#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 -0.77 -0.01 1.61 0.15 -1.26 -5.16 113.70 108.26 1x4g s SER 2 Ca 0.00 0.99 -0.16 0.00 0.70 0.00 0.00 55.95 57.48 1x4g s SER 2 Cb 0.00 1.84 0.03 0.00 -1.71 0.00 0.00 66.02 66.17 1x4g s SER 2 CO 0.00 -0.25 0.33 -0.55 1.20 0.00 0.00 173.24 173.97 1x4g s SER 3 N 2.76 -0.21 0.00 5.45 0.15 -1.26 -5.06 113.70 115.53 1x4g s SER 3 Ca 0.07 0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.82 1x4g s SER 3 Cb -0.14 0.33 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 1x4g s SER 3 CO -0.18 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 174.40 1x4g n GLY 4 N 1.20 0.30 2.47 9.45 0.00 -1.26 -5.13 105.19 112.22 1x4g n GLY 4 Ca -0.21 -0.46 -0.26 0.00 0.00 0.00 0.00 46.02 45.08 1x4g n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4g s SER 5 N 0.00 2.07 0.15 1.61 1.04 -1.26 -5.12 113.70 112.18 1x4g s SER 5 Ca 0.00 -2.46 -0.12 0.00 0.48 0.00 0.00 55.95 53.85 1x4g s SER 5 Cb 0.00 -0.26 0.01 0.00 0.10 0.00 0.00 66.02 65.87 1x4g s SER 5 CO 0.00 -0.24 0.33 -0.94 0.98 0.00 0.00 173.24 173.36 1x4g s SER 6 N 0.71 -0.04 0.41 7.02 1.04 -1.26 -5.17 113.70 116.41 1x4g s SER 6 Ca 0.24 -0.66 -0.08 0.00 0.48 0.00 0.00 55.95 55.93 1x4g s SER 6 Cb -0.11 0.45 -0.05 0.00 0.10 0.00 0.00 66.02 66.40 1x4g s SER 6 CO -0.08 -0.88 0.74 -0.83 0.98 0.00 0.00 173.24 173.17 1x4g s GLY 7 N -2.90 1.79 0.16 7.32 0.00 -1.26 -4.96 107.32 107.48 1x4g s GLY 7 Ca 0.11 -0.35 0.00 0.00 0.00 0.00 0.00 44.72 44.47 1x4g s GLY 7 CO -0.05 -0.18 0.00 -2.01 0.00 0.00 0.00 173.10 170.86 1x4g n ASN 8 N -1.52 -1.27 -4.37 1.64 2.85 -1.26 -5.09 115.26 106.24 1x4g n ASN 8 Ca 0.01 0.30 -0.38 0.00 -0.11 0.00 0.00 54.58 54.40 1x4g n ASN 8 Cb 0.54 1.45 -0.12 0.00 1.24 0.00 0.00 39.78 42.90 1x4g n ASN 8 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 1x4g s THR 9 N -2.00 4.23 0.23 -0.44 -4.23 -1.26 -5.08 115.64 107.09 1x4g s THR 9 Ca 0.00 -0.71 0.09 0.00 -1.18 0.00 0.00 61.69 59.89 1x4g s THR 9 Cb 0.00 -3.24 -0.05 0.00 1.34 0.00 0.00 72.50 70.56 1x4g s THR 9 CO 0.00 -0.02 -0.15 -0.54 -0.54 0.00 0.00 174.62 173.37 1x4g s LYS 10 N 1.53 1.44 0.04 3.99 -0.14 -1.26 -5.16 119.74 120.17 1x4g s LYS 10 Ca 0.02 -1.65 0.00 0.00 -1.36 0.00 0.00 55.97 52.98 1x4g s LYS 10 Cb -0.18 -1.28 -0.03 0.00 -1.68 0.00 0.00 37.83 34.66 1x4g s LYS 10 CO 0.04 0.21 -0.04 1.14 -0.76 0.00 0.00 175.35 175.94 1x4g s GLN 11 N -3.62 0.48 0.10 1.68 -2.07 -1.26 -4.64 119.66 110.33 1x4g s GLN 11 Ca 0.25 -0.87 0.03 0.00 -1.82 0.00 0.00 55.36 52.95 1x4g s GLN 11 Cb -0.01 0.05 -0.04 0.00 -1.09 0.00 0.00 33.01 31.92 1x4g s GLN 11 CO 0.09 -0.05 0.09 -0.51 -1.32 0.00 0.00 175.29 173.60 1x4g s LEU 12 N -2.04 3.81 0.01 2.60 1.43 -1.26 -5.08 118.68 118.15 1x4g s LEU 12 Ca -0.06 -0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.71 1x4g s LEU 12 Cb -0.03 -2.47 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 1x4g s LEU 12 CO -0.04 0.15 1.12 -0.13 0.23 0.00 0.00 176.35 177.69 1x4g s ARG 13 N -2.54 4.46 0.33 1.70 1.81 -1.26 -4.84 118.95 118.60 1x4g s ARG 13 Ca 0.30 1.63 0.10 0.00 -1.72 0.00 0.00 55.73 56.04 1x4g s ARG 13 Cb -0.12 -3.43 0.91 0.00 -0.45 0.00 0.00 34.95 31.87 1x4g s ARG 13 CO 0.22 -0.23 1.73 0.35 -0.68 0.00 0.00 175.30 176.70 1x4g h PHE 14 N 6.92 0.98 0.00 -0.53 3.57 -1.98 0.90 116.94 126.81 1x4g h PHE 14 Ca -0.40 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.08 1x4g h PHE 14 Cb 1.20 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 