#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 0.28 -0.29 1.61 1.04 -1.26 -5.14 113.70 109.95 1x4g s SER 2 Ca 0.00 -0.75 -0.00 0.00 0.48 0.00 0.00 55.95 55.68 1x4g s SER 2 Cb 0.00 0.25 0.14 0.00 0.10 0.00 0.00 66.02 66.50 1x4g s SER 2 CO 0.00 -0.60 0.31 -0.55 0.98 0.00 0.00 173.24 173.38 1x4g s SER 3 N -2.63 1.48 0.69 7.02 0.15 -1.26 -5.15 113.70 114.00 1x4g s SER 3 Ca 0.02 -0.69 0.00 0.00 0.70 0.00 0.00 55.95 55.98 1x4g s SER 3 Cb 0.04 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 64.94 1x4g s SER 3 CO -0.08 -0.38 0.00 0.61 1.20 0.00 0.00 173.24 174.58 1x4g n GLY 4 N 5.32 -0.68 3.13 9.45 0.00 -1.26 -4.77 105.19 116.37 1x4g n GLY 4 Ca -0.02 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.29 1x4g n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x4g n SER 5 N -2.36 -6.66 -3.47 1.61 3.41 -1.26 -4.98 113.62 99.91 1x4g n SER 5 Ca 0.00 0.49 -0.24 0.00 -0.26 0.00 0.00 58.87 58.86 1x4g n SER 5 Cb 0.00 -1.54 -0.12 0.00 -0.26 0.00 0.00 64.21 62.29 1x4g n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1x4g s SER 6 N -0.81 2.62 0.00 4.04 0.01 -1.26 -5.00 113.70 113.30 1x4g s SER 6 Ca 0.00 -1.25 0.00 0.00 1.31 0.00 0.00 55.95 56.01 1x4g s SER 6 Cb 0.00 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.25 1x4g s SER 6 CO 0.00 -0.39 0.00 0.61 0.41 0.00 0.00 173.24 173.87 1x4g n GLY 7 N 5.03 -1.84 3.24 3.44 0.00 -1.26 -5.17 105.19 108.63 1x4g n GLY 7 Ca -0.01 0.87 -0.13 0.00 0.00 0.00 0.00 46.02 46.75 1x4g n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1x4g s ASN 8 N 0.00 -0.34 0.28 1.61 2.47 -1.26 -5.04 114.94 112.66 1x4g s ASN 8 Ca 0.00 0.64 0.08 0.00 0.42 0.00 0.00 52.86 54.00 1x4g s ASN 8 Cb 0.00 0.67 0.40 0.00 -1.45 0.00 0.00 41.25 40.87 1x4g s ASN 8 CO 0.00 -0.15 1.65 0.71 -3.72 0.00 0.00 177.10 175.59 1x4g h THR 9 N 4.52 1.37 -2.75 -5.21 1.35 -2.05 -3.49 112.91 106.66 1x4g h THR 9 Ca -0.27 -1.80 0.30 0.00 -0.55 0.00 0.00 66.41 64.09 1x4g h THR 9 Cb 1.18 1.92 -0.07 0.00 -1.73 0.00 0.00 68.15 69.45 1x4g h THR 9 CO 0.30 0.53 -0.39 0.29 -0.25 0.00 0.00 175.52 175.99 1x4g n LYS 10 N -3.92 -2.20 -0.14 4.72 4.01 -1.26 -4.93 118.16 114.43 1x4g n LYS 10 Ca -0.02 1.45 0.02 0.00 -0.51 0.00 0.00 58.31 59.25 1x4g n LYS 10 Cb 0.55 -2.69 -0.00 0.00 -0.51 0.00 0.00 35.03 32.38 1x4g n LYS 10 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1x4g n GLN 11 N -3.55 -0.28 -3.86 1.97 0.00 -1.26 -4.73 117.38 105.66 1x4g n GLN 11 Ca 0.01 0.19 -0.34 0.00 0.00 0.00 0.00 57.00 56.85 1x4g n GLN 11 Cb 0.50 -0.34 -0.05 0.00 0.00 0.00 0.00 30.24 30.35 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 0.00 4.37 0.03 2.61 1.43 -1.26 -5.06 118.68 120.80 1x4g s LEU 12 Ca 0.00 0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 1x4g s LEU 12 Cb 0.00 -2.60 -0.05 0.00 0.03 0.00 0.00 46.19 43.57 1x4g s LEU 12 CO 0.00 0.27 1.28 -0.13 0.23 0.00 0.00 176.35 177.99 1x4g s ARG 13 N -1.83 4.36 0.56 1.70 1.81 -1.26 -4.76 118.95 119.53 1x4g s ARG 13 Ca 0.27 1.84 0.28 0.00 -1.72 0.00 0.00 55.73 56.40 1x4g s ARG 13 Cb -0.13 -3.43 1.47 0.00 -0.45 0.00 0.00 34.95 32.42 1x4g s ARG 13 CO 0.17 -0.40 1.95 0.35 -0.68 0.00 0.00 175.30 176.70 1x4g h PHE 14 N 7.18 0.00 0.00 -0.53 3.04 -1.97 0.35 116.94 125.00 1x4g h PHE 14 Ca -0.39 0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.50 1x4g h PHE 14 Cb 1.19 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.70 1x4g h PHE 14 CO 0.70 0.00 -0.25 0.93 -2.02 0.00 0.00 178.31 177.67 1x4g h