#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hrv h PRO 2 N 0.00 0.06 -0.02 1.61 0.11 -2.04 -2.75 132.00 128.97 2hrv h PRO 2 Ca 0.00 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2hrv h PRO 2 Cb 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.10 2hrv h PRO 2 CO 0.00 0.04 -0.11 0.43 -0.21 0.00 0.00 178.00 178.15 2hrv n SER 3 N -4.43 2.09 -4.73 -2.05 7.64 -1.26 -4.78 113.62 106.11 2hrv n SER 3 Ca 0.07 -1.61 -0.42 0.00 1.01 0.00 0.00 58.87 57.92 2hrv n SER 3 Cb 0.46 0.09 -0.03 0.00 -1.01 0.00 0.00 64.21 63.73 2hrv n SER 3 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2hrv s ASP 4 N -2.14 6.96 -0.43 6.43 1.01 -1.04 -4.92 116.67 122.55 2hrv s ASP 4 Ca 0.29 2.25 -0.04 0.00 0.71 0.00 0.00 52.55 55.77 2hrv s ASP 4 Cb 0.20 -2.59 0.08 0.00 1.01 0.00 0.00 42.92 41.61 2hrv s ASP 4 CO 0.38 -0.51 2.69 0.23 0.21 0.00 0.00 175.17 178.17 2hrv n MET 5 N 3.29 2.31 -3.69 8.23 2.81 -1.26 -4.50 117.12 124.32 2hrv n MET 5 Ca 0.08 -2.22 -0.00 0.00 -1.81 0.00 0.00 57.70 53.75 2hrv n MET 5 Cb 0.44 -2.07 -0.01 0.00 -0.71 0.00 0.00 33.22 30.87 2hrv n MET 5 CO 0.00 0.00 0.00 1.52 1.51 0.00 0.00 175.97 179.00 2hrv s TYR 6 N -1.68 -0.06 0.02 2.03 1.13 -1.14 -4.49 117.35 113.15 2hrv s TYR 6 Ca 0.56 -0.12 0.07 0.00 -1.41 0.00 0.00 57.07 56.17 2hrv s TYR 6 Cb 0.36 0.58 -0.03 0.00 -1.10 0.00 0.00 41.96 41.78 2hrv s TYR 6 CO -0.19 -0.47 -0.20 0.08 -2.51 0.00 0.00 175.55 172.27 2hrv s VAL 7 N -2.66 2.62 -0.22 -3.49 1.01 -0.51 -4.92 120.40 112.24 2hrv s VAL 7 Ca 0.14 -1.13 -0.04 0.00 0.00 0.00 0.00 61.98 60.95 2hrv s VAL 7 Cb 0.03 -2.05 0.08 0.00 0.00 0.00 0.00 36.38 34.43 2hrv s VAL 7 CO -0.02 0.42 0.10 -2.28 0.00 0.00 0.00 175.10 173.32 2hrv s HIS 8 N -0.83 0.36 -0.31 5.22 5.04 -1.26 -0.68 115.29 122.84 2hrv s HIS 8 Ca 0.13 -0.61 -0.03 0.00 -1.54 0.00 0.00 55.06 53.01 2hrv s HIS 8 Cb -0.10 -0.83 0.04 0.00 0.04 0.00 0.00 32.58 31.73 2hrv s HIS 8 CO 0.03 -0.65 0.03 0.08 -2.34 0.00 0.00 174.74 171.89 2hrv s VAL 9 N 2.08 3.22 0.00 0.89 1.01 0.27 -1.31 120.40 126.56 2hrv s VAL 9 Ca 0.05 -1.28 0.00 0.00 0.00 0.00 0.00 61.98 60.74 2hrv s VAL 9 Cb -0.16 -2.83 0.00 0.00 0.00 0.00 0.00 36.38 33.39 2hrv s VAL 9 CO -0.19 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.41 2hrv n GLY 10 N 4.68 3.77 1.10 4.51 0.00 -1.13 -0.93 105.19 117.20 2hrv n GLY 10 Ca -0.13 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 45.93 2hrv n GLY 10 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hrv n ASN 11 N 5.81 3.20 -4.65 1.61 4.13 -1.26 -0.76 115.26 123.34 2hrv n ASN 11 Ca 0.00 -2.15 -0.35 0.00 1.68 0.00 0.00 54.58 53.76 2hrv n ASN 11 Cb 0.00 -0.42 -0.10 0.00 -1.54 0.00 0.00 39.78 37.72 2hrv n ASN 11 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2hrv s LEU 12 N -1.22 3.72 -0.08 3.41 1.43 -0.10 -0.20 118.68 125.64 2hrv s LEU 12 Ca 0.36 0.10 -0.00 0.00 -1.03 0.00 0.00 54.13 53.56 2hrv s LEU 12 Cb 0.21 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 2hrv s LEU 12 CO 0.21 0.24 -0.04 -0.63 0.23 0.00 0.00 176.35 176.36 2hrv s ILE 13 N -0.05 3.92 -0.14 -0.59 -1.09 0.21 -0.57 121.20 122.88 2hrv s ILE 13 Ca 0.05 -0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.08 2hrv s ILE 13 Cb -0.12 -2.62 0.02 0.00 -1.58 0.00 0.00 42.46 38.16 2hrv s ILE 13 CO 0.01 0.59 -0.12 -0.31 -1.23 0.00 0.00 174.94 173.88 2hrv s TYR 14 N -0.75 2.01 0.08 3.97 1.51 0.15 -1.88 117.35 122.43 2hrv s TYR 14 Ca 0.11 -1.12 -0.01 0.00 -1.01 0.00 0.00 57.07 55.05 2hrv s TYR 14 Cb -0.11 -1.51 -0.04 0.00 -0.11 0.00 0.00 41.96 40.19 2hrv s TYR 14 CO 0.02 -0.64 -0.01 1.03 -1.11 0.00 0.00 175.55 174.84 2hrv s ARG 15 N 1.54 0.72 