#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5o s SER 2 N 0.00 2.36 -0.95 1.61 0.15 -1.26 -5.08 113.70 110.53 1v5o s SER 2 Ca 0.00 -0.56 -0.22 0.00 0.70 0.00 0.00 55.95 55.86 1v5o s SER 2 Cb 0.00 -0.39 0.07 0.00 -1.71 0.00 0.00 66.02 63.98 1v5o s SER 2 CO 0.00 -0.30 1.33 -0.55 1.20 0.00 0.00 173.24 174.91 1v5o s SER 3 N 2.01 6.48 0.43 5.45 0.15 -1.26 -4.96 113.70 122.00 1v5o s SER 3 Ca 0.02 -1.47 0.06 0.00 0.70 0.00 0.00 55.95 55.26 1v5o s SER 3 Cb -0.16 -2.52 -0.06 0.00 -1.71 0.00 0.00 66.02 61.57 1v5o s SER 3 CO -0.08 -1.43 0.06 -0.83 1.20 0.00 0.00 173.24 172.16 1v5o s GLY 4 N 4.46 2.54 0.30 9.45 0.00 -1.26 -5.16 107.32 117.64 1v5o s GLY 4 Ca 0.40 -1.98 -0.13 0.00 0.00 0.00 0.00 44.72 43.02 1v5o s GLY 4 CO -0.06 -2.07 0.57 -0.45 0.00 0.00 0.00 173.10 171.10 1v5o s SER 5 N -3.79 0.10 0.05 1.64 0.15 -1.26 -5.08 113.70 105.51 1v5o s SER 5 Ca 0.33 -1.03 0.00 0.00 0.70 0.00 0.00 55.95 55.94 1v5o s SER 5 Cb 0.07 0.67 0.00 0.00 -1.71 0.00 0.00 66.02 65.06 1v5o s SER 5 CO 0.17 -1.31 0.00 -1.20 1.20 0.00 0.00 173.24 172.10 1v5o n SER 6 N -0.79 -0.32 -1.06 5.45 7.64 -1.26 -5.16 113.62 118.11 1v5o n SER 6 Ca -0.03 0.09 0.14 0.00 1.01 0.00 0.00 58.87 60.09 1v5o n SER 6 Cb 0.61 0.56 -0.04 0.00 -1.01 0.00 0.00 64.21 64.33 1v5o n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v5o n GLY 7 N -0.20 -1.37 3.09 0.23 0.00 -1.26 -4.91 105.19 100.78 1v5o n GLY 7 Ca 0.00 -0.83 -0.18 0.00 0.00 0.00 0.00 46.02 45.02 1v5o n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1v5o s MET 8 N -1.90 0.76 -0.06 1.61 0.00 0.39 -4.80 119.30 115.30 1v5o s MET 8 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 55.69 54.74 1v5o s MET 8 Cb 0.00 -0.71 -0.03 0.00 0.00 0.00 0.00 34.83 34.10 1v5o s MET 8 CO 0.00 0.17 1.09 -1.17 0.00 0.00 0.00 175.02 175.11 1v5o s LEU 9 N -1.05 4.28 -0.24 0.18 2.96 -1.26 -2.03 118.68 121.52 1v5o s LEU 9 Ca -0.01 1.69 0.01 0.00 -0.22 0.00 0.00 54.13 55.60 1v5o s LEU 9 Cb -0.07 -3.56 0.06 0.00 0.50 0.00 0.00 46.19 43.12 1v5o s LEU 9 CO 0.01 -0.48 -0.07 -0.63 -1.32 0.00 0.00 176.35 173.86 1v5o s ILE 10 N 1.89 1.70 -0.20 6.68 -1.09 0.17 -2.69 121.20 127.67 1v5o s ILE 10 Ca 0.52 -1.34 -0.19 0.00 -2.23 0.00 0.00 60.65 57.42 1v5o s ILE 10 Cb -0.22 -1.93 -0.03 0.00 -1.58 0.00 0.00 42.46 38.70 1v5o s ILE 10 CO 0.21 -0.09 0.52 -0.89 -1.23 0.00 0.00 174.94 173.47 1v5o s THR 11 N 1.31 5.10 0.12 2.92 2.01 -1.07 0.23 115.64 126.27 1v5o s THR 11 Ca -0.06 0.97 0.02 0.00 0.31 0.00 0.00 61.69 62.93 1v5o s THR 11 Cb -0.19 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 1v5o s THR 11 CO -0.06 0.18 0.21 -0.69 -0.69 0.00 0.00 174.62 173.57 1v5o s VAL 12 N 1.60 5.09 -0.31 3.82 1.01 -0.46 0.45 120.40 131.61 1v5o s VAL 12 Ca 0.24 -0.69 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 1v5o s VAL 12 Cb -0.15 -3.56 0.11 0.00 0.00 0.00 0.00 36.38 32.77 1v5o s VAL 12 CO 0.10 -0.01 0.13 -0.47 0.00 0.00 0.00 175.10 174.85 1v5o s TYR 13 N -1.64 0.76 0.49 5.22 6.14 -0.90 -3.42 117.35 124.00 1v5o s TYR 13 Ca 0.33 -1.22 -0.18 0.00 0.64 0.00 0.00 57.07 56.64 1v5o s TYR 13 Cb -0.12 -1.13 -0.09 0.00 0.42 0.00 0.00 41.96 41.04 1v5o s TYR 13 CO 0.27 -0.84 0.97 0.00 0.64 0.00 0.00 175.55 176.59 1v5o n VAL 15 N -1.26 0.42 0.00 0.00 0.24 -1.25 -3.55 118.33 112.93 1v5o n VAL 15 Ca 0.07 0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.50 