1x4g h PHE 14 CO 0.68 0.06 -0.26 0.93 -2.23 0.00 0.00 178.31 177.49 1x4g h GLU 15 N 0.56 0.00 0.00 1.11 5.08 -1.94 0.14 114.58 119.53 1x4g h GLU 15 Ca 0.65 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.84 1x4g h GLU 15 Cb 1.27 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 1x4g h GLU 15 CO -0.47 0.26 -1.00 0.22 -1.00 0.00 0.00 179.01 177.02 1x4g h ASP 16 N 0.00 0.00 0.35 1.42 3.58 0.33 -3.34 116.42 118.75 1x4g h ASP 16 Ca -0.00 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 57.12 1x4g h ASP 16 Cb 0.58 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.64 1x4g h ASP 16 CO 0.03 0.66 -1.56 0.58 -2.88 0.00 0.00 179.24 176.08 1x4g h VAL 17 N 0.00 1.16 0.00 2.25 2.07 -0.51 -3.16 116.25 118.06 1x4g h VAL 17 Ca -0.08 -2.72 -0.11 0.00 0.82 0.00 0.00 66.70 64.61 1x4g h VAL 17 Cb 1.58 2.85 -0.04 0.00 -1.52 0.00 0.00 31.29 34.15 1x4g h VAL 17 CO 0.07 0.84 -0.19 1.33 0.02 0.00 0.00 177.57 179.64 1x4g n VAL 18 N -3.57 2.34 0.00 2.57 0.24 0.00 -3.12 118.33 116.79 1x4g n VAL 18 Ca -0.18 -1.03 0.00 0.00 -2.04 0.00 0.00 64.34 61.09 1x4g n VAL 18 Cb 1.07 -1.77 0.00 0.00 -1.47 0.00 0.00 33.84 31.66 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 2.24 0.00 -0.26 -1.34 3.02 -1.26 -4.96 115.26 112.70 1x4g n ASN 19 Ca 0.25 0.00 0.23 0.00 -0.03 0.00 0.00 54.58 55.04 1x4g n ASN 19 Cb 0.68 0.00 0.43 0.00 -0.61 0.00 0.00 39.78 40.29 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 -0.84 -0.05 -4.59 3.52 6.02 -1.18 -4.22 117.38 116.03 1x4g n GLN 20 Ca 0.00 1.13 -0.25 0.00 -0.01 0.00 0.00 57.00 57.87 1x4g n GLN 20 Cb 0.00 -1.99 -0.14 0.00 1.02 0.00 0.00 30.24 29.13 1x4g n GLN 20 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1x4g s SER 21 N -4.68 2.46 0.42 1.08 0.15 -1.26 -5.11 113.70 106.75 1x4g s SER 21 Ca -0.08 -0.54 -0.13 0.00 0.70 0.00 0.00 55.95 55.90 1x4g s SER 21 Cb 0.27 -0.19 -0.11 0.00 -1.71 0.00 0.00 66.02 64.27 1x4g s SER 21 CO 0.63 0.14 -0.15 -1.20 1.20 0.00 0.00 173.24 173.87 1x4g n SER 22 N 1.76 -2.93 0.07 5.45 7.64 -1.26 -4.84 113.62 119.51 1x4g n SER 22 Ca -0.17 0.45 -0.04 0.00 1.01 0.00 0.00 58.87 60.12 1x4g n SER 22 Cb 0.53 -0.63 0.17 0.00 -1.01 0.00 0.00 64.21 63.28 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 -0.09 0.32 -0.02 1.43 0.13 -1.95 -3.25 132.00 128.58 1x4g h PRO 23 Ca -0.31 -0.17 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 1x4g h PRO 23 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1x4g h PRO 23 CO 0.30 0.71 -0.07 0.87 -0.23 0.00 0.00 178.00 179.58 1x4g h LYS 24 N 0.26 0.08 -6.41 0.86 1.57 -2.03 -3.42 116.57 107.48 1x4g h LYS 24 Ca 0.02 -0.06 -0.54 0.00 -1.87 0.00 0.00 60.65 58.19 1x4g h LYS 24 Cb 0.90 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 33.14 1x4g h LYS 24 CO 0.07 0.70 1.06 1.21 -0.57 0.00 0.00 179.45 181.92 1x4g s ASN 25 N -5.97 6.20 -0.38 0.86 2.47 -1.23 -4.96 114.94 111.94 1x4g s ASN 25 Ca -0.16 -0.14 -0.03 0.00 0.42 0.00 0.00 52.86 52.95 1x4g s ASN 25 Cb 0.01 -2.55 0.09 0.00 -1.45 0.00 0.00 41.25 37.35 1x4g s ASN 25 CO 0.70 -1.74 0.14 0.00 -3.72 0.00 0.00 177.10 172.48 1x4g s THR 27 N 1.17 1.20 -0.24 0.00 2.01 -1.26 -3.10 115.64 115.43 1x4g s THR 27 Ca 0.05 -1.46 0.00 0.00 0.31 0.00 0.00 61.69 60.59 1x4g s THR 27 Cb -0.22 -1.25 0.07 0.00 0.01 0.00 0.00 72.50 71.10 1x4g s THR 27 CO -0.03 -0.29 -0.02 -0.69 -0.69 0.00 0.00 174.62 172.90 1x4g s VAL 28 N -1.59 1.36 -0.49 3.82 1.01 0.80 -2.84 120.40 122.48 1x4g s VAL 28 Ca 