GLU 15 N 0.00 0.00 0.00 1.11 5.08 -1.94 -0.81 114.58 118.02 1x4g h GLU 15 Ca 0.25 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.46 1x4g h GLU 15 Cb 1.12 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.35 1x4g h GLU 15 CO -0.00 0.25 -0.78 0.22 -1.00 0.00 0.00 179.01 177.70 1x4g h ASP 16 N 0.00 0.00 -0.17 1.42 1.82 -0.71 -3.36 116.42 115.42 1x4g h ASP 16 Ca -0.00 -0.69 0.02 0.00 -0.39 0.00 0.00 57.03 55.97 1x4g h ASP 16 Cb 0.49 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.49 1x4g h ASP 16 CO 0.03 1.30 0.12 0.58 -1.61 0.00 0.00 179.24 179.67 1x4g h VAL 17 N -1.00 0.99 -0.14 2.25 2.07 -1.38 -1.89 116.25 117.14 1x4g h VAL 17 Ca -0.22 -0.05 -0.10 0.00 0.82 0.00 0.00 66.70 67.16 1x4g h VAL 17 Cb 1.19 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.76 1x4g h VAL 17 CO -0.13 0.02 0.12 0.55 0.02 0.00 0.00 177.57 178.16 1x4g n VAL 18 N -4.51 2.19 0.00 2.57 3.14 -0.31 -3.56 118.33 117.86 1x4g n VAL 18 Ca 0.00 -0.82 0.00 0.00 -2.96 0.00 0.00 64.34 60.56 1x4g n VAL 18 Cb 0.16 -1.43 0.00 0.00 -1.06 0.00 0.00 33.84 31.51 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 1.11 0.00 -0.33 6.55 2.85 -0.86 -4.97 115.26 119.62 1x4g n ASN 19 Ca 0.09 0.00 0.05 0.00 -0.11 0.00 0.00 54.58 54.61 1x4g n ASN 19 Cb 0.53 0.00 0.12 0.00 1.24 0.00 0.00 39.78 41.67 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 -0.83 -0.09 -4.19 1.20 6.02 -0.77 -4.35 117.38 114.37 1x4g n GLN 20 Ca 0.00 1.42 -0.29 0.00 -0.01 0.00 0.00 57.00 58.11 1x4g n GLN 20 Cb 0.00 -2.11 -0.09 0.00 1.02 0.00 0.00 30.24 29.06 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 -5.24 4.66 0.53 1.08 0.01 -1.26 -5.09 113.70 108.39 1x4g s SER 21 Ca -0.14 -0.33 -0.19 0.00 1.31 0.00 0.00 55.95 56.60 1x4g s SER 21 Cb 0.24 -0.98 -0.09 0.00 0.21 0.00 0.00 66.02 65.40 1x4g s SER 21 CO 0.71 0.16 0.61 -1.20 0.41 0.00 0.00 173.24 173.92 1x4g n SER 22 N 0.50 -0.66 0.22 2.44 7.64 -1.26 -4.87 113.62 117.63 1x4g n SER 22 Ca -0.12 0.80 0.09 0.00 1.01 0.00 0.00 58.87 60.66 1x4g n SER 22 Cb 0.53 -1.19 0.49 0.00 -1.01 0.00 0.00 64.21 63.02 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 0.49 0.00 -0.12 1.43 0.13 -1.96 -3.10 132.00 128.87 1x4g h PRO 23 Ca -0.45 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.52 1x4g h PRO 23 Cb 1.39 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.53 1x4g h PRO 23 CO 0.49 0.25 -0.57 0.87 -0.23 0.00 0.00 178.00 178.81 1x4g h LYS 24 N 0.00 0.60 -4.58 0.86 1.79 -2.04 -3.41 116.57 109.79 1x4g h LYS 24 Ca -0.00 -0.48 -0.71 0.00 -2.18 0.00 0.00 60.65 57.27 1x4g h LYS 24 Cb 0.68 0.10 -0.21 0.00 -1.58 0.00 0.00 32.23 31.22 1x4g h LYS 24 CO 0.03 1.10 -0.06 1.21 -1.08 0.00 0.00 179.45 180.65 1x4g s ASN 25 N -6.78 6.19 -0.40 0.86 2.47 -1.17 -5.02 114.94 111.09 1x4g s ASN 25 Ca -0.12 -1.31 -0.05 0.00 0.42 0.00 0.00 52.86 51.80 1x4g s ASN 25 Cb 0.06 -2.26 0.09 0.00 -1.45 0.00 0.00 41.25 37.70 1x4g s ASN 25 CO 0.85 -0.90 0.20 0.00 -3.72 0.00 0.00 177.10 173.52 1x4g s THR 27 N 1.25 1.11 -0.26 0.00 2.01 -1.26 -2.87 115.64 115.61 1x4g s THR 27 Ca 0.05 -1.09 0.02 0.00 0.31 0.00 0.00 61.69 60.98 1x4g s THR 27 Cb -0.23 -1.03 0.07 0.00 0.01 0.00 0.00 72.50 71.32 1x4g s THR 27 CO -0.02 -0.06 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.11 1x4g s VAL 28 N -0.97 1.82 -0.48 3.82 1.01 0.95 -2.12 120.40 124.43 1x4g s VAL 28 Ca 0.01 -1.54 -0.24 0.00 0.00 0.00 0.00 61.98 60.20 1x4g s VAL 28 Cb -0.08 -2.09 0.03 0.00 0.00 0.00 0.00 36.38 34.24 