#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 -0.12 0.01 1.61 0.15 -1.26 -5.09 113.70 109.00 1x4g s SER 2 Ca 0.00 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.57 1x4g s SER 2 Cb 0.00 0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1x4g s SER 2 CO 0.00 -0.32 0.00 -1.20 1.20 0.00 0.00 173.24 172.92 1x4g n SER 3 N -0.28 0.05 -1.40 5.45 7.64 -1.26 -5.14 113.62 118.68 1x4g n SER 3 Ca -0.04 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1x4g n SER 3 Cb 0.60 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1x4g n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4g n GLY 4 N 2.80 -2.79 0.09 0.23 0.00 -1.26 -4.99 105.19 99.27 1x4g n GLY 4 Ca 0.00 -0.42 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 1x4g n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1x4g h SER 5 N 0.00 0.20 -4.67 1.61 0.02 -2.08 -3.47 113.55 105.16 1x4g h SER 5 Ca 0.00 -0.70 -0.22 0.00 -0.84 0.00 0.00 61.79 60.02 1x4g h SER 5 Cb 0.00 -0.06 -0.15 0.00 0.14 0.00 0.00 62.40 62.33 1x4g h SER 5 CO 0.00 0.87 -0.69 -0.55 -1.14 0.00 0.00 176.83 175.33 1x4g s SER 6 N -6.19 1.07 0.00 3.07 0.15 -1.26 -5.07 113.70 105.47 1x4g s SER 6 Ca -0.16 -1.04 0.00 0.00 0.70 0.00 0.00 55.95 55.45 1x4g s SER 6 Cb 0.01 0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 1x4g s SER 6 CO 0.73 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 175.28 1x4g n GLY 7 N -0.07 -1.43 0.86 9.45 0.00 -1.26 -5.05 105.19 107.70 1x4g n GLY 7 Ca -0.11 -0.74 0.01 0.00 0.00 0.00 0.00 46.02 45.18 1x4g n GLY 7 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1x4g n ASN 8 N 0.00 0.21 -3.52 1.61 6.94 -1.26 -5.05 115.26 114.19 1x4g n ASN 8 Ca 0.00 -1.86 -0.00 0.00 -0.02 0.00 0.00 54.58 52.70 1x4g n ASN 8 Cb 0.00 -0.15 -0.04 0.00 -2.36 0.00 0.00 39.78 37.22 1x4g n ASN 8 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1x4g s THR 9 N 0.00 -0.65 -0.26 5.53 -1.32 -1.26 -5.14 115.64 112.54 1x4g s THR 9 Ca 0.11 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.57 1x4g s THR 9 Cb 0.12 -1.00 0.14 0.00 -1.51 0.00 0.00 72.50 70.25 1x4g s THR 9 CO -0.05 0.00 0.36 -0.54 -2.21 0.00 0.00 174.62 172.17 1x4g s LYS 10 N 2.53 0.34 -0.05 7.08 -0.14 -1.26 -5.14 119.74 123.10 1x4g s LYS 10 Ca -0.05 0.29 -0.31 0.00 -1.36 0.00 0.00 55.97 54.54 1x4g s LYS 10 Cb -0.08 -0.54 0.13 0.00 -1.68 0.00 0.00 37.83 35.65 1x4g s LYS 10 CO -0.18 -0.80 1.35 -1.14 -0.76 0.00 0.00 175.35 173.82 1x4g s GLN 11 N 2.49 0.23 -0.05 1.68 0.74 -1.26 -5.01 119.66 118.48 1x4g s GLN 11 Ca 0.11 -0.13 0.06 0.00 0.05 0.00 0.00 55.36 55.45 1x4g s GLN 11 Cb -0.14 0.07 -0.01 0.00 1.10 0.00 0.00 33.01 34.03 1x4g s GLN 11 CO -0.22 -0.11 -0.25 -0.51 -0.55 0.00 0.00 175.29 173.66 1x4g s LEU 12 N -3.13 2.06 0.03 3.68 1.43 -1.26 -5.09 118.68 116.39 1x4g s LEU 12 Ca 0.17 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.47 1x4g s LEU 12 Cb 0.05 -1.35 -0.07 0.00 0.03 0.00 0.00 46.19 44.85 1x4g s LEU 12 CO -0.05 0.25 1.67 -0.13 0.23 0.00 0.00 176.35 178.32 1x4g s ARG 13 N -0.21 4.19 0.34 1.70 1.81 -1.26 -4.78 118.95 120.74 1x4g s ARG 13 Ca -0.02 2.30 0.11 0.00 -1.72 0.00 0.00 55.73 56.41 1x4g s ARG 13 Cb -0.13 -3.76 0.92 0.00 -0.45 0.00 0.00 34.95 31.53 1x4g s ARG 13 CO 0.03 -0.78 1.75 0.35 -0.68 0.00 0.00 175.30 175.97 1x4g h PHE 14 N 8.84 0.92 0.00 -0.53 3.57 -1.98 0.72 116.94 128.48 1x4g h PHE 14 Ca -0.42 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.05 1x4g h PHE 14 Cb 1.20 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 