0.02 -1.21 -0.23 0.00 0.00 0.00 0.00 61.98 60.56 1x4g s VAL 28 Cb -0.08 -1.72 0.03 0.00 0.00 0.00 0.00 36.38 34.61 1x4g s VAL 28 CO 0.02 -0.20 0.81 -0.47 0.00 0.00 0.00 175.10 175.26 1x4g s TYR 29 N 1.45 2.94 -0.31 5.22 6.14 0.74 -1.99 117.35 131.55 1x4g s TYR 29 Ca -0.03 0.01 -0.10 0.00 0.64 0.00 0.00 57.07 57.60 1x4g s TYR 29 Cb -0.18 -3.76 -0.01 0.00 0.42 0.00 0.00 41.96 38.42 1x4g s TYR 29 CO -0.08 -1.10 0.16 0.00 0.64 0.00 0.00 175.55 175.16 1x4g s GLY 31 N 1.63 0.50 0.00 0.00 0.00 -0.19 0.65 107.32 109.91 1x4g s GLY 31 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 44.72 44.64 1x4g s GLY 31 CO 0.07 0.61 0.00 0.61 0.00 0.00 0.00 173.10 174.39 1x4g n GLY 32 N 4.35 0.26 3.76 0.20 0.00 -1.17 0.88 105.19 113.48 1x4g n GLY 32 Ca -0.20 0.07 -0.39 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 2.39 0.00 -0.61 1.01 -1.26 -4.73 121.20 118.00 1x4g s ILE 33 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 60.65 60.97 1x4g s ILE 33 Cb 0.00 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.30 1x4g s ILE 33 CO 0.00 0.02 0.00 0.00 0.00 0.00 0.00 174.94 174.96 1x4g n ALA 34 N -0.48 1.84 -1.17 9.38 0.00 -1.26 -4.25 120.51 124.56 1x4g n ALA 34 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.51 1x4g n ALA 34 Cb 0.45 0.00 0.24 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 -1.42 3.58 -2.02 0.00 7.64 -1.26 -4.54 113.62 115.61 1x4g n SER 35 Ca 0.00 -3.35 -0.02 0.00 1.01 0.00 0.00 58.87 56.51 1x4g n SER 35 Cb 0.00 -0.63 0.06 0.00 -1.01 0.00 0.00 64.21 62.63 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 -0.69 0.97 3.61 0.23 0.00 -1.26 -5.12 105.19 102.92 1x4g n GLY 36 Ca 0.31 -0.10 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.31 4.11 -0.11 0.99 0.20 -1.26 -4.99 118.68 115.31 1x4g s LEU 37 Ca 0.05 0.44 -0.10 0.00 0.69 0.00 0.00 54.13 55.21 1x4g s LEU 37 Cb 0.25 -2.70 0.03 0.00 -0.43 0.00 0.00 46.19 43.34 1x4g s LEU 37 CO -0.07 -0.37 0.30 0.42 -0.29 0.00 0.00 176.35 176.34 1x4g s THR 38 N 2.41 -0.00 0.25 3.68 -4.23 -1.26 -4.81 115.64 111.68 1x4g s THR 38 Ca 0.22 0.02 -0.04 0.00 -1.18 0.00 0.00 61.69 60.71 1x4g s THR 38 Cb -0.15 -0.43 0.25 0.00 1.34 0.00 0.00 72.50 73.51 1x4g s THR 38 CO 0.10 0.01 1.67 -0.78 -0.54 0.00 0.00 174.62 175.08 1x4g h ASP 39 N 5.85 -0.04 -0.57 3.99 3.58 -1.96 0.39 116.42 127.66 1x4g h ASP 39 Ca -0.28 0.16 0.06 0.00 0.42 0.00 0.00 57.03 57.40 1x4g h ASP 39 Cb 1.19 0.23 -0.03 0.00 1.72 0.00 0.00 39.33 42.43 1x4g h ASP 39 CO 0.32 -0.08 0.38 -0.61 -2.88 0.00 0.00 179.24 176.37 1x4g h GLN 40 N 0.23 0.52 0.56 0.28 4.15 -1.98 0.86 115.11 119.73 1x4g h GLN 40 Ca 0.44 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 59.80 1x4g h GLN 40 Cb 0.78 -0.12 0.01 0.00 0.21 0.00 0.00 27.48 28.36 1x4g h GLN 40 CO -0.56 0.34 -0.27 1.25 -1.93 0.00 0.00 178.83 177.66 1x4g h LEU 41 N 0.53 -0.63 -1.31 -2.39 5.85 -0.62 0.46 115.31 117.20 1x4g h LEU 41 Ca 0.25 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 1x4g h LEU 41 Cb 0.29 0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1x4g h LEU 41 CO -0.07 -0.28 0.40 0.24 -0.34 0.00 0.00 178.44 178.38 1x4g h MET 42 N -1.02 0.87 -0.43 1.25 2.86 -1.16 0.23 114.93 117.53 1x4g h MET 42 Ca -0.08 -0.07 -0.09 0.00 -2.06 0.00 0.00 59.70 57.41 1x4g h MET 42 Cb 0.64 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1x4g h MET 42 CO 0.13 0.60 -0.07 -0.09 1.06 0.00 0.00 176.91 178.53 1x4g h ARG 43 N 0.88 0.80 -0.11 1.72 2.43 -0.79 -0.52 