1x4g s VAL 28 CO 0.02 -0.19 0.85 -0.47 0.00 0.00 0.00 175.10 175.31 1x4g s TYR 29 N 1.23 2.93 -0.37 5.22 6.14 0.91 -1.37 117.35 132.04 1x4g s TYR 29 Ca -0.03 0.16 -0.11 0.00 0.64 0.00 0.00 57.07 57.73 1x4g s TYR 29 Cb -0.19 -3.82 0.02 0.00 0.42 0.00 0.00 41.96 38.39 1x4g s TYR 29 CO -0.07 -1.09 0.21 0.00 0.64 0.00 0.00 175.55 175.23 1x4g s GLY 31 N 1.56 0.76 0.00 0.00 0.00 -0.30 0.90 107.32 110.24 1x4g s GLY 31 Ca 0.02 -0.48 0.00 0.00 0.00 0.00 0.00 44.72 44.26 1x4g s GLY 31 CO 0.07 -0.10 0.00 0.61 0.00 0.00 0.00 173.10 173.68 1x4g n GLY 32 N 3.43 0.65 3.75 0.20 0.00 -0.96 0.13 105.19 112.39 1x4g n GLY 32 Ca -0.20 0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 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 2.31 0.00 -0.61 1.01 -1.26 -4.77 121.20 117.88 1x4g s ILE 33 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.88 1x4g s ILE 33 Cb 0.00 -3.12 0.00 0.00 0.01 0.00 0.00 42.46 39.35 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 -0.94 1.92 -1.13 9.38 0.00 -1.26 -4.42 120.51 124.06 1x4g n ALA 34 Ca 0.10 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.60 1x4g n ALA 34 Cb 0.46 0.09 0.21 0.00 0.00 0.00 0.00 19.45 20.21 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 -1.61 3.09 -2.69 0.00 7.64 -1.26 -4.63 113.62 114.16 1x4g n SER 35 Ca 0.00 -3.22 -0.03 0.00 1.01 0.00 0.00 58.87 56.63 1x4g n SER 35 Cb 0.10 -0.53 0.12 0.00 -1.01 0.00 0.00 64.21 62.89 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 -0.92 1.85 3.41 0.23 0.00 -1.26 -5.09 105.19 103.41 1x4g n GLY 36 Ca 0.22 -0.25 -0.44 0.00 0.00 0.00 0.00 46.02 45.55 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 -3.86 5.48 -0.05 0.99 0.20 -1.26 -4.97 118.68 115.22 1x4g s LEU 37 Ca 0.14 -1.21 -0.02 0.00 0.69 0.00 0.00 54.13 53.73 1x4g s LEU 37 Cb 0.43 -2.18 0.04 0.00 -0.43 0.00 0.00 46.19 44.04 1x4g s LEU 37 CO -0.11 -0.60 0.10 0.42 -0.29 0.00 0.00 176.35 175.87 1x4g s THR 38 N 1.67 -0.05 0.26 3.68 -4.23 -1.26 -4.75 115.64 110.96 1x4g s THR 38 Ca 0.05 0.20 0.03 0.00 -1.18 0.00 0.00 61.69 60.78 1x4g s THR 38 Cb -0.23 -0.17 0.34 0.00 1.34 0.00 0.00 72.50 73.78 1x4g s THR 38 CO 0.08 0.08 1.27 -0.90 -0.54 0.00 0.00 174.62 174.61 1x4g n ASP 39 N 4.20 -0.07 -0.24 3.99 5.68 -1.26 0.19 116.55 129.04 1x4g n ASP 39 Ca -0.27 1.38 0.04 0.00 -0.50 0.00 0.00 54.79 55.44 1x4g n ASP 39 Cb 0.51 -0.51 0.17 0.00 -1.14 0.00 0.00 41.12 40.14 1x4g n ASP 39 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 1x4g h GLN 40 N 0.00 0.41 0.62 0.11 4.15 -1.98 0.29 115.11 118.71 1x4g h GLN 40 Ca 0.50 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.87 1x4g h GLN 40 Cb 1.07 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.67 1x4g h GLN 40 CO -0.75 0.27 -0.30 1.25 -1.93 0.00 0.00 178.83 177.36 1x4g h LEU 41 N 0.42 -0.71 -1.57 -2.39 5.85 0.17 0.14 115.31 117.21 1x4g h LEU 41 Ca 0.39 0.02 0.19 0.00 0.84 0.00 0.00 57.88 59.32 1x4g h LEU 41 Cb 0.58 0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.73 1x4g h LEU 41 CO -0.39 -0.51 0.57 0.24 -0.34 0.00 0.00 178.44 178.01 1x4g h MET 42 N -0.84 0.36 -0.08 1.25 2.86 -1.25 0.47 114.93 117.70 1x4g h MET 42 Ca -0.09 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.51 1x4g h MET 42 Cb 0.64 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.22 1x4g h MET 42 CO 0.14 0.24 -0.03 -0.09 1.06 0.00 0.00 176.91 178.23 1x4g h ARG 43 N 0.38 0.16 0.00 1.72 2.43 -0.19 -1.25 114.38 117.63 1x4g h ARG 43 Ca 0.43 