1v5o n VAL 15 Cb 0.54 -0.98 0.00 0.00 -1.47 0.00 0.00 33.84 31.93 1v5o n VAL 15 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1v5o n ARG 16 N -3.31 0.00 -3.80 7.34 1.74 -1.26 -2.89 116.66 114.48 1v5o n ARG 16 Ca 0.00 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.85 1v5o n ARG 16 Cb 0.06 -0.13 -0.01 0.00 -1.02 0.00 0.00 32.46 31.36 1v5o n ARG 16 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1v5o n ARG 17 N -0.66 -0.70 -2.73 5.56 1.85 -1.26 0.19 116.66 118.92 1v5o n ARG 17 Ca 0.00 -0.15 -0.08 0.00 -1.00 0.00 0.00 57.85 56.62 1v5o n ARG 17 Cb 0.00 -1.13 0.03 0.00 -1.05 0.00 0.00 32.46 30.32 1v5o n ARG 17 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1v5o n ASP 18 N -0.87 -2.83 -3.15 2.89 -0.08 -1.26 -4.30 116.55 106.95 1v5o n ASP 18 Ca -0.09 -0.22 0.00 0.00 -1.51 0.00 0.00 54.79 52.97 1v5o n ASP 18 Cb 0.32 -2.24 0.00 0.00 2.34 0.00 0.00 41.12 41.54 1v5o n ASP 18 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1v5o n LEU 19 N -2.20 -3.78 0.15 -2.67 7.99 0.52 -4.92 117.00 112.09 1v5o n LEU 19 Ca -0.05 0.52 0.00 0.00 -0.01 0.00 0.00 56.01 56.47 1v5o n LEU 19 Cb 0.54 -1.55 0.00 0.00 -0.11 0.00 0.00 43.42 42.30 1v5o n LEU 19 CO 0.24 -1.71 0.00 0.41 -1.51 0.00 0.00 177.39 174.82 1v5o n THR 20 N 1.56 0.00 -2.61 -5.08 -1.04 -0.61 -5.04 114.28 101.46 1v5o n THR 20 Ca 0.00 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.98 1v5o n THR 20 Cb 0.39 -0.17 0.00 0.00 -1.82 0.00 0.00 70.33 68.73 1v5o n THR 20 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1v5o n GLU 21 N -3.21 -1.40 -3.10 -2.82 0.00 -1.14 -4.96 120.64 104.00 1v5o n GLU 21 Ca 0.00 1.50 -0.23 0.00 0.00 0.00 0.00 57.16 58.43 1v5o n GLU 21 Cb 0.00 -4.72 0.00 0.00 0.00 0.00 0.00 31.44 26.72 1v5o n GLU 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1v5o s VAL 22 N -2.62 4.25 -0.17 6.31 0.11 -1.23 -4.83 120.40 122.22 1v5o s VAL 22 Ca 0.09 -0.52 -0.05 0.00 -2.93 0.00 0.00 61.98 58.58 1v5o s VAL 22 Cb -0.03 -3.56 0.06 0.00 -1.53 0.00 0.00 36.38 31.32 1v5o s VAL 22 CO 0.58 -0.38 0.09 -0.89 -3.33 0.00 0.00 175.10 171.17 1v5o s THR 23 N -2.48 -0.06 -0.01 5.04 2.01 -1.26 -1.07 115.64 117.81 1v5o s THR 23 Ca 0.46 -0.15 -0.13 0.00 0.31 0.00 0.00 61.69 62.18 1v5o s THR 23 Cb -0.10 -0.58 0.02 0.00 0.01 0.00 0.00 72.50 71.85 1v5o s THR 23 CO 0.37 -0.26 0.27 0.72 -0.69 0.00 0.00 174.62 175.03 1v5o s PHE 24 N 2.13 -0.13 0.36 4.92 -0.71 -1.22 -5.04 117.98 118.29 1v5o s PHE 24 Ca 0.02 0.17 0.06 0.00 -1.04 0.00 0.00 56.93 56.14 1v5o s PHE 24 Cb -0.16 0.06 -0.01 0.00 -1.21 0.00 0.00 43.02 41.71 1v5o s PHE 24 CO -0.09 -0.37 0.51 -1.54 -1.34 0.00 0.00 175.22 172.40 1v5o s SER 25 N -1.35 5.91 -0.05 1.98 1.04 -1.26 -1.35 113.70 118.62 1v5o s SER 25 Ca -0.14 -0.15 -0.12 0.00 0.48 0.00 0.00 55.95 56.03 1v5o s SER 25 Cb -0.06 -1.20 0.02 0.00 0.10 0.00 0.00 66.02 64.88 1v5o s SER 25 CO 0.04 -0.51 0.28 -0.76 0.98 0.00 0.00 173.24 173.26 1v5o s LEU 26 N -4.25 0.97 -0.32 2.42 1.43 0.14 -4.93 118.68 114.13 1v5o s LEU 26 Ca 0.47 0.24 -0.08 0.00 -1.03 0.00 0.00 54.13 53.73 1v5o s LEU 26 Cb -0.10 1.07 0.02 0.00 0.03 0.00 0.00 46.19 47.22 1v5o s LEU 26 CO 0.32 -0.30 0.12 -1.58 0.23 0.00 0.00 176.35 175.14 1v5o s GLN 27 N -0.75 2.95 0.16 1.70 0.74 -1.26 0.42 119.66 123.61 1v5o s GLN 27 Ca -0.08 -0.97 0.02 0.00 0.05 