#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5o n SER 2 N 0.00 -0.55 -4.07 1.61 2.88 -1.26 -5.06 113.62 107.16 1v5o n SER 2 Ca 0.00 0.49 -0.32 0.00 -1.33 0.00 0.00 58.87 57.71 1v5o n SER 2 Cb 0.00 0.72 -0.15 0.00 -0.75 0.00 0.00 64.21 64.03 1v5o n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1v5o s SER 3 N -4.69 4.33 -0.01 -3.46 0.01 -1.26 -4.98 113.70 103.63 1v5o s SER 3 Ca 0.00 -1.33 -0.02 0.00 1.31 0.00 0.00 55.95 55.91 1v5o s SER 3 Cb 0.00 -1.54 -0.01 0.00 0.21 0.00 0.00 66.02 64.68 1v5o s SER 3 CO 0.00 -0.17 -0.04 0.61 0.41 0.00 0.00 173.24 174.05 1v5o n GLY 4 N 4.45 -0.25 0.73 3.44 0.00 -1.26 -5.00 105.19 107.30 1v5o n GLY 4 Ca -0.15 -0.04 -0.03 0.00 0.00 0.00 0.00 46.02 45.81 1v5o n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v5o n SER 5 N -2.82 1.32 0.06 1.61 7.64 -1.26 -5.08 113.62 115.09 1v5o n SER 5 Ca -0.02 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.06 1v5o n SER 5 Cb 0.06 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.80 1v5o n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1v5o n SER 6 N -3.75 -1.16 0.00 6.43 2.88 -1.26 -5.17 113.62 111.58 1v5o n SER 6 Ca -0.04 0.59 0.00 0.00 -1.33 0.00 0.00 58.87 58.08 1v5o n SER 6 Cb 0.16 1.42 0.00 0.00 -0.75 0.00 0.00 64.21 65.04 1v5o n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v5o n GLY 7 N -1.16 -1.03 3.30 0.46 0.00 -1.26 -5.00 105.19 100.50 1v5o n GLY 7 Ca 0.00 -1.64 -0.25 0.00 0.00 0.00 0.00 46.02 44.13 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 -1.30 1.16 -0.17 1.61 0.00 0.91 -4.80 119.30 116.71 1v5o s MET 8 Ca 0.00 -1.19 -0.18 0.00 0.00 0.00 0.00 55.69 54.32 1v5o s MET 8 Cb 0.00 -1.46 -0.04 0.00 0.00 0.00 0.00 34.83 33.34 1v5o s MET 8 CO 0.00 0.34 0.50 -1.17 0.00 0.00 0.00 175.02 174.69 1v5o s LEU 9 N -1.93 4.19 -0.25 0.18 2.96 -1.26 -1.74 118.68 120.83 1v5o s LEU 9 Ca 0.07 0.72 -0.01 0.00 -0.22 0.00 0.00 54.13 54.69 1v5o s LEU 9 Cb -0.10 -2.70 0.03 0.00 0.50 0.00 0.00 46.19 43.92 1v5o s LEU 9 CO 0.04 -0.12 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.26 1v5o s ILE 10 N 1.30 2.80 -0.32 6.68 -1.09 0.19 -3.16 121.20 127.58 1v5o s ILE 10 Ca 0.25 -1.12 -0.22 0.00 -2.23 0.00 0.00 60.65 57.33 1v5o s ILE 10 Cb -0.15 -2.45 -0.00 0.00 -1.58 0.00 0.00 42.46 38.27 1v5o s ILE 10 CO 0.10 0.15 0.71 -0.89 -1.23 0.00 0.00 174.94 173.78 1v5o s THR 11 N 1.29 4.84 0.25 2.92 2.01 -1.04 0.92 115.64 126.83 1v5o s THR 11 Ca -0.01 0.92 0.02 0.00 0.31 0.00 0.00 61.69 62.93 1v5o s THR 11 Cb -0.17 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.20 1v5o s THR 11 CO -0.04 -0.26 0.42 -0.69 -0.69 0.00 0.00 174.62 173.35 1v5o s VAL 12 N 2.83 5.20 -0.26 3.82 1.01 0.49 0.15 120.40 133.64 1v5o s VAL 12 Ca 0.29 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 1v5o s VAL 12 Cb -0.14 -3.81 0.14 0.00 0.00 0.00 0.00 36.38 32.56 1v5o s VAL 12 CO 0.13 -0.33 0.36 -0.47 0.00 0.00 0.00 175.10 174.79 1v5o s TYR 13 N -2.02 -0.76 0.27 5.22 6.14 -0.91 -2.12 117.35 123.16 1v5o s TYR 13 Ca 0.37 0.42 -0.09 0.00 0.64 0.00 0.00 57.07 58.41 1v5o s TYR 13 Cb -0.10 -0.16 -0.07 0.00 0.42 0.00 0.00 41.96 42.05 1v5o s TYR 13 CO 0.31 -0.83 0.59 0.00 0.64 0.00 0.00 175.55 176.26 1v5o n VAL 15 N -0.41 0.02 0.00 0.00 0.24 -1.25 -1.60 118.33 115.33 