0.12 -0.62 0.52 -0.64 -1.42 118.95 119.17 2hrv s ARG 15 Ca 0.05 -1.29 -0.31 0.00 -0.52 0.00 0.00 55.73 53.66 2hrv s ARG 15 Cb -0.13 0.18 -0.08 0.00 0.52 0.00 0.00 34.95 35.44 2hrv s ARG 15 CO -0.10 -0.14 1.45 -0.80 0.02 0.00 0.00 175.30 175.72 2hrv s ASN 16 N -2.97 6.75 0.23 0.23 -0.87 -1.26 -1.16 114.94 115.90 2hrv s ASN 16 Ca 0.12 2.40 -0.06 0.00 -1.57 0.00 0.00 52.86 53.75 2hrv s ASN 16 Cb 0.08 -2.59 0.37 0.00 -0.02 0.00 0.00 41.25 39.10 2hrv s ASN 16 CO -0.06 -0.71 1.76 0.25 -2.57 0.00 0.00 177.10 175.77 2hrv h LEU 17 N 6.95 0.41 -0.16 0.60 5.85 -1.08 -1.98 115.31 125.89 2hrv h LEU 17 Ca -0.42 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.38 2hrv h LEU 17 Cb 1.21 0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2hrv h LEU 17 CO 0.88 0.21 0.00 0.00 -0.34 0.00 0.00 178.44 179.20 2hrv n HIS 18 N -4.91 0.14 0.99 1.25 1.44 -1.26 -1.64 115.22 111.23 2hrv n HIS 18 Ca 0.12 0.06 0.11 0.00 -2.01 0.00 0.00 57.72 56.00 2hrv n HIS 18 Cb 0.32 -0.60 -0.03 0.00 0.12 0.00 0.00 29.99 29.80 2hrv n HIS 18 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2hrv n LEU 19 N -1.64 1.84 -4.70 2.39 4.77 -0.75 -4.94 117.00 113.97 2hrv n LEU 19 Ca 0.02 -0.71 -0.42 0.00 -0.03 0.00 0.00 56.01 54.87 2hrv n LEU 19 Cb 0.13 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2hrv n LEU 19 CO 0.11 0.35 0.85 0.12 -1.33 0.00 0.00 177.39 177.50 2hrv s PHE 20 N -2.54 3.43 0.00 -1.77 5.36 -0.65 -4.88 117.98 116.93 2hrv s PHE 20 Ca 0.16 1.38 0.00 0.00 -0.96 0.00 0.00 56.93 57.52 2hrv s PHE 20 Cb 0.17 -3.34 0.00 0.00 -0.34 0.00 0.00 43.02 39.51 2hrv s PHE 20 CO 0.62 -0.94 0.14 -1.71 -1.46 0.00 0.00 175.22 171.86 2hrv n ASN 21 N 4.31 0.28 -3.83 6.13 2.85 -1.26 -5.07 115.26 118.68 2hrv n ASN 21 Ca 0.09 -0.84 -0.30 0.00 -0.11 0.00 0.00 54.58 53.42 2hrv n ASN 21 Cb 0.47 0.07 0.24 0.00 1.24 0.00 0.00 39.78 41.80 2hrv n ASN 21 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2hrv s SER 22 N -0.07 0.90 0.52 1.20 0.01 -1.26 -5.04 113.70 109.96 2hrv s SER 22 Ca 0.00 0.65 -0.12 0.00 1.31 0.00 0.00 55.95 57.79 2hrv s SER 22 Cb 0.00 -0.91 -0.06 0.00 0.21 0.00 0.00 66.02 65.26 2hrv s SER 22 CO 0.00 -4.14 0.93 -1.83 0.41 0.00 0.00 173.24 168.61 2hrv s GLU 23 N -5.38 3.75 0.78 12.44 1.03 -1.26 -5.04 118.70 125.01 2hrv s GLU 23 Ca 0.71 0.69 -0.13 0.00 0.03 0.00 0.00 54.97 56.27 2hrv s GLU 23 Cb -0.10 -2.20 0.07 0.00 -0.80 0.00 0.00 34.13 31.10 2hrv s GLU 23 CO 0.56 -0.31 1.16 -1.64 -1.33 0.00 0.00 175.26 173.70 2hrv s MET 24 N -4.48 1.94 -0.15 -4.83 -1.94 -1.26 -5.06 119.30 103.52 2hrv s MET 24 Ca 0.55 1.57 -0.17 0.00 -1.71 0.00 0.00 55.69 55.92 2hrv s MET 24 Cb -0.10 -1.83 0.05 0.00 2.01 0.00 0.00 34.83 34.95 2hrv s MET 24 CO 0.41 -1.95 0.47 -1.58 -0.01 0.00 0.00 175.02 172.36 2hrv s HIS 25 N -2.34 -0.49 0.53 -0.03 2.46 -1.26 -5.05 115.29 109.11 2hrv s HIS 25 Ca 0.69 1.15 0.32 0.00 0.47 0.00 0.00 55.06 57.70 2hrv s HIS 25 Cb -0.25 0.18 1.48 0.00 -0.13 0.00 0.00 32.58 33.87 2hrv s HIS 25 CO 0.50 -0.29 1.87 1.05 -2.47 0.00 0.00 174.74 175.40 2hrv h GLU 26 N 5.07 0.02 0.00 2.88 9.09 -1.99 -1.38 114.58 128.26 2hrv h GLU 26 Ca -0.28 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.13 2hrv h GLU 26 Cb 1.17 -0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.27 2hrv h GLU 26 CO 0.24 0.01 0.00 -1.13 0.05 0.00 0.00 179.01 178.18 2hrv n SER 27 N -4.26 0.37 -4.73 3.06 3.41 -1.26 -4.89 113.62 105.32 2hrv n SER 27 Ca 0.20 0.56 -0.42 0.00 -0.26 0.00 0.00 58.87 58.95 2hrv n SER 27 Cb 1.02 -0.65 -0.02 0.00 -0.26 0.00 0.00 64.21 64.30 2hrv n SER 27 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2hrv n ILE 28 N -1.87 0.76 -4.37 -1.33 5.41 -0.52 -4.49 119.36 112.95 2hrv n ILE 28 Ca 0.04 -0.19 -0.25 0.00 1.00 0.00 0.00 62.75 63.36 2hrv n ILE 28 Cb 0.29 -1.90 -0.17 0.00 -0.71 0.00 0.00 39.64 37.15 2hrv n ILE 28 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2hrv s LEU 29 N -0.01 1.50 -0.10 1.39 1.43 0.29 -4.99 118.68 118.18 2hrv s LEU 29 Ca 0.67 -0.29 0.03 0.00 -1.03 0.00 0.00 54.13 53.52 2hrv s LEU 29 Cb -0.52 -0.