#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4g n SER 2 N 0.00 -7.21 0.04 1.61 2.88 -1.26 -4.96 113.62 104.72 1x4g n SER 2 Ca 0.00 0.73 -0.03 0.00 -1.33 0.00 0.00 58.87 58.25 1x4g n SER 2 Cb 0.00 -3.65 -0.01 0.00 -0.75 0.00 0.00 64.21 59.80 1x4g n SER 2 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1x4g h SER 3 N 2.91 -0.16 0.00 -3.46 0.87 -2.13 -3.51 113.55 108.08 1x4g h SER 3 Ca -0.08 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1x4g h SER 3 Cb 0.69 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1x4g h SER 3 CO 0.10 0.22 0.00 0.61 -0.53 0.00 0.00 176.83 177.24 1x4g n GLY 4 N 1.26 0.07 1.08 5.77 0.00 -1.26 -5.16 105.19 106.95 1x4g n GLY 4 Ca -0.02 -0.27 0.12 0.00 0.00 0.00 0.00 46.02 45.86 1x4g n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x4g n SER 5 N 0.00 -5.69 -4.19 1.61 7.64 -1.26 -4.91 113.62 106.82 1x4g n SER 5 Ca 0.00 0.60 -0.24 0.00 1.01 0.00 0.00 58.87 60.24 1x4g n SER 5 Cb 0.00 -3.47 -0.14 0.00 -1.01 0.00 0.00 64.21 59.59 1x4g n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x4g s SER 6 N -5.58 2.11 0.27 6.43 1.04 -1.26 -5.04 113.70 111.68 1x4g s SER 6 Ca 0.00 -0.42 -0.02 0.00 0.48 0.00 0.00 55.95 55.99 1x4g s SER 6 Cb 0.00 -0.19 0.59 0.00 0.10 0.00 0.00 66.02 66.52 1x4g s SER 6 CO 0.00 0.16 1.63 1.23 0.98 0.00 0.00 173.24 177.23 1x4g h GLY 7 N 5.24 1.10 -3.46 7.32 0.00 -2.09 -3.47 103.07 107.70 1x4g h GLY 7 Ca -0.39 0.07 0.36 0.00 0.00 0.00 0.00 47.33 47.37 1x4g h GLY 7 CO 0.46 -0.36 -1.10 -2.01 0.00 0.00 0.00 176.54 173.53 1x4g n ASN 8 N -5.34 -8.29 -3.96 0.19 5.15 -1.26 -4.94 115.26 96.81 1x4g n ASN 8 Ca 0.18 1.26 -0.23 0.00 -0.60 0.00 0.00 54.58 55.19 1x4g n ASN 8 Cb 0.60 -4.85 -0.16 0.00 -0.53 0.00 0.00 39.78 34.84 1x4g n ASN 8 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1x4g s THR 9 N -3.80 0.87 0.08 -0.44 2.01 -1.26 -5.14 115.64 107.96 1x4g s THR 9 Ca 0.00 -0.31 -0.21 0.00 0.31 0.00 0.00 61.69 61.47 1x4g s THR 9 Cb 0.00 -0.83 0.05 0.00 0.01 0.00 0.00 72.50 71.73 1x4g s THR 9 CO 0.00 0.30 0.51 -0.75 -0.69 0.00 0.00 174.62 173.99 1x4g s LYS 10 N 0.83 1.09 0.50 4.92 2.47 -1.26 -5.14 119.74 123.15 1x4g s LYS 10 Ca -0.12 -0.37 0.00 0.00 -1.56 0.00 0.00 55.97 53.92 1x4g s LYS 10 Cb -0.15 0.49 0.00 0.00 -1.46 0.00 0.00 37.83 36.71 1x4g s LYS 10 CO 0.02 -0.42 0.00 1.04 0.16 0.00 0.00 175.35 176.15 1x4g n GLN 11 N 0.14 -3.12 -4.16 4.03 3.00 -1.26 -4.96 117.38 111.05 1x4g n GLN 11 Ca -0.18 2.37 -0.16 0.00 -0.01 0.00 0.00 57.00 59.03 1x4g n GLN 11 Cb 0.62 -3.73 -0.14 0.00 0.00 0.00 0.00 30.24 26.98 1x4g n GLN 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1x4g s LEU 12 N -7.16 2.02 0.31 1.08 1.43 -1.26 -5.13 118.68 109.97 1x4g s LEU 12 Ca 0.00 -0.12 -0.29 0.00 -1.03 0.00 0.00 54.13 52.69 1x4g s LEU 12 Cb 0.00 -0.27 -0.10 0.00 0.03 0.00 0.00 46.19 45.85 1x4g s LEU 12 CO 0.00 0.05 1.31 -0.13 0.23 0.00 0.00 176.35 177.81 1x4g s ARG 13 N -0.20 4.36 0.22 1.70 1.81 -1.26 -4.73 118.95 120.86 1x4g s ARG 13 Ca 0.01 2.19 -0.09 0.00 -1.72 0.00 0.00 55.73 56.13 1x4g s ARG 13 Cb -0.02 -3.09 0.19 0.00 -0.45 0.00 0.00 34.95 31.57 1x4g s ARG 13 CO -0.00 -0.20 1.88 0.35 -0.68 0.00 0.00 175.30 176.65 1x4g h PHE 14 N 3.72 1.08 0.00 -0.53 3.04 -1.99 0.14 116.94 122.40 1x4g h PHE 14 Ca -0.48 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.48 1x4g h PHE 14 Cb 1.22 -0.36 0.00 0.00 2.56 0.00 0.00 35.95 39.37 1x4g h PHE 14 CO 0.57 0.71 0.00 0.39 -2.02 0.00 0.00 178.31 177.95 1x4g n GLU 15 N -4.47 0.19 -0.06 1.11 1.02 -1.26 -1.74 120.64 115.44 1x4g n GLU 15 Ca 0.09 0.39 -0.13 0.00 -0.02 0.00 0.00 57.16 57.49 1x4g n GLU 15 Cb 0.04 -1.84 -0.14 0.00 -0.02 0.00 0.00 31.44 29.47 1x4g n GLU 15 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1x4g n ASP 16 N -2.20 1.04 -0.03 1.62 -0.08 -0.32 -4.14 116.55 112.44 1x4g n ASP 16 Ca 0.03 0.16 -0.15 0.00 -1.51 0.00 0.00 54.79 53.31 1x4g n ASP 16 Cb 0.24 0.05 -0.11 0.00 2.34 0.00 0.00 41.12 43.65 1x4g n ASP 16 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1x4g h VAL 17 N 0.01 1.49 0.00 5.18 2.07 -0.59 -2.77 116.25 121.65 1x4g h VAL 17 Ca -0.44 -1.82 0.00 0.00 0.82 0.00 0.00 66.70 65.26 1x4g h VAL 17 Cb 2.07 2.57 0.00 0.00 -1.52 0.00 0.00 31.29 34.41 1x4g h VAL 17 CO 0.04 0.51 0.05 1.33 0.02 0.00 0.00 177.57 179.51 1x4g n VAL 18 N -4.49 1.19 -0.04 2.57 0.24 -0.71 -1.26 118.33 115.82 1x4g n VAL 18 Ca -0.09 0.68 -0.18 0.00 -2.04 0.00 0.00 64.34 62.71 1x4g n VAL 18 Cb 0.49 -1.68 -0.14 0.00 -1.47 0.00 0.00 33.84 31.04 1x4g n VAL 18 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1x4g n ASN 19 N -2.03 1.74 -0.29 -1.34 3.02 -1.17 -4.40 115.26 110.78 1x4g n ASN 19 Ca -0.01 0.12 -0.00 0.00 -0.03 0.00 0.00 54.58 54.66 1x4g n ASN 19 Cb 0.07 -0.48 0.04 0.00 -0.61 0.00 0.00 39.78 38.80 1x4g n ASN 19 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x4g n GLN 20 N -3.30 -0.17 -4.35 3.52 1.13 -0.39 -4.46 117.38 109.36 1x4g n GLN 20 Ca -0.34 1.16 -0.25 0.00 -1.94 0.00 0.00 57.00 55.63 1x4g n GLN 20 Cb 1.04 -1.72 -0.09 0.00 0.11 0.00 0.00 30.24 29.58 1x4g n GLN 20 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1x4g s SER 21 N -5.26 4.15 0.70 1.08 0.15 -1.25 -5.12 113.70 108.14 1x4g s SER 21 Ca -0.10 -1.03 -0.16 0.00 0.70 0.00 0.00 55.95 55.35 1x4g s SER 21 Cb 0.16 -0.51 0.02 0.00 -1.71 0.00 0.00 66.02 63.98 1x4g s SER 21 CO 0.54 -0.27 1.20 -0.94 1.20 0.00 0.00 173.24 174.97 1x4g s SER 22 N -3.72 4.49 0.43 5.45 1.04 -1.26 -4.90 113.70 115.22 1x4g s SER 22 Ca 0.35 2.33 0.22 0.00 0.48 0.00 0.00 55.95 59.33 1x4g s SER 22 Cb 0.01 -2.59 0.94 0.00 0.10 0.00 0.00 66.02 64.48 1x4g s SER 22 CO 0.19 -2.06 1.85 1.55 0.98 0.00 0.00 173.24 175.75 1x4g h PRO 23 N -0.03 0.00 0.27 4.02 0.13 -1.94 -3.24 132.00 131.22 1x4g h PRO 23 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1x4g h PRO 23 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1x4g h PRO 23 CO 0.51 0.27 -0.13 0.87 -0.23 0.00 0.00 178.00 179.29 1x4g h LYS 24 N 0.00 -0.35 -6.02 0.86 1.79 -1.99 -3.41 116.57 107.45 1x4g h LYS 24 Ca -0.00 0.02 -0.60 0.00 -2.18 0.00 0.00 60.65 57.89 1x4g h LYS 24 Cb 0.70 0.08 -0.11 0.00 -1.58 0.00 0.00 32.23 31.31 1x4g h LYS 24 CO 0.04 -0.00 0.58 1.21 -1.08 0.00 0.00 179.45 180.20 1x4g s ASN 25 N -5.19 6.41 -0.37 0.86 2.47 -1.22 -5.00 114.94 112.90 1x4g s ASN 25 Ca -0.13 -0.12 -0.01 0.00 0.42 0.00 0.00 52.86 53.01 1x4g s ASN 25 Cb 0.01 -2.45 0.09 0.00 -1.45 0.00 0.00 41.25 37.46 1x4g s ASN 25 CO 0.50 -1.15 0.12 0.00 -3.72 0.00 0.00 177.10 172.85 1x4g s THR 27 N 1.13 1.30 -0.21 0.00 2.01 -1.26 -3.04 115.64 115.57 1x4g s THR 27 Ca 0.05 -1.92 -0.03 0.00 0.31 0.00 0.00 61.69 60.10 1x4g s THR 27 Cb -0.21 -1.71 0.07 0.00 0.01 0.00 0.00 72.50 70.65 1x4g s THR 27 CO -0.04 -0.58 0.07 -0.69 -0.69 0.00 0.00 174.62 172.68 1x4g s VAL 28 N -2.74 0.32 -0.21 3.82 1.01 0.14 -3.25 120.40 119.49 1x4g s VAL 28 Ca 0.14 -0.54 -0.21 0.00 0.00 0.00 0.00 61.98 61.36 1x4g s VAL 28 Cb -0.01 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 1x4g