x4g n LYS 61 Ca -0.10 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.38 1x4g n LYS 61 Cb 0.80 -1.33 0.00 0.00 -1.84 0.00 0.00 35.03 32.66 1x4g n LYS 61 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1x4g n GLY 62 N 2.41 1.62 3.29 0.72 0.00 0.46 -5.02 105.19 108.67 1x4g n GLY 62 Ca -0.24 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.67 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 0.87 0.26 1.61 -0.85 -1.08 -1.49 117.35 114.67 1x4g s TYR 63 Ca 0.00 -1.16 0.02 0.00 -0.52 0.00 0.00 57.07 55.41 1x4g s TYR 63 Cb 0.00 -0.34 -0.03 0.00 0.38 0.00 0.00 41.96 41.97 1x4g s TYR 63 CO 0.00 -0.70 0.22 0.45 -1.52 0.00 0.00 175.55 174.00 1x4g s SER 64 N -3.09 0.81 -0.05 -0.18 0.15 0.27 -0.27 113.70 111.34 1x4g s SER 64 Ca 0.31 -1.53 0.01 0.00 0.70 0.00 0.00 55.95 55.44 1x4g s SER 64 Cb 0.05 0.48 0.02 0.00 -1.71 0.00 0.00 66.02 64.86 1x4g s SER 64 CO 0.09 -0.97 -0.04 -0.36 1.20 0.00 0.00 173.24 173.16 1x4g s PHE 65 N -3.80 0.76 -0.21 3.44 0.08 0.24 -2.04 117.98 116.47 1x4g s PHE 65 Ca 0.39 -0.22 -0.03 0.00 0.12 0.00 0.00 56.93 57.19 1x4g s PHE 65 Cb 0.04 -0.71 0.07 0.00 -0.57 0.00 0.00 43.02 41.85 1x4g s PHE 65 CO 0.19 -0.22 0.05 0.08 -0.10 0.00 0.00 175.22 175.21 1x4g s VAL 66 N 1.11 0.47 -0.25 -0.44 1.01 -0.31 -0.34 120.40 121.66 1x4g s VAL 66 Ca -0.08 -0.60 -0.14 0.00 0.00 0.00 0.00 61.98 61.16 1x4g s VAL 66 Cb -0.14 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 1x4g s VAL 66 CO -0.01 -0.28 0.31 -0.13 0.00 0.00 0.00 175.10 174.99 1x4g s ARG 67 N 1.87 4.06 0.24 2.72 3.00 -1.06 0.24 118.95 130.02 1x4g s ARG 67 Ca 0.01 -0.03 -0.06 0.00 0.00 0.00 0.00 55.73 55.65 1x4g s ARG 67 Cb -0.17 -3.60 -0.06 0.00 0.00 0.00 0.00 34.95 31.12 1x4g s ARG 67 CO -0.11 -0.14 0.52 -0.06 0.00 0.00 0.00 175.30 175.51 1x4g s PHE 68 N 1.64 3.46 -0.80 -0.53 0.40 -1.17 -1.66 117.98 119.31 1x4g s PHE 68 Ca 0.13 0.69 0.19 0.00 -0.60 0.00 0.00 56.93 57.35 1x4g s PHE 68 Cb -0.15 -2.13 0.79 0.00 0.51 0.00 0.00 43.02 42.04 1x4g s PHE 68 CO 0.08 0.25 1.59 -1.13 0.70 0.00 0.00 175.22 176.72 1x4g n SER 69 N -0.49 0.27 -3.87 1.36 3.41 -1.25 -4.74 113.62 108.31 1x4g n SER 69 Ca -0.01 0.56 -0.11 0.00 -0.26 0.00 0.00 58.87 59.05 1x4g n SER 69 Cb 0.53 -0.62 -0.10 0.00 -0.26 0.00 0.00 64.21 63.76 1x4g n SER 69 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1x4g s THR 70 N -3.12 0.09 0.14 6.66 -4.23 -1.26 -5.05 115.64 108.86 1x4g s THR 70 Ca 0.07 -0.72 -0.12 0.00 -1.18 0.00 0.00 61.69 59.74 1x4g s THR 