1v5o n VAL 15 Ca 0.01 0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.31 1v5o n VAL 15 Cb 0.53 -1.02 0.00 0.00 -1.47 0.00 0.00 33.84 31.88 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 -2.78 0.00 -1.40 7.34 1.74 -1.26 -2.21 116.66 118.09 1v5o n ARG 16 Ca 0.00 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.94 1v5o n ARG 16 Cb 0.25 -0.14 -0.06 0.00 -1.02 0.00 0.00 32.46 31.49 1v5o n ARG 16 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1v5o n ARG 17 N 0.00 -1.32 -2.02 5.56 1.74 -1.26 -1.36 116.66 117.99 1v5o n ARG 17 Ca 0.00 0.82 -0.04 0.00 -0.77 0.00 0.00 57.85 57.86 1v5o n ARG 17 Cb 0.00 -5.08 0.02 0.00 -1.02 0.00 0.00 32.46 26.38 1v5o n ARG 17 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1v5o n ASP 18 N -0.59 -3.42 -2.86 0.55 2.03 -1.26 -4.51 116.55 106.49 1v5o n ASP 18 Ca -0.14 -0.20 -0.05 0.00 0.52 0.00 0.00 54.79 54.92 1v5o n ASP 18 Cb 0.46 -1.94 0.01 0.00 -0.72 0.00 0.00 41.12 38.92 1v5o n ASP 18 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1v5o n LEU 19 N -1.98 -7.27 0.10 -2.67 7.94 -0.47 -4.96 117.00 107.69 1v5o n LEU 19 Ca -0.02 0.95 0.00 0.00 -1.11 0.00 0.00 56.01 55.83 1v5o n LEU 19 Cb 0.53 -3.11 0.00 0.00 0.53 0.00 0.00 43.42 41.38 1v5o n LEU 19 CO 0.18 -2.59 0.00 0.41 -1.11 0.00 0.00 177.39 174.28 1v5o n THR 20 N 0.37 0.00 -2.03 1.96 -1.04 -0.94 -5.10 114.28 107.50 1v5o n THR 20 Ca 0.03 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1v5o n THR 20 Cb 0.24 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.75 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 -2.85 -3.87 -4.38 -2.82 2.13 -0.94 -4.98 120.64 102.92 1v5o n GLU 21 Ca 0.00 2.94 -0.20 0.00 0.66 0.00 0.00 57.16 60.56 1v5o n GLU 21 Cb 0.00 -3.69 -0.10 0.00 0.27 0.00 0.00 31.44 27.92 1v5o n GLU 21 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1v5o s VAL 22 N -0.45 1.84 -0.05 6.31 0.11 -0.63 -4.88 120.40 122.65 1v5o s VAL 22 Ca -0.01 -2.23 -0.01 0.00 -2.93 0.00 0.00 61.98 56.80 1v5o s VAL 22 Cb 0.00 -2.17 0.03 0.00 -1.53 0.00 0.00 36.38 32.71 1v5o s VAL 22 CO 0.03 -0.50 0.02 -0.89 -3.33 0.00 0.00 175.10 170.43 1v5o s THR 23 N -2.91 0.19 0.13 5.04 2.01 -1.26 0.18 115.64 119.02 1v5o s THR 23 Ca 0.25 0.21 -0.15 0.00 0.31 0.00 0.00 61.69 62.31 1v5o s THR 23 Cb -0.00 -0.36 0.03 0.00 0.01 0.00 0.00 72.50 72.17 1v5o s THR 23 CO 0.09 0.21 0.39 0.72 -0.69 0.00 0.00 174.62 175.35 1v5o s PHE 24 N 1.84 -0.16 0.39 4.92 -0.71 -0.90 -5.01 117.98 118.35 1v5o s PHE 24 Ca 0.02 -0.17 0.08 0.00 -1.04 0.00 0.00 56.93 55.81 1v5o s PHE 24 Cb -0.12 0.24 -0.05 0.00 -1.21 0.00 0.00 43.02 41.88 1v5o s PHE 24 CO -0.04 -0.71 0.17 -1.12 -1.34 0.00 0.00 175.22 172.18 1v5o s SER 25 N -2.82 4.49 0.17 1.98 0.01 -1.26 0.19 113.70 116.46 1v5o s SER 25 Ca 0.04 -0.98 -0.07 0.00 1.31 0.00 0.00 55.95 56.24 1v5o s SER 25 Cb 0.02 -0.54 -0.02 0.00 0.21 0.00 0.00 66.02 65.69 1v5o s SER 25 CO -0.11 -0.46 0.26 -0.76 0.41 0.00 0.00 173.24 172.57 1v5o s LEU 26 N -3.89 1.03 -0.25 2.44 1.43 0.26 -4.87 118.68 114.84 1v5o s LEU 26 Ca 0.40 -0.97 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 1v5o s LEU 26 Cb 0.02 1.05 0.07 0.00 0.03 0.00 0.00 46.19 47.35 1v5o s LEU 26 CO 0.23 -0.89 -0.04 -1.58 0.23 0.00 0.00 176.35 174.29 1v5o s GLN 27 N -4.00 