114.38 118.80 1x4g h ARG 43 Ca 0.23 -0.29 -0.19 0.00 -0.81 0.00 0.00 59.98 58.92 1x4g h ARG 43 Cb -0.05 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1x4g h ARG 43 CO -0.05 0.91 -0.71 0.37 -1.51 0.00 0.00 179.97 178.98 1x4g h GLN 44 N 0.63 0.49 -0.36 0.20 4.15 -0.40 1.23 115.11 121.05 1x4g h GLN 44 Ca 0.11 -0.39 -0.14 0.00 0.77 0.00 0.00 58.65 59.00 1x4g h GLN 44 Cb 0.59 0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.35 1x4g h GLN 44 CO 0.04 1.02 -0.33 1.15 -1.93 0.00 0.00 178.83 178.77 1x4g h THR 45 N 0.34 1.28 0.00 2.39 2.02 -0.49 -3.16 112.91 115.29 1x4g h THR 45 Ca -0.03 -1.50 0.00 0.00 0.77 0.00 0.00 66.41 65.66 1x4g h THR 45 Cb 1.29 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.06 1x4g h THR 45 CO 0.13 0.49 -1.35 0.49 0.37 0.00 0.00 175.52 175.65 1x4g n PHE 46 N -4.07 0.41 -0.31 3.16 3.72 -0.21 -4.34 117.46 115.83 1x4g n PHE 46 Ca -0.01 0.12 -0.08 0.00 -0.05 0.00 0.00 57.45 57.43 1x4g n PHE 46 Cb 0.50 -0.63 -0.07 0.00 -0.94 0.00 0.00 39.48 38.34 1x4g n PHE 46 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1x4g n SER 47 N -2.30 -0.77 0.01 4.37 7.64 0.42 -1.22 113.62 121.76 1x4g n SER 47 Ca -0.01 1.41 -0.13 0.00 1.01 0.00 0.00 58.87 61.15 1x4g n SER 47 Cb 0.52 -0.22 -0.09 0.00 -1.01 0.00 0.00 64.21 63.40 1x4g n SER 47 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1x4g h PRO 48 N 0.00 -0.06 -1.92 1.43 0.13 -1.79 -3.14 132.00 126.66 1x4g h PRO 48 Ca 0.12 0.00 0.56 0.00 -0.87 0.00 0.00 66.00 65.81 1x4g h PRO 48 Cb 0.30 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 31.36 1x4g h PRO 48 CO -0.69 0.40 1.38 0.74 -0.23 0.00 0.00 178.00 179.60 1x4g h PHE 49 N -0.54 0.01 0.00 1.56 0.04 -1.49 -3.44 116.94 113.07 1x4g h PHE 49 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1x4g h PHE 49 Cb 0.49 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.63 1x4g h PHE 49 CO 0.09 -0.01 0.00 0.41 -0.60 0.00 0.00 178.31 178.20 1x4g n GLY 50 N -1.91 -1.67 3.69 -1.45 0.00 -0.36 -4.66 105.19 98.84 1x4g n GLY 50 Ca 0.43 -1.12 -0.40 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.53 4.37 -0.20 1.61 0.74 -1.26 -4.27 119.66 119.12 1x4g s GLN 51 Ca 0.00 0.90 -0.11 0.00 0.05 0.00 0.00 55.36 56.20 1x4g s GLN 51 Cb 0.00 -3.50 -0.05 0.00 1.10 0.00 0.00 33.01 30.56 1x4g s GLN 51 CO 0.00 -0.10 0.16 0.42 -0.55 0.00 0.00 175.29 175.23 1x4g s ILE 52 N 1.36 5.39 -0.20 -2.34 1.01 -1.26 -3.29 121.20 121.86 1x4g s ILE 52 Ca 0.37 0.26 -0.15 0.00 0.00 0.00 0.00 60.65 61.13 1x4g s ILE 52 Cb -0.17 -3.50 -0.19 0.00 0.01 0.00 0.00 42.46 38.60 1x4g s ILE 52 CO 0.16 0.42 0.11 0.23 0.00 0.00 0.00 174.94 175.86 1x4g n MET 53 N 3.61 0.62 -3.83 2.79 2.81 -0.31 -4.99 117.12 117.83 1x4g n MET 53 Ca -0.15 0.41 -0.12 0.00 -1.81 0.00 0.00 57.70 56.02 1x4g n MET 53 Cb 0.52 -1.67 -0.12 0.00 -0.71 0.00 0.00 33.22 31.23 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 0.20 -0.07 0.03 2.56 -1.25 -5.02 118.70 112.70 1x4g s GLU 54 Ca -0.30 0.15 0.02 0.00 0.00 0.00 0.00 54.97 54.84 1x4g s GLU 54 Cb 0.08 0.09 0.01 0.00 2.00 0.00 0.00 34.13 36.32 1x4g s GLU 54 CO 0.62 -0.03 -0.11 0.42 -0.56 0.00 0.00 175.26 175.60 1x4g s ILE 55 N -0.06 1.09 -0.27 -3.70 1.01 -1.26 -2.50 121.20 115.51 1x4g s ILE 55 Ca -0.01 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.21 1x4g s ILE 55 Cb -0.02 -1.01 0.08 0.00 0.01 0.00 0.00 42.46 41.52 1x4g s ILE 55 CO 0.00 0.35 0.01 -0.13 0.00 0.00 0.00 174.94 175.17 1x4g s ARG 56 N 0.80 1.27 -0.16 