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.89 2hrv s LEU 29 CO 0.45 -0.02 -0.20 -0.69 0.23 0.00 0.00 176.35 176.12 2hrv s VAL 30 N 0.97 2.41 -0.58 -1.59 1.01 -1.26 -0.72 120.40 120.64 2hrv s VAL 30 Ca -0.09 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 60.98 2hrv s VAL 30 Cb -0.15 -1.94 0.15 0.00 0.00 0.00 0.00 36.38 34.44 2hrv s VAL 30 CO 0.00 0.55 0.37 -0.55 0.00 0.00 0.00 175.10 175.47 2hrv s SER 31 N 0.16 4.96 0.29 3.32 0.15 0.01 -4.95 113.70 117.63 2hrv s SER 31 Ca -0.11 -2.85 -0.03 0.00 0.70 0.00 0.00 55.95 53.66 2hrv s SER 31 Cb -0.16 -1.78 0.41 0.00 -1.71 0.00 0.00 66.02 62.77 2hrv s SER 31 CO 0.06 -0.34 1.95 1.88 1.20 0.00 0.00 173.24 178.00 2hrv h TYR 32 N 6.93 1.06 0.00 3.44 0.05 -1.98 -1.62 116.97 124.85 2hrv h TYR 32 Ca -0.04 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.75 2hrv h TYR 32 Cb 0.94 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 38.32 2hrv h TYR 32 CO 0.64 0.69 0.00 -1.13 -1.05 0.00 0.00 178.16 177.31 2hrv n SER 33 N -4.39 0.00 0.00 3.88 3.41 -1.26 -2.92 113.62 112.34 2hrv n SER 33 Ca 0.09 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 2hrv n SER 33 Cb 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 2hrv n SER 33 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2hrv n SER 34 N -0.91 1.21 -3.25 4.04 7.64 -0.69 -2.45 113.62 119.21 2hrv n SER 34 Ca 0.19 -1.32 -0.23 0.00 1.01 0.00 0.00 58.87 58.51 2hrv n SER 34 Cb 0.09 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.31 2hrv n SER 34 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2hrv n ASP 35 N -0.16 -5.37 -4.23 6.43 2.03 -0.71 -4.90 116.55 109.64 2hrv n ASP 35 Ca 0.00 -0.38 -0.26 0.00 0.52 0.00 0.00 54.79 54.67 2hrv n ASP 35 Cb 0.12 -4.34 -0.15 0.00 -0.72 0.00 0.00 41.12 36.03 2hrv n ASP 35 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2hrv s LEU 36 N -6.74 2.11 -0.02 -2.67 2.96 -0.90 -0.56 118.68 112.85 2hrv s LEU 36 Ca 0.39 -0.45 0.03 0.00 -0.22 0.00 0.00 54.13 53.88 2hrv s LEU 36 Cb -0.18 -0.98 -0.00 0.00 0.50 0.00 0.00 46.19 45.52 2hrv s LEU 36 CO 0.48 0.19 -0.12 -0.51 -1.32 0.00 0.00 176.35 175.07 2hrv s ILE 37 N -0.65 0.96 -0.03 6.68 2.07 -0.31 -0.81 121.20 129.11 2hrv s ILE 37 Ca 0.07 -0.50 0.05 0.00 -1.41 0.00 0.00 60.65 58.87 2hrv s ILE 37 Cb -0.08 -0.82 -0.01 0.00 0.13 0.00 0.00 42.46 41.68 2hrv s ILE 37 CO 0.01 0.28 -0.19 -0.63 -1.91 0.00 0.00 174.94 172.50 2hrv s ILE 38 N -0.10 1.50 0.10 2.00 1.01 0.11 -1.63 121.20 124.19 2hrv s ILE 38 Ca 0.01 -0.78 -0.25 0.00 0.00 0.00 0.00 60.65 59.63 2hrv s ILE 38 Cb -0.07 -1.27 0.08 0.00 0.01 0.00 0.00 42.46 41.21 2hrv s ILE 38 CO 0.00 0.43 0.68 -0.72 0.00 0.00 0.00 174.94 175.33 2hrv s TYR 39 N -0.19 -0.50 0.26 3.97 1.13 -0.79 -0.55 117.35 120.69 2hrv s TYR 39 Ca 0.01 0.36 -0.14 0.00 -1.41 0.00 0.00 57.07 55.89 2hrv s TYR 39 Cb -0.10 0.54 -0.08 0.00 -1.10 0.00 0.00 41.96 41.22 2hrv s TYR 39 CO 0.01 -0.75 0.66 1.03 -2.51 0.00 0.00 175.55 173.99 2hrv s ARG 40 N -3.37 3.98 0.31 -3.49 0.52 -1.26 -0.62 118.95 115.02 2hrv s ARG 40 Ca 0.01 0.57 0.03 0.00 -0.52 0.00 0.00 55.73 55.82 2hrv s ARG 40 Cb -0.01 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.81 2hrv s ARG 40 CO -0.10 0.27 0.16 -0.08 0.02 0.00 0.00 175.30 175.57 2hrv s THR 41 N -1.81 0.36 -0.22 0.02 -1.32 0.72 -4.92 115.64 108.47 2hrv s THR 41 Ca 0.49 -2.00 0.18 0.00 -1.21 0.00 0.00 61.69 59.15 2hrv s THR 41 Cb -0.12 -2.51 0.05 0.00 -1.51 0.00 0.00 72.50 68.42 2hrv s THR 41 CO 0.19 0.00 1.24 -0.55 -2.21 0.00 0.00 174.62 173.29 2hrv h ASN 42 N 2.18 0.00 -2.13 8.08 7.08 -1.98 -3.45 115.58 125.35 2hrv h ASN 42 Ca -0.34 0.00 -0.45 0.00 -3.08 0.00 0.00 56.30 52.44 2hrv h ASN 42 Cb 1.25 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 37.50 2hrv h ASN 42 CO 0.52 0.32 -0.26 0.42 -2.08 0.00 0.00 177.43 176.36 2hrv s THR 43 N -3.08 4.05 -0.13 6.14 -4.23 -1.26 -5.08 115.64 112.05 2hrv s THR 43 Ca 0.02 -0.83 -0.03 0.00 -1.18 0.00 0.00 61.69 59.67 2hrv s THR 43 Cb 0.08 -3.44 -0.03 0.00 1.34 0.00 0.00 72.50 70.45 2hrv s THR 43 CO 0.76 -0.22 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.92 2hrv s VAL 44 N -2.31 4.12 0.32 2.29 1.01 -1.26 -4.48 120.40 120.09 2hrv s VAL 44 Ca 0.46 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 62.22 2hrv s VAL 44 Cb -0.10 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.48 2hrv s VAL 44 CO 0.33 0.53 0.36 -0.83 0.00 0.00 0.00 175.10 175.49 2hrv s GLY 45 N -0.09 1.60 -0.08 4.51 0.00 0.06 -4.93 107.32 108.39 2hrv s GLY 45 Ca 0.03 -1.51 0.13 0.00 0.00 0.00 0.00 44.72 43.37 2hrv s GLY 45 CO 0.02 -1.45 1.29 2.09 0.00 0.00 0.00 173.10 175.05 2hrv n ASP 46 N -1.46 3.17 -4.84 1.64 5.75 -1.17 -2.82 116.55 116.82 2hrv n ASP 46 Ca -0.03 -2.48 -0.31 0.00 -0.01 0.00 0.00 54.79 51.96 2hrv n ASP 46 Cb 0.59 -0.35 0.04 0.00 -1.03 0.00 0.00 41.12 40.37 2hrv n ASP 46 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2hrv s ASP 47 N -1.51 5.55 -0.04 -1.12 1.01 -0.43 -5.01 116.67 115.13 2hrv s ASP 47 Ca 0.29 1.43 -0.02 0.00 0.71 0.00 0.00 52.55 54.96 2hrv s ASP 47 Cb 0.21 -2.33 0.03 0.00 1.01 0.00 0.00 42.92 41.84 2hrv s ASP 47 CO 0.10 -1.31 0.07 -0.47 0.21 0.00 0.00 175.17 173.78 2hrv s TYR 48 N -3.16 -0.01 -0.34 4.23 5.04 -1.26 -4.35 117.35 117.50 2hrv s TYR 48 Ca 0.57 0.29 -0.14 0.00 -2.44 0.00 0.00 57.07 55.36 2hrv s TYR 48 Cb -0.13 -0.33 -0.01 0.00 0.35 0.00 0.00 41.96 41.84 2hrv s TYR 48 CO 0.54 -0.17 0.28 0.42 -1.34 0.00 0.00 175.55 175.28 2hrv s ILE 49 N 1.73 5.25 0.99 3.14 1.01 -1.26 -0.98 121.20 131.08 2hrv s ILE 49 Ca -0.01 -0.17 -0.17 0.00 0.00 0.00 0.00 60.65 60.30 2hrv s ILE 49 Cb -0.12 -3.76 0.22 0.00 0.01 0.00 0.00 42.46 38.81 2hrv s ILE 49 CO -0.04 -0.05 1.35 -2.16 0.00 0.00 0.00 174.94 174.04 2hrv s PRO 50 N 1.80 0.42 -0.20 2.79 0.04 -1.26 -4.99 135.00 133.60 2hrv s PRO 50 Ca 0.08 -0.50 0.12 0.00 0.04 0.00 0.00 61.00 60.74 2hrv s PRO 50 Cb -0.17 -1.83 0.43 0.00 0.04 0.00 0.00 34.50 32.97 2hrv s PRO 50 CO 0.11 -2.55 1.20 0.43 0.04 0.00 0.00 177.00 176.23 2hrv n SER 51 N -3.84 2.29 -3.23 6.66 7.64 -1.26 -4.64 113.62 117.23 2hrv n SER 51 Ca 0.16 -3.58 -0.13 0.00 1.01 0.00 0.00 58.87 56.34 2hrv n SER 51 Cb 0.59 -0.46 0.07 0.00 -1.01 0.00 0.00 64.21 63.40 2hrv n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hrv n ASP 53 N -3.07 1.54 -4.63 0.00 5.75 -1.26 -5.07 116.55 109.80 2hrv n ASP 53 Ca 0.09 -3.07 -0.38 0.00 -0.01 0.00 0.00 54.79 51.42 2hrv n ASP 53 Cb 0.30 -0.42 0.05 0.00 -1.03 0.00 0.00 41.12 40.03 2hrv n ASP 53 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2hrv n THR 55 N -1.59 0.00 -2.67 0.00 -2.24 -1.26 -4.96 114.28 101.56 2hrv n THR 55 Ca 0.13 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.48 2hrv n THR 55 Cb 0.46 0.09 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 2hrv n THR 55 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2hrv