70 Cb 0.10 -0.48 -0.05 0.00 1.34 0.00 0.00 72.50 73.41 1x4g s THR 70 CO 0.34 -0.39 1.47 -0.74 -0.54 0.00 0.00 174.62 174.76 1x4g h HIS 71 N 4.19 1.09 -0.38 3.99 2.76 -1.85 -3.00 115.15 121.95 1x4g h HIS 71 Ca -0.31 -0.32 0.06 0.00 -2.20 0.00 0.00 60.37 57.60 1x4g h HIS 71 Cb 1.19 -0.23 -0.05 0.00 1.55 0.00 0.00 27.41 29.87 1x4g h HIS 71 CO 0.59 1.14 0.06 0.93 -1.30 0.00 0.00 177.93 179.35 1x4g h GLU 72 N 0.72 0.18 0.47 5.26 5.08 -1.97 -0.87 114.58 123.46 1x4g h GLU 72 Ca 0.06 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1x4g h GLU 72 Cb 0.95 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1x4g h GLU 72 CO 0.09 0.12 -0.35 0.77 -1.00 0.00 0.00 179.01 178.63 1x4g h SER 73 N 0.18 -0.92 -0.28 1.42 0.02 -1.89 -2.10 113.55 109.98 1x4g h SER 73 Ca 0.18 0.07 0.07 0.00 -0.84 0.00 0.00 61.79 61.26 1x4g h SER 73 Cb 0.22 0.29 -0.08 0.00 0.14 0.00 0.00 62.40 62.98 1x4g h SER 73 CO -0.25 -0.53 -0.30 0.00 -1.14 0.00 0.00 176.83 174.62 1x4g h ALA 74 N -0.41 -0.21 -0.54 3.77 0.00 -1.36 -1.76 119.26 118.75 1x4g h ALA 74 Ca -0.05 0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.04 1x4g h ALA 74 Cb 0.69 0.61 -0.11 0.00 0.00 0.00 0.00 17.79 18.99 1x4g h ALA 74 CO 0.01 -0.72 -0.22 0.00 0.00 0.00 0.00 179.25 178.32 1x4g h ALA 75 N 0.69 0.19 -0.13 0.00 0.00 -1.02 0.24 119.26 119.23 1x4g h ALA 75 Ca 0.14 0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.29 1x4g h ALA 75 Cb 0.52 0.56 -0.06 0.00 0.00 0.00 0.00 17.79 18.81 1x4g h ALA 75 CO -0.44 -0.54 -0.28 0.45 0.00 0.00 0.00 179.25 178.44 1x4g h HIS 76 N -0.09 -0.76 -0.36 0.00 3.86 -0.64 0.27 115.15 117.42 1x4g h HIS 76 Ca 0.25 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 1x4g h HIS 76 Cb 0.48 0.36 -0.02 0.00 1.06 0.00 0.00 27.41 29.29 1x4g h HIS 76 CO -0.52 -0.36 0.21 0.00 0.86 0.00 0.00 177.93 178.12 1x4g h ALA 77 N 0.54 1.69 0.43 2.45 0.00 -0.62 -2.56 119.26 121.19 1x4g h ALA 77 Ca 0.10 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1x4g h ALA 77 Cb 0.50 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1x4g h ALA 77 CO -0.33 0.27 -0.21 0.82 0.00 0.00 0.00 179.25 179.80 1x4g h ILE 78 N 0.50 0.00 -1.31 0.00 2.04 0.91 0.57 117.51 120.22 1x4g h ILE 78 Ca 0.13 -0.34 0.39 0.00 1.00 0.00 0.00 64.86 66.04 1x4g h ILE 78 Cb -0.01 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 35.98 1x4g h ILE 78 CO -0.02 0.00 0.89 -0.37 0.00 0.00 0.00 178.15 178.64 1x4g h VAL 79 N -0.93 0.29 0.00 1.67 -1.51 -0.48 0.96 116.25 116.24 1x4g