2.79 1.81 -0.51 -4.95 118.95 120.00 1x4g s ARG 56 Ca -0.12 -1.12 -0.13 0.00 -1.72 0.00 0.00 55.73 52.64 1x4g s ARG 56 Cb -0.15 -2.50 -0.05 0.00 -0.45 0.00 0.00 34.95 31.80 1x4g s ARG 56 CO 0.02 -0.77 0.27 0.14 -0.68 0.00 0.00 175.30 174.29 1x4g s VAL 57 N 1.41 5.32 -0.65 3.52 -7.23 -1.26 0.36 120.40 121.87 1x4g s VAL 57 Ca 0.02 0.50 0.05 0.00 -1.81 0.00 0.00 61.98 60.74 1x4g s VAL 57 Cb -0.18 -3.61 0.16 0.00 0.56 0.00 0.00 36.38 33.31 1x4g s VAL 57 CO -0.12 0.41 0.42 -0.36 -0.31 0.00 0.00 175.10 175.15 1x4g s PHE 58 N 0.33 3.43 -1.81 2.82 0.40 0.13 -4.91 117.98 118.36 1x4g s PHE 58 Ca 0.16 -3.28 0.15 0.00 -0.60 0.00 0.00 56.93 53.36 1x4g s PHE 58 Cb -0.13 -2.72 0.87 0.00 0.51 0.00 0.00 43.02 41.55 1x4g s PHE 58 CO 0.04 -0.61 1.37 -0.35 0.70 0.00 0.00 175.22 176.37 1x4g n PRO 59 N 2.32 0.40 -0.03 0.24 -0.04 -1.26 -0.41 135.00 136.22 1x4g n PRO 59 Ca 0.15 0.05 -0.14 0.00 -0.04 0.00 0.00 63.50 63.52 1x4g n PRO 59 Cb 0.34 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.16 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 -1.10 0.68 -0.09 0.54 2.13 -1.26 -4.45 120.64 117.10 1x4g n GLU 60 Ca 0.10 0.25 -0.09 0.00 0.66 0.00 0.00 57.16 58.08 1x4g n GLU 60 Cb 0.08 -1.72 -0.14 0.00 0.27 0.00 0.00 31.44 29.92 1x4g n GLU 60 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1x4g n LYS 61 N -3.19 1.03 -0.16 5.31 4.01 -1.03 -5.03 118.16 119.10 1x4g n LYS 61 Ca -0.25 -0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.54 1x4g n LYS 61 Cb 1.06 -1.46 0.00 0.00 -0.51 0.00 0.00 35.03 34.11 1x4g n LYS 61 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1x4g n GLY 62 N 1.91 0.85 3.58 0.72 0.00 0.45 -5.06 105.19 107.64 1x4g n GLY 62 Ca -0.30 -0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.80 0.12 0.15 1.61 -0.85 -1.02 -3.03 117.35 112.51 1x4g s TYR 63 Ca 0.00 -0.49 -0.10 0.00 -0.52 0.00 0.00 57.07 55.97 1x4g s TYR 63 Cb 0.00 0.31 -0.00 0.00 0.38 0.00 0.00 41.96 42.65 1x4g s TYR 63 CO 0.00 -0.97 0.28 0.45 -1.52 0.00 0.00 175.55 173.79 1x4g s SER 64 N -2.95 0.03 0.05 -0.18 0.15 0.21 0.21 113.70 111.22 1x4g s SER 64 Ca 0.16 -0.78 0.07 0.00 0.70 0.00 0.00 55.95 56.10 1x4g s SER 64 Cb -0.01 0.42 -0.03 0.00 -1.71 0.00 0.00 66.02 64.70 1x4g s SER 64 CO 0.04 -0.86 -0.19 -0.36 1.20 0.00 0.00 173.24 173.06 1x4g s PHE 65 N -3.93 1.70 -0.22 3.44 0.08 0.16 -1.92 117.98 117.28 1x4g s PHE 65 Ca 0.13 -0.37 -0.04 0.00 0.12 0.00 0.00 56.93 56.77 1x4g s PHE 65 Cb 0.03 -1.01 0.12 0.00 -0.57 0.00 0.00 43.02 41.60 1x4g s PHE 65 CO -0.03 0.09 0.37 0.08 -0.10 0.00 0.00 175.22 175.63 1x4g s VAL 66 N -0.84 -0.58 -0.26 -0.44 1.01 -0.84 -1.43 120.40 117.02 1x4g s VAL 66 Ca 0.06 -0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.94 1x4g s VAL 66 Cb -0.09 -0.75 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 1x4g s VAL 66 CO 0.02 -0.07 0.15 -0.13 0.00 0.00 0.00 175.10 175.06 1x4g s ARG 67 N 2.54 3.88 0.49 2.72 3.00 -1.04 -0.14 118.95 130.39 1x4g s ARG 67 Ca 0.09 -0.36 -0.02 0.00 0.00 0.00 0.00 55.73 55.44 1x4g s ARG 67 Cb -0.15 -3.53 -0.00 0.00 0.00 0.00 0.00 34.95 31.27 1x4g s ARG 67 CO -0.14 -0.14 0.75 -0.06 0.00 0.00 0.00 175.30 175.70 1x4g s PHE 68 N 1.59 3.26 -0.49 -0.53 0.40 -1.18 -1.16 117.98 119.87 1x4g s PHE 68 Ca 0.07 0.40 0.24 0.00 -0.60 0.00 0.00 56.93 57.03 1x4g s PHE 68 Cb -0.15 -2.43 0.36 0.00 0.51 0.00 0.00 43.02 41.30 1x4g s PHE 68 CO 0.08 -0.48 1.46 0.66 0.70 0.00 0.00 175.22 177.63 1x4g h SER 69 N 0.22 0.00 -4.48 