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 59.45 1x4g h ARG 43 Cb 1.10 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.63 1x4g h ARG 43 CO -0.14 0.51 -0.38 0.37 -1.51 0.00 0.00 179.97 178.82 1x4g h GLN 44 N -0.20 0.00 -0.09 0.20 4.15 0.55 1.30 115.11 121.03 1x4g h GLN 44 Ca 0.02 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.35 1x4g h GLN 44 Cb 0.46 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 1x4g h GLN 44 CO 0.01 0.38 -0.30 1.15 -1.93 0.00 0.00 178.83 178.14 1x4g h THR 45 N 0.00 1.41 0.00 2.39 2.02 -0.04 -3.30 112.91 115.39 1x4g h THR 45 Ca -0.00 -1.66 0.00 0.00 0.77 0.00 0.00 66.41 65.51 1x4g h THR 45 Cb 0.87 2.25 0.00 0.00 -1.74 0.00 0.00 68.15 69.53 1x4g h THR 45 CO 0.05 0.48 -1.03 0.49 0.37 0.00 0.00 175.52 175.88 1x4g n PHE 46 N -4.43 0.22 -0.37 3.16 3.72 -0.48 -4.34 117.46 114.93 1x4g n PHE 46 Ca -0.08 0.06 -0.10 0.00 -0.05 0.00 0.00 57.45 57.28 1x4g n PHE 46 Cb 0.48 -0.39 -0.09 0.00 -0.94 0.00 0.00 39.48 38.54 1x4g n PHE 46 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1x4g h SER 47 N 0.00 -1.98 -0.07 4.37 0.02 0.16 -1.91 113.55 114.14 1x4g h SER 47 Ca 0.00 0.30 -0.03 0.00 -0.84 0.00 0.00 61.79 61.22 1x4g h SER 47 Cb 0.71 0.87 -0.00 0.00 0.14 0.00 0.00 62.40 64.12 1x4g h SER 47 CO 0.00 -0.22 -0.07 1.55 -1.14 0.00 0.00 176.83 176.95 1x4g h PRO 48 N -0.02 0.17 -1.90 3.45 0.13 -1.78 -3.13 132.00 128.92 1x4g h PRO 48 Ca 0.14 -0.09 0.55 0.00 -0.87 0.00 0.00 66.00 65.73 1x4g h PRO 48 Cb 0.39 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.44 1x4g h PRO 48 CO -0.85 0.61 1.39 1.19 -0.23 0.00 0.00 178.00 180.11 1x4g n PHE 49 N -4.71 0.00 0.00 1.56 3.72 -0.80 -4.79 117.46 112.44 1x4g n PHE 49 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1x4g n PHE 49 Cb 0.30 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.37 1x4g n PHE 49 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1x4g n GLY 50 N -1.89 -0.71 3.44 1.37 0.00 -0.79 -4.71 105.19 101.89 1x4g n GLY 50 Ca 0.43 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.69 1.95 -0.02 1.61 0.74 -1.26 -4.62 119.66 117.35 1x4g s GLN 51 Ca 0.00 -1.05 0.07 0.00 0.05 0.00 0.00 55.36 54.43 1x4g s GLN 51 Cb 0.00 -2.12 -0.02 0.00 1.10 0.00 0.00 33.01 31.97 1x4g s GLN 51 CO 0.00 0.52 -0.24 0.42 -0.55 0.00 0.00 175.29 175.44 1x4g s ILE 52 N -0.94 1.91 -0.18 -2.34 1.01 -1.26 -4.18 121.20 115.22 1x4g s ILE 52 Ca 0.14 -1.02 -0.04 0.00 0.00 0.00 0.00 60.65 59.73 1x4g s ILE 52 Cb -0.10 -1.59 -0.10 0.00 0.01 0.00 0.00 42.46 40.68 1x4g s ILE 52 CO 0.05 0.54 -0.19 0.23 0.00 0.00 0.00 174.94 175.57 1x4g n MET 53 N 2.57 0.41 -3.88 2.79 2.81 -0.97 -4.99 117.12 115.85 1x4g n MET 53 Ca -0.16 0.13 -0.13 0.00 -1.81 0.00 0.00 57.70 55.74 1x4g n MET 53 Cb 0.52 -1.25 -0.14 0.00 -0.71 0.00 0.00 33.22 31.64 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 -2.34 0.03 -0.09 0.03 -6.30 -1.26 -5.04 118.70 103.73 1x4g s GLU 54 Ca -0.24 0.01 0.00 0.00 -2.50 0.00 0.00 54.97 52.24 1x4g s GLU 54 Cb 0.08 -0.06 0.02 0.00 0.00 0.00 0.00 34.13 34.17 1x4g s GLU 54 CO 0.36 -0.02 -0.08 0.42 0.02 0.00 0.00 175.26 175.96 1x4g s ILE 55 N 0.14 0.98 -0.29 -3.70 1.01 -1.26 -2.70 121.20 115.38 1x4g s ILE 55 Ca -0.01 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.35 1x4g s ILE 55 Cb -0.02 -0.97 0.08 0.00 0.01 0.00 0.00 42.46 41.56 1x4g s ILE 55 CO -0.00 0.35 0.00 -0.13 0.00 0.00 0.00 174.94 175.15 1x4g s ARG 56 N 1.35 1.50 -0.25 2.79 1.81 -0.47 -4.95 118.95 120.73 1x4g