s GLN 56 N -1.57 3.57 0.00 -0.78 0.74 -1.26 -0.67 119.66 119.69 2hrv s GLN 56 Ca 0.00 0.28 0.00 0.00 0.05 0.00 0.00 55.36 55.69 2hrv s GLN 56 Cb 0.00 -3.96 0.00 0.00 1.10 0.00 0.00 33.01 30.15 2hrv s GLN 56 CO 0.00 -1.45 0.00 0.00 -0.55 0.00 0.00 175.29 173.29 2hrv n ALA 57 N 7.82 0.00 -3.35 1.58 0.00 0.50 -4.50 120.51 122.56 2hrv n ALA 57 Ca 0.08 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.38 2hrv n ALA 57 Cb 0.49 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.85 2hrv n ALA 57 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2hrv s THR 58 N -1.79 0.02 0.04 0.00 -1.32 0.05 -0.21 115.64 112.43 2hrv s THR 58 Ca 0.00 -0.19 -0.04 0.00 -1.21 0.00 0.00 61.69 60.24 2hrv s THR 58 Cb 0.00 -0.72 -0.02 0.00 -1.51 0.00 0.00 72.50 70.25 2hrv s THR 58 CO 0.00 -0.11 0.07 -0.72 -2.21 0.00 0.00 174.62 171.65 2hrv s TYR 59 N -0.72 0.27 -0.17 9.09 1.13 -0.50 -0.07 117.35 126.38 2hrv s TYR 59 Ca -0.08 -0.63 -0.23 0.00 -1.41 0.00 0.00 57.07 54.71 2hrv s TYR 59 Cb -0.03 -0.19 -0.02 0.00 -1.10 0.00 0.00 41.96 40.61 2hrv s TYR 59 CO 0.04 -0.37 0.73 -0.47 -2.51 0.00 0.00 175.55 172.98 2hrv s TYR 60 N -2.90 3.42 -0.44 -3.49 5.04 -0.44 -1.44 117.35 117.10 2hrv s TYR 60 Ca -0.03 1.12 -0.09 0.00 -2.44 0.00 0.00 57.07 55.64 2hrv s TYR 60 Cb 0.01 -2.90 0.10 0.00 0.35 0.00 0.00 41.96 39.51 2hrv s TYR 60 CO -0.06 -0.17 0.30 0.00 -1.34 0.00 0.00 175.55 174.28 2hrv h LYS 62 N 8.41 -0.07 0.00 0.00 1.63 -1.85 0.32 116.57 125.01 2hrv h LYS 62 Ca -0.22 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.58 2hrv h LYS 62 Cb 1.08 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 32.72 2hrv h LYS 62 CO 0.81 -0.05 -0.02 1.12 -3.45 0.00 0.00 179.45 177.85 2hrv h HIS 63 N -0.08 0.00 -0.00 1.91 2.07 -1.90 0.08 115.15 117.23 2hrv h HIS 63 Ca 0.16 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.68 2hrv h HIS 63 Cb 0.31 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.29 2hrv h HIS 63 CO -0.33 0.02 -0.78 1.63 -3.07 0.00 0.00 177.93 175.40 2hrv n LYS 64 N -3.22 0.32 -4.10 5.12 4.76 -0.88 -4.98 118.16 115.17 2hrv n LYS 64 Ca -0.02 -0.25 -0.31 0.00 -2.87 0.00 0.00 58.31 54.87 2hrv n LYS 64 Cb 0.18 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.85 2hrv n LYS 64 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2hrv n ASN 65 N -1.12 -1.46 -3.70 4.39 5.15 0.05 -4.96 115.26 113.61 2hrv n ASN 65 Ca 0.06 -1.04 -0.10 0.00 -0.60 0.00 0.00 54.58 52.90 2hrv n ASN 65 Cb 0.36 -2.79 -0.04 0.00 -0.53 0.00 0.00 39.78 36.79 2hrv n ASN 65 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2hrv s ARG 66 N -6.80 1.33 0.28 1.20 1.70 -1.17 -5.01 118.95 110.49 2hrv s ARG 66 Ca 0.32 -0.81 -0.06 0.00 -0.47 0.00 0.00 55.73 54.70 2hrv s ARG 66 Cb -0.17 0.52 -0.06 0.00 -0.57 0.00 0.00 34.95 34.67 2hrv s ARG 66 CO 0.92 -0.56 0.57 0.71 -1.08 0.00 0.00 175.30 175.85 2hrv s TYR 67 N -3.85 3.46 -0.04 5.89 1.51 -1.26 -1.62 117.35 121.44 2hrv s TYR 67 Ca 0.08 0.73 0.02 0.00 -1.01 0.00 0.00 57.07 56.88 2hrv s TYR 67 Cb -0.01 -2.17 0.01 0.00 -0.11 0.00 0.00 41.96 39.69 2hrv s TYR 67 CO -0.05 0.17 -0.07 -0.06 -1.11 0.00 0.00 175.55 174.43 2hrv s PHE 68 N -2.04 0.92 0.62 2.71 0.40 -0.52 -4.96 117.98 115.11 2hrv s PHE 68 Ca 0.45 -0.26 -0.16 0.00 -0.60 0.00 0.00 56.93 56.36 2hrv s PHE 68 Cb -0.11 -0.72 -0.02 0.00 0.51 0.00 0.00 43.02 42.68 2hrv s PHE 68 CO 0.28 -0.17 1.10 -1.25 0.70 0.00 0.00 175.22 175.89 2hrv s PRO 69 N 0.58 3.02 -0.27 0.24 0.04 -1.26 -1.41 135.00 135.94 2hrv s PRO 69 Ca -0.09 1.40 -0.23 0.00 0.04 0.00 0.00 61.00 62.12 2hrv s PRO 69 Cb -0.12 -1.98 0.07 0.00 0.04 0.00 0.00 34.50 32.51 2hrv s PRO 69 CO 0.01 -1.07 0.71 -1.50 0.04 0.00 0.00 177.00 175.19 2hrv s ILE 70 N -2.24 -0.00 -0.24 0.56 2.07 0.70 -4.86 121.20 117.19 2hrv s ILE 70 Ca 0.67 0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.82 2hrv s ILE 70 Cb -0.20 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.34 2hrv s ILE 70 CO 0.37 0.00 0.15 -0.89 -1.91 0.00 0.00 174.94 172.66 2hrv s THR 71 N 0.65 5.17 0.18 4.00 2.01 -1.26 -0.37 115.64 126.03 2hrv s THR 71 Ca -0.02 0.12 0.07 0.00 0.31 0.00 0.00 61.69 62.16 2hrv s THR 71 Cb -0.05 -3.