1x4g h PHE 14 CO 0.82 0.10 -0.31 0.93 -2.23 0.00 0.00 178.31 177.62 1x4g h GLU 15 N 0.56 0.00 0.08 1.11 5.08 -1.95 -1.66 114.58 117.81 1x4g h GLU 15 Ca 0.62 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.70 1x4g h GLU 15 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 1x4g h GLU 15 CO -0.41 0.31 -1.34 0.22 -1.00 0.00 0.00 179.01 176.79 1x4g h ASP 16 N 0.00 0.27 0.39 1.42 3.58 -0.06 -3.31 116.42 118.72 1x4g h ASP 16 Ca -0.00 -0.34 -0.14 0.00 0.42 0.00 0.00 57.03 56.97 1x4g h ASP 16 Cb 0.60 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.55 1x4g h ASP 16 CO 0.04 1.28 -0.59 0.58 -2.88 0.00 0.00 179.24 177.66 1x4g h VAL 17 N 0.05 1.39 -0.12 2.25 2.07 -0.57 -2.99 116.25 118.34 1x4g h VAL 17 Ca -0.16 -1.97 -0.10 0.00 0.82 0.00 0.00 66.70 65.29 1x4g h VAL 17 Cb 1.95 2.00 -0.04 0.00 -1.52 0.00 0.00 31.29 33.68 1x4g h VAL 17 CO 0.16 0.58 0.03 1.33 0.02 0.00 0.00 177.57 179.68 1x4g n VAL 18 N -3.87 2.33 0.00 2.57 0.24 -0.65 -3.43 118.33 115.52 1x4g n VAL 18 Ca -0.02 -0.93 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 1x4g n VAL 18 Cb 0.61 -1.55 0.00 0.00 -1.47 0.00 0.00 33.84 31.43 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 1.43 0.00 -0.25 -1.34 3.02 -1.20 -4.95 115.26 111.96 1x4g n ASN 19 Ca 0.13 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.75 1x4g n ASN 19 Cb 0.58 0.00 0.14 0.00 -0.61 0.00 0.00 39.78 39.89 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 -1.07 -0.06 -4.49 3.52 6.02 -1.13 -4.40 117.38 115.76 1x4g n GLN 20 Ca 0.00 1.09 -0.24 0.00 -0.01 0.00 0.00 57.00 57.84 1x4g n GLN 20 Cb 0.00 -1.67 -0.10 0.00 1.02 0.00 0.00 30.24 29.49 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 -5.11 3.47 0.44 1.08 0.01 -1.26 -5.11 113.70 107.22 1x4g s SER 21 Ca -0.10 -1.13 -0.23 0.00 1.31 0.00 0.00 55.95 55.80 1x4g s SER 21 Cb 0.20 -0.29 -0.11 0.00 0.21 0.00 0.00 66.02 66.03 1x4g s SER 21 CO 0.55 -0.14 0.77 -1.20 0.41 0.00 0.00 173.24 173.64 1x4g n SER 22 N -0.68 0.14 -0.03 2.44 7.64 -1.26 -4.92 113.62 116.95 1x4g n SER 22 Ca -0.05 0.95 -0.13 0.00 1.01 0.00 0.00 58.87 60.65 1x4g n SER 22 Cb 0.62 -1.24 -0.09 0.00 -1.01 0.00 0.00 64.21 62.49 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 1.06 0.11 -0.90 1.43 0.13 -1.94 -3.22 132.00 128.68 1x4g h PRO 23 Ca -0.43 -0.06 0.21 0.00 -0.87 0.00 0.00 66.00 64.86 1x4g h PRO 23 Cb 1.37 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.38 1x4g h PRO 23 CO 0.54 0.57 0.43 1.57 -0.23 0.00 0.00 178.00 180.87 1x4g h LYS 24 N -0.34 0.45 -5.29 0.86 2.10 -2.03 -3.35 116.57 108.97 1x4g h LYS 24 Ca 0.01 -0.03 -0.66 0.00 -2.00 0.00 0.00 60.65 57.97 1x4g h LYS 24 Cb 0.55 -0.10 -0.16 0.00 -0.90 0.00 0.00 32.23 31.62 1x4g h LYS 24 CO 0.01 0.30 0.05 1.21 -2.00 0.00 0.00 179.45 179.01 1x4g s ASN 25 N -5.22 6.30 -0.35 7.07 2.47 -1.21 -5.02 114.94 118.97 1x4g s ASN 25 Ca -0.12 -0.36 -0.00 0.00 0.42 0.00 0.00 52.86 52.80 1x4g s ASN 25 Cb 0.25 -2.30 0.09 0.00 -1.45 0.00 0.00 41.25 37.84 1x4g s ASN 25 CO 0.78 -0.71 0.09 0.00 -3.72 0.00 0.00 177.10 173.54 1x4g s THR 27 N 1.09 1.25 -0.23 0.00 2.01 -1.26 -2.91 115.64 115.59 1x4g s THR 27 Ca 0.05 -1.64 -0.01 0.00 0.31 0.00 0.00 61.69 60.40 1x4g s THR 27 Cb -0.21 -1.44 0.07 0.00 0.01 0.00 0.00 72.50 70.93 1x4g s THR 27 CO -0.05 -0.40 0.02 -0.69 -0.69 0.00 0.00 174.62 172.82 1x4g s VAL 28 N -2.02 0.92 -0.26 3.82 1.01 0.10 -3.02 120.40 120.95 1x4g s VAL 28 Ca 0.07 -0.94 -0.21 0.00 0.00 0.00 0.00 