h VAL 79 Ca -0.06 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 1x4g h VAL 79 Cb 0.45 0.15 0.00 0.00 -2.13 0.00 0.00 31.29 29.75 1x4g h VAL 79 CO 0.10 0.02 0.00 -0.24 -1.23 0.00 0.00 177.57 176.22 1x4g n SER 80 N -4.43 0.00 0.29 4.19 2.88 -0.97 -4.15 113.62 111.43 1x4g n SER 80 Ca 0.32 0.30 0.09 0.00 -1.33 0.00 0.00 58.87 58.25 1x4g n SER 80 Cb 1.32 -0.47 0.48 0.00 -0.75 0.00 0.00 64.21 64.79 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 0.00 -0.58 2.46 2.07 0.36 -3.33 116.25 117.23 1x4g h VAL 81 Ca 0.00 0.00 -0.47 0.00 0.82 0.00 0.00 66.70 67.05 1x4g h VAL 81 Cb 0.00 0.39 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 1x4g h VAL 81 CO 0.00 0.00 1.53 -3.20 0.02 0.00 0.00 177.57 175.92 1x4g n ASN 82 N -2.55 3.73 0.00 0.57 5.15 0.33 -2.33 115.26 120.16 1x4g n ASN 82 Ca -0.01 -2.78 0.00 0.00 -0.60 0.00 0.00 54.58 51.19 1x4g n ASN 82 Cb 0.53 -1.73 0.00 0.00 -0.53 0.00 0.00 39.78 38.05 1x4g n ASN 82 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x4g n GLY 83 N 5.59 0.97 3.97 8.20 0.00 -1.25 -4.78 105.19 117.90 1x4g n GLY 83 Ca 0.47 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.36 2.32 -0.20 2.61 -4.23 -0.98 -4.95 115.64 108.83 1x4g s THR 84 Ca 0.00 -0.53 -0.01 0.00 -1.18 0.00 0.00 61.69 59.97 1x4g s THR 84 Cb 0.00 -2.79 0.06 0.00 1.34 0.00 0.00 72.50 71.11 1x4g s THR 84 CO 0.00 0.00 -0.01 -0.89 -0.54 0.00 0.00 174.62 173.18 1x4g s THR 85 N -3.08 0.96 -0.23 3.99 2.01 -1.26 -2.24 115.64 115.79 1x4g s THR 85 Ca 0.63 -0.81 -0.05 0.00 0.31 0.00 0.00 61.69 61.77 1x4g s THR 85 Cb -0.08 -1.34 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 1x4g s THR 85 CO 0.43 -0.13 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.59 1x4g s ILE 86 N 1.66 3.56 -1.31 1.82 1.01 -0.07 -4.57 121.20 123.30 1x4g s ILE 86 Ca -0.03 -0.49 -0.08 0.00 0.00 0.00 0.00 60.65 60.05 1x4g s ILE 86 Cb -0.17 -2.66 0.01 0.00 0.01 0.00 0.00 42.46 39.64 1x4g s ILE 86 CO -0.07 0.36 1.14 -0.62 0.00 0.00 0.00 174.94 175.75 1x4g n GLU 87 N 4.82 -7.66 -1.35 2.79 -0.58 -1.26 -1.46 120.64 115.94 1x4g n GLU 87 Ca -0.17 0.81 -0.12 0.00 -0.42 0.00 0.00 57.16 57.25 1x4g n GLU 87 Cb 0.50 -5.78 -0.05 0.00 -0.57 0.00 0.00 31.44 25.54 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 -1.91 1.29 3.04 0.62 0.00 -1.26 -4.98 105.19 101.98 1x4g n GLY 88 Ca -0.01 -0.34 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.38 2.00 -0.21 1.61 3.76 -0.53 -5.10 115.29 114.45 1x4g s HIS 89 Ca 0.00 -1.00 -0.29 0.00 -0.15 0.00 0.00 55.06 53.62 1x4g s HIS 89 Cb 0.00 -1.46 -0.02 0.00 1.11 0.00 0.00 32.58 32.20 1x4g s HIS 89 CO 0.00 -0.54 1.54 0.54 -0.85 0.00 0.00 174.74 175.43 1x4g s VAL 90 N 1.18 3.81 0.33 -0.90 0.11 -1.26 -0.89 120.40 122.78 1x4g s VAL 90 Ca -0.02 0.93 -0.08 0.00 -2.93 0.00 0.00 61.98 59.87 1x4g s VAL 90 Cb -0.14 -3.77 -0.06 0.00 -1.53 0.00 0.00 36.38 30.88 1x4g s VAL 90 CO -0.05 -0.27 0.65 0.68 -3.33 0.00 0.00 175.10 172.78 1x4g s VAL 91 N 4.76 4.90 -0.19 2.04 -7.23 -0.95 -4.05 120.40 119.68 1x4g s VAL 91 Ca 0.68 0.38 0.00 0.00 -1.81 0.00 0.00 61.98 61.23 1x4g s VAL 91 Cb -0.24 -3.72 0.04 0.00 0.56 0.00 0.00 36.38 33.02 1x4g s VAL 91 CO 0.27 -0.38 -0.08 -0.54 -0.31 0.00 0.00 175.10 174.06 1x4g s LYS 92 N -3.58 1.81 -0.29 4.82 1.02 0.66 -3.76 119.74 120.43 1x4g s LYS 92 Ca 0.48 -0.71 -0.13 0.00 0.02 0.00 0.00 55.97 55.63 1x4g s LYS 92 Cb -0.11 -2.25 -0.04 0.00 -0.52 0.00 0.00 37.83 34.91 1x4g s LYS 92 CO 0.29 -0.42 0.27 0.00 -0.92 0.00 0.00 175.35 174.56 1x4g n TYR 94 N 5.18 -0.28 -3.09 0.00 4.01 -0.05 -4.77 117.16 118.16 1x4g n TYR 94 Ca -0.12 -2.44 -0.45 0.00 -0.16 0.00 0.00 57.90 54.73 1x4g n TYR 94 Cb 0.51 0.12 -0.04 0.00 -0.31 0.00 0.00 39.34 39.63 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 -3.07 3.04 0.00 -0.72 0.52 -1.26 -0.16 118.94 117.28 1x4g s TRP 95 Ca 0.27 -1.04 0.00 0.00 0.02 0.00 0.00 56.10 55.35 1x4g s TRP 95 Cb 0.01 -4.05 0.00 0.00 -1.15 0.00 0.00 33.47 28.29 1x4g s TRP 95 CO 0.19 -1.32 0.33 0.41 0.02 0.00 0.00 176.95 176.59 1x4g n GLY 96 N 5.21 -2.46 4.28 0.98 0.00 -1.05 -4.74 105.19 107.43 1x4g n GLY 96 Ca -0.05 0.53 -0.33 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.79 -1.61 0.08 1.61 4.81 -1.26 -4.82 118.16 116.17 1x4g n LYS 97 Ca 0.00 0.19 -0.11 0.00 -0.87 0.00 0.00 58.31 57.52 1x4g n LYS 97 Cb 0.00 -4.17 -0.03 0.00 0.02 0.00 0.00 35.03 30.85 1x4g n LYS 97 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1x4g h GLU 98 N -1.58 0.31 -6.76 1.64 5.08 -2.01 -3.45 114.58 107.81 1x4g h GLU 98 Ca -0.63 -0.34 -0.53 0.00 -1.00 0.00 0.00 59.36 56.86 1x4g h GLU 98 Cb 1.39 0.10 0.07 0.00 0.50 0.00 0.00 28.75 30.81 1x4g h GLU 98 CO 0.74 1.03 0.85 -1.54 -1.00 0.00 0.00 179.01 179.10 1x4g s SER 99 N -7.01 6.48 0.17 1.42 1.04 -1.26 -4.88 113.70 109.66 1x4g s SER 99 Ca -0.04 2.82 0.20 0.00 0.48 0.00 0.00 55.95 59.41 1x4g s SER 99 Cb 0.09 -2.63 0.86 0.00 0.10 0.00 0.00 66.02 64.45 1x4g s SER 99 CO 0.85 -0.84 1.63 -0.81 0.98 0.00 0.00 173.24 175.05 1x4g