s VAL 28 CO 0.02 -0.33 0.66 -0.47 0.00 0.00 0.00 175.10 174.98 1x4g s TYR 29 N 1.94 3.36 -0.32 5.22 6.14 0.28 -1.60 117.35 132.37 1x4g s TYR 29 Ca 0.02 0.95 -0.06 0.00 0.64 0.00 0.00 57.07 58.62 1x4g s TYR 29 Cb -0.17 -2.84 0.03 0.00 0.42 0.00 0.00 41.96 39.41 1x4g s TYR 29 CO -0.13 -0.21 0.09 0.00 0.64 0.00 0.00 175.55 175.94 1x4g s GLY 31 N 1.42 1.03 0.00 0.00 0.00 -0.15 0.23 107.32 109.86 1x4g s GLY 31 Ca -0.01 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 43.96 1x4g s GLY 31 CO 0.02 -0.32 0.00 0.61 0.00 0.00 0.00 173.10 173.41 1x4g n GLY 32 N 3.29 2.02 3.77 0.20 0.00 -1.13 0.22 105.19 113.56 1x4g n GLY 32 Ca -0.19 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.29 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 3.13 0.00 -0.61 1.01 -1.26 -4.72 121.20 118.75 1x4g s ILE 33 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 60.65 61.37 1x4g s ILE 33 Cb 0.00 -3.30 0.00 0.00 0.01 0.00 0.00 42.46 39.17 1x4g s ILE 33 CO 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 174.94 174.80 1x4g n ALA 34 N -1.24 1.37 -0.01 9.38 0.00 -1.26 -4.12 120.51 124.63 1x4g n ALA 34 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.66 1x4g n ALA 34 Cb 0.51 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.79 1x4g n ALA 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1x4g n SER 35 N -1.41 0.01 -2.33 0.00 2.88 -1.26 -4.48 113.62 107.02 1x4g n SER 35 Ca 0.00 -0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.31 1x4g n SER 35 Cb 0.00 2.00 0.01 0.00 -0.75 0.00 0.00 64.21 65.47 1x4g n SER 35 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4g n GLY 36 N 1.26 5.55 3.44 0.46 0.00 -1.26 -5.01 105.19 109.63 1x4g n GLY 36 Ca -0.04 -2.50 -0.44 0.00 0.00 0.00 0.00 46.02 43.04 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 -3.55 5.13 -0.01 0.99 0.20 -1.26 -4.98 118.68 115.20 1x4g s LEU 37 Ca 0.46 -0.94 -0.04 0.00 0.69 0.00 0.00 54.13 54.31 1x4g s LEU 37 Cb 0.40 -2.33 -0.00 0.00 -0.43 0.00 0.00 46.19 43.84 1x4g s LEU 37 CO -0.07 -0.67 0.07 0.42 -0.29 0.00 0.00 176.35 175.81 1x4g s THR 38 N 2.08 0.06 0.22 3.68 -4.23 -1.26 -4.72 115.64 111.47 1x4g s THR 38 Ca 0.10 -0.49 -0.07 0.00 -1.18 0.00 0.00 61.69 60.05 1x4g s THR 38 Cb -0.20 -0.27 0.17 0.00 1.34 0.00 0.00 72.50 73.55 1x4g s THR 38 CO 0.11 -0.27 1.76 -0.78 -0.54 0.00 0.00 174.62 174.90 1x4g h ASP 39 N 5.05 0.34 -0.37 3.99 1.82 -1.96 0.85 116.42 126.15 1x4g h ASP 39 Ca -0.29 0.08 0.11 0.00 -0.39 0.00 0.00 57.03 56.54 1x4g h ASP 39 Cb 1.20 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 41.23 1x4g h ASP 39 CO 0.43 0.19 0.27 -0.61 -1.61 0.00 0.00 179.24 177.91 1x4g h GLN 40 N 0.50 0.00 0.30 0.28 5.75 -1.98 0.26 115.11 120.22 1x4g h GLN 40 Ca 0.35 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.83 1x4g h GLN 40 Cb 0.42 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.97 1x4g h GLN 40 CO -0.31 0.00 -0.14 1.25 -2.65 0.00 0.00 178.83 176.98 1x4g h LEU 41 N 0.00 -0.34 -1.04 -2.39 5.85 -1.22 -1.77 115.31 114.41 1x4g h LEU 41 Ca 0.17 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1x4g h LEU 41 Cb 0.72 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 1x4g h LEU 41 CO -0.00 0.13 0.23 0.24 -0.34 0.00 0.00 178.44 178.70 1x4g h MET 42 N -0.96 0.92 -0.56 1.25 2.86 -1.13 0.19 114.93 117.51 1x4g h MET 42 Ca -0.04 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.40 1x4g h MET 42 Cb 0.50 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 1x4g h MET 42 CO 0.07 