1.36 4.64 -1.88 -3.45 113.55 109.96 1x4g h SER 69 Ca -0.46 -0.04 -0.37 0.00 -0.47 0.00 0.00 61.79 60.45 1x4g h SER 69 Cb 1.25 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.13 1x4g h SER 69 CO 0.59 0.02 -0.76 0.42 -0.87 0.00 0.00 176.83 176.23 1x4g s THR 70 N -3.22 1.00 0.30 2.95 -4.23 -1.26 -5.04 115.64 106.14 1x4g s THR 70 Ca 0.06 -1.36 0.08 0.00 -1.18 0.00 0.00 61.69 59.29 1x4g s THR 70 Cb 0.09 -1.08 0.03 0.00 1.34 0.00 0.00 72.50 72.88 1x4g s THR 70 CO 0.69 -0.33 1.69 -0.74 -0.54 0.00 0.00 174.62 175.40 1x4g h HIS 71 N 4.13 0.18 0.32 3.99 2.76 -1.89 -3.21 115.15 121.42 1x4g h HIS 71 Ca -0.39 -0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 57.71 1x4g h HIS 71 Cb 1.19 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 30.12 1x4g h HIS 71 CO 0.64 0.59 -0.15 0.93 -1.30 0.00 0.00 177.93 178.63 1x4g h GLU 72 N 0.12 -0.41 -0.87 5.26 5.08 -1.96 -2.47 114.58 119.33 1x4g h GLU 72 Ca 0.01 0.03 0.08 0.00 -1.00 0.00 0.00 59.36 58.47 1x4g h GLU 72 Cb 0.87 0.09 -0.10 0.00 0.50 0.00 0.00 28.75 30.11 1x4g h GLU 72 CO 0.07 -0.27 -0.51 0.43 -1.00 0.00 0.00 179.01 177.72 1x4g n SER 73 N -3.24 -0.92 -0.31 1.42 7.64 -1.24 0.88 113.62 117.84 1x4g n SER 73 Ca -0.05 1.62 0.15 0.00 1.01 0.00 0.00 58.87 61.60 1x4g n SER 73 Cb 0.17 -0.23 0.34 0.00 -1.01 0.00 0.00 64.21 63.47 1x4g n SER 73 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x4g h ALA 74 N 0.37 1.51 -0.44 -0.43 0.00 -1.61 0.34 119.26 119.00 1x4g h ALA 74 Ca 0.14 0.18 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 1x4g h ALA 74 Cb 0.36 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1x4g h ALA 74 CO -0.82 -0.41 -0.20 0.00 0.00 0.00 0.00 179.25 177.82 1x4g h ALA 75 N 1.75 0.80 -0.58 0.00 0.00 0.99 -0.56 119.26 121.66 1x4g h ALA 75 Ca 0.60 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 1x4g h ALA 75 Cb 1.19 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1x4g h ALA 75 CO -0.57 0.65 0.14 0.45 0.00 0.00 0.00 179.25 179.93 1x4g h HIS 76 N 0.77 0.93 0.02 0.00 3.86 0.24 0.62 115.15 121.59 1x4g h HIS 76 Ca 0.11 -0.09 -0.20 0.00 -1.16 0.00 0.00 60.37 59.02 1x4g h HIS 76 Cb 0.75 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 1x4g h HIS 76 CO 0.04 0.77 -0.94 0.00 0.86 0.00 0.00 177.93 178.66 1x4g h ALA 77 N 1.29 0.45 0.11 2.45 0.00 -0.92 -3.17 119.26 119.47 1x4g h ALA 77 Ca 0.19 -0.81 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1x4g h ALA 77 Cb 0.31 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1x4g h ALA 77 CO -0.00 1.07 -0.05 0.82 0.00 0.00 0.00 179.25 181.09 1x4g h ILE 78 N 0.03 1.06 -0.80 0.00 2.04 -0.77 0.22 117.51 119.29 1x4g h ILE 78 Ca -0.03 -1.27 0.21 0.00 1.00 0.00 0.00 64.86 64.77 1x4g h ILE 78 Cb 1.63 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 39.46 1x4g h ILE 78 CO 0.13 0.28 0.56 -0.37 0.00 0.00 0.00 178.15 178.74 1x4g h VAL 79 N -0.80 0.66 0.00 1.67 -1.51 -1.00 0.23 116.25 115.50 1x4g h VAL 79 Ca -0.01 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1x4g h VAL 79 Cb 0.57 0.48 0.00 0.00 -2.13 0.00 0.00 31.29 30.20 1x4g h VAL 79 CO 0.02 0.03 0.00 -1.20 -1.23 0.00 0.00 177.57 175.19 1x4g n SER 80 N -4.39 0.00 -0.52 4.19 7.64 -1.20 -4.31 113.62 115.03 1x4g n SER 80 Ca 0.16 0.23 0.43 0.00 1.01 0.00 0.00 58.87 60.70 1x4g n SER 80 Cb 0.76 -0.45 0.73 0.00 -1.01 0.00 0.00 64.21 64.24 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 0.13 -0.53 0.44 2.07 -0.57 -3.37 116.25 114.43 1x4g h VAL 81 Ca 