0.00 0.00 55.36 54.38 1v5o s GLN 27 Cb -0.04 -3.49 -0.01 0.00 1.10 0.00 0.00 33.01 30.57 1v5o s GLN 27 CO 0.02 -0.55 0.06 1.33 -0.55 0.00 0.00 175.29 175.61 1v5o n VAL 28 N 4.89 0.00 -4.32 1.34 0.24 -0.86 -4.90 118.33 114.72 1v5o n VAL 28 Ca -0.13 -0.95 -0.24 0.00 -2.04 0.00 0.00 64.34 60.98 1v5o n VAL 28 Cb 0.47 0.35 -0.08 0.00 -1.47 0.00 0.00 33.84 33.10 1v5o n VAL 28 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1v5o s ASN 29 N -1.99 4.24 0.39 -1.34 0.01 -1.26 0.15 114.94 115.13 1v5o s ASN 29 Ca 0.09 -0.91 0.21 0.00 -0.71 0.00 0.00 52.86 51.54 1v5o s ASN 29 Cb 0.00 -0.59 0.60 0.00 0.41 0.00 0.00 41.25 41.67 1v5o s ASN 29 CO 0.06 -0.17 1.69 1.55 -1.51 0.00 0.00 177.10 178.72 1v5o h PRO 30 N 1.85 0.00 -0.75 -0.60 0.13 -1.95 -2.77 132.00 127.91 1v5o h PRO 30 Ca -0.43 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.66 1v5o h PRO 30 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 1v5o h PRO 30 CO 0.64 0.29 0.05 -0.25 -0.23 0.00 0.00 178.00 178.51 1v5o n ASP 31 N -3.31 4.12 -4.56 1.44 9.92 -1.26 0.12 116.55 123.02 1v5o n ASP 31 Ca 0.01 -2.68 -0.38 0.00 -0.53 0.00 0.00 54.79 51.21 1v5o n ASP 31 Cb 0.53 -0.64 -0.11 0.00 -0.64 0.00 0.00 41.12 40.26 1v5o n ASP 31 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1v5o s PHE 32 N -2.19 3.19 0.75 1.24 5.36 -1.04 -4.96 117.98 120.33 1v5o s PHE 32 Ca 0.37 0.01 -0.16 0.00 -0.96 0.00 0.00 56.93 56.19 1v5o s PHE 32 Cb 0.29 -2.35 -0.08 0.00 -0.34 0.00 0.00 43.02 40.54 1v5o s PHE 32 CO 0.10 -0.19 0.06 0.39 -1.46 0.00 0.00 175.22 174.12 1v5o n GLU 33 N 5.00 0.11 -0.09 10.12 4.71 -1.26 -2.19 120.64 137.05 1v5o n GLU 33 Ca -0.14 0.06 -0.11 0.00 -0.01 0.00 0.00 57.16 56.95 1v5o n GLU 33 Cb 0.52 -1.45 -0.04 0.00 -1.01 0.00 0.00 31.44 29.46 1v5o n GLU 33 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1v5o h LEU 34 N -0.53 0.48 -2.07 -4.62 7.12 0.01 -2.38 115.31 113.32 1v5o h LEU 34 Ca -0.44 -0.34 0.09 0.00 0.13 0.00 0.00 57.88 57.32 1v5o h LEU 34 Cb 1.36 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 41.34 1v5o h LEU 34 CO 0.37 0.71 0.25 0.77 -0.13 0.00 0.00 178.44 180.41 1v5o h SER 35 N 0.25 0.00 -0.35 1.25 4.64 -1.71 0.97 113.55 118.59 1v5o h SER 35 Ca 0.07 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.28 1v5o h SER 35 Cb 0.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1v5o h SER 35 CO 0.02 0.00 -0.20 0.78 -0.87 0.00 0.00 176.83 176.56 1v5o h ASN 36 N 0.00 0.79 0.13 4.97 2.35 -1.73 -1.59 115.58 120.50 1v5o h ASN 36 Ca 0.14 -0.42 -0.02 0.00 -0.55 0.00 0.00 56.30 55.45 1v5o h ASN 36 Cb 0.63 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.78 1v5o h ASN 36 CO -0.00 1.03 -0.10 0.15 -1.65 0.00 0.00 177.43 176.86 1v5o h PHE 37 N 0.54 0.00 0.14 1.19 3.57 -0.58 -2.44 116.94 119.36 1v5o h PHE 37 Ca 0.07 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1v5o h PHE 37 Cb 0.75 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.49 1v5o h PHE 37 CO 0.06 0.10 -0.07 0.00 -2.23 0.00 0.00 178.31 176.17 1v5o h ARG 38 N 0.00 -0.18 -1.15 1.11 3.08 -1.10 -2.58 114.38 113.55 1v5o h ARG 38 Ca -0.00 0.01 0.34 0.00 0.07 0.00 0.00 59.98 60.41 1v5o h ARG 38 Cb 0.19 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 30.17 1v5o h ARG 38 CO 0.01 0.21 0.73 0.28 -1.07 0.00 0.00 179.97 180.13 1v5o h VAL 39 N -0.95 0.33 0.23 2.04 2.07 -1.12 