61.98 60.90 1x4g s VAL 28 Cb -0.06 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.91 1x4g s VAL 28 CO 0.03 -0.27 0.66 -0.47 0.00 0.00 0.00 175.10 175.05 1x4g s TYR 29 N 1.66 3.28 -0.35 5.22 6.14 0.88 -1.62 117.35 132.56 1x4g s TYR 29 Ca -0.00 0.85 -0.08 0.00 0.64 0.00 0.00 57.07 58.48 1x4g s TYR 29 Cb -0.18 -2.90 0.04 0.00 0.42 0.00 0.00 41.96 39.34 1x4g s TYR 29 CO -0.11 -0.36 0.14 0.00 0.64 0.00 0.00 175.55 175.87 1x4g s GLY 31 N 1.45 1.28 0.00 0.00 0.00 0.17 -0.12 107.32 110.10 1x4g s GLY 31 Ca -0.01 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 43.80 1x4g s GLY 31 CO 0.04 -0.27 0.00 0.61 0.00 0.00 0.00 173.10 173.48 1x4g n GLY 32 N 3.57 1.26 3.76 0.20 0.00 -1.00 0.24 105.19 113.22 1x4g n GLY 32 Ca -0.19 -0.02 -0.36 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 2.79 0.00 -0.61 1.01 -1.26 -4.69 121.20 118.45 1x4g s ILE 33 Ca 0.00 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.18 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 -0.07 0.00 0.00 0.00 0.00 0.00 174.94 174.87 1x4g n ALA 34 N -1.21 1.60 0.86 9.38 0.00 -1.26 -4.12 120.51 125.75 1x4g n ALA 34 Ca 0.11 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.64 1x4g n ALA 34 Cb 0.49 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.84 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 -1.56 0.88 -2.41 0.00 7.64 -1.26 -4.48 113.62 112.43 1x4g n SER 35 Ca 0.00 -0.94 -0.14 0.00 1.01 0.00 0.00 58.87 58.80 1x4g n SER 35 Cb 0.00 0.99 0.03 0.00 -1.01 0.00 0.00 64.21 64.22 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 1.43 4.31 3.49 0.23 0.00 -1.26 -5.03 105.19 108.36 1x4g n GLY 36 Ca 0.04 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.65 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 -3.64 4.79 -0.07 0.99 0.20 -1.26 -4.97 118.68 114.71 1x4g s LEU 37 Ca 0.40 -0.59 -0.08 0.00 0.69 0.00 0.00 54.13 54.55 1x4g s LEU 37 Cb 0.38 -2.36 0.02 0.00 -0.43 0.00 0.00 46.19 43.79 1x4g s LEU 37 CO -0.01 -0.52 0.22 0.42 -0.29 0.00 0.00 176.35 176.17 1x4g s THR 38 N 2.08 0.01 0.28 3.68 -4.23 -1.26 -4.79 115.64 111.42 1x4g s THR 38 Ca 0.12 -0.09 0.01 0.00 -1.18 0.00 0.00 61.69 60.55 1x4g s THR 38 Cb -0.17 -0.34 0.28 0.00 1.34 0.00 0.00 72.50 73.61 1x4g s THR 38 CO 0.13 -0.05 1.68 -0.78 -0.54 0.00 0.00 174.62 175.06 1x4g h ASP 39 N 5.56 0.17 -0.84 3.99 1.82 -1.96 0.40 116.42 125.55 1x4g h ASP 39 Ca -0.26 0.16 0.11 0.00 -0.39 0.00 0.00 57.03 56.65 1x4g h ASP 39 Cb 1.19 0.19 -0.06 0.00 0.68 0.00 0.00 39.33 41.33 1x4g h ASP 39 CO 0.37 -0.05 0.55 -0.61 -1.61 0.00 0.00 179.24 177.89 1x4g h GLN 40 N 0.32 0.74 0.61 0.28 4.15 -1.98 0.15 115.11 119.39 1x4g h GLN 40 Ca 0.53 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.87 1x4g h GLN 40 Cb 1.00 -0.17 0.01 0.00 0.21 0.00 0.00 27.48 28.53 1x4g h GLN 40 CO -0.56 0.49 -0.29 1.25 -1.93 0.00 0.00 178.83 177.79 1x4g h LEU 41 N 0.76 -0.70 -1.23 -2.39 5.85 -0.58 0.69 115.31 117.72 1x4g h LEU 41 Ca 0.40 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.26 1x4g h LEU 41 Cb 0.50 0.18 -0.07 0.00 0.37 0.00 0.00 40.66 41.64 1x4g h LEU 41 CO -0.16 -0.39 0.58 0.24 -0.34 0.00 0.00 178.44 178.36 1x4g h MET 42 N -1.04 0.78 -0.06 1.25 2.86 -1.25 0.43 114.93 117.90 1x4g h MET 42 Ca -0.08 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 1x4g h MET 42 Cb 0.63 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 32.11 1x4g h MET 42 CO 0.14 0.51 -0.00 -0.09 1.06 0.00 0.00 176.91 178.53 1x4g h ARG 43 N 0.80 0.10 