0.00 -0.02 -0.12 0.00 0.82 0.00 0.00 66.70 67.39 1x4g h VAL 81 Cb 0.00 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 1x4g h VAL 81 CO 0.00 0.01 0.48 -3.20 0.02 0.00 0.00 177.57 174.88 1x4g n ASN 82 N -4.31 1.63 0.00 0.57 5.15 0.81 -0.23 115.26 118.87 1x4g n ASN 82 Ca 0.38 -1.22 0.00 0.00 -0.60 0.00 0.00 54.58 53.13 1x4g n ASN 82 Cb 1.62 -1.55 0.00 0.00 -0.53 0.00 0.00 39.78 39.31 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 6.57 1.40 3.94 8.20 0.00 -1.19 -4.70 105.19 119.41 1x4g n GLY 83 Ca 0.47 0.00 -0.25 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 -2.00 5.19 -0.32 2.61 -4.23 0.68 -4.90 115.64 112.67 1x4g s THR 84 Ca 0.00 -0.57 -0.02 0.00 -1.18 0.00 0.00 61.69 59.93 1x4g s THR 84 Cb 0.00 -3.80 0.06 0.00 1.34 0.00 0.00 72.50 70.10 1x4g s THR 84 CO 0.00 -0.32 0.04 -0.89 -0.54 0.00 0.00 174.62 172.91 1x4g s THR 85 N -2.02 2.98 -0.37 3.99 2.01 -1.26 -0.50 115.64 120.48 1x4g s THR 85 Ca 0.38 -1.57 -0.16 0.00 0.31 0.00 0.00 61.69 60.64 1x4g s THR 85 Cb -0.10 -2.81 -0.00 0.00 0.01 0.00 0.00 72.50 69.60 1x4g s THR 85 CO 0.31 -0.24 0.40 -0.63 -0.69 0.00 0.00 174.62 173.77 1x4g s ILE 86 N 1.21 5.13 -1.63 1.82 1.01 0.50 -4.21 121.20 125.03 1x4g s ILE 86 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 60.65 60.58 1x4g s ILE 86 Cb -0.20 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.36 1x4g s ILE 86 CO -0.02 -0.21 0.00 -0.62 0.00 0.00 0.00 174.94 174.09 1x4g n GLU 87 N 5.49 -1.37 -0.70 2.79 -0.58 -1.26 -1.59 120.64 123.42 1x4g n GLU 87 Ca -0.08 0.94 0.00 0.00 -0.42 0.00 0.00 57.16 57.60 1x4g n GLU 87 Cb 0.49 -5.36 0.00 0.00 -0.57 0.00 0.00 31.44 26.00 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 -0.95 0.59 3.05 0.62 0.00 -1.26 -5.05 105.19 102.19 1x4g n GLY 88 Ca -0.20 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 44.98 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 2.14 -0.01 1.61 3.76 -0.62 -5.08 115.29 115.10 1x4g s HIS 89 Ca 0.00 -1.11 -0.30 0.00 -0.15 0.00 0.00 55.06 53.50 1x4g s HIS 89 Cb 0.00 -1.55 -0.07 0.00 1.11 0.00 0.00 32.58 32.08 1x4g s HIS 89 CO 0.00 -0.58 1.69 0.54 -0.85 0.00 0.00 174.74 175.54 1x4g s VAL 90 N 1.19 3.37 0.02 -0.90 0.11 -1.26 -0.37 120.40 122.56 1x4g s VAL 90 Ca -0.01 0.56 0.01 0.00 -2.93 0.00 0.00 61.98 59.61 1x4g s VAL 90 Cb -0.14 -3.36 -0.04 0.00 -1.53 0.00 0.00 36.38 31.31 1x4g s VAL 90 CO -0.06 -0.04 0.08 0.68 -3.33 0.00 0.00 175.10 172.44 1x4g s VAL 91 N 3.68 4.68 -0.13 2.04 -7.23 0.35 -4.15 120.40 119.63 1x4g s VAL 91 Ca 0.75 -0.52 0.02 0.00 -1.81 0.00 0.00 61.98 60.42 1x4g s VAL 91 Cb -0.36 -3.18 0.00 0.00 0.56 0.00 0.00 36.38 33.40 1x4g s VAL 91 CO 0.32 0.27 -0.20 -1.59 -0.31 0.00 0.00 175.10 173.59 1x4g s LYS 92 N -1.96 3.10 -0.26 4.82 -2.85 0.26 -3.17 119.74 119.68 1x4g s LYS 92 Ca 0.25 -0.83 -0.05 0.00 -1.00 0.00 0.00 55.97 54.34 1x4g s LYS 92 Cb -0.12 -2.45 -0.00 0.00 -2.06 0.00 0.00 37.83 33.20 1x4g s LYS 92 CO 0.17 0.07 0.02 0.00 0.10 0.00 0.00 175.35 175.71 1x4g n TYR 94 N 4.84 0.21 -3.08 0.00 4.01 -0.16 -4.77 117.16 118.20 1x4g n TYR 94 Ca -0.16 -1.98 -0.45 0.00 -0.16 0.00 0.00 57.90 55.15 1x4g n TYR 94 Cb 0.50 -0.04 -0.03 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 -2.67 3.26 -0.18 -0.72 0.52 -1.26 -0.18 118.94 117.71 1x4g s TRP 95 Ca 0.14 -1.43 -0.39 0.00 0.02 0.00 0.00 56.10 54.43 1x4g s TRP 95 Cb 0.01 -4.09 -0.16 0.00 -1.15 0.00 0.00 33.47 28.08 1x4g s TRP 95 CO 0.10 -1.31 1.63 0.41 0.02 0.00 0.00 176.95 