1.14 116.25 120.00 1v5o h VAL 39 Ca -0.02 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1v5o h VAL 39 Cb 0.47 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 1v5o h VAL 39 CO 0.03 0.05 -0.11 -0.07 0.02 0.00 0.00 177.57 177.49 1v5o h LEU 40 N 0.25 -0.26 -1.79 2.57 3.38 -1.46 -1.79 115.31 116.21 1v5o h LEU 40 Ca 0.70 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.45 1v5o h LEU 40 Cb 1.98 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.80 1v5o h LEU 40 CO -0.38 0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.26 1v5o h GLU 42 N 0.00 0.00 0.00 0.00 4.81 0.16 -0.54 114.58 119.01 1v5o h GLU 42 Ca 0.00 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 1v5o h GLU 42 Cb 0.13 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 1v5o h GLU 42 CO 0.00 0.01 -1.56 1.28 -0.73 0.00 0.00 179.01 178.01 1v5o n LEU 43 N -3.03 0.65 -0.03 1.64 4.77 0.85 -2.60 117.00 119.25 1v5o n LEU 43 Ca 0.03 0.28 -0.01 0.00 -0.03 0.00 0.00 56.01 56.28 1v5o n LEU 43 Cb 0.54 0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.73 1v5o n LEU 43 CO 0.35 0.13 -0.11 -0.33 -1.33 0.00 0.00 177.39 176.11 1v5o h GLU 44 N 0.00 0.00 -0.03 3.23 4.39 -1.28 -3.42 114.58 117.48 1v5o h GLU 44 Ca -0.17 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.49 1v5o h GLU 44 Cb 1.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.18 1v5o h GLU 44 CO 0.03 0.00 -0.12 1.03 -1.16 0.00 0.00 179.01 178.79 1v5o h SER 45 N -0.42 0.17 0.00 1.42 0.87 -1.33 -3.48 113.55 110.77 1v5o h SER 45 Ca 0.00 -0.63 0.00 0.00 -1.23 0.00 0.00 61.79 59.93 1v5o h SER 45 Cb 0.16 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1v5o h SER 45 CO 0.00 0.77 0.00 0.61 -0.53 0.00 0.00 176.83 177.68 1v5o n GLY 46 N 0.63 2.33 3.59 5.77 0.00 -1.07 -5.02 105.19 111.41 1v5o n GLY 46 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1v5o n GLY 46 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1v5o n VAL 47 N -0.31 2.31 -2.38 1.61 0.31 -1.26 -4.86 118.33 113.75 1v5o n VAL 47 Ca 0.00 -0.50 -0.43 0.00 -0.01 0.00 0.00 64.34 63.40 1v5o n VAL 47 Cb 0.00 -1.05 -0.02 0.00 -0.91 0.00 0.00 33.84 31.86 1v5o n VAL 47 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1v5o s PRO 48 N -1.90 3.86 0.50 5.55 0.04 -1.26 -4.01 135.00 137.78 1v5o s PRO 48 Ca 0.63 1.26 0.44 0.00 0.04 0.00 0.00 61.00 63.36 1v5o s PRO 48 Cb -0.58 -3.92 1.59 0.00 0.04 0.00 0.00 34.50 31.63 1v5o s PRO 48 CO 0.57 -1.20 1.48 0.00 0.04 0.00 0.00 177.00 177.90 1v5o n ALA 49 N 7.87 1.69 0.19 8.56 0.00 -1.26 0.21 120.51 137.76 1v5o n ALA 49 Ca 0.15 0.67 -0.15 0.00 0.00 0.00 0.00 53.44 54.12 1v5o n ALA 49 Cb 0.47 -1.07 -0.08 0.00 0.00 0.00 0.00 19.45 18.77 1v5o n ALA 49 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1v5o h GLU 50 N 0.00 -0.42 0.01 0.00 5.08 -1.97 -3.15 114.58 114.14 1v5o h GLU 50 Ca 0.88 0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 59.04 1v5o h GLU 50 Cb 3.38 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 32.69 1v5o h GLU 50 CO -0.11 -0.21 -1.18 0.93 -1.00 0.00 0.00 179.01 177.44 1v5o h GLU 51 N -0.54 0.03 -6.31 2.33 4.39 0.17 -3.45 114.58 111.20 1v5o h GLU 51 Ca -0.04 -0.05 -0.63 0.00 0.34 0.00 0.00 59.36 58.98 1v5o h GLU 51 Cb 0.40 0.02 0.03 0.00 -0.10 0.00 0.00 28.75 29.09 1v5o h GLU 51 CO 0.07 0.92 0.96 0.00 -1.16 0.00 0.00 179.01 179.80 1v5o