1.65 0.06 1.70 0.74 -1.26 0.53 119.66 119.08 1v5o s GLN 27 Ca 0.20 -1.13 0.00 0.00 0.05 0.00 0.00 55.36 54.49 1v5o s GLN 27 Cb 0.04 -2.66 -0.00 0.00 1.10 0.00 0.00 33.01 31.49 1v5o s GLN 27 CO 0.02 -0.65 0.02 1.33 -0.55 0.00 0.00 175.29 175.46 1v5o n VAL 28 N 4.61 0.00 -4.36 1.34 0.24 -0.71 -4.92 118.33 114.53 1v5o n VAL 28 Ca -0.10 -0.33 -0.25 0.00 -2.04 0.00 0.00 64.34 61.62 1v5o n VAL 28 Cb 0.43 0.11 -0.09 0.00 -1.47 0.00 0.00 33.84 32.83 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 -1.36 4.14 0.31 -1.34 0.01 -1.26 -0.06 114.94 115.38 1v5o s ASN 29 Ca 0.02 -1.01 0.26 0.00 -0.71 0.00 0.00 52.86 51.42 1v5o s ASN 29 Cb 0.00 -0.52 0.89 0.00 0.41 0.00 0.00 41.25 42.04 1v5o s ASN 29 CO 0.02 -0.24 1.76 1.55 -1.51 0.00 0.00 177.10 178.69 1v5o h PRO 30 N 1.83 0.00 -0.83 -0.60 0.13 -1.96 -2.90 132.00 127.66 1v5o h PRO 30 Ca -0.43 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.22 1v5o h PRO 30 Cb 1.25 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.11 1v5o h PRO 30 CO 0.67 0.00 0.43 -3.47 -0.23 0.00 0.00 178.00 175.40 1v5o n ASP 31 N -2.51 4.55 -4.36 1.44 -0.08 -1.26 0.22 116.55 114.55 1v5o n ASP 31 Ca 0.03 -3.71 -0.35 0.00 -1.51 0.00 0.00 54.79 49.25 1v5o n ASP 31 Cb 0.36 -0.79 -0.14 0.00 2.34 0.00 0.00 41.12 42.89 1v5o n ASP 31 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 1v5o s PHE 32 N -3.45 2.97 0.44 -0.67 5.36 -1.10 -4.99 117.98 116.54 1v5o s PHE 32 Ca 0.56 -0.75 -0.24 0.00 -0.96 0.00 0.00 56.93 55.53 1v5o s PHE 32 Cb 0.47 -2.08 -0.09 0.00 -0.34 0.00 0.00 43.02 40.97 1v5o s PHE 32 CO 0.05 -0.42 1.20 0.39 -1.46 0.00 0.00 175.22 174.98 1v5o n GLU 33 N 4.52 1.71 -0.32 10.12 4.71 -1.26 -1.84 120.64 138.28 1v5o n GLU 33 Ca -0.18 0.61 0.18 0.00 -0.01 0.00 0.00 57.16 57.77 1v5o n GLU 33 Cb 0.51 -2.30 0.44 0.00 -1.01 0.00 0.00 31.44 29.08 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 1.81 0.56 -1.07 -4.62 7.12 0.81 0.64 115.31 120.57 1v5o h LEU 34 Ca -0.47 0.08 0.00 0.00 0.13 0.00 0.00 57.88 57.62 1v5o h LEU 34 Cb 1.31 -0.01 -0.04 0.00 -0.53 0.00 0.00 40.66 41.38 1v5o h LEU 34 CO 0.58 0.16 0.57 0.77 -0.13 0.00 0.00 178.44 180.39 1v5o h SER 35 N 0.53 1.05 -0.28 1.25 4.64 -1.64 0.39 113.55 119.49 1v5o h SER 35 Ca 0.57 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.79 1v5o h SER 35 Cb 1.22 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 1v5o h SER 35 CO -0.31 0.79 0.03 0.78 -0.87 0.00 0.00 176.83 177.25 1v5o h ASN 36 N 1.23 0.54 0.54 4.97 4.21 -0.04 -1.05 115.58 125.98 1v5o h ASN 36 Ca 0.33 -0.10 -0.15 0.00 1.21 0.00 0.00 56.30 57.58 1v5o h ASN 36 Cb -0.10 -0.14 -0.02 0.00 -1.12 0.00 0.00 38.32 36.95 1v5o h ASN 36 CO -0.07 0.59 -0.69 0.15 -1.29 0.00 0.00 177.43 176.13 1v5o h PHE 37 N 0.56 0.17 0.36 1.19 3.57 -0.46 -3.11 116.94 119.23 1v5o h PHE 37 Ca 0.12 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1v5o h PHE 37 Cb 0.31 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.03 1v5o h PHE 37 CO 0.01 0.77 -0.17 0.00 -2.23 0.00 0.00 178.31 176.69 1v5o h ARG 38 N 0.09 -0.47 -1.07 1.11 3.08 -0.22 -1.71 114.38 115.19 1v5o h ARG 38 Ca -0.01 0.03 0.43 0.00 0.07 0.00 0.00 59.98 60.50 1v5o h ARG 38 Cb 1.22 0.11 -0.17 0.00 0.08 0.00 0.00 29.97 31.21 1v5o h ARG 38 CO 0.10 -0.31 0.60 0.28 -1.07 