n PRO 100 N 2.49 0.13 -1.49 4.02 -0.04 -1.26 -4.79 135.00 134.05 1x4g n PRO 100 Ca 0.09 0.37 -0.42 0.00 -0.04 0.00 0.00 63.50 63.50 1x4g n PRO 100 Cb 0.38 -1.75 -0.15 0.00 -0.04 0.00 0.00 33.50 31.95 1x4g n PRO 100 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1x4g n ASP 101 N -1.99 0.35 -4.47 3.54 8.00 -1.26 -4.88 116.55 115.84 1x4g n ASP 101 Ca 0.03 0.18 -0.33 0.00 0.71 0.00 0.00 54.79 55.38 1x4g n ASP 101 Cb 0.21 -0.94 -0.13 0.00 -0.02 0.00 0.00 41.12 40.24 1x4g n ASP 101 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1x4g s MET 102 N 8.88 2.54 -0.11 -1.24 1.75 -1.26 -5.10 119.30 124.76 1x4g s MET 102 Ca 1.35 -0.70 -0.30 0.00 -1.25 0.00 0.00 55.69 54.79 1x4g s MET 102 Cb -1.24 -2.39 0.11 0.00 2.84 0.00 0.00 34.83 34.15 1x4g s MET 102 CO 0.49 0.60 0.90 -0.08 -0.65 0.00 0.00 175.02 176.29 1x4g s THR 103 N -0.68 0.00 -0.17 10.11 -1.32 -1.26 -5.15 115.64 117.17 1x4g s THR 103 Ca 0.10 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.59 1x4g s THR 103 Cb -0.11 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 69.91 1x4g s THR 103 CO 0.01 0.00 -0.12 -0.44 -2.21 0.00 0.00 174.62 171.85 1x4g s SER 104 N -1.35 2.93 -0.37 8.08 0.01 -1.26 -5.04 113.70 116.69 1x4g s SER 104 Ca -0.03 -0.63 -0.03 0.00 1.31 0.00 0.00 55.95 56.57 1x4g s SER 104 Cb -0.00 -1.19 0.20 0.00 0.21 0.00 0.00 66.02 65.24 1x4g s SER 104 CO 0.02 -0.09 0.96 -0.83 0.41 0.00 0.00 173.24 173.71 1x4g s GLY 105 N 1.46 -1.61 1.15 3.44 0.00 -1.26 -5.17 107.32 105.33 1x4g s GLY 105 Ca 0.03 0.60 -0.17 0.00 0.00 0.00 0.00 44.72 45.17 1x4g s GLY 105 CO -0.10 4.12 1.11 2.56 0.00 0.00 0.00 173.10 180.79 1x4g s PRO 106 N 1.39 -0.79 0.39 2.90 0.04 -1.26 -5.01 135.00 132.66 1x4g s PRO 106 Ca 0.21 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.33 1x4g s PRO 106 Cb 0.05 -1.63 0.00 0.00 0.04 0.00 0.00 34.50 32.96 1x4g s PRO 106 CO -0.11 -3.45 0.00 0.45 0.04 0.00 0.00 177.00 173.93 1x4g n SER 107 N -4.61 -3.01 -3.86 6.66 2.88 -1.26 -5.16 113.62 105.26 1x4g n SER 107 Ca 0.11 0.73 -0.20 0.00 -1.33 0.00 0.00 58.87 58.18 1x4g n SER 107 Cb 0.59 2.88 -0.09 0.00 -0.75 0.00 0.00 64.21 66.84 1x4g n SER 107 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1x4g s SER 108 N -2.66 1.70 0.00 -3.46 1.04 -1.26 -5.37 113.70 103.69 1x4g s SER 108 Ca 0.00 -1.62 0.00 0.00 0.48 0.00 0.00 55.95 54.81 1x4g s SER 108 Cb 0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1x4g s SER 108 CO 0.00 -0.94 0.00 0.61 0.98 0.00 0.00 173.24 173.89