n ALA 52 N -2.42 0.70 -2.64 3.43 0.00 0.56 -3.45 120.51 116.69 1v5o n ALA 52 Ca -0.05 0.35 -0.23 0.00 0.00 0.00 0.00 53.44 53.52 1v5o n ALA 52 Cb 0.97 -2.40 -0.07 0.00 0.00 0.00 0.00 19.45 17.96 1v5o n ALA 52 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1v5o s GLN 53 N 3.06 2.40 -0.03 0.00 -1.52 0.31 -4.83 119.66 119.05 1v5o s GLN 53 Ca 0.90 -1.39 0.01 0.00 -1.95 0.00 0.00 55.36 52.93 1v5o s GLN 53 Cb -0.76 -2.22 0.01 0.00 -0.22 0.00 0.00 33.01 29.82 1v5o s GLN 53 CO 0.50 0.32 -0.05 0.42 -0.25 0.00 0.00 175.29 176.23 1v5o s ILE 54 N -2.32 0.53 -0.03 1.08 1.09 -1.26 -3.07 121.20 117.23 1v5o s ILE 54 Ca 0.33 -0.17 0.06 0.00 -1.10 0.00 0.00 60.65 59.77 1v5o s ILE 54 Cb -0.06 -0.53 -0.01 0.00 -1.06 0.00 0.00 42.46 40.81 1v5o s ILE 54 CO 0.21 0.20 -0.20 -0.69 -0.10 0.00 0.00 174.94 174.36 1v5o s VAL 55 N 0.59 1.64 -0.03 2.92 1.01 -0.98 -1.83 120.40 123.72 1v5o s VAL 55 Ca -0.08 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.06 1v5o s VAL 55 Cb -0.11 -1.38 0.01 0.00 0.00 0.00 0.00 36.38 34.90 1v5o s VAL 55 CO 0.00 0.46 -0.06 -0.47 0.00 0.00 0.00 175.10 175.04 1v5o s TYR 56 N -0.27 0.73 0.00 5.22 5.04 -1.07 -3.02 117.35 123.98 1v5o s TYR 56 Ca 0.02 -0.18 0.00 0.00 -2.44 0.00 0.00 57.07 54.47 1v5o s TYR 56 Cb -0.10 -0.57 0.00 0.00 0.35 0.00 0.00 41.96 41.64 1v5o s TYR 56 CO 0.01 -0.11 0.00 -1.33 -1.34 0.00 0.00 175.55 172.77 1v5o n MET 57 N 3.54 0.00 -1.22 4.97 2.81 -1.26 -1.69 117.12 124.27 1v5o n MET 57 Ca -0.20 0.00 -0.00 0.00 -1.81 0.00 0.00 57.70 55.68 1v5o n MET 57 Cb 0.54 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.05 1v5o n MET 57 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1v5o n GLU 58 N 0.00 0.04 -4.24 0.03 -0.58 -1.26 -5.16 120.64 109.47 1v5o n GLU 58 Ca 0.00 -0.05 -0.14 0.00 -0.42 0.00 0.00 57.16 56.55 1v5o n GLU 58 Cb 0.00 0.17 -0.10 0.00 -0.57 0.00 0.00 31.44 30.94 1v5o n GLU 58 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 1v5o s GLN 59 N 0.00 1.17 -0.55 3.49 -0.21 -0.68 -5.11 119.66 117.77 1v5o s GLN 59 Ca 0.00 -1.59 -0.05 0.00 0.02 0.00 0.00 55.36 53.74 1v5o s GLN 59 Cb 0.01 -0.15 0.14 0.00 1.00 0.00 0.00 33.01 34.01 1v5o s GLN 59 CO -0.00 -0.21 0.38 -1.17 -2.12 0.00 0.00 175.29 172.16 1v5o s LEU 60 N -3.19 5.47 0.12 2.90 2.96 -1.26 -2.60 118.68 123.08 1v5o s LEU 60 Ca 0.29 -2.40 -0.34 0.00 -0.22 0.00 0.00 54.13 51.46 1v5o s LEU 60 Cb 0.07 -1.91 -0.13 0.00 0.50 0.00 0.00 46.19 44.71 1v5o s LEU 60 CO 0.07 -0.51 1.66 0.18 -1.32 0.00 0.00 176.35 176.43 1v5o n LEU 61 N 4.16 3.30 -2.48 -0.68 4.77 -0.76 -4.88 117.00 120.42 1v5o n LEU 61 Ca 0.02 1.06 -0.11 0.00 -0.03 0.00 0.00 56.01 56.95 1v5o n LEU 61 Cb 0.40 -1.44 0.04 0.00 -2.33 0.00 0.00 43.42 40.09 1v5o n LEU 61 CO 0.36 -0.18 0.07 0.35 -1.33 0.00 0.00 177.39 176.66 1v5o n THR 62 N 3.84 1.82 -3.65 -5.08 -2.24 -1.26 -4.51 114.28 103.19 1v5o n THR 62 Ca 0.18 -3.49 -0.29 0.00 -2.27 0.00 0.00 64.05 58.18 1v5o n THR 62 Cb 0.30 0.24 -0.15 0.00 -2.10 0.00 0.00 70.33 68.62 1v5o n THR 62 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1v5o s ASP 63 N -3.71 3.77 0.33 3.42 -1.08 -1.26 -4.96 116.67 113.18 1v5o s ASP 63 Ca 0.37 -1.45 0.23 0.00 -0.52 0.00 0.00 52.55 51.19 1v5o s ASP 63 Cb 0.36 -0.62 0.32 0.00 -1.46 0.00 0.00 42.92 41.52 1v5o s ASP 63 CO -0.01 -0.42 1.48 -2.24 0.52 0.00 0.00 175.17 174.50 1v5o