0.00 0.00 179.97 179.57 1v5o n VAL 39 N -4.17 -0.39 0.31 2.04 0.31 -0.47 0.14 118.33 116.09 1v5o n VAL 39 Ca -0.06 1.99 -0.15 0.00 -0.01 0.00 0.00 64.34 66.11 1v5o n VAL 39 Cb 0.19 -3.23 -0.08 0.00 -0.91 0.00 0.00 33.84 29.82 1v5o n VAL 39 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1v5o h LEU 40 N 0.00 -0.68 -2.39 7.52 3.38 -1.50 -1.53 115.31 120.11 1v5o h LEU 40 Ca 0.85 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.80 1v5o h LEU 40 Cb 2.36 0.18 0.00 0.00 0.09 0.00 0.00 40.66 43.28 1v5o h LEU 40 CO -0.71 -0.33 0.08 0.00 0.09 0.00 0.00 178.44 177.57 1v5o h GLU 42 N 0.00 0.00 0.03 0.00 4.81 0.18 -2.64 114.58 116.97 1v5o h GLU 42 Ca 0.00 0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 58.89 1v5o h GLU 42 Cb 0.17 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 1v5o h GLU 42 CO 0.00 0.00 -1.91 1.28 -0.73 0.00 0.00 179.01 177.65 1v5o n LEU 43 N -2.24 2.24 0.15 1.64 4.77 0.35 -2.53 117.00 121.37 1v5o n LEU 43 Ca 0.05 0.27 -0.06 0.00 -0.03 0.00 0.00 56.01 56.24 1v5o n LEU 43 Cb 0.44 -0.97 -0.03 0.00 -2.33 0.00 0.00 43.42 40.53 1v5o n LEU 43 CO 0.33 0.58 0.41 -0.08 -1.33 0.00 0.00 177.39 177.30 1v5o h GLU 44 N -0.59 -0.37 0.01 3.23 4.22 -1.30 -3.35 114.58 116.44 1v5o h GLU 44 Ca -0.48 0.03 -0.00 0.00 0.08 0.00 0.00 59.36 58.98 1v5o h GLU 44 Cb 1.65 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.98 1v5o h GLU 44 CO -0.17 -0.25 -0.00 1.03 -2.18 0.00 0.00 179.01 177.44 1v5o h SER 45 N -0.45 -0.01 0.00 1.04 0.87 -1.72 -3.48 113.55 109.80 1v5o h SER 45 Ca -0.04 -0.53 0.00 0.00 -1.23 0.00 0.00 61.79 59.99 1v5o h SER 45 Cb 0.30 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.26 1v5o h SER 45 CO 0.06 0.53 0.00 0.61 -0.53 0.00 0.00 176.83 177.50 1v5o n GLY 46 N 0.37 2.02 3.62 5.77 0.00 -1.05 -5.04 105.19 110.88 1v5o n GLY 46 Ca -0.09 0.00 -0.41 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 -0.27 2.49 -2.38 1.61 0.31 -1.25 -4.82 118.33 114.03 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 -1.21 -0.02 0.00 -0.91 0.00 0.00 33.84 31.70 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 -2.06 3.88 0.49 5.55 0.04 -1.26 -3.95 135.00 137.70 1v5o s PRO 48 Ca 0.63 1.28 0.43 0.00 0.04 0.00 0.00 61.00 63.39 1v5o s PRO 48 Cb -0.55 -3.91 1.56 0.00 0.04 0.00 0.00 34.50 31.65 1v5o s PRO 48 CO 0.57 -1.16 1.45 0.00 0.04 0.00 0.00 177.00 177.89 1v5o n ALA 49 N 7.79 1.66 0.18 8.56 0.00 -1.26 0.24 120.51 137.67 1v5o n ALA 49 Ca 0.15 0.66 -0.14 0.00 0.00 0.00 0.00 53.44 54.10 1v5o n ALA 49 Cb 0.46 -1.04 -0.08 0.00 0.00 0.00 0.00 19.45 18.79 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 -0.41 0.00 0.00 5.08 -1.98 -3.16 114.58 114.11 1v5o h GLU 50 Ca 0.86 0.03 -0.20 0.00 -1.00 0.00 0.00 59.36 59.05 1v5o h GLU 50 Cb 3.32 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 32.63 1v5o h GLU 50 CO -0.11 -0.20 -1.12 0.93 -1.00 0.00 0.00 179.01 177.52 1v5o h GLU 51 N -0.54 0.00 -6.52 2.33 4.39 0.19 -3.46 114.58 110.97 1v5o h GLU 51 Ca -0.04 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.13 1v5o h GLU 51 Cb 0.40 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 29.09 1v5o h GLU 51 CO 0.07 0.70 1.05 0.00 -1.16 0.00 0.00 179.01 179.68 1v5o s ALA 52 N -2.76 3.77 0.34 3.43 0.00 0.65 -1.71 121.76 125.48 