s ARG 56 Ca -0.02 -1.37 -0.15 0.00 -1.72 0.00 0.00 55.73 52.47 1x4g s ARG 56 Cb -0.14 -2.74 -0.04 0.00 -0.45 0.00 0.00 34.95 31.58 1x4g s ARG 56 CO -0.04 -0.78 0.36 0.14 -0.68 0.00 0.00 175.30 174.30 1x4g s VAL 57 N 1.22 5.20 -0.85 3.52 -7.23 -1.26 0.39 120.40 121.38 1x4g s VAL 57 Ca 0.02 0.58 -0.04 0.00 -1.81 0.00 0.00 61.98 60.73 1x4g s VAL 57 Cb -0.19 -3.69 0.21 0.00 0.56 0.00 0.00 36.38 33.28 1x4g s VAL 57 CO -0.10 0.20 0.74 -0.36 -0.31 0.00 0.00 175.10 175.27 1x4g s PHE 58 N 1.77 3.82 -1.85 2.82 0.40 0.90 -4.88 117.98 120.95 1x4g s PHE 58 Ca 0.15 -2.85 0.15 0.00 -0.60 0.00 0.00 56.93 53.79 1x4g s PHE 58 Cb -0.15 -3.34 0.89 0.00 0.51 0.00 0.00 43.02 40.93 1x4g s PHE 58 CO 0.09 -0.80 1.36 -0.35 0.70 0.00 0.00 175.22 176.22 1x4g n PRO 59 N 2.74 0.42 -0.05 0.24 -0.04 -1.26 -0.43 135.00 136.61 1x4g n PRO 59 Ca 0.18 0.04 -0.01 0.00 -0.04 0.00 0.00 63.50 63.67 1x4g n PRO 59 Cb 0.38 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.19 1x4g n PRO 59 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1x4g n GLU 60 N -1.07 0.67 -0.08 0.54 1.02 -1.26 -4.51 120.64 115.94 1x4g n GLU 60 Ca 0.11 -0.05 -0.09 0.00 -0.02 0.00 0.00 57.16 57.11 1x4g n GLU 60 Cb 0.07 -1.55 -0.12 0.00 -0.02 0.00 0.00 31.44 29.82 1x4g n GLU 60 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1x4g n LYS 61 N -2.59 1.30 -0.02 3.49 4.76 -0.93 -5.02 118.16 119.15 1x4g n LYS 61 Ca -0.20 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1x4g n LYS 61 Cb 0.91 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.71 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 2.13 1.59 3.22 0.72 0.00 0.43 -5.05 105.19 108.23 1x4g n GLY 62 Ca -0.27 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 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 0.85 0.14 1.61 -0.85 -1.10 -2.26 117.35 113.73 1x4g s TYR 63 Ca 0.00 -1.17 -0.06 0.00 -0.52 0.00 0.00 57.07 55.32 1x4g s TYR 63 Cb 0.00 -0.40 -0.02 0.00 0.38 0.00 0.00 41.96 41.93 1x4g s TYR 63 CO 0.00 -0.62 0.18 0.45 -1.52 0.00 0.00 175.55 174.04 1x4g s SER 64 N -3.07 0.16 -0.05 -0.18 0.15 0.26 -0.07 113.70 110.90 1x4g s SER 64 Ca 0.28 -0.95 0.05 0.00 0.70 0.00 0.00 55.95 56.03 1x4g s SER 64 Cb 0.06 0.37 -0.01 0.00 -1.71 0.00 0.00 66.02 64.73 1x4g s SER 64 CO 0.05 -0.80 -0.22 -0.36 1.20 0.00 0.00 173.24 173.11 1x4g s PHE 65 N -3.97 2.13 -0.23 3.44 0.08 0.16 -1.82 117.98 117.76 1x4g s PHE 65 Ca 0.17 -0.63 -0.04 0.00 0.12 0.00 0.00 56.93 56.54 1x4g s PHE 65 Cb 0.05 -1.41 0.08 0.00 -0.57 0.00 0.00 43.02 41.17 1x4g s PHE 65 CO -0.02 -0.20 0.13 0.08 -0.10 0.00 0.00 175.22 175.11 1x4g s VAL 66 N -0.06 -0.11 -0.05 -0.44 1.01 -0.47 -1.37 120.40 118.91 1x4g s VAL 66 Ca -0.04 -0.42 -0.16 0.00 0.00 0.00 0.00 61.98 61.36 1x4g s VAL 66 Cb -0.13 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 1x4g s VAL 66 CO 0.03 -0.47 0.42 -0.13 0.00 0.00 0.00 175.10 174.95 1x4g s ARG 67 N 2.15 4.09 0.06 2.72 3.00 -1.10 -0.04 118.95 129.84 1x4g s ARG 67 Ca 0.06 0.40 0.05 0.00 0.00 0.00 0.00 55.73 56.24 1x4g s ARG 67 Cb -0.16 -3.31 -0.04 0.00 0.00 0.00 0.00 34.95 31.45 1x4g s ARG 67 CO -0.22 0.48 -0.06 -0.06 0.00 0.00 0.00 175.30 175.44 1x4g s PHE 68 N -0.40 2.86 -2.11 -0.53 0.40 -1.14 -2.29 117.98 114.76 1x4g s PHE 68 Ca 0.24 -0.08 0.17 0.00 -0.60 0.00 0.00 56.93 56.66 1x4g s PHE 68 Cb -0.16 -1.53 0.75 0.00 0.51 0.00 0.00 43.02 42.59 1x4g s PHE 68 CO 0.12 0.42 1.51 0.45 0.70 0.00 0.00 175.22 178.42 1x4g n SER 69 N 1.01 0.91 -3.38 1.36 