0.00 1.72 2.43 -0.67 0.41 114.38 119.17 1x4g h ARG 43 Ca 0.43 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.54 1x4g h ARG 43 Cb 0.55 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1x4g h ARG 43 CO -0.20 0.39 -0.15 0.37 -1.51 0.00 0.00 179.97 178.87 1x4g h GLN 44 N -0.19 0.00 0.21 0.20 4.15 -0.12 1.26 115.11 120.62 1x4g h GLN 44 Ca 0.02 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 59.12 1x4g h GLN 44 Cb 0.34 0.00 0.03 0.00 0.21 0.00 0.00 27.48 28.06 1x4g h GLN 44 CO 0.00 0.15 -1.44 1.15 -1.93 0.00 0.00 178.83 176.77 1x4g h THR 45 N 0.00 1.32 0.00 2.39 2.02 0.03 -3.33 112.91 115.33 1x4g h THR 45 Ca -0.00 -2.80 0.00 0.00 0.77 0.00 0.00 66.41 64.38 1x4g h THR 45 Cb 0.64 2.99 0.00 0.00 -1.74 0.00 0.00 68.15 70.04 1x4g h THR 45 CO 0.02 0.84 -1.18 0.49 0.37 0.00 0.00 175.52 176.06 1x4g n PHE 46 N -3.65 0.08 -0.23 3.16 3.72 0.12 -4.37 117.46 116.29 1x4g n PHE 46 Ca -0.15 0.02 -0.10 0.00 -0.05 0.00 0.00 57.45 57.17 1x4g n PHE 46 Cb 1.08 -0.25 -0.06 0.00 -0.94 0.00 0.00 39.48 39.31 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 -1.73 0.08 4.37 0.87 0.15 -0.26 113.55 117.04 1x4g h SER 47 Ca 0.00 0.26 -0.13 0.00 -1.23 0.00 0.00 61.79 60.69 1x4g h SER 47 Cb 0.67 0.76 -0.01 0.00 -0.44 0.00 0.00 62.40 63.38 1x4g h SER 47 CO 0.00 -0.34 -0.44 1.55 -0.53 0.00 0.00 176.83 177.07 1x4g h PRO 48 N -0.24 0.44 0.00 2.24 0.13 -1.79 -2.86 132.00 129.93 1x4g h PRO 48 Ca 0.15 -0.23 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1x4g h PRO 48 Cb 0.55 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.69 1x4g h PRO 48 CO -0.71 0.79 -0.01 0.74 -0.23 0.00 0.00 178.00 178.58 1x4g h PHE 49 N 0.36 0.00 0.00 1.56 0.04 -1.34 -3.47 116.94 114.09 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 0.92 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.07 1x4g h PHE 49 CO 0.03 0.01 0.00 0.41 -0.60 0.00 0.00 178.31 178.16 1x4g n GLY 50 N -1.02 -0.97 3.79 -1.45 0.00 -0.26 -4.73 105.19 100.55 1x4g n GLY 50 Ca -0.03 -1.39 -0.39 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.98 4.34 0.01 1.61 0.74 -1.26 -4.23 119.66 118.89 1x4g s GLN 51 Ca 0.00 0.87 0.04 0.00 0.05 0.00 0.00 55.36 56.33 1x4g s GLN 51 Cb 0.00 -3.28 -0.03 0.00 1.10 0.00 0.00 33.01 30.80 1x4g s GLN 51 CO 0.00 0.53 -0.11 0.42 -0.55 0.00 0.00 175.29 175.58 1x4g s ILE 52 N -0.83 3.32 -0.21 -2.34 1.01 -1.26 -3.75 121.20 117.14 1x4g s ILE 52 Ca 0.32 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 59.91 1x4g s ILE 52 Cb -0.20 -2.42 -0.08 0.00 0.01 0.00 0.00 42.46 39.77 1x4g s ILE 52 CO 0.21 0.39 -0.34 0.23 0.00 0.00 0.00 174.94 175.43 1x4g n MET 53 N 1.62 0.53 -4.14 2.79 2.81 -0.97 -4.98 117.12 114.79 1x4g n MET 53 Ca -0.16 0.22 -0.15 0.00 -1.81 0.00 0.00 57.70 55.80 1x4g n MET 53 Cb 0.52 -1.41 -0.13 0.00 -0.71 0.00 0.00 33.22 31.50 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 -2.69 0.59 -0.06 0.03 2.12 -1.25 -5.06 118.70 112.37 1x4g s GLU 54 Ca -0.32 -0.62 0.00 0.00 0.36 0.00 0.00 54.97 54.39 1x4g s GLU 54 Cb 0.09 -0.46 0.02 0.00 0.26 0.00 0.00 34.13 34.03 1x4g s GLU 54 CO 0.43 0.11 -0.04 0.42 -0.54 0.00 0.00 175.26 175.64 1x4g s ILE 55 N -0.95 0.55 -0.26 -3.70 1.01 -1.26 -2.95 121.20 113.63 1x4g s ILE 55 Ca -0.04 -0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.55 1x4g s ILE 55 Cb -0.08 -0.62 0.07 0.00 0.01 0.00 0.00 42.46 41.85 1x4g s ILE 55 CO 0.00 0.25 -0.05 -0.60 0.00 0.00 0.00 174.94 174.55 1x4g s ARG 56 N 1.31 1.75 -0.10 2.79 3.00 -0.08 -4.95 118.95 122.67 1x4g s ARG 56 Ca -0.05 -1.26 -0.12 0.00 -1.00 0.00 0.00 55.73 53.30 1x4g s ARG 56 Cb -0.14 -2.76 -0.05 0.00 0.00 0.00 0.00 34.95 32.01 1x4g s ARG 56 CO -0.02 -0.67 0.28 0.14 0.00 0.00 0.00 175.30 175.03 1x4g s VAL 57 N 1.23 5.28 -0.60 7.11 -7.23 -1.26 0.99 120.40 125.91 1x4g s VAL 57 Ca -0.03 0.53 0.04 0.00 -1.81 0.00 0.00 61.98 60.71 1x4g s VAL 57 Cb -0.19 -3.59 0.15 0.00 0.56 0.00 0.00 36.38 33.32 1x4g s VAL 57 CO -0.07 0.51 0.39 -0.36 -0.31 0.00 0.00 175.10 175.26 1x4g s PHE 58 N -0.43 3.10 -1.40 2.82 0.40 0.13 -4.92 117.98 117.68 1x4g s PHE 58 Ca 0.18 -3.12 0.15 0.00 -0.60 0.00 0.00 56.93 53.54 1x4g s PHE 58 Cb -0.14 -2.51 0.73 0.00 0.51 0.00 0.00 43.02 41.61 1x4g s PHE 58 CO 0.07 -0.65 1.41 -0.35 0.70 0.00 0.00 175.22 176.40 1x4g n PRO 59 N 2.53 0.19 -0.07 0.24 -0.04 -1.26 -0.41 135.00 136.18 1x4g n PRO 59 Ca 0.15 0.16 -0.06 0.00 -0.04 0.00 0.00 63.50 63.71 1x4g n PRO 59 Cb 0.35 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.15 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 -1.30 0.68 -0.08 0.54 0.28 -1.26 -4.46 120.64 115.04 1x4g n GLU 60 Ca 0.07 -0.02 -0.09 0.00 -0.16 0.00 0.00 57.16 56.96 1x4g n GLU 60 Cb 0.12 -1.55 -0.15 0.00 1.43 0.00 0.00 31.44 31.29 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 -2.68 0.67 -0.47 3.44 4.76 -0.99 -5.01 118.16 117.88 1x4g n LYS 61 Ca -0.25 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1x4g n LYS 61 Cb 1.03 -1.59 0.00 0.00 -1.84 0.00 0.00 35.03 32.62 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 1.68 1.58 3.65 0.72 0.00 0.46 -5.05 105.19 108.23 1x4g n GLY 62 Ca -0.28 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.02 0.47 0.29 1.61 -0.85 -1.04 -2.39 117.35 113.43 1x4g s TYR 63 Ca 0.00 -0.89 -0.07 0.00 -0.52 0.00 0.00 57.07 55.60 1x4g s TYR 63 Cb 0.00 0.34 -0.00 0.00 0.38 0.00 0.00 41.96 42.68 1x4g s TYR 63 CO 0.00 -1.23 0.44 0.45 -1.52 0.00 0.00 175.55 173.69 1x4g s SER 64 N -3.10 0.41 -0.03 -0.18 0.15 0.83 0.17 113.70 111.97 1x4g s SER 64 Ca 0.22 -1.26 0.02 0.00 0.70 0.00 0.00 55.95 55.63 1x4g s SER 64 Cb -0.02 0.60 0.01 0.00 -1.71 0.00 0.00 66.02 64.90 1x4g s SER 64 CO 0.13 -1.19 -0.08 -0.36 1.20 0.00 0.00 173.24 172.94 1x4g s PHE 65 N -3.54 0.88 -0.20 3.44 0.08 0.28 -2.50 117.98 116.41 1x4g s PHE 65 Ca 0.28 -0.22 -0.04 0.00 0.12 0.00 0.00 56.93 57.07 1x4g s PHE 65 Cb 0.00 -0.65 0.08 0.00 -0.57 0.00 0.00 43.02 41.89 1x4g s PHE 65 CO 0.15 -0.11 0.16 0.08 -0.10 0.00 0.00 175.22 175.40 1x4g s VAL 66 N 0.31 -0.21 -0.24 -0.44 1.01 -0.64 -0.91 120.40 119.29 1x4g s VAL 66 Ca -0.05 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 61.62 1x4g s VAL 66 Cb -0.09 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 1x4g s VAL 66 CO 0.00 -0.30 0.16 -0.13 0.00 0.00 0.00 175.10 174.84 1x4g s ARG 67 N 2.23 4.05 0.37 2.72 3.00 -1.15 0.03 118.95 130.19 1x4g s ARG 67 Ca 0.05 -0.28 0.01 0.00 0.00 0.00 0.00 55.73 55.51 1x4g s ARG 67 Cb -0.16 -3.54 -0.02 0.00 0.00 0.00 0.00 34.95 31.23 1x4g s ARG 67 CO -0.14 0.04 0.57 -0.06 0.00 0.00 0.00 175.30 175.71 1x4g s PHE 68 N 1.11 3.41 -0.29 -0.53 0.40 -1.15 -2.28 117.98 118.65 1x4g s PHE 68 Ca 0.07 0.27 0.28 0.00 -0.60 0.00 0.00 56.93 56.95 1x4g s PHE 68 Cb -0.14 -1.99 0.90 0.00 0.51 0.00 0.00 43.02 42.30 1x4g s PHE 68 CO 0.05 0.01 1.79 0.66 0.70 0.00 0.00 175.22 178.43 1x4g h SER 69 N 0.69 0.00 -4.47 1.36 4.64 -1.89 -3.44 113.55 110.44 1x4g h SER 69 Ca -0.49 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.53 