0.77 0.17 -0.09 1.06 0.00 0.00 176.91 178.89 1x4g h ARG 43 N 0.90 0.87 -0.08 1.72 2.43 -0.57 0.11 114.38 119.75 1x4g h ARG 43 Ca 0.21 -0.19 -0.23 0.00 -0.81 0.00 0.00 59.98 58.96 1x4g h ARG 43 Cb 0.20 -0.12 0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1x4g h ARG 43 CO -0.02 0.79 -0.83 0.37 -1.51 0.00 0.00 179.97 178.77 1x4g h GLN 44 N 0.78 0.72 -0.58 0.20 4.15 -0.99 0.87 115.11 120.26 1x4g h GLN 44 Ca 0.18 -0.66 -0.08 0.00 0.77 0.00 0.00 58.65 58.86 1x4g h GLN 44 Cb 0.28 0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 1x4g h GLN 44 CO -0.01 1.25 0.04 1.15 -1.93 0.00 0.00 178.83 179.34 1x4g h THR 45 N 0.41 1.26 0.00 2.39 2.02 -0.52 -2.92 112.91 115.54 1x4g h THR 45 Ca -0.08 -1.05 0.00 0.00 0.77 0.00 0.00 66.41 66.05 1x4g h THR 45 Cb 1.48 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 1x4g h THR 45 CO 0.17 0.38 -1.05 0.49 0.37 0.00 0.00 175.52 175.88 1x4g n PHE 46 N -4.20 0.24 -0.27 3.16 3.72 0.37 -4.28 117.46 116.20 1x4g n PHE 46 Ca 0.03 0.07 -0.12 0.00 -0.05 0.00 0.00 57.45 57.39 1x4g n PHE 46 Cb 0.31 -0.41 -0.09 0.00 -0.94 0.00 0.00 39.48 38.34 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 -1.91 -0.15 4.37 0.87 1.00 -1.98 113.55 115.75 1x4g h SER 47 Ca 0.00 0.27 -0.06 0.00 -1.23 0.00 0.00 61.79 60.77 1x4g h SER 47 Cb 0.72 0.82 -0.00 0.00 -0.44 0.00 0.00 62.40 63.50 1x4g h SER 47 CO 0.00 -0.30 -0.15 1.55 -0.53 0.00 0.00 176.83 177.41 1x4g h PRO 48 N -0.19 0.36 -0.67 2.24 0.13 -1.78 -3.07 132.00 129.02 1x4g h PRO 48 Ca 0.11 -0.19 0.19 0.00 -0.87 0.00 0.00 66.00 65.25 1x4g h PRO 48 Cb 0.47 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.58 1x4g h PRO 48 CO -0.73 0.74 0.97 0.74 -0.23 0.00 0.00 178.00 179.50 1x4g h PHE 49 N -0.01 0.00 0.00 1.56 0.04 -1.60 -3.45 116.94 113.48 1x4g h PHE 49 Ca 0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1x4g h PHE 49 Cb 0.68 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.83 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 -1.60 -0.52 3.82 -1.45 0.00 -0.80 -4.69 105.19 99.95 1x4g n GLY 50 Ca 0.15 -1.20 -0.38 0.00 0.00 0.00 0.00 46.02 44.58 1x4g n GLY 50 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1x4g s GLN 51 N -2.00 4.09 -0.16 1.61 0.74 -1.26 -4.41 119.66 118.27 1x4g s GLN 51 Ca 0.00 0.61 -0.00 0.00 0.05 0.00 0.00 55.36 56.02 1x4g s GLN 51 Cb 0.00 -3.22 -0.00 0.00 1.10 0.00 0.00 33.01 30.89 1x4g s GLN 51 CO 0.00 0.65 -0.14 0.42 -0.55 0.00 0.00 175.29 175.67 1x4g s ILE 52 N -1.11 2.73 -0.17 -2.34 1.01 -1.26 -3.82 121.20 116.24 1x4g s ILE 52 Ca 0.27 -0.75 -0.22 0.00 0.00 0.00 0.00 60.65 59.96 1x4g s ILE 52 Cb -0.18 -2.16 -0.19 0.00 0.01 0.00 0.00 42.46 39.94 1x4g s ILE 52 CO 0.17 0.51 0.38 0.24 0.00 0.00 0.00 174.94 176.24 1x4g h MET 53 N 7.30 0.00 -4.05 2.79 2.86 -1.73 -3.49 114.93 118.61 1x4g h MET 53 Ca -0.33 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.18 1x4g h MET 53 Cb 1.19 0.00 -0.17 0.00 0.06 0.00 0.00 31.60 32.68 1x4g h MET 53 CO 0.57 0.85 -0.63 -2.00 1.06 0.00 0.00 176.91 176.76 1x4g s GLU 54 N -2.24 0.55 -0.01 1.72 2.12 -1.26 -5.05 118.70 114.54 1x4g s GLU 54 Ca -0.22 -0.96 0.01 0.00 0.36 0.00 0.00 54.97 54.16 1x4g s GLU 54 Cb 0.02 0.20 0.01 0.00 0.26 0.00 0.00 34.13 34.61 1x4g s GLU 54 CO 0.56 -0.12 -0.03 0.42 -0.54 0.00 0.00 175.26 175.55 1x4g s ILE 55 N -3.06 0.31 -0.24 -3.70 1.01 -1.26 -3.27 121.20 110.98 1x4g s ILE 55 Ca -0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.50 1x4g s ILE 55 Cb 0.02 -0.30 0.08 0.00 0.01 0.00 0.00 