2.88 -1.26 -4.61 113.62 110.53 1x4g n SER 69 Ca -0.14 -1.67 -0.13 0.00 -1.33 0.00 0.00 58.87 55.61 1x4g n SER 69 Cb 0.52 -0.07 -0.09 0.00 -0.75 0.00 0.00 64.21 63.82 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 -1.86 -0.51 0.49 2.46 -4.23 -1.26 -5.01 115.64 105.73 1x4g s THR 70 Ca 0.26 -0.24 0.40 0.00 -1.18 0.00 0.00 61.69 60.93 1x4g s THR 70 Cb 0.13 -0.88 0.61 0.00 1.34 0.00 0.00 72.50 73.70 1x4g s THR 70 CO 0.20 -0.26 1.57 1.57 -0.54 0.00 0.00 174.62 177.16 1x4g n HIS 71 N 5.34 0.41 0.28 3.99 -0.00 -1.26 -0.51 115.22 123.48 1x4g n HIS 71 Ca -0.03 0.41 -0.14 0.00 0.46 0.00 0.00 57.72 58.43 1x4g n HIS 71 Cb 0.49 -0.88 -0.07 0.00 -0.12 0.00 0.00 29.99 29.41 1x4g n HIS 71 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 1x4g h GLU 72 N 0.00 -0.79 -0.16 1.57 5.08 -1.96 -2.02 114.58 116.30 1x4g h GLU 72 Ca 0.91 0.05 0.03 0.00 -1.00 0.00 0.00 59.36 59.35 1x4g h GLU 72 Cb 3.25 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 32.64 1x4g h GLU 72 CO -0.28 -0.53 -0.37 0.77 -1.00 0.00 0.00 179.01 177.60 1x4g h SER 73 N -0.82 -1.21 -1.05 1.42 0.02 -1.12 0.53 113.55 111.32 1x4g h SER 73 Ca -0.07 0.15 0.39 0.00 -0.84 0.00 0.00 61.79 61.42 1x4g h SER 73 Cb 0.66 0.48 -0.16 0.00 0.14 0.00 0.00 62.40 63.52 1x4g h SER 73 CO 0.05 -0.31 0.60 0.00 -1.14 0.00 0.00 176.83 176.03 1x4g h ALA 74 N -0.58 2.20 -0.39 3.77 0.00 -1.54 0.86 119.26 123.56 1x4g h ALA 74 Ca 0.03 0.22 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 1x4g h ALA 74 Cb 0.44 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1x4g h ALA 74 CO -0.34 -0.91 -0.08 0.00 0.00 0.00 0.00 179.25 177.93 1x4g h ALA 75 N 1.89 0.54 -0.15 0.00 0.00 -0.17 -1.18 119.26 120.18 1x4g h ALA 75 Ca 0.81 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 55.41 1x4g h ALA 75 Cb 2.13 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.77 1x4g h ALA 75 CO -0.66 0.39 0.06 0.45 0.00 0.00 0.00 179.25 179.48 1x4g h HIS 76 N 0.56 0.24 -0.25 0.00 3.86 0.19 -0.85 115.15 118.89 1x4g h HIS 76 Ca 0.10 -0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.25 1x4g h HIS 76 Cb 0.59 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.97 1x4g h HIS 76 CO 0.05 0.33 -0.03 0.00 0.86 0.00 0.00 177.93 179.13 1x4g h ALA 77 N 0.89 1.47 0.44 2.45 0.00 -1.06 -2.74 119.26 120.70 1x4g h ALA 77 Ca 0.05 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1x4g h ALA 77 Cb 0.20 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1x4g h ALA 77 CO -0.00 0.38 -0.21 0.82 0.00 0.00 0.00 179.25 180.23 1x4g h ILE 78 N 0.38 0.27 -1.13 0.00 2.04 -0.94 0.56 117.51 118.69 1x4g h ILE 78 Ca 0.08 -0.59 0.31 0.00 1.00 0.00 0.00 64.86 65.67 1x4g h ILE 78 Cb 0.31 0.42 -0.07 0.00 -0.74 0.00 0.00 36.82 36.73 1x4g h ILE 78 CO 0.01 0.06 0.77 -0.37 0.00 0.00 0.00 178.15 178.62 1x4g h VAL 79 N -1.05 0.44 0.00 1.67 -1.51 -1.13 0.72 116.25 115.39 1x4g h VAL 79 Ca -0.06 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.35 1x4g h VAL 79 Cb 0.54 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 29.95 1x4g h VAL 79 CO 0.10 0.03 -0.09 0.28 -1.23 0.00 0.00 177.57 176.66 1x4g h SER 80 N 0.18 0.00 -0.50 4.19 0.02 -1.45 -3.38 113.55 112.61 1x4g h SER 80 Ca 0.59 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 61.69 1x4g h SER 80 Cb 1.95 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 64.47 1x4g h SER 80 CO -0.16 0.16 0.69 0.58 -1.14 0.00 0.00 176.83 176.96 1x4g h VAL 81 N -0.23 0.18 -0.54 2.27 2.07 0.28 -3.33 116.25 