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.00 2hrv s THR 71 CO -0.04 0.33 0.06 0.68 -0.69 0.00 0.00 174.62 174.97 2hrv s VAL 72 N 1.22 4.03 -0.10 3.82 -7.23 0.16 -4.31 120.40 117.99 2hrv s VAL 72 Ca 0.07 -1.34 0.03 0.00 -1.81 0.00 0.00 61.98 58.93 2hrv s VAL 72 Cb -0.14 -3.06 -0.00 0.00 0.56 0.00 0.00 36.38 33.74 2hrv s VAL 72 CO 0.06 -0.15 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.58 2hrv s THR 73 N -1.82 2.23 0.16 5.32 2.01 0.47 -4.71 115.64 119.30 2hrv s THR 73 Ca 0.29 -0.96 -0.29 0.00 0.31 0.00 0.00 61.69 61.04 2hrv s THR 73 Cb -0.09 -1.86 -0.07 0.00 0.01 0.00 0.00 72.50 70.48 2hrv s THR 73 CO 0.21 0.56 0.91 -0.55 -0.69 0.00 0.00 174.62 175.05 2hrv s SER 74 N 0.29 7.51 -0.08 3.53 0.15 -1.26 -1.28 113.70 122.56 2hrv s SER 74 Ca -0.16 1.79 -0.01 0.00 0.70 0.00 0.00 55.95 58.27 2hrv s SER 74 Cb -0.17 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.59 2hrv s SER 74 CO 0.08 0.05 -0.02 -1.00 1.20 0.00 0.00 173.24 173.55 2hrv s HIS 75 N -0.56 0.88 0.13 3.44 3.76 -0.41 -5.00 115.29 117.53 2hrv s HIS 75 Ca 0.43 -0.31 -0.21 0.00 -0.15 0.00 0.00 55.06 54.81 2hrv s HIS 75 Cb -0.24 -0.90 -0.04 0.00 1.11 0.00 0.00 32.58 32.51 2hrv s HIS 75 CO 0.29 -0.36 1.69 0.22 -0.85 0.00 0.00 174.74 175.73 2hrv h ASP 76 N 8.20 -0.29 -5.17 1.40 3.58 -1.94 -2.14 116.42 120.06 2hrv h ASP 76 Ca -0.23 0.06 -0.12 0.00 0.42 0.00 0.00 57.03 57.16 2hrv h ASP 76 Cb 1.13 0.15 -0.16 0.00 1.72 0.00 0.00 39.33 42.17 2hrv h ASP 76 CO 0.31 -0.12 -0.60 -1.66 -2.88 0.00 0.00 179.24 174.29 2hrv s TRP 77 N -6.18 0.37 -0.18 0.28 1.48 -1.26 -0.84 118.94 112.61 2hrv s TRP 77 Ca -0.14 -0.82 -0.22 0.00 -1.06 0.00 0.00 56.10 53.86 2hrv s TRP 77 Cb 0.10 -0.27 0.06 0.00 -1.16 0.00 0.00 33.47 32.20 2hrv s TRP 77 CO 0.68 -0.39 0.60 -0.47 -4.06 0.00 0.00 176.95 173.31 2hrv s TYR 78 N -3.40 -0.63 -0.23 1.66 5.04 -0.30 -4.99 117.35 114.50 2hrv s TYR 78 Ca 0.02 1.46 -0.23 0.00 -2.44 0.00 0.00 57.07 55.88 2hrv s TYR 78 Cb 0.04 0.25 -0.01 0.00 0.35 0.00 0.00 41.96 42.59 2hrv s TYR 78 CO -0.08 -0.38 0.74 -2.00 -1.34 0.00 0.00 175.55 172.49 2hrv s GLU 79 N -0.05 4.18 -0.21 4.97 2.12 -1.26 -0.78 118.70 127.67 2hrv s GLU 79 Ca -0.03 0.79 -0.10 0.00 0.36 0.00 0.00 54.97 55.99 2hrv s GLU 79 Cb -0.04 -3.62 -0.05 0.00 0.26 0.00 0.00 34.13 30.68 2hrv s GLU 79 CO 0.03 -0.41 0.14 0.42 -0.54 0.00 0.00 175.26 174.89 2hrv s ILE 80 N 2.49 5.38 0.96 -3.70 -1.09 0.23 -4.94 121.20 120.54 2hrv s ILE 80 Ca 0.32 0.18 -0.16 0.00 -2.23 0.00 0.00 60.65 58.76 2hrv s ILE 80 Cb -0.16 -3.47 0.25 0.00 -1.58 0.00 0.00 42.46 37.50 2hrv s ILE 80 CO 0.09 0.41 0.57 0.00 -1.23 0.00 0.00 174.94 174.77 2hrv n GLN 81 N 3.77 -3.90 -2.58 2.79 1.13 -1.26 0.04 117.38 117.36 2hrv n GLN 81 Ca -0.16 -0.95 -0.36 0.00 -1.94 0.00 0.00 57.00 53.59 2hrv n GLN 81 Cb 0.52 -1.24 -0.04 0.00 0.11 0.00 0.00 30.24 29.58 2hrv n GLN 81 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 2hrv s GLU 82 N -4.35 4.15 0.26 -1.09 2.12 -1.26 -3.58 118.70 114.94 2hrv s GLU 82 Ca 0.44 1.44 0.01 0.00 0.36 0.00 0.00 54.97 57.22 2hrv s GLU 82 Cb -0.08 -2.47 -0.03 0.00 0.26 0.00 0.00 34.13 31.81 2hrv s GLU 82 CO 0.37 -0.14 0.23 -1.54 -0.54 0.00 0.00 175.26 173.64 2hrv s SER 83 N -1.68 0.69 0.52 -1.70 1.04 0.74 -4.84 113.70 108.46 2hrv s SER 83 Ca 0.59 -1.48 0.23 0.00 0.48 0.00 0.00 55.95 55.77 2hrv s SER 83 Cb -0.20 0.47 1.39 0.00 0.10 0.00 0.00 66.02 67.79 2hrv s SER 83 CO 0.25 -0.97 2.10 -0.33 0.98 0.00 0.00 173.24 175.27 2hrv h GLU 84 N 2.40 0.00 0.00 4.02 3.07 -2.00 -3.10 114.58 118.97 2hrv h GLU 84 Ca -0.31 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 2hrv h GLU 84 Cb 1.