1v5o s ALA 52 Ca -0.00 1.40 0.09 0.00 0.00 0.00 0.00 51.96 53.45 1v5o s ALA 52 Cb 0.09 -3.73 -0.05 0.00 0.00 0.00 0.00 23.12 19.43 1v5o s ALA 52 CO 0.81 -1.13 0.04 -0.65 0.00 0.00 0.00 175.76 174.83 1v5o s GLN 53 N 2.41 2.13 -0.03 0.00 -1.52 0.15 -4.77 119.66 118.03 1v5o s GLN 53 Ca 0.78 -1.73 0.02 0.00 -1.95 0.00 0.00 55.36 52.48 1v5o s GLN 53 Cb -0.45 -1.97 0.01 0.00 -0.22 0.00 0.00 33.01 30.38 1v5o s GLN 53 CO 0.34 0.11 -0.07 0.42 -0.25 0.00 0.00 175.29 175.85 1v5o s ILE 54 N -2.51 0.65 0.08 1.08 1.09 -1.26 -2.81 121.20 117.53 1v5o s ILE 54 Ca 0.36 -0.26 0.10 0.00 -1.10 0.00 0.00 60.65 59.74 1v5o s ILE 54 Cb -0.00 -0.61 -0.03 0.00 -1.06 0.00 0.00 42.46 40.75 1v5o s ILE 54 CO 0.20 0.22 -0.25 -0.69 -0.10 0.00 0.00 174.94 174.33 1v5o s VAL 55 N 0.44 2.32 -0.07 2.92 1.01 -0.63 -1.35 120.40 125.04 1v5o s VAL 55 Ca -0.06 -1.49 -0.16 0.00 0.00 0.00 0.00 61.98 60.26 1v5o s VAL 55 Cb -0.10 -1.97 0.03 0.00 0.00 0.00 0.00 36.38 34.35 1v5o s VAL 55 CO 0.00 0.26 0.39 -0.47 0.00 0.00 0.00 175.10 175.28 1v5o s TYR 56 N -0.93 -0.33 0.00 5.22 5.04 -0.94 -3.21 117.35 122.20 1v5o s TYR 56 Ca 0.13 0.67 0.00 0.00 -2.44 0.00 0.00 57.07 55.44 1v5o s TYR 56 Cb -0.10 0.15 0.00 0.00 0.35 0.00 0.00 41.96 42.36 1v5o s TYR 56 CO 0.04 -0.35 0.00 -1.33 -1.34 0.00 0.00 175.55 172.57 1v5o n MET 57 N 1.82 0.00 0.00 4.97 2.81 -1.26 -2.37 117.12 123.09 1v5o n MET 57 Ca -0.18 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.71 1v5o n MET 57 Cb 0.57 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.08 1v5o n MET 57 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 1v5o n GLU 58 N 0.00 0.00 -2.79 0.03 0.28 -1.26 -5.14 120.64 111.76 1v5o n GLU 58 Ca 0.00 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 56.71 1v5o n GLU 58 Cb 0.00 0.00 -0.02 0.00 1.43 0.00 0.00 31.44 32.85 1v5o n GLU 58 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 1v5o s GLN 59 N -0.53 3.67 -0.31 3.44 -1.52 -1.00 -5.04 119.66 118.37 1v5o s GLN 59 Ca 0.00 0.32 -0.21 0.00 -1.95 0.00 0.00 55.36 53.53 1v5o s GLN 59 Cb 0.00 -2.40 -0.01 0.00 -0.22 0.00 0.00 33.01 30.38 1v5o s GLN 59 CO 0.00 -0.09 0.65 -1.17 -0.25 0.00 0.00 175.29 174.43 1v5o s LEU 60 N -4.22 4.14 0.03 2.90 2.96 -1.26 -2.21 118.68 121.03 1v5o s LEU 60 Ca 0.49 0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 54.54 1v5o s LEU 60 Cb -0.10 -2.85 -0.07 0.00 0.50 0.00 0.00 46.19 43.67 1v5o s LEU 60 CO 0.37 -0.50 1.59 -0.76 -1.32 0.00 0.00 176.35 175.73 1v5o s LEU 61 N 2.66 4.35 -0.36 -0.68 1.43 -0.45 -4.90 118.68 120.72 1v5o s LEU 61 Ca 0.26 2.35 0.06 0.00 -1.03 0.00 0.00 54.13 55.77 1v5o s LEU 61 Cb -0.15 -3.56 0.45 0.00 0.03 0.00 0.00 46.19 42.96 1v5o s LEU 61 CO 0.12 -0.85 1.27 0.35 0.23 0.00 0.00 176.35 177.47 1v5o n THR 62 N 4.83 2.62 -3.66 5.49 -2.24 -1.26 -4.40 114.28 115.67 1v5o n THR 62 Ca 0.15 -4.25 -0.23 0.00 -2.27 0.00 0.00 64.05 57.46 1v5o n THR 62 Cb 0.42 -1.17 -0.18 0.00 -2.10 0.00 0.00 70.33 67.30 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 -3.38 1.72 -0.07 3.42 2.15 -1.26 -5.00 116.67 114.25 1v5o s ASP 63 Ca 0.52 -0.24 0.06 0.00 0.43 0.00 0.00 52.55 53.32 1v5o s ASP 63 Cb 0.42 -0.22 -0.24 0.00 -0.30 0.00 0.00 42.92 42.58 1v5o s ASP 63 CO -0.02 -0.29 0.56 -0.90 -0.17 0.00 0.00 175.17 