177.79 1x4g n GLY 96 N 5.00 0.74 3.15 0.98 0.00 -1.13 -4.86 105.19 109.07 1x4g n GLY 96 Ca 0.12 0.87 0.05 0.00 0.00 0.00 0.00 46.02 47.05 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 2.66 0.38 -0.75 1.61 2.36 -1.26 -4.40 119.74 120.35 1x4g s LYS 97 Ca 0.94 0.51 0.01 0.00 -2.55 0.00 0.00 55.97 54.89 1x4g s LYS 97 Cb -1.04 0.26 0.36 0.00 -1.05 0.00 0.00 37.83 36.35 1x4g s LYS 97 CO 0.60 -0.59 1.53 -0.85 1.55 0.00 0.00 175.35 177.59 1x4g n GLU 98 N 5.36 3.75 -3.82 4.03 0.28 -1.26 -4.87 120.64 124.10 1x4g n GLU 98 Ca 0.02 -4.36 -0.28 0.00 -0.16 0.00 0.00 57.16 52.39 1x4g n GLU 98 Cb 0.54 -2.31 -0.12 0.00 1.43 0.00 0.00 31.44 30.98 1x4g n GLU 98 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1x4g s SER 99 N -2.24 4.32 0.00 -1.84 0.15 -1.26 -4.91 113.70 107.92 1x4g s SER 99 Ca 0.47 -3.75 0.16 0.00 0.70 0.00 0.00 55.95 53.53 1x4g s SER 99 Cb 0.33 -1.46 0.92 0.00 -1.71 0.00 0.00 66.02 64.11 1x4g s SER 99 CO -0.23 -0.10 1.34 -0.81 1.20 0.00 0.00 173.24 174.65 1x4g n PRO 100 N 2.09 0.48 -1.20 5.44 -0.04 -1.26 -4.97 135.00 135.54 1x4g n PRO 100 Ca 0.21 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 1x4g n PRO 100 Cb 0.37 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.33 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 -1.01 -6.45 0.14 3.54 8.00 -1.26 -5.05 116.55 114.46 1x4g n ASP 101 Ca 0.12 1.43 0.00 0.00 0.71 0.00 0.00 54.79 57.04 1x4g n ASP 101 Cb 0.05 -3.65 0.00 0.00 -0.02 0.00 0.00 41.12 37.51 1x4g n ASP 101 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 1x4g n MET 102 N -2.39 0.00 -3.03 -1.24 2.81 -1.26 -5.12 117.12 106.88 1x4g n MET 102 Ca -0.00 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.88 1x4g n MET 102 Cb 0.37 0.00 -0.01 0.00 -0.71 0.00 0.00 33.22 32.88 1x4g n MET 102 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1x4g n THR 103 N -3.28 -3.99 -1.42 2.03 -1.04 -1.26 -4.74 114.28 100.58 1x4g n THR 103 Ca 0.00 0.73 0.15 0.00 -2.04 0.00 0.00 64.05 62.89 1x4g n THR 103 Cb 0.00 -3.66 -0.09 0.00 -1.82 0.00 0.00 70.33 64.76 1x4g n THR 103 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1x4g n SER 104 N 1.72 -7.69 -3.94 8.00 2.88 -1.26 -4.93 113.62 108.39 1x4g n SER 104 Ca -0.05 1.47 -0.30 0.00 -1.33 0.00 0.00 58.87 58.67 1x4g n SER 104 Cb 0.28 -4.87 0.21 0.00 -0.75 0.00 0.00 64.21 59.09 1x4g n SER 104 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x4g s GLY 105 N -7.02 1.72 -0.21 0.46 0.00 -1.26 -4.96 107.32 96.05 1x4g s GLY 105 Ca 0.00 -1.16 -0.29 0.00 0.00 0.00 0.00 44.72 43.27 1x4g s GLY 105 CO 0.00 -0.33 1.60 2.56 0.00 0.00 0.00 173.10 176.93 1x4g s PRO 106 N -5.75 3.84 0.16 2.90 0.04 -1.26 -4.49 135.00 130.44 1x4g s PRO 106 Ca 0.74 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.47 1x4g s PRO 106 Cb -0.05 -4.02 0.00 0.00 0.04 0.00 0.00 34.50 30.47 1x4g s PRO 106 CO 0.54 -1.24 0.00 0.45 0.04 0.00 0.00 177.00 176.79 1x4g n SER 107 N 8.28 -1.47 -0.08 6.66 2.88 -1.26 -5.00 113.62 123.63 1x4g n SER 107 Ca 0.18 0.46 -0.16 0.00 -1.33 0.00 0.00 58.87 58.02 1x4g n SER 107 Cb 0.45 1.60 -0.12 0.00 -0.75 0.00 0.00 64.21 65.39 1x4g n SER 107 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1x4g h SER 108 N 0.00 0.00 0.00 -3.46 0.02 -1.99 -3.57 113.55 104.55 1x4g h SER 108 Ca 0.00 -0.73 0.00 0.00 -0.84 0.00 0.00 61.79 60.22 1x4g h SER 108 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1x4g h SER 108 CO 0.00 1.17 0.00 0.61 -1.14 0.00 0.00 176.83 177.47