42.46 42.27 1x4g s ILE 55 CO -0.07 0.12 0.08 -0.13 0.00 0.00 0.00 174.94 174.93 1x4g s ARG 56 N 0.25 0.54 -0.13 2.79 1.81 -0.46 -4.95 118.95 118.80 1x4g s ARG 56 Ca -0.02 -0.61 -0.11 0.00 -1.72 0.00 0.00 55.73 53.27 1x4g s ARG 56 Cb -0.06 -1.87 -0.05 0.00 -0.45 0.00 0.00 34.95 32.52 1x4g s ARG 56 CO -0.00 -0.82 0.24 0.14 -0.68 0.00 0.00 175.30 174.17 1x4g s VAL 57 N 1.86 5.34 -0.62 3.52 -7.23 -1.26 0.11 120.40 122.11 1x4g s VAL 57 Ca 0.04 0.43 0.04 0.00 -1.81 0.00 0.00 61.98 60.69 1x4g s VAL 57 Cb -0.17 -3.54 0.16 0.00 0.56 0.00 0.00 36.38 33.39 1x4g s VAL 57 CO -0.19 0.50 0.41 -0.36 -0.31 0.00 0.00 175.10 175.16 1x4g s PHE 58 N -0.30 3.16 -1.74 2.82 0.40 0.18 -4.92 117.98 117.58 1x4g s PHE 58 Ca 0.16 -3.15 0.15 0.00 -0.60 0.00 0.00 56.93 53.49 1x4g s PHE 58 Cb -0.13 -2.53 0.85 0.00 0.51 0.00 0.00 43.02 41.72 1x4g s PHE 58 CO 0.05 -0.63 1.38 -0.35 0.70 0.00 0.00 175.22 176.36 1x4g n PRO 59 N 2.42 0.37 -0.10 0.24 -0.04 -1.26 -0.30 135.00 136.33 1x4g n PRO 59 Ca 0.16 0.07 -0.11 0.00 -0.04 0.00 0.00 63.50 63.58 1x4g n PRO 59 Cb 0.35 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.16 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 -1.13 0.68 -0.08 0.54 0.28 -1.26 -4.51 120.64 115.17 1x4g n GLU 60 Ca 0.10 0.03 -0.08 0.00 -0.16 0.00 0.00 57.16 57.04 1x4g n GLU 60 Cb 0.08 -1.53 -0.15 0.00 1.43 0.00 0.00 31.44 31.27 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 -2.84 0.67 -0.61 3.44 4.76 -1.01 -5.02 118.16 117.56 1x4g n LYS 61 Ca -0.34 0.05 0.00 0.00 -2.87 0.00 0.00 58.31 55.15 1x4g n LYS 61 Cb 1.13 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 32.74 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 1.67 1.03 3.82 0.72 0.00 0.60 -5.05 105.19 107.97 1x4g n GLY 62 Ca -0.27 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.23 -0.07 0.29 1.61 -0.85 -1.03 -2.85 117.35 112.23 1x4g s TYR 63 Ca 0.00 -0.42 -0.04 0.00 -0.52 0.00 0.00 57.07 56.09 1x4g s TYR 63 Cb 0.00 0.68 -0.01 0.00 0.38 0.00 0.00 41.96 43.01 1x4g s TYR 63 CO 0.00 -1.28 0.40 0.45 -1.52 0.00 0.00 175.55 173.61 1x4g s SER 64 N -2.96 0.59 -0.00 -0.18 0.15 0.14 0.48 113.70 111.91 1x4g s SER 64 Ca 0.13 -1.35 0.03 0.00 0.70 0.00 0.00 55.95 55.46 1x4g s SER 64 Cb -0.05 0.59 -0.01 0.00 -1.71 0.00 0.00 66.02 64.84 1x4g s SER 64 CO 0.08 -1.16 -0.09 -0.36 1.20 0.00 0.00 173.24 172.91 1x4g s PHE 65 N -3.51 0.80 -0.20 3.44 0.08 0.30 -2.32 117.98 116.58 1x4g s PHE 65 Ca 0.31 -0.17 -0.04 0.00 0.12 0.00 0.00 56.93 57.14 1x4g s PHE 65 Cb 0.01 -0.51 0.10 0.00 -0.57 0.00 0.00 43.02 42.05 1x4g s PHE 65 CO 0.17 -0.01 0.32 0.08 -0.10 0.00 0.00 175.22 175.67 1x4g s VAL 66 N -0.29 -0.49 -0.19 -0.44 1.01 -0.63 -1.35 120.40 118.01 1x4g s VAL 66 Ca 0.03 0.05 -0.07 0.00 0.00 0.00 0.00 61.98 61.99 1x4g s VAL 66 Cb -0.04 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 1x4g s VAL 66 CO -0.00 -0.05 0.06 -0.13 0.00 0.00 0.00 175.10 174.98 1x4g s ARG 67 N 2.47 3.91 0.03 2.72 3.00 -1.20 0.26 118.95 130.14 1x4g s ARG 67 Ca 0.06 -0.37 -0.02 0.00 0.00 0.00 0.00 55.73 55.40 1x4g s ARG 67 Cb -0.14 -3.23 -0.04 0.00 0.00 0.00 0.00 34.95 31.54 1x4g s ARG 67 CO -0.12 0.19 0.21 -0.06 0.00 0.00 0.00 175.30 175.51 1x4g s PHE 68 N 0.61 3.53 -0.41 -0.53 0.40 -1.17 -1.87 117.98 118.54 1x4g s PHE 68 Ca 0.03 0.32 0.21 0.00 -0.60 0.00 0.00 56.93 56.90 1x4g s PHE 68 Cb -0.13 -1.81 1.00 0.00 0.51 0.00 0.00 43.02 42.59 1x4g s PHE 68 CO 0.01 0.61 1.65 0.45 0.70 0.00 0.00 175.22 178.65 1x4g n SER 69 N 0.59 0.57 -4.04 1.36 2.88 -1.25 -4.69 113.62 109.05 1x4g n SER 69 Ca -0.08 0.69 -0.08 0.00 -1.33 0.00 0.00 58.87 58.07 1x4g n SER 69 Cb 0.52 -0.79 -0.11 0.00 -0.75 0.00 0.00 64.21 63.08 1x4g n SER 69 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1x4g s THR 70 N -3.39 0.19 0.16 2.46 -4.23 -1.26 -5.05 115.64 104.53 1x4g s THR 70 Ca 0.02 -1.35 0.04 0.00 -1.18 0.00 0.00 61.69 59.21 1x4g s THR 70 Cb 0.08 -0.88 -0.16 0.00 1.34 0.00 0.00 72.50 72.87 1x4g s THR 70 CO 0.29 -0.73 1.37 -0.74 -0.54 0.00 0.00 174.62 174.26 1x4g h HIS 71 N 3.92 0.23 -0.62 3.99 2.76 -1.84 -3.20 115.15 120.38 1x4g h HIS 71 Ca -0.33 -0.13 -0.02 0.00 -2.20 0.00 0.00 60.37 57.69 1x4g h HIS 71 Cb 1.18 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 30.09 1x4g h HIS 71 CO 0.60 0.97 0.32 0.93 -1.30 0.00 0.00 177.93 179.45 1x4g h GLU 72 N 0.08 0.87 0.15 5.26 5.08 -1.96 -1.75 114.58 122.30 1x4g h GLU 72 Ca -0.04 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 1x4g h GLU 72 Cb 1.55 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.63 1x4g h GLU 72 CO 0.13 0.68 -0.07 0.77 -1.00 0.00 0.00 179.01 179.52 1x4g h SER 73 N 0.84 -0.17 0.26 1.42 0.02 -1.86 -2.10 113.55 111.96 1x4g h SER 73 Ca 0.22 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1x4g h SER 73 Cb 0.07 0.04 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1x4g h SER 73 CO -0.03 -0.07 -0.36 0.00 -1.14 0.00 0.00 176.83 175.23 1x4g h ALA 74 N 0.60 -0.71 -0.97 3.77 0.00 -1.53 -2.00 119.26 118.42 1x4g h ALA 74 Ca -0.02 -0.10 0.22 0.00 0.00 0.00 0.00 54.91 55.02 1x4g h ALA 74 Cb 0.20 0.55 -0.12 0.00 0.00 0.00 0.00 17.79 18.42 1x4g h ALA 74 CO 0.03 -0.95 0.54 0.00 0.00 0.00 0.00 179.25 178.88 1x4g h ALA 75 N -0.16 1.66 -0.85 0.00 0.00 -1.29 0.27 119.26 118.88 1x4g h ALA 75 Ca -0.00 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1x4g h ALA 75 Cb 0.65 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 1x4g h ALA 75 CO -0.13 -0.24 0.56 0.45 0.00 0.00 0.00 179.25 179.90 1x4g h HIS 76 N 0.57 1.07 -0.03 0.00 3.86 -0.66 0.19 115.15 120.15 1x4g h HIS 76 Ca 0.60 0.03 -0.22 0.00 -1.16 0.00 0.00 60.37 59.62 1x4g h HIS 76 Cb 1.10 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 29.21 1x4g h HIS 76 CO -0.04 0.66 -0.90 0.00 0.86 0.00 0.00 177.93 178.51 1x4g h ALA 77 N 1.32 0.38 0.39 2.45 0.00 -0.15 -3.14 119.26 120.51 1x4g h ALA 77 Ca 0.32 -0.68 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1x4g h ALA 77 Cb -0.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1x4g h ALA 77 CO -0.08 0.78 -0.19 0.82 0.00 0.00 0.00 179.25 180.59 1x4g h ILE 78 N 0.28 0.52 -1.04 0.00 2.04 -0.22 0.68 117.51 119.77 1x4g h ILE 78 Ca -0.07 -0.56 0.27 0.00 1.00 0.00 0.00 64.86 65.49 1x4g h ILE 78 Cb 1.52 0.75 -0.10 0.00 -0.74 0.00 0.00 36.82 38.25 1x4g h ILE 78 CO 0.16 0.09 0.66 -0.37 0.00 0.00 0.00 178.15 178.69 1x4g h VAL 79 N -0.89 0.51 0.00 1.67 -1.51 -0.75 0.48 116.25 115.76 1x4g h VAL 79 Ca -0.05 -0.15 0.00 0.00 -1.23 0.00 0.00 66.70 65.27 1x4g h VAL 79 Cb 0.55 0.05 0.00 0.00 -2.13 0.00 0.00 31.29 29.75 1x4g h VAL 79 CO 0.09 0.08 0.00 -1.20 -1.23 0.00 0.00 177.57 175.31 1x4g n SER 80 N -4.69 0.00 -0.32 4.19 7.64 -1.18 -4.31 113.62 114.95 1x4g n SER 80 Ca 0.26 0.29 0.15 0.00 1.01 0.00 0.00 58.87 60.58 1x4g n SER 80 Cb 0.86 -0.46 0.30 0.00 -1.01 0.00 0.00 64.21 63.91 1x4g n SER 80 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1x4g h VAL 81 N 0.00 0.11 -0.39 0.44 2.07 0.42 -3.36 116.25 115.54 1x4g h VAL 81 Ca 0.00 -0.02 -0.21 0.00 