1x4g h SER 69 Cb 1.23 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.17 1x4g h SER 69 CO 0.60 0.00 -0.66 0.42 -0.87 0.00 0.00 176.83 176.32 1x4g s THR 70 N -3.38 0.68 -0.24 2.95 -4.23 -1.26 -5.05 115.64 105.11 1x4g s THR 70 Ca 0.05 -1.99 0.21 0.00 -1.18 0.00 0.00 61.69 58.78 1x4g s THR 70 Cb 0.08 -2.22 0.03 0.00 1.34 0.00 0.00 72.50 71.74 1x4g s THR 70 CO 0.57 -0.39 1.12 -0.74 -0.54 0.00 0.00 174.62 174.64 1x4g h HIS 71 N 2.63 0.00 0.53 3.99 2.76 -1.88 -3.34 115.15 119.85 1x4g h HIS 71 Ca -0.37 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 57.77 1x4g h HIS 71 Cb 1.21 0.00 0.01 0.00 1.55 0.00 0.00 27.41 30.18 1x4g h HIS 71 CO 0.52 0.15 -0.26 0.93 -1.30 0.00 0.00 177.93 177.98 1x4g h GLU 72 N 0.00 -0.69 -0.05 5.26 5.08 -1.96 -2.40 114.58 119.81 1x4g h GLU 72 Ca -0.03 0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.40 1x4g h GLU 72 Cb 1.14 0.16 -0.06 0.00 0.50 0.00 0.00 28.75 30.49 1x4g h GLU 72 CO 0.01 -0.46 -0.54 1.03 -1.00 0.00 0.00 179.01 178.06 1x4g h SER 73 N -0.82 -1.68 -0.97 1.42 0.87 -1.85 -0.19 113.55 110.33 1x4g h SER 73 Ca -0.07 0.19 0.32 0.00 -1.23 0.00 0.00 61.79 61.00 1x4g h SER 73 Cb 0.55 0.65 -0.16 0.00 -0.44 0.00 0.00 62.40 62.99 1x4g h SER 73 CO 0.12 -0.51 0.41 0.00 -0.53 0.00 0.00 176.83 176.32 1x4g h ALA 74 N -0.38 1.75 -0.11 6.23 0.00 -1.68 1.24 119.26 126.30 1x4g h ALA 74 Ca 0.02 0.24 -0.12 0.00 0.00 0.00 0.00 54.91 55.05 1x4g h ALA 74 Cb 0.70 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1x4g h ALA 74 CO -0.39 -0.65 -0.47 0.00 0.00 0.00 0.00 179.25 177.74 1x4g h ALA 75 N 1.89 0.98 -0.21 0.00 0.00 -0.58 -1.71 119.26 119.63 1x4g h ALA 75 Ca 0.71 -0.46 -0.18 0.00 0.00 0.00 0.00 54.91 54.97 1x4g h ALA 75 Cb 1.64 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.34 1x4g h ALA 75 CO -0.71 0.64 -0.60 0.45 0.00 0.00 0.00 179.25 179.04 1x4g h HIS 76 N 0.23 0.91 -0.00 0.00 3.86 0.31 -2.06 115.15 118.39 1x4g h HIS 76 Ca 0.01 -0.34 -0.15 0.00 -1.16 0.00 0.00 60.37 58.74 1x4g h HIS 76 Cb 0.93 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.21 1x4g h HIS 76 CO 0.02 1.13 -0.69 0.00 0.86 0.00 0.00 177.93 179.26 1x4g h ALA 77 N 0.79 0.86 0.25 2.45 0.00 -0.69 -3.14 119.26 119.78 1x4g h ALA 77 Ca -0.00 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 1x4g h ALA 77 Cb 1.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1x4g h ALA 77 CO 0.12 0.85 -0.12 0.82 0.00 0.00 0.00 179.25 180.92 1x4g h ILE 78 N 0.01 0.50 -1.13 0.00 2.04 -1.25 0.22 117.51 117.89 1x4g h ILE 78 Ca -0.01 -0.91 0.32 0.00 1.00 0.00 0.00 64.86 65.26 1x4g h ILE 78 Cb 1.21 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 1x4g h ILE 78 CO 0.09 0.13 0.80 -0.37 0.00 0.00 0.00 178.15 178.79 1x4g h VAL 79 N -0.97 0.44 0.00 1.67 -1.51 -1.47 0.61 116.25 115.03 1x4g h VAL 79 Ca -0.03 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.41 1x4g h VAL 79 Cb 0.47 0.35 0.00 0.00 -2.13 0.00 0.00 31.29 29.97 1x4g h VAL 79 CO 0.06 0.02 -0.01 -1.28 -1.23 0.00 0.00 177.57 175.13 1x4g h SER 80 N 0.09 0.00 -0.93 4.19 0.87 -1.55 -3.38 113.55 112.83 1x4g h SER 80 Ca 0.56 0.00 0.27 0.00 -1.23 0.00 0.00 61.79 61.39 1x4g h SER 80 Cb 2.06 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 63.99 1x4g h SER 80 CO -0.08 0.01 0.88 0.58 -0.53 0.00 0.00 176.83 177.69 1x4g h VAL 81 N -0.01 0.23 -0.85 2.23 2.07 -0.45 -3.37 116.25 116.09 1x4g h VAL 81 Ca 0.00 0.00 -0.23 0.00 0.82 0.00 0.00 66.70 67.29 1x4g h VAL 81 Cb 0.01 