116.96 1x4g h VAL 81 Ca 0.00 0.00 -0.36 0.00 0.82 0.00 0.00 66.70 67.16 1x4g h VAL 81 Cb 0.09 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 1x4g h VAL 81 CO 0.00 0.00 1.13 0.21 0.02 0.00 0.00 177.57 178.93 1x4g s ASN 82 N -4.47 5.21 0.00 0.57 3.84 0.25 -1.98 114.94 118.36 1x4g s ASN 82 Ca -0.03 -1.60 0.00 0.00 0.21 0.00 0.00 52.86 51.43 1x4g s ASN 82 Cb 0.13 -2.58 0.00 0.00 -0.55 0.00 0.00 41.25 38.25 1x4g s ASN 82 CO 0.45 -2.87 0.00 0.61 -2.79 0.00 0.00 177.10 172.50 1x4g n GLY 83 N 5.92 1.16 3.93 1.21 0.00 -1.22 -4.81 105.19 111.38 1x4g n GLY 83 Ca 0.44 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.59 5.07 -0.32 2.61 -4.23 -0.84 -4.93 115.64 111.42 1x4g s THR 84 Ca 0.00 -0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.18 1x4g s THR 84 Cb 0.00 -3.86 0.07 0.00 1.34 0.00 0.00 72.50 70.06 1x4g s THR 84 CO 0.00 -0.60 0.02 -0.89 -0.54 0.00 0.00 174.62 172.61 1x4g s THR 85 N -2.38 2.69 -0.28 3.99 2.01 -1.26 -0.94 115.64 119.47 1x4g s THR 85 Ca 0.41 -1.78 -0.14 0.00 0.31 0.00 0.00 61.69 60.50 1x4g s THR 85 Cb -0.10 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 1x4g s THR 85 CO 0.37 -0.30 0.32 -0.63 -0.69 0.00 0.00 174.62 173.69 1x4g s ILE 86 N 1.12 5.21 -1.55 1.82 1.01 0.29 -4.26 121.20 124.83 1x4g s ILE 86 Ca -0.00 0.39 -0.04 0.00 0.00 0.00 0.00 60.65 61.00 1x4g s ILE 86 Cb -0.20 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.61 1x4g s ILE 86 CO -0.04 0.15 0.48 -0.62 0.00 0.00 0.00 174.94 174.91 1x4g n GLU 87 N 5.27 -4.17 -1.05 2.79 -0.58 -1.26 -0.84 120.64 120.80 1x4g n GLU 87 Ca -0.10 0.87 -0.02 0.00 -0.42 0.00 0.00 57.16 57.49 1x4g n GLU 87 Cb 0.51 -5.68 -0.01 0.00 -0.57 0.00 0.00 31.44 25.69 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 -1.39 0.54 3.05 0.62 0.00 -1.26 -5.02 105.19 101.74 1x4g n GLY 88 Ca -0.13 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.01 2.36 0.01 1.61 3.76 -0.02 -5.09 115.29 115.92 1x4g s HIS 89 Ca 0.00 -1.36 -0.30 0.00 -0.15 0.00 0.00 55.06 53.25 1x4g s HIS 89 Cb 0.00 -1.70 -0.07 0.00 1.11 0.00 0.00 32.58 31.92 1x4g s HIS 89 CO 0.00 -0.71 1.71 0.54 -0.85 0.00 0.00 174.74 175.42 1x4g s VAL 90 N 1.43 3.26 0.16 -0.90 0.11 -1.26 -0.55 120.40 122.65 1x4g s VAL 90 Ca 0.05 0.50 0.04 0.00 -2.93 0.00 0.00 61.98 59.64 1x4g s VAL 90 Cb -0.13 -3.32 -0.04 0.00 -1.53 0.00 0.00 36.38 31.36 1x4g s VAL 90 CO -0.11 -0.03 0.22 0.68 -3.33 0.00 0.00 175.10 172.53 1x4g s VAL 91 N 3.53 4.91 -0.12 2.04 -7.23 -0.11 -4.27 120.40 119.16 1x4g s VAL 91 Ca 0.76 -0.90 0.01 0.00 -1.81 0.00 0.00 61.98 60.04 1x4g s VAL 91 Cb -0.38 -3.53 0.02 0.00 0.56 0.00 0.00 36.38 33.05 1x4g s VAL 91 CO 0.33 -0.12 -0.13 -1.59 -0.31 0.00 0.00 175.10 173.28 1x4g s LYS 92 N -3.22 2.06 -0.28 4.82 -2.85 0.34 -3.43 119.74 117.16 1x4g s LYS 92 Ca 0.33 -0.49 -0.08 0.00 -1.00 0.00 0.00 55.97 54.73 1x4g s LYS 92 Cb -0.10 -1.84 -0.01 0.00 -2.06 0.00 0.00 37.83 33.81 1x4g s LYS 92 CO 0.26 -0.14 0.09 0.00 0.10 0.00 0.00 175.35 175.66 1x4g n TYR 94 N 4.92 0.25 -3.10 0.00 4.01 -0.17 -4.71 117.16 118.35 1x4g n TYR 94 Ca -0.15 -1.88 -0.45 0.00 -0.16 0.00 0.00 57.90 55.26 1x4g n TYR 94 Cb 0.50 -0.05 -0.02 0.00 -0.31 0.00 0.00 39.34 39.46 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 -2.59 3.47 -0.90 -0.72 0.52 -1.26 -0.06 118.94 117.40 1x4g s TRP 95 Ca 0.12 -1.78 -0.24 0.00 0.02 0.00 0.00 56.10 54.22 1x4g s TRP 95 Cb 0.01 -4.09 -0.22 0.00 -1.15 0.00 0.00 33.47 28.02 1x4g s TRP 95 CO 0.09 -1.26 2.35 0.41 