h ASP 64 N 8.24 0.00 1.51 -0.34 3.04 -1.95 -3.09 116.42 123.83 1v5o h ASP 64 Ca -0.17 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.61 1v5o h ASP 64 Cb 1.02 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.31 1v5o h ASP 64 CO 0.45 0.01 -0.10 0.45 -2.04 0.00 0.00 179.24 178.01 1v5o h HIS 65 N 0.00 0.00 -3.65 4.15 3.86 -1.97 -2.75 115.15 114.78 1v5o h HIS 65 Ca 0.00 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.71 1v5o h HIS 65 Cb 0.95 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.40 1v5o h HIS 65 CO 0.00 0.00 0.06 0.00 0.86 0.00 0.00 177.93 178.85 1v5o s SER 67 N -2.61 4.74 -0.09 0.00 1.04 -1.26 0.49 113.70 116.00 1v5o s SER 67 Ca 0.52 -0.36 -0.20 0.00 0.48 0.00 0.00 55.95 56.39 1v5o s SER 67 Cb -0.10 -0.19 -0.16 0.00 0.10 0.00 0.00 66.02 65.66 1v5o s SER 67 CO 0.23 -1.57 0.68 -0.07 0.98 0.00 0.00 173.24 173.49 1v5o h LEU 68 N -0.23 -0.08 -1.95 2.42 3.38 -1.45 -3.20 115.31 114.20 1v5o h LEU 68 Ca -0.37 -0.51 0.25 0.00 0.09 0.00 0.00 57.88 57.35 1v5o h LEU 68 Cb 1.28 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 42.01 1v5o h LEU 68 CO 0.43 0.61 0.62 1.23 0.09 0.00 0.00 178.44 181.43 1v5o h GLY 69 N -0.92 0.08 0.86 0.83 0.00 0.71 0.47 103.07 105.11 1v5o h GLY 69 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1v5o h GLY 69 CO 0.02 -0.00 -0.07 0.23 0.00 0.00 0.00 176.54 176.71 1v5o h SER 70 N 0.04 -0.17 -0.38 0.19 0.87 -1.70 -2.76 113.55 109.64 1v5o h SER 70 Ca 0.42 -0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 60.85 1v5o h SER 70 Cb 1.62 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 63.60 1v5o h SER 70 CO -0.02 0.01 0.20 1.88 -0.53 0.00 0.00 176.83 178.37 1v5o h TYR 71 N -0.35 0.56 0.00 2.24 0.05 -0.94 -3.46 116.97 115.07 1v5o h TYR 71 Ca -0.02 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1v5o h TYR 71 Cb 0.27 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 37.83 1v5o h TYR 71 CO -0.02 0.41 0.00 0.41 -1.05 0.00 0.00 178.16 177.91 1v5o n GLY 72 N -1.28 0.95 3.71 3.88 0.00 -0.62 -5.11 105.19 106.72 1v5o n GLY 72 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1v5o n GLY 72 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1v5o s LEU 73 N 0.00 4.22 0.48 0.99 1.02 -1.07 -5.01 118.68 119.31 1v5o s LEU 73 Ca 0.00 0.56 0.02 0.00 0.02 0.00 0.00 54.13 54.73 1v5o s LEU 73 Cb 0.00 -2.47 -0.02 0.00 0.02 0.00 0.00 46.19 43.72 1v5o s LEU 73 CO 0.00 0.03 0.04 -1.59 0.02 0.00 0.00 176.35 174.85 1v5o s LYS 74 N 0.73 2.11 0.13 1.70 -2.85 -1.26 -4.46 119.74 115.84 1v5o s LYS 74 Ca 0.19 -2.33 -0.31 0.00 -1.00 0.00 0.00 55.97 52.53 1v5o s LYS 74 Cb -0.14 -1.26 -0.08 0.00 -2.06 0.00 0.00 37.83 34.29 1v5o s LYS 74 CO 0.06 -0.39 1.33 0.16 0.10 0.00 0.00 175.35 176.62 1v5o s ASP 75 N -3.79 6.89 0.00 0.03 1.47 -1.26 -2.89 116.67 117.12 1v5o s ASP 75 Ca 0.12 2.30 0.00 0.00 1.18 0.00 0.00 52.55 56.15 1v5o s ASP 75 Cb 0.02 -2.59 0.00 0.00 -0.34 0.00 0.00 42.92 40.01 1v5o s ASP 75 CO 0.07 -0.58 0.00 0.61 0.68 0.00 0.00 175.17 175.95 1v5o n GLY 76 N 3.12 0.96 3.96 2.12 0.00 -1.09 -4.79 105.19 109.46 1v5o n GLY 76 Ca 0.09 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.69 1v5o n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1v5o s ASP 77 N -2.18 5.69 -0.03 1.61 1.01 -1.11 -5.03 116.67 116.62 1v5o s ASP 77 Ca 0.00 0.23 -0.00 0.00 0.71 0.00 