174.36 1v5o n ASP 64 N 5.27 1.28 0.26 -0.34 5.75 -1.26 -3.82 116.55 123.69 1v5o n ASP 64 Ca -0.05 0.35 0.12 0.00 -0.01 0.00 0.00 54.79 55.20 1v5o n ASP 64 Cb 0.49 -0.32 0.69 0.00 -1.03 0.00 0.00 41.12 40.95 1v5o n ASP 64 CO 0.00 0.00 0.00 0.45 -0.11 0.00 0.00 177.20 177.54 1v5o h HIS 65 N 0.02 0.00 -4.25 2.11 3.86 -1.96 -2.36 115.15 112.57 1v5o h HIS 65 Ca -0.33 0.00 -0.52 0.00 -1.16 0.00 0.00 60.37 58.36 1v5o h HIS 65 Cb 2.02 0.00 0.13 0.00 1.06 0.00 0.00 27.41 30.62 1v5o h HIS 65 CO 0.03 0.14 0.34 0.00 0.86 0.00 0.00 177.93 179.29 1v5o s SER 67 N -2.85 5.18 0.01 0.00 0.01 -1.26 0.10 113.70 114.89 1v5o s SER 67 Ca 0.65 -0.53 -0.25 0.00 1.31 0.00 0.00 55.95 57.13 1v5o s SER 67 Cb -0.20 -0.96 -0.14 0.00 0.21 0.00 0.00 66.02 64.93 1v5o s SER 67 CO 0.50 -0.32 1.05 -0.07 0.41 0.00 0.00 173.24 174.81 1v5o h LEU 68 N 1.33 -0.77 -1.95 2.44 3.38 -1.52 -2.64 115.31 115.57 1v5o h LEU 68 Ca -0.45 0.03 0.13 0.00 0.09 0.00 0.00 57.88 57.68 1v5o h LEU 68 Cb 1.25 0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 1v5o h LEU 68 CO 0.59 -0.39 0.48 1.23 0.09 0.00 0.00 178.44 180.45 1v5o h GLY 69 N -1.24 0.00 1.54 0.83 0.00 -0.44 0.60 103.07 104.36 1v5o h GLY 69 Ca -0.09 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.10 1v5o h GLY 69 CO 0.15 0.00 -0.43 0.23 0.00 0.00 0.00 176.54 176.49 1v5o h SER 70 N 0.00 0.53 1.10 0.19 0.87 -1.67 -2.97 113.55 111.61 1v5o h SER 70 Ca 0.22 -0.24 -0.19 0.00 -1.23 0.00 0.00 61.79 60.35 1v5o h SER 70 Cb 1.18 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.96 1v5o h SER 70 CO -0.00 0.90 -0.90 1.88 -0.53 0.00 0.00 176.83 178.18 1v5o h TYR 71 N 0.41 0.00 0.00 2.24 0.05 0.49 -3.48 116.97 116.68 1v5o h TYR 71 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1v5o h TYR 71 Cb 0.92 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.66 1v5o h TYR 71 CO 0.03 0.89 0.00 0.41 -1.05 0.00 0.00 178.16 178.45 1v5o n GLY 72 N 1.32 1.70 3.75 3.88 0.00 -0.36 -5.11 105.19 110.37 1v5o n GLY 72 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 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 4.47 0.31 0.99 1.02 -0.97 -4.99 118.68 119.50 1v5o s LEU 73 Ca 0.00 1.44 0.04 0.00 0.02 0.00 0.00 54.13 55.62 1v5o s LEU 73 Cb 0.00 -3.20 -0.03 0.00 0.02 0.00 0.00 46.19 42.99 1v5o s LEU 73 CO 0.00 0.06 0.29 -1.59 0.02 0.00 0.00 176.35 175.12 1v5o s LYS 74 N -0.24 1.67 0.04 1.70 -2.85 -1.26 -4.39 119.74 114.40 1v5o s LYS 74 Ca 0.37 -1.88 -0.30 0.00 -1.00 0.00 0.00 55.97 53.15 1v5o s LYS 74 Cb -0.21 0.34 -0.07 0.00 -2.06 0.00 0.00 37.83 35.83 1v5o s LYS 74 CO 0.23 -0.62 1.51 0.34 0.10 0.00 0.00 175.35 176.90 1v5o s ASP 75 N -3.30 6.74 0.00 0.03 2.15 -1.26 -3.23 116.67 117.80 1v5o s ASP 75 Ca 0.38 2.29 0.00 0.00 0.43 0.00 0.00 52.55 55.65 1v5o s ASP 75 Cb 0.03 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1v5o s ASP 75 CO 0.23 -0.79 0.00 0.61 -0.17 0.00 0.00 175.17 175.05 1v5o n GLY 76 N 3.79 1.08 3.75 2.66 0.00 -1.19 -4.86 105.19 110.43 1v5o n GLY 76 Ca 0.14 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.07 4.29 -0.15 1.61 1.11 -1.20 -5.08 116.67 115.18 1v5o s ASP 77 Ca 0.00 -1.32 -0.06 0.00 0.18 0.00 0.00 52.55 51.36 1v5o s ASP 77 Cb 0.00 -0.03 0.07 0.00 1.07 0.00 0.00 42.92 44.02 1v5o s ASP 77 CO 0.00 -0.71 