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 2hrv h GLU 84 CO 0.45 0.10 -1.29 2.48 -1.40 0.00 0.00 179.01 179.36 2hrv n TYR 85 N -3.95 0.00 -3.92 4.33 0.18 -1.26 -5.02 117.16 107.52 2hrv n TYR 85 Ca -0.02 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.65 2hrv n TYR 85 Cb 0.19 -0.20 -0.12 0.00 -0.38 0.00 0.00 39.34 38.84 2hrv n TYR 85 CO 0.00 0.00 0.00 0.71 -2.08 0.00 0.00 176.86 175.49 2hrv s TYR 86 N -2.59 0.12 0.71 -3.48 2.02 -1.17 -5.07 117.35 107.89 2hrv s TYR 86 Ca -0.02 -0.25 -0.04 0.00 -0.37 0.00 0.00 57.07 56.39 2hrv s TYR 86 Cb 0.07 -0.09 0.09 0.00 -0.40 0.00 0.00 41.96 41.63 2hrv s TYR 86 CO 0.44 -0.11 0.99 -1.25 -1.57 0.00 0.00 175.55 174.06 2hrv s PRO 87 N -0.77 1.91 0.13 -1.71 0.04 -1.26 0.26 135.00 133.61 2hrv s PRO 87 Ca -0.08 -0.68 -0.35 0.00 0.04 0.00 0.00 61.00 59.92 2hrv s PRO 87 Cb -0.05 -2.26 -0.15 0.00 0.04 0.00 0.00 34.50 32.08 2hrv s PRO 87 CO -0.00 -1.33 1.49 1.17 0.04 0.00 0.00 177.00 178.36 2hrv n LYS 88 N -2.86 1.77 -3.91 4.56 4.81 -1.24 -4.46 118.16 116.83 2hrv n LYS 88 Ca 0.11 0.64 -0.09 0.00 -0.87 0.00 0.00 58.31 58.10 2hrv n LYS 88 Cb 0.60 -2.36 -0.04 0.00 0.02 0.00 0.00 35.03 33.25 2hrv n LYS 88 CO 0.00 0.00 0.00 -3.38 1.17 0.00 0.00 177.40 175.19 2hrv s HIS 89 N 0.76 0.13 -0.10 5.64 -3.43 0.11 -4.89 115.29 113.50 2hrv s HIS 89 Ca 0.81 -0.52 -0.18 0.00 -0.80 0.00 0.00 55.06 54.37 2hrv s HIS 89 Cb -0.78 0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 30.67 2hrv s HIS 89 CO 0.41 -1.03 0.49 0.42 -2.00 0.00 0.00 174.74 173.04 2hrv s ILE 90 N -3.96 5.15 -0.04 -5.38 -1.09 -1.26 0.75 121.20 115.37 2hrv s ILE 90 Ca 0.17 0.99 0.04 0.00 -2.23 0.00 0.00 60.65 59.61 2hrv s ILE 90 Cb -0.02 -3.83 -0.00 0.00 -1.58 0.00 0.00 42.46 37.03 2hrv s ILE 90 CO 0.06 0.34 -0.16 -1.58 -1.23 0.00 0.00 174.94 172.38 2hrv s GLN 91 N 0.48 1.67 0.37 2.79 0.74 0.04 -4.81 119.66 120.93 2hrv s GLN 91 Ca 0.27 -0.55 0.07 0.00 0.05 0.00 0.00 55.36 55.20 2hrv s GLN 91 Cb -0.15 -1.45 -0.00 0.00 1.10 0.00 0.00 33.01 32.50 2hrv s GLN 91 CO 0.11 0.20 0.48 0.71 -0.55 0.00 0.00 175.29 176.25 2hrv s TYR 92 N 0.12 2.98 -1.03 1.67 1.51 -1.03 -1.15 117.35 120.43 2hrv s TYR 92 Ca -0.05 -0.30 -0.12 0.00 -1.01 0.00 0.00 57.07 55.60 2hrv s TYR 92 Cb -0.12 -2.11 -0.03 0.00 -0.11 0.00 0.00 41.96 39.60 2hrv s TYR 92 CO 0.02 -0.13 0.81 0.09 -1.11 0.00 0.00 175.55 175.23 2hrv n ASN 93 N -1.68 -6.13 -4.72 2.29 3.02 -0.02 -4.74 115.26 103.28 2hrv n ASN 93 Ca 0.03 -0.77 -0.22 0.00 -0.03 0.00 0.00 54.58 53.58 2hrv n ASN 93 Cb 0.59 -4.17 -0.06 0.00 -0.61 0.00 0.00 39.78 35.53 2hrv n ASN 93 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2hrv s LEU 94 N -5.64 3.45 -0.03 3.41 2.01 -0.80 -0.56 118.68 120.52 2hrv s LEU 94 Ca 0.37 -0.49 0.01 0.00 0.01 0.00 0.00 54.13 54.02 2hrv s LEU 94 Cb -0.10 -1.97 0.02 0.00 0.01 0.00 0.00 46.19 44.15 2hrv s LEU 94 CO 0.81 -0.04 -0.03 -0.76 1.01 0.00 0.00 176.35 177.34 2hrv s LEU 95 N -3.76 1.41 0.01 1.79 1.43 -0.37 -1.29 118.68 117.91 2hrv s LEU 95 Ca 0.33 -0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.39 2hrv s LEU 95 Cb -0.07 -0.34 -0.02 