0.00 52.55 53.49 1v5o s ASP 77 Cb 0.00 -1.38 0.03 0.00 1.01 0.00 0.00 42.92 42.57 1v5o s ASP 77 CO 0.00 -0.82 0.02 -0.32 0.21 0.00 0.00 175.17 174.26 1v5o s MET 78 N -4.62 0.19 0.29 8.23 1.75 -1.26 -2.60 119.30 121.28 1v5o s MET 78 Ca 0.51 0.16 0.09 0.00 -1.25 0.00 0.00 55.69 55.20 1v5o s MET 78 Cb -0.10 -0.50 -0.06 0.00 2.84 0.00 0.00 34.83 37.01 1v5o s MET 78 CO 0.38 -0.20 -0.12 0.14 -0.65 0.00 0.00 175.02 174.58 1v5o s VAL 79 N 1.38 2.04 0.01 10.11 -7.23 0.17 -4.77 120.40 122.11 1v5o s VAL 79 Ca -0.05 -2.23 0.06 0.00 -1.81 0.00 0.00 61.98 57.95 1v5o s VAL 79 Cb -0.13 -2.42 -0.03 0.00 0.56 0.00 0.00 36.38 34.36 1v5o s VAL 79 CO -0.03 -0.33 -0.16 -0.69 -0.31 0.00 0.00 175.10 173.58 1v5o s VAL 80 N -2.76 2.94 0.05 1.32 1.01 -1.17 -2.11 120.40 119.69 1v5o s VAL 80 Ca 0.30 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.30 1v5o s VAL 80 Cb 0.01 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.14 1v5o s VAL 80 CO 0.13 0.43 0.06 -0.22 0.00 0.00 0.00 175.10 175.50 1v5o s LEU 81 N -1.20 3.73 -0.15 3.92 0.20 0.21 -2.31 118.68 123.08 1v5o s LEU 81 Ca 0.14 -0.00 -0.06 0.00 0.69 0.00 0.00 54.13 54.89 1v5o s LEU 81 Cb -0.11 -2.34 0.07 0.00 -0.43 0.00 0.00 46.19 43.38 1v5o s LEU 81 CO 0.04 0.21 0.33 -0.76 -0.29 0.00 0.00 176.35 175.88 1v5o s LEU 82 N -2.14 -0.28 -0.30 -0.68 1.02 -1.17 -3.83 118.68 111.29 1v5o s LEU 82 Ca 0.26 0.75 -0.11 0.00 0.02 0.00 0.00 54.13 55.06 1v5o s LEU 82 Cb -0.12 1.00 -0.03 0.00 0.02 0.00 0.00 46.19 47.07 1v5o s LEU 82 CO 0.18 -0.22 0.18 -1.58 0.02 0.00 0.00 176.35 174.94 1v5o s GLN 83 N 2.18 3.61 0.69 1.70 0.74 -1.26 -0.53 119.66 126.79 1v5o s GLN 83 Ca -0.03 -0.55 -0.12 0.00 0.05 0.00 0.00 55.36 54.72 1v5o s GLN 83 Cb -0.11 -3.65 0.17 0.00 1.10 0.00 0.00 33.01 30.52 1v5o s GLN 83 CO -0.10 -0.33 0.55 1.63 -0.55 0.00 0.00 175.29 176.48 1v5o n LYS 84 N 5.04 -2.56 -0.80 1.67 5.02 -1.22 -4.55 118.16 120.76 1v5o n LYS 84 Ca -0.14 -0.89 -0.33 0.00 -2.02 0.00 0.00 58.31 54.93 1v5o n LYS 84 Cb 0.50 -0.91 0.12 0.00 -0.02 0.00 0.00 35.03 34.72 1v5o n LYS 84 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1v5o n ASP 85 N -4.15 -2.59 -1.73 4.39 9.92 -1.26 -4.84 116.55 116.28 1v5o n ASP 85 Ca 0.08 0.22 -0.08 0.00 -0.53 0.00 0.00 54.79 54.47 1v5o n ASP 85 Cb 0.32 -1.09 0.19 0.00 -0.64 0.00 0.00 41.12 39.90 1v5o n ASP 85 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1v5o n ASN 86 N -0.75 3.89 -3.65 -2.24 5.15 -1.26 -4.81 115.26 111.59 1v5o n ASN 86 Ca 0.04 -2.96 -0.02 0.00 -0.60 0.00 0.00 54.58 51.04 1v5o n ASN 86 Cb 0.56 -0.70 -0.07 0.00 -0.53 0.00 0.00 39.78 39.04 1v5o n ASN 86 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1v5o s VAL 87 N -2.33 0.00 0.00 3.44 0.11 -1.26 -5.11 120.40 115.26 1v5o s VAL 87 Ca 0.40 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.45 1v5o s VAL 87 Cb 0.33 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 34.18 1v5o s VAL 87 CO 0.09 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 172.47 1v5o n GLY 88 N 2.78 0.34 3.59 6.54 0.00 -1.26 -5.17 105.19 112.02 1v5o n GLY 88 Ca -0.15 -0.15 -0.00 0.00 0.00 0.00 0.00 46.02 45.71 1v5o n GLY 88 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1v5o s LEU 89 N 0.00 -1.03 -0.04 0.99 0.05 -1.26 -5.06 118.68 112.33 1v5o s LEU 89 Ca 0.00 1.41 0.06 0.00 0.05 0.00 0.00 54.13 55.65 1v5o s LEU 