0.31 -0.32 1.18 0.00 0.00 175.17 175.63 1v5o s MET 78 N -3.93 0.22 0.25 8.23 1.75 -1.26 -2.51 119.30 122.05 1v5o s MET 78 Ca 0.29 0.79 0.11 0.00 -1.25 0.00 0.00 55.69 55.63 1v5o s MET 78 Cb 0.03 0.05 -0.05 0.00 2.84 0.00 0.00 34.83 37.70 1v5o s MET 78 CO 0.16 -0.25 -0.13 0.14 -0.65 0.00 0.00 175.02 174.30 1v5o s VAL 79 N 2.19 2.89 -0.07 10.11 -7.23 0.39 -4.90 120.40 123.77 1v5o s VAL 79 Ca -0.02 -2.08 -0.01 0.00 -1.81 0.00 0.00 61.98 58.06 1v5o s VAL 79 Cb -0.11 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 34.30 1v5o s VAL 79 CO -0.10 -0.31 -0.02 -0.69 -0.31 0.00 0.00 175.10 173.67 1v5o s VAL 80 N -2.21 4.09 0.08 1.32 1.01 -1.20 -2.15 120.40 121.35 1v5o s VAL 80 Ca 0.28 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.94 1v5o s VAL 80 Cb -0.06 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1v5o s VAL 80 CO 0.16 0.58 0.10 -0.22 0.00 0.00 0.00 175.10 175.72 1v5o s LEU 81 N -0.92 3.86 -0.12 3.92 0.20 0.21 -1.60 118.68 124.23 1v5o s LEU 81 Ca 0.14 0.01 -0.05 0.00 0.69 0.00 0.00 54.13 54.92 1v5o s LEU 81 Cb -0.11 -2.53 0.06 0.00 -0.43 0.00 0.00 46.19 43.18 1v5o s LEU 81 CO 0.03 0.17 0.25 -0.76 -0.29 0.00 0.00 176.35 175.74 1v5o s LEU 82 N -2.45 -0.09 -0.41 -0.68 1.02 -1.12 -3.87 118.68 111.09 1v5o s LEU 82 Ca 0.30 0.55 -0.17 0.00 0.02 0.00 0.00 54.13 54.83 1v5o s LEU 82 Cb -0.12 0.67 0.02 0.00 0.02 0.00 0.00 46.19 46.77 1v5o s LEU 82 CO 0.23 -0.22 0.42 -1.58 0.02 0.00 0.00 176.35 175.22 1v5o s GLN 83 N 2.09 3.17 1.46 1.70 0.74 -1.26 0.34 119.66 127.92 1v5o s GLN 83 Ca -0.01 -0.70 -0.24 0.00 0.05 0.00 0.00 55.36 54.45 1v5o s GLN 83 Cb -0.12 -3.94 0.38 0.00 1.10 0.00 0.00 33.01 30.43 1v5o s GLN 83 CO -0.08 -0.80 0.91 1.63 -0.55 0.00 0.00 175.29 176.40 1v5o n LYS 84 N 5.56 -4.74 -0.89 1.67 4.76 -0.69 -4.62 118.16 119.21 1v5o n LYS 84 Ca -0.08 -1.52 -0.35 0.00 -2.87 0.00 0.00 58.31 53.49 1v5o n LYS 84 Cb 0.48 -1.89 0.08 0.00 -1.84 0.00 0.00 35.03 31.86 1v5o n LYS 84 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1v5o n ASP 85 N -5.76 -3.64 -1.91 4.39 9.92 -1.26 -4.84 116.55 113.45 1v5o n ASP 85 Ca 0.14 0.11 -0.05 0.00 -0.53 0.00 0.00 54.79 54.46 1v5o n ASP 85 Cb 0.61 -0.84 0.29 0.00 -0.64 0.00 0.00 41.12 40.54 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 1.34 4.67 -3.62 -2.24 2.85 -1.26 -4.79 115.26 112.20 1v5o n ASN 86 Ca 0.01 -3.09 -0.09 0.00 -0.11 0.00 0.00 54.58 51.29 1v5o n ASN 86 Cb 0.62 -0.73 -0.10 0.00 1.24 0.00 0.00 39.78 40.81 1v5o n ASN 86 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1v5o s VAL 87 N -2.76 -0.62 -0.29 3.44 0.11 -1.26 -5.11 120.40 113.90 1v5o s VAL 87 Ca 0.50 0.15 0.06 0.00 -2.93 0.00 0.00 61.98 59.76 1v5o s VAL 87 Cb 0.40 -0.66 0.20 0.00 -1.53 0.00 0.00 36.38 34.79 1v5o s VAL 87 CO 0.13 0.05 0.60 -0.83 -3.33 0.00 0.00 175.10 171.72 1v5o s GLY 88 N 2.59 -1.26 -0.87 6.54 0.00 -1.26 -5.08 107.32 107.98 1v5o s GLY 88 Ca 0.00 1.09 -0.03 0.00 0.00 0.00 0.00 44.72 45.79 1v5o s GLY 88 CO -0.13 3.69 0.75 -2.27 0.00 0.00 0.00 173.10 175.15 1v5o s LEU 89 N 2.83 5.58 -0.42 0.66 0.20 -1.26 -4.90 118.68 121.38 1v5o s LEU 89 Ca 0.11 -3.58 0.06 0.00 0.69 0.00 0.00 54.13 51.41 1v5o s LEU 89 Cb -0.10 -1.92 0.21 0.00 -0.43 0.00 0.00 46.19 43.95 1v5o s LEU 89 CO -0.26 -0.22 0.52 0.54 -0.29 0.00 0.00 176.35 176.64 1v5o n ARG 90 N 2.54 0.49 -3.77 1.98 1.74 -1.26 -5.08 116.66 113.31 1v5o n ARG 90 Ca 0.20 -2.89 -0.29 0.00 -0.77 0.00 0.00 57.85 54.10 1v5o n ARG 90 Cb 0.37 -1.45 -0.16 0.00 -1.02 0.00 0.00 32.46 30.21 1v5o n ARG 90 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1v5o s THR 91 N -0.24 0.84 0.47 0.55 -4.23 -1.26 -5.13 115.64 106.64 1v5o s THR 91 Ca 0.33 -1.05 -0.21 0.00 -1.18 0.00 0.00 61.69 59.58 1v5o s THR 91 Cb 0.11 -1.44 -0.09 0.00 1.34 0.00 0.00 72.50 72.42 1v5o s THR 91 CO -0.15 -0.41 1.04 -2.16 -0.54 0.00 0.00 174.62 172.40 1v5o s PRO 92 N 1.68 3.87 0.00 3.99 0.04 -1.26 -5.00 135.00 138.32 1v5o s PRO 92 Ca 0.03 1.40 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1v5o s PRO 92 Cb -0.17 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.18 1v5o s PRO 92 CO -0.16 -0.38 0.00 0.41 0.04 0.00 0.00 177.00 176.92 1v5o n GLY 93 N -0.12 2.14 5.00 0.56 0.00 -1.26 -5.00 105.19 106.51 1v5o n GLY 93 Ca 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1v5o n GLY 93 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1v5o n ARG 94 N 0.00 0.00 -3.01 1.61 0.63 -1.26 -4.75 116.66 109.87 1v5o n ARG 94 Ca 0.00 0.00 -0.03 0.00 -0.92 0.00 0.00 57.85 56.90 1v5o n ARG 94 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1v5o n ARG 94 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1v5o n THR 95 N 0.00 -6.56 -1.63 5.15 -1.04 -1.26 -4.94 114.28 104.00 1v5o n THR 95 Ca 0.00 1.02 -0.31 0.00 -2.04 0.00 0.00 64.05 62.72 1v5o n THR 95 Cb 0.00 -4.81 0.04 0.00 -1.82 0.00 0.00 70.33 63.74 1v5o n THR 95 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1v5o s PRO 96 N -1.45 2.99 -0.08 -2.82 0.04 -1.26 -5.06 135.00 127.37 1v5o s PRO 96 Ca 0.04 0.98 0.01 0.00 0.04 0.00 0.00 61.00 62.07 1v5o s PRO 96 Cb -0.01 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 1v5o s PRO 96 CO 0.41 -1.06 -0.08 0.45 0.04 0.00 0.00 177.00 176.77 1v5o s SER 97 N -3.68 4.58 -0.34 6.66 0.15 -1.26 -5.08 113.70 114.72 1v5o s SER 97 Ca 0.59 -0.06 -0.00 0.00 0.70 0.00 0.00 55.95 57.18 1v5o s SER 97 Cb -0.14 -1.21 0.14 0.00 -1.71 0.00 0.00 66.02 63.09 1v5o s SER 97 CO 0.53 0.34 0.24 -0.83 1.20 0.00 0.00 173.24 174.72 1v5o s GLY 98 N -0.66 0.49 -0.50 9.45 0.00 -1.26 -5.10 107.32 109.75 1v5o s GLY 98 Ca 0.10 -1.37 -0.28 0.00 0.00 0.00 0.00 44.72 43.16 1v5o s GLY 98 CO 0.02 2.29 1.46 2.56 0.00 0.00 0.00 173.10 179.43 1v5o s PRO 99 N 1.47 3.36 0.29 2.90 0.04 -1.26 -4.99 135.00 136.81 1v5o s PRO 99 Ca 0.15 0.70 -0.15 0.00 0.04 0.00 0.00 61.00 61.75 1v5o s PRO 99 Cb -0.19 -4.11 -0.09 0.00 0.04 0.00 0.00 34.50 30.16 1v5o s PRO 99 CO -0.10 -1.84 0.70 -1.12 0.04 0.00 0.00 177.00 174.68 1v5o s SER 100 N 4.56 6.78 0.23 6.66 0.01 -1.26 -5.08 113.70 125.61 1v5o s SER 100 Ca 0.58 1.23 -0.16 0.00 1.31 0.00 0.00 55.95 58.91 1v5o s SER 100 Cb -0.13 -2.35 0.01 0.00 0.21 0.00 0.00 66.02 63.76 1v5o s SER 100 CO 0.28 -0.15 0.55 -0.94 0.41 0.00 0.00 173.24 173.39 1v5o s SER 101 N -2.20 -0.19 0.00 2.44 1.04 -1.26 -5.36 113.70 108.18 1v5o s SER 101 Ca 0.51 -0.70 0.00 0.00 0.48 0.00 0.00 55.95 56.25 1v5o s SER 101 Cb -0.11 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1v5o s SER 101 CO 0.18 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.86