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1x4g h VAL 81 CO 0.00 0.00 0.65 0.21 0.02 0.00 0.00 177.57 178.45 1x4g s ASN 82 N -4.54 4.58 0.00 0.57 2.47 0.21 -1.21 114.94 117.02 1x4g s ASN 82 Ca -0.04 -0.05 0.00 0.00 0.42 0.00 0.00 52.86 53.19 1x4g s ASN 82 Cb 0.18 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.43 1x4g s ASN 82 CO 0.61 -3.16 0.00 0.61 -3.72 0.00 0.00 177.10 171.45 1x4g n GLY 83 N 6.59 1.36 3.97 1.21 0.00 -1.24 -4.85 105.19 112.23 1x4g n GLY 83 Ca 0.40 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.21 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 4.16 -0.17 2.61 -4.23 -0.35 -4.97 115.64 110.69 1x4g s THR 84 Ca 0.00 -0.76 0.01 0.00 -1.18 0.00 0.00 61.69 59.76 1x4g s THR 84 Cb 0.00 -3.49 0.02 0.00 1.34 0.00 0.00 72.50 70.37 1x4g s THR 84 CO 0.00 -0.26 -0.20 -0.89 -0.54 0.00 0.00 174.62 172.74 1x4g s THR 85 N -2.33 2.01 -0.17 3.99 2.01 -1.26 -1.56 115.64 118.33 1x4g s THR 85 Ca 0.45 -0.91 0.00 0.00 0.31 0.00 0.00 61.69 61.54 1x4g s THR 85 Cb -0.10 -1.82 0.00 0.00 0.01 0.00 0.00 72.50 70.60 1x4g s THR 85 CO 0.34 0.53 -0.16 -0.63 -0.69 0.00 0.00 174.62 174.02 1x4g s ILE 86 N 1.28 2.54 -2.08 1.82 1.01 -0.28 -4.61 121.20 120.89 1x4g s ILE 86 Ca 0.04 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.89 1x4g s ILE 86 Cb -0.13 -2.08 0.00 0.00 0.01 0.00 0.00 42.46 40.26 1x4g s ILE 86 CO -0.12 0.51 0.00 -0.62 0.00 0.00 0.00 174.94 174.71 1x4g n GLU 87 N 4.30 -1.46 -0.59 2.79 -0.58 -1.26 -0.56 120.64 123.28 1x4g n GLU 87 Ca -0.20 1.16 0.00 0.00 -0.42 0.00 0.00 57.16 57.70 1x4g n GLU 87 Cb 0.51 -5.54 0.00 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 -0.41 0.65 3.05 0.62 0.00 -1.26 -5.05 105.19 102.79 1x4g n GLY 88 Ca -0.20 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.07 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 2.04 -0.32 1.61 3.76 0.27 -5.09 115.29 115.57 1x4g s HIS 89 Ca 0.00 -1.02 -0.28 0.00 -0.15 0.00 0.00 55.06 53.60 1x4g s HIS 89 Cb 0.00 -1.48 -0.03 0.00 1.11 0.00 0.00 32.58 32.18 1x4g s HIS 89 CO 0.00 -0.54 1.89 0.54 -0.85 0.00 0.00 174.74 175.78 1x4g s VAL 90 N 1.15 3.37 0.29 -0.90 0.11 -1.26 -1.13 120.40 122.03 1x4g s VAL 90 Ca -0.03 0.37 -0.21 0.00 -2.93 0.00 0.00 61.98 59.18 1x4g s VAL 90 Cb -0.14 -3.52 -0.09 0.00 -1.53 0.00 0.00 36.38 31.10 1x4g s VAL 90 CO -0.04 -0.34 0.81 0.68 -3.33 0.00 0.00 175.10 172.88 1x4g s VAL 91 N 7.32 4.46 -0.23 2.04 -7.23 -0.60 -4.01 120.40 122.14 1x4g s VAL 91 Ca 0.84 1.42 0.02 0.00 -1.81 0.00 0.00 61.98 62.45 1x4g s VAL 91 Cb -0.24 -3.84 0.05 0.00 0.56 0.00 0.00 36.38 32.90 1x4g s VAL 91 CO 0.33 0.08 -0.14 -0.54 -0.31 0.00 0.00 175.10 174.53 1x4g s LYS 92 N -2.26 2.45 -0.26 4.82 1.02 0.67 -3.67 119.74 122.52 1x4g s LYS 92 Ca 0.49 -1.18 -0.14 0.00 0.02 0.00 0.00 55.97 55.16 1x4g s LYS 92 Cb -0.16 -2.78 -0.04 0.00 -0.52 0.00 0.00 37.83 34.33 1x4g s LYS 92 CO 0.20 -0.46 0.32 0.00 -0.92 0.00 0.00 175.35 174.49 1x4g n TYR 94 N 5.12 -0.41 -3.14 0.00 4.01 0.09 -4.78 117.16 118.06 1x4g n TYR 94 Ca -0.10 -1.99 -0.45 0.00 -0.16 0.00 0.00 57.90 55.20 1x4g n TYR 94 Cb 0.51 0.16 -0.04 0.00 -0.31 0.00 0.00 39.34 39.66 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 -2.90 3.09 -0.27 -0.72 0.52 -1.26 -0.09 118.94 117.31 1x4g s TRP 95 Ca 0.25 -1.11 -0.35 0.00 0.02 0.00 0.00 56.10 54.92 1x4g s TRP 95 Cb 0.01 -4.00 -0.11 0.00 -1.15 0.00 0.00 33.47 28.22 1x4g s TRP 95 CO 0.18 -1.26 2.06 0.41 0.02 0.00 0.00 176.95 178.36 1x4g n GLY 96 N 5.19 0.81 1.32 