89 Cb 0.00 2.17 -0.01 0.00 -2.05 0.00 0.00 46.19 46.30 1v5o s LEU 89 CO 0.00 -0.20 -0.24 -0.13 -0.55 0.00 0.00 176.35 175.24 1v5o s ARG 90 N 2.80 2.23 0.16 1.48 0.52 -1.26 -5.14 118.95 119.75 1v5o s ARG 90 Ca -0.05 -0.85 0.08 0.00 -0.52 0.00 0.00 55.73 54.39 1v5o s ARG 90 Cb -0.11 -1.98 -0.04 0.00 0.52 0.00 0.00 34.95 33.34 1v5o s ARG 90 CO -0.19 0.41 -0.09 0.95 0.02 0.00 0.00 175.30 176.41 1v5o s THR 91 N -0.29 3.26 0.82 0.02 -4.23 -1.26 -5.13 115.64 108.83 1v5o s THR 91 Ca 0.01 -1.54 -0.12 0.00 -1.18 0.00 0.00 61.69 58.86 1v5o s THR 91 Cb -0.12 -2.59 0.08 0.00 1.34 0.00 0.00 72.50 71.21 1v5o s THR 91 CO 0.02 -0.05 1.10 -2.16 -0.54 0.00 0.00 174.62 172.99 1v5o s PRO 92 N -2.66 1.92 -0.13 3.99 0.04 -1.26 -5.05 135.00 131.85 1v5o s PRO 92 Ca 0.24 0.58 -0.07 0.00 0.04 0.00 0.00 61.00 61.78 1v5o s PRO 92 Cb -0.09 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 1v5o s PRO 92 CO 0.15 -1.72 0.14 0.20 0.04 0.00 0.00 177.00 175.81 1v5o s GLY 93 N -3.93 2.13 0.24 0.56 0.00 -1.26 -5.10 107.32 99.96 1v5o s GLY 93 Ca 0.61 -0.65 -0.03 0.00 0.00 0.00 0.00 44.72 44.65 1v5o s GLY 93 CO 0.54 -0.29 0.46 -1.60 0.00 0.00 0.00 173.10 172.20 1v5o s ARG 94 N -0.79 3.57 -0.33 2.90 6.06 -1.26 -5.08 118.95 124.03 1v5o s ARG 94 Ca 0.14 -0.18 0.04 0.00 -2.50 0.00 0.00 55.73 53.23 1v5o s ARG 94 Cb -0.12 -2.76 0.09 0.00 0.06 0.00 0.00 34.95 32.23 1v5o s ARG 94 CO 0.03 0.33 0.03 0.99 -2.50 0.00 0.00 175.30 174.17 1v5o s THR 95 N -1.95 2.28 -0.23 4.11 2.01 -1.26 -5.08 115.64 115.52 1v5o s THR 95 Ca 0.41 -2.24 -0.29 0.00 0.31 0.00 0.00 61.69 59.88 1v5o s THR 95 Cb -0.11 -2.64 -0.01 0.00 0.01 0.00 0.00 72.50 69.75 1v5o s THR 95 CO 0.29 -0.52 1.32 -2.16 -0.69 0.00 0.00 174.62 172.86 1v5o s PRO 96 N 0.93 4.04 0.19 4.92 0.04 -1.26 -4.97 135.00 138.90 1v5o s PRO 96 Ca 0.08 1.47 -0.23 0.00 0.04 0.00 0.00 61.00 62.36 1v5o s PRO 96 Cb -0.19 -3.85 0.05 0.00 0.04 0.00 0.00 34.50 30.56 1v5o s PRO 96 CO -0.07 -0.96 0.68 -1.54 0.04 0.00 0.00 177.00 175.14 1v5o s SER 97 N 2.57 -0.43 0.00 6.66 1.04 -1.26 -5.14 113.70 117.15 1v5o s SER 97 Ca 0.57 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.77 1v5o s SER 97 Cb -0.20 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1v5o s SER 97 CO 0.20 -1.08 0.00 0.61 0.98 0.00 0.00 173.24 173.95 1v5o n GLY 98 N -0.40 -0.54 3.77 7.32 0.00 -1.26 -5.18 105.19 108.90 1v5o n GLY 98 Ca -0.11 0.67 -0.30 0.00 0.00 0.00 0.00 46.02 46.28 1v5o n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5o s PRO 99 N 0.00 0.11 -0.00 1.61 0.04 -1.26 -5.10 135.00 130.40 1v5o s PRO 99 Ca 0.00 -0.10 -0.28 0.00 0.04 0.00 0.00 61.00 60.66 1v5o s PRO 99 Cb 0.00 -1.76 0.09 0.00 0.04 0.00 0.00 34.50 32.88 1v5o s PRO 99 CO 0.00 -2.82 0.78 -1.54 0.04 0.00 0.00 177.00 173.46 1v5o s SER 100 N -4.30 -0.49 0.42 6.66 1.04 -1.26 -5.14 113.70 110.63 1v5o s SER 100 Ca 0.70 0.25 0.00 0.00 0.48 0.00 0.00 55.95 57.38 1v5o s SER 100 Cb -0.09 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.50 1v5o s SER 100 CO 0.54 -0.66 0.00 -0.24 0.98 0.00 0.00 173.24 173.86 1v5o n SER 101 N 0.19 -6.18 0.00 7.02 2.88 -1.26 -5.38 113.62 110.89 1v5o n SER 101 Ca -0.14 1.30 0.00 0.00 -1.33 0.00 0.00 58.87 58.71 1v5o n SER 101 Cb 0.61 -3.38 0.00 0.00 -0.75 0.00 0.00 64.21 60.68 1v5o n SER 101 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42