0.82 0.00 0.00 66.70 67.29 1x4g h VAL 81 Cb 0.00 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 29.77 1x4g h VAL 81 CO 0.00 0.01 0.97 -3.20 0.02 0.00 0.00 177.57 175.37 1x4g n ASN 82 N -5.40 0.81 0.00 0.57 2.85 0.17 0.68 115.26 114.93 1x4g n ASN 82 Ca 0.23 -0.95 0.00 0.00 -0.11 0.00 0.00 54.58 53.75 1x4g n ASN 82 Cb 0.76 -1.27 0.00 0.00 1.24 0.00 0.00 39.78 40.52 1x4g n ASN 82 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1x4g n GLY 83 N 6.30 1.50 3.99 8.20 0.00 -1.24 -4.67 105.19 119.26 1x4g n GLY 83 Ca 0.53 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.36 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 -2.00 3.46 -0.27 2.61 -4.23 0.21 -4.98 115.64 110.44 1x4g s THR 84 Ca 0.00 -0.85 0.02 0.00 -1.18 0.00 0.00 61.69 59.69 1x4g s THR 84 Cb 0.00 -3.22 0.07 0.00 1.34 0.00 0.00 72.50 70.70 1x4g s THR 84 CO 0.00 -0.11 -0.05 -0.89 -0.54 0.00 0.00 174.62 173.03 1x4g s THR 85 N -2.41 1.98 -0.32 3.99 2.01 -1.26 -1.91 115.64 117.72 1x4g s THR 85 Ca 0.51 -1.68 -0.10 0.00 0.31 0.00 0.00 61.69 60.73 1x4g s THR 85 Cb -0.10 -2.22 -0.00 0.00 0.01 0.00 0.00 72.50 70.19 1x4g s THR 85 CO 0.34 -0.20 0.16 -0.63 -0.69 0.00 0.00 174.62 173.60 1x4g s ILE 86 N 1.15 4.60 -1.34 1.82 1.01 -0.01 -4.47 121.20 123.95 1x4g s ILE 86 Ca -0.03 -0.49 -0.08 0.00 0.00 0.00 0.00 60.65 60.04 1x4g s ILE 86 Cb -0.19 -3.38 0.01 0.00 0.01 0.00 0.00 42.46 38.90 1x4g s ILE 86 CO -0.07 0.02 1.12 -0.62 0.00 0.00 0.00 174.94 175.39 1x4g n GLU 87 N 4.98 -7.61 -1.16 2.79 -0.58 -1.26 -1.35 120.64 116.45 1x4g n GLU 87 Ca -0.13 0.82 -0.06 0.00 -0.42 0.00 0.00 57.16 57.37 1x4g n GLU 87 Cb 0.49 -5.81 -0.02 0.00 -0.57 0.00 0.00 31.44 25.52 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 -1.95 0.76 3.05 0.62 0.00 -1.26 -4.99 105.19 101.42 1x4g n GLY 88 Ca 0.00 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.00 2.32 -0.23 1.61 3.76 -0.45 -5.09 115.29 115.21 1x4g s HIS 89 Ca 0.00 -1.30 -0.29 0.00 -0.15 0.00 0.00 55.06 53.32 1x4g s HIS 89 Cb 0.00 -1.67 -0.03 0.00 1.11 0.00 0.00 32.58 31.99 1x4g s HIS 89 CO 0.00 -0.68 1.83 0.54 -0.85 0.00 0.00 174.74 175.57 1x4g s VAL 90 N 1.36 3.42 0.25 -0.90 0.11 -1.26 -0.83 120.40 122.55 1x4g s VAL 90 Ca 0.03 0.46 -0.19 0.00 -2.93 0.00 0.00 61.98 59.35 1x4g s VAL 90 Cb -0.13 -3.48 -0.09 0.00 -1.53 0.00 0.00 36.38 31.15 1x4g s VAL 90 CO -0.10 -0.25 0.75 0.68 -3.33 0.00 0.00 175.10 172.86 1x4g s VAL 91 N 6.25 4.55 -0.24 2.04 -7.23 -0.80 -4.08 120.40 120.88 1x4g s VAL 91 Ca 0.81 1.28 0.01 0.00 -1.81 0.00 0.00 61.98 62.27 1x4g s VAL 91 Cb -0.27 -3.82 0.04 0.00 0.56 0.00 0.00 36.38 32.88 1x4g s VAL 91 CO 0.33 0.12 -0.10 -0.54 -0.31 0.00 0.00 175.10 174.60 1x4g s LYS 92 N -2.19 2.58 -0.32 4.82 1.02 0.61 -3.67 119.74 122.59 1x4g s LYS 92 Ca 0.46 -1.13 -0.12 0.00 0.02 0.00 0.00 55.97 55.20 1x4g s LYS 92 Cb -0.16 -2.88 -0.03 0.00 -0.52 0.00 0.00 37.83 34.24 1x4g s LYS 92 CO 0.20 -0.45 0.22 0.00 -0.92 0.00 0.00 175.35 174.40 1x4g n TYR 94 N 5.09 0.03 -3.16 0.00 4.01 -0.23 -4.75 117.16 118.14 1x4g n TYR 94 Ca -0.13 -2.45 -0.45 0.00 -0.16 0.00 0.00 57.90 54.71 1x4g n TYR 94 Cb 0.50 0.03 -0.01 0.00 -0.31 0.00 0.00 39.34 39.55 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 -3.01 3.65 0.10 -0.72 0.52 -1.26 -0.56 118.94 117.66 1x4g s TRP 95 Ca 0.21 -1.98 -0.33 0.00 0.02 0.00 0.00 56.10 54.02 1x4g s TRP 95 Cb 0.01 -4.03 -0.18 0.00 -1.15 0.00 0.00 33.47 28.13 1x4g s TRP 95 CO 0.15 -1.18 0.76 0.41 0.02 0.00 0.00 176.95 177.10 1x4g n GLY 96 N 