0.98 0.00 -1.17 -4.57 105.19 107.75 1x4g n GLY 96 Ca -0.06 0.91 0.00 0.00 0.00 0.00 0.00 46.02 46.86 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 7.51 0.00 -1.45 1.61 4.81 -1.26 -4.50 118.16 124.88 1x4g n LYS 97 Ca 0.34 0.00 -0.48 0.00 -0.87 0.00 0.00 58.31 57.30 1x4g n LYS 97 Cb 0.25 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.27 1x4g n LYS 97 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1x4g n GLU 98 N -1.99 0.31 -4.10 1.64 -0.00 -1.26 -4.95 120.64 110.30 1x4g n GLU 98 Ca 0.00 0.11 -0.33 0.00 -0.00 0.00 0.00 57.16 56.94 1x4g n GLU 98 Cb 0.00 -1.22 -0.07 0.00 -0.00 0.00 0.00 31.44 30.15 1x4g n GLU 98 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 1x4g s SER 99 N -0.83 5.69 0.41 -1.84 1.04 -1.26 -5.01 113.70 111.90 1x4g s SER 99 Ca 0.64 0.15 0.20 0.00 0.48 0.00 0.00 55.95 57.43 1x4g s SER 99 Cb -0.90 -1.64 0.88 0.00 0.10 0.00 0.00 66.02 64.46 1x4g s SER 99 CO 0.57 0.27 1.83 1.55 0.98 0.00 0.00 173.24 178.44 1x4g h PRO 100 N 4.09 0.00 -3.21 4.02 0.13 -2.08 -3.39 132.00 131.56 1x4g h PRO 100 Ca -0.49 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.10 1x4g h PRO 100 Cb 1.18 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.91 1x4g h PRO 100 CO 0.62 0.30 -0.77 0.34 -0.23 0.00 0.00 178.00 178.27 1x4g s ASP 101 N -6.43 3.52 0.24 1.44 2.15 -1.26 -5.13 116.67 111.20 1x4g s ASP 101 Ca -0.01 -1.28 0.10 0.00 0.43 0.00 0.00 52.55 51.78 1x4g s ASP 101 Cb 0.12 -0.57 -0.04 0.00 -0.30 0.00 0.00 42.92 42.13 1x4g s ASP 101 CO 0.66 -0.40 -0.06 0.00 -0.17 0.00 0.00 175.17 175.20 1x4g s MET 102 N 1.89 2.14 -0.86 4.34 0.23 -1.26 -5.08 119.30 120.69 1x4g s MET 102 Ca 0.07 -1.41 -0.15 0.00 -1.03 0.00 0.00 55.69 53.18 1x4g s MET 102 Cb -0.17 -2.11 0.21 0.00 -1.53 0.00 0.00 34.83 31.23 1x4g s MET 102 CO -0.26 0.38 0.84 0.99 -2.03 0.00 0.00 175.02 174.95 1x4g s THR 103 N -2.13 5.48 -0.26 3.16 2.01 -1.26 -4.98 115.64 117.66 1x4g s THR 103 Ca 0.29 -2.36 -0.23 0.00 0.31 0.00 0.00 61.69 59.70 1x4g s THR 103 Cb -0.07 -4.53 0.07 0.00 0.01 0.00 0.00 72.50 67.98 1x4g s THR 103 CO 0.18 -1.11 0.68 -0.55 -0.69 0.00 0.00 174.62 173.12 1x4g s SER 104 N 2.37 -0.74 0.55 3.53 0.15 -1.26 -5.15 113.70 113.15 1x4g s SER 104 Ca 0.21 1.39 -0.21 0.00 0.70 0.00 0.00 55.95 58.04 1x4g s SER 104 Cb -0.09 1.39 -0.05 0.00 -1.71 0.00 0.00 66.02 65.57 1x4g s SER 104 CO -0.09 -0.24 1.35 -0.83 1.20 0.00 0.00 173.24 174.64 1x4g s GLY 105 N 0.51 2.89 1.02 9.45 0.00 -1.26 -5.00 107.32 114.93 1x4g s GLY 105 Ca -0.01 1.33 -0.13 0.00 0.00 0.00 0.00 44.72 45.91 1x4g s GLY 105 CO -0.01 1.84 1.09 2.56 0.00 0.00 0.00 173.10 178.58 1x4g s PRO 106 N -2.95 0.25 0.22 2.90 0.04 -1.26 -5.09 135.00 129.11 1x4g s PRO 106 Ca 0.72 0.46 -0.21 0.00 0.04 0.00 0.00 61.00 62.02 1x4g s PRO 106 Cb -0.40 -1.72 0.04 0.00 0.04 0.00 0.00 34.50 32.46 1x4g s PRO 106 CO 0.47 -2.84 0.64 -1.12 0.04 0.00 0.00 177.00 174.18 1x4g s SER 107 N -3.47 -0.36 0.23 6.66 0.01 -1.26 -5.15 113.70 110.36 1x4g s SER 107 Ca 0.66 -0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.53 1x4g s SER 107 Cb -0.18 0.65 0.00 0.00 0.21 0.00 0.00 66.02 66.70 1x4g s SER 107 CO 0.58 -1.16 0.00 -0.24 0.41 0.00 0.00 173.24 172.83 1x4g n SER 108 N -0.41 -4.01 0.00 2.44 2.88 -1.26 -5.34 113.62 107.93 1x4g n SER 108 Ca -0.09 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 57.93 1x4g n SER 108 Cb 0.62 -2.17 0.00 0.00 -0.75 0.00 0.00 64.21 61.91 1x4g n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42