0.02 0.00 0.00 176.95 178.55 1x4g n GLY 96 N 4.60 -0.44 2.94 0.98 0.00 -0.90 -4.78 105.19 107.59 1x4g n GLY 96 Ca 0.22 0.86 -0.04 0.00 0.00 0.00 0.00 46.02 47.06 1x4g n GLY 96 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x4g s LYS 97 N 7.81 0.93 -0.37 1.61 2.20 -1.26 -4.49 119.74 126.16 1x4g s LYS 97 Ca 1.22 -0.76 0.03 0.00 -0.36 0.00 0.00 55.97 56.10 1x4g s LYS 97 Cb -1.07 -0.11 0.15 0.00 -1.51 0.00 0.00 37.83 35.30 1x4g s LYS 97 CO 0.46 -1.26 0.35 -1.21 -0.36 0.00 0.00 175.35 173.32 1x4g s GLU 98 N 1.29 0.65 -0.49 4.03 0.41 -1.26 -5.00 118.70 118.33 1x4g s GLU 98 Ca 0.23 -1.05 -0.23 0.00 -0.41 0.00 0.00 54.97 53.50 1x4g s GLU 98 Cb -0.03 -0.88 0.03 0.00 -1.78 0.00 0.00 34.13 31.48 1x4g s GLU 98 CO -0.06 -1.22 0.55 -1.13 -0.49 0.00 0.00 175.26 172.92 1x4g n SER 99 N 4.07 -4.49 -4.69 -0.19 3.41 -1.26 -4.80 113.62 105.67 1x4g n SER 99 Ca 0.13 -0.37 -0.42 0.00 -0.26 0.00 0.00 58.87 57.94 1x4g n SER 99 Cb 0.44 -1.36 -0.03 0.00 -0.26 0.00 0.00 64.21 63.00 1x4g n SER 99 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1x4g s PRO 100 N -2.89 4.27 -0.62 4.33 0.04 -1.26 -4.87 135.00 134.00 1x4g s PRO 100 Ca 0.23 2.03 -0.37 0.00 0.04 0.00 0.00 61.00 62.92 1x4g s PRO 100 Cb -0.02 -3.56 -0.18 0.00 0.04 0.00 0.00 34.50 30.78 1x4g s PRO 100 CO 0.76 -0.59 2.34 -0.25 0.04 0.00 0.00 177.00 179.30 1x4g n ASP 101 N 5.32 0.97 -4.65 6.66 8.00 -1.26 -4.86 116.55 126.73 1x4g n ASP 101 Ca 0.13 0.40 -0.41 0.00 0.71 0.00 0.00 54.79 55.63 1x4g n ASP 101 Cb 0.43 -1.02 -0.06 0.00 -0.02 0.00 0.00 41.12 40.46 1x4g n ASP 101 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1x4g s MET 102 N 7.10 4.18 0.32 -1.24 -1.94 -1.26 -5.04 119.30 121.42 1x4g s MET 102 Ca 1.21 0.68 -0.28 0.00 -1.71 0.00 0.00 55.69 55.60 1x4g s MET 102 Cb -1.22 -3.61 -0.09 0.00 2.01 0.00 0.00 34.83 31.92 1x4g s MET 102 CO 0.55 -0.34 1.13 0.99 -0.01 0.00 0.00 175.02 177.33 1x4g s THR 103 N 2.26 3.37 0.21 2.05 2.01 -1.26 -5.04 115.64 119.25 1x4g s THR 103 Ca 0.30 1.30 -0.22 0.00 0.31 0.00 0.00 61.69 63.37 1x4g s THR 103 Cb -0.16 -3.79 0.05 0.00 0.01 0.00 0.00 72.50 68.61 1x4g s THR 103 CO 0.09 0.25 0.68 -0.94 -0.69 0.00 0.00 174.62 174.01 1x4g s SER 104 N -0.97 -0.40 1.06 3.53 1.04 -1.26 -5.18 113.70 111.52 1x4g s SER 104 Ca 0.49 -0.30 -0.04 0.00 0.48 0.00 0.00 55.95 56.57 1x4g s SER 104 Cb -0.31 0.65 0.07 0.00 0.10 0.00 0.00 66.02 66.53 1x4g s SER 104 CO 0.40 -1.14 0.22 0.61 0.98 0.00 0.00 173.24 174.32 1x4g n GLY 105 N -0.42 -2.73 3.60 7.32 0.00 -1.26 -4.90 105.19 106.81 1x4g n GLY 105 Ca -0.10 -1.42 -0.43 0.00 0.00 0.00 0.00 46.02 44.07 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 -3.51 3.44 -0.17 1.61 0.04 -1.26 -4.97 135.00 130.18 1x4g s PRO 106 Ca 0.15 1.34 -0.14 0.00 0.04 0.00 0.00 61.00 62.38 1x4g s PRO 106 Cb -0.02 -4.14 0.05 0.00 0.04 0.00 0.00 34.50 30.43 1x4g s PRO 106 CO 0.12 -1.73 0.45 -1.12 0.04 0.00 0.00 177.00 174.76 1x4g s SER 107 N 5.38 -0.49 0.29 6.66 0.01 -1.26 -5.04 113.70 119.25 1x4g s SER 107 Ca 0.75 0.92 0.00 0.00 1.31 0.00 0.00 55.95 58.93 1x4g s SER 107 Cb -0.21 0.90 0.00 0.00 0.21 0.00 0.00 66.02 66.93 1x4g s SER 107 CO 0.33 -0.17 0.00 -1.20 0.41 0.00 0.00 173.24 172.61 1x4g n SER 108 N 3.18 -2.65 0.00 2.44 7.64 -1.26 -5.19 113.62 117.78 1x4g n SER 108 Ca -0.16 0.75 0.00 0.00 1.01 0.00 0.00 58.87 60.48 1x4g n SER 108 Cb 0.57 2.64 0.00 0.00 -1.01 0.00 0.00 64.21 66.40 1x4g n SER 108 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64