4.17 -1.03 0.70 0.98 0.00 -1.20 -4.87 105.19 103.94 1x4g n GLY 96 Ca 0.22 0.52 -0.09 0.00 0.00 0.00 0.00 46.02 46.68 1x4g n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x4g n LYS 97 N 1.20 0.20 -0.67 1.61 4.01 -1.26 -4.48 118.16 118.78 1x4g n LYS 97 Ca 0.18 0.09 0.00 0.00 -0.51 0.00 0.00 58.31 58.07 1x4g n LYS 97 Cb 0.17 -0.84 0.00 0.00 -0.51 0.00 0.00 35.03 33.85 1x4g n LYS 97 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 1x4g n GLU 98 N -3.54 -0.91 -0.01 1.97 2.13 -1.26 -4.87 120.64 114.15 1x4g n GLU 98 Ca -0.16 0.98 -0.13 0.00 0.66 0.00 0.00 57.16 58.51 1x4g n GLU 98 Cb 0.52 -0.70 -0.08 0.00 0.27 0.00 0.00 31.44 31.45 1x4g n GLU 98 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 1x4g h SER 99 N 0.67 -1.47 -3.63 4.31 0.02 -2.05 -3.41 113.55 107.99 1x4g h SER 99 Ca 0.00 0.17 -0.52 0.00 -0.84 0.00 0.00 61.79 60.60 1x4g h SER 99 Cb 0.00 0.57 0.04 0.00 0.14 0.00 0.00 62.40 63.15 1x4g h SER 99 CO 0.00 -0.41 0.61 -2.16 -1.14 0.00 0.00 176.83 173.73 1x4g s PRO 100 N -5.29 4.43 -0.05 3.45 0.04 -1.26 -4.97 135.00 131.35 1x4g s PRO 100 Ca -0.13 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.73 1x4g s PRO 100 Cb 0.06 -3.15 -0.29 0.00 0.04 0.00 0.00 34.50 31.15 1x4g s PRO 100 CO 0.52 -0.13 0.91 -0.44 0.04 0.00 0.00 177.00 177.89 1x4g h ASP 101 N 4.41 0.40 -4.46 6.66 5.19 -1.93 -3.49 116.42 123.20 1x4g h ASP 101 Ca -0.46 -0.93 0.20 0.00 -0.62 0.00 0.00 57.03 55.21 1x4g h ASP 101 Cb 1.22 -0.13 -0.17 0.00 0.18 0.00 0.00 39.33 40.43 1x4g h ASP 101 CO 0.71 1.30 0.68 -0.04 -3.12 0.00 0.00 179.24 178.77 1x4g s MET 102 N -2.52 0.54 -0.21 3.56 -1.94 -1.26 -5.09 119.30 112.38 1x4g s MET 102 Ca -0.14 -0.20 -0.29 0.00 -1.71 0.00 0.00 55.69 53.34 1x4g s MET 102 Cb 0.01 0.24 -0.04 0.00 2.01 0.00 0.00 34.83 37.05 1x4g s MET 102 CO 0.81 -0.24 1.77 0.95 -0.01 0.00 0.00 175.02 178.30 1x4g s THR 103 N -2.72 3.49 0.00 2.05 -4.23 -1.26 -3.76 115.64 109.21 1x4g s THR 103 Ca 0.08 0.55 0.00 0.00 -1.18 0.00 0.00 61.69 61.13 1x4g s THR 103 Cb -0.01 -3.52 0.00 0.00 1.34 0.00 0.00 72.50 70.31 1x4g s THR 103 CO -0.06 -0.24 0.00 -0.24 -0.54 0.00 0.00 174.62 173.54 1x4g n SER 104 N 9.05 0.00 0.00 3.99 2.88 -1.26 -4.89 113.62 123.39 1x4g n SER 104 Ca 0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 1x4g n SER 104 Cb 0.45 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 1x4g n SER 104 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x4g n GLY 105 N 0.00 -0.26 0.00 0.46 0.00 -1.25 -4.59 105.19 99.56 1x4g n GLY 105 Ca 0.00 -1.66 0.07 0.00 0.00 0.00 0.00 46.02 44.44 1x4g n GLY 105 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4g n PRO 106 N -0.02 0.17 -2.98 1.61 -0.04 -1.26 -4.92 135.00 127.55 1x4g n PRO 106 Ca 0.00 0.16 -0.08 0.00 -0.04 0.00 0.00 63.50 63.55 1x4g n PRO 106 Cb 0.00 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 31.97 1x4g n PRO 106 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x4g n SER 107 N -1.32 -7.69 -3.18 3.54 7.64 -1.26 -5.05 113.62 106.30 1x4g n SER 107 Ca 0.06 0.25 0.04 0.00 1.01 0.00 0.00 58.87 60.24 1x4g n SER 107 Cb 0.13 -5.06 -0.02 0.00 -1.01 0.00 0.00 64.21 58.25 1x4g n SER 107 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x4g s SER 108 N -2.69 -0.95 0.00 6.43 1.04 -1.26 -5.31 113.70 110.96 1x4g s SER 108 Ca 0.17 0.65 0.00 0.00 0.48 0.00 0.00 55.95 57.24 1x4g s SER 108 Cb -0.04 1.82 0.00 0.00 0.10 0.00 0.00 66.02 67.90 1x4g s SER 108 CO 0.77 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.43