0.00 0.03 0.00 0.00 46.19 45.80 2hrv s LEU 95 CO 0.22 -0.05 -0.15 -0.63 0.23 0.00 0.00 176.35 175.98 2hrv s ILE 96 N 0.74 1.16 0.35 -0.59 1.01 -0.40 -0.65 121.20 122.82 2hrv s ILE 96 Ca -0.09 -0.79 -0.11 0.00 0.00 0.00 0.00 60.65 59.67 2hrv s ILE 96 Cb -0.12 -1.00 0.03 0.00 0.01 0.00 0.00 42.46 41.38 2hrv s ILE 96 CO -0.00 0.20 0.64 -0.83 0.00 0.00 0.00 174.94 174.95 2hrv s GLY 97 N -0.67 0.76 -0.11 6.18 0.00 -0.85 -0.40 107.32 112.23 2hrv s GLY 97 Ca 0.04 -1.01 -0.15 0.00 0.00 0.00 0.00 44.72 43.60 2hrv s GLY 97 CO 0.00 -0.57 0.37 1.85 0.00 0.00 0.00 173.10 174.76 2hrv s GLU 98 N -2.85 4.19 0.00 2.90 2.12 -1.26 -1.62 118.70 122.18 2hrv s GLU 98 Ca 0.21 0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.82 2hrv s GLU 98 Cb -0.03 -3.38 0.00 0.00 0.26 0.00 0.00 34.13 30.98 2hrv s GLU 98 CO 0.14 0.32 0.00 0.41 -0.54 0.00 0.00 175.26 175.59 2hrv n GLY 99 N 2.98 1.91 3.78 -1.50 0.00 -0.64 -4.83 105.19 106.89 2hrv n GLY 99 Ca -0.11 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.70 2hrv n GLY 99 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hrv s PRO 100 N -2.00 3.11 -0.28 1.61 0.04 -1.26 -3.41 135.00 132.81 2hrv s PRO 100 Ca 0.00 1.43 -0.22 0.00 0.04 0.00 0.00 61.00 62.25 2hrv s PRO 100 Cb 0.00 -1.99 0.11 0.00 0.04 0.00 0.00 34.50 32.66 2hrv s PRO 100 CO 0.00 -1.01 0.89 0.00 0.04 0.00 0.00 177.00 176.92 2hrv s GLU 102 N 0.65 0.95 0.39 0.00 0.41 -1.26 -4.73 118.70 115.11 2hrv s GLU 102 Ca -0.02 -1.18 -0.24 0.00 -0.41 0.00 0.00 54.97 53.12 2hrv s GLU 102 Cb -0.05 0.31 -0.12 0.00 -1.78 0.00 0.00 34.13 32.49 2hrv s GLU 102 CO -0.08 -0.30 0.74 -2.30 -0.49 0.00 0.00 175.26 172.84 2hrv n PRO 103 N -0.10 0.86 0.00 0.39 -0.02 -1.26 -1.45 135.00 133.42 2hrv n PRO 103 Ca -0.10 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2hrv n PRO 103 Cb 0.63 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 2hrv n PRO 103 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hrv n GLY 104 N 1.55 1.20 0.08 -1.23 0.00 -1.26 -4.90 105.19 100.63 2hrv n GLY 104 Ca 0.11 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 2hrv n GLY 104 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2hrv n ASP 105 N 0.00 0.75 -4.71 1.61 8.00 -0.53 -4.85 116.55 116.83 2hrv n ASP 105 Ca 0.00 0.36 -0.43 0.00 0.71 0.00 0.00 54.79 55.42 2hrv n ASP 105 Cb 0.00 -0.34 -0.02 0.00 -0.02 0.00 0.00 41.12 40.74 2hrv n ASP 105 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hrv n GLY 107 N 1.86 2.73 3.72 0.00 0.00 -0.12 -4.91 105.19 108.47 2hrv n GLY 107 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2hrv n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hrv n GLY 108 N -1.51 0.95 3.80 -0.02 0.00 -0.97 -2.89 105.19 104.55 2hrv n GLY 108 Ca 0.00 0.40 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 2hrv n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hrv s LYS 109 N -1.13 4.28 -0.13 1.61 1.02 -1.26 -0.65 119.74 123.47 2hrv s LYS 109 Ca 0.61 1.25 0.03 0.00 0.02 0.00 0.00 55.97 57.87 2hrv s LYS 109 Cb -0.55 -2.38 0.01 0.00 -0.52 0.00 0.00 37.83 34.38 2hrv s LYS 109 CO 0.55 0.00 -0.22 -1.17 -0.92 0.00 0.00 175.35 173.60 2hrv s LEU 110 N -2.84 2.15 0.09 3.17 2.96 0.14 -1.33 118.68 123.01 2hrv s LEU 110 Ca 0.59 -0.58 0.06 0.00 -0.22 0.00 0.00 54.13 53.98 2hrv s LEU 110 Cb -0.14 -1.45 -0.03 0.00 0.50 0.00 0.00 46.19 45.07 2hrv s LEU 110 CO 0.18 0.10 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.39 2hrv s LEU 111 N 0.72 2.30 0.00 -0.68 1.02 0.90 -0.66 118.68 122.29 2hrv s LEU 111 Ca -0.09 -0.66 0.01 0.00 0.02 0.00 0.00 54.13 53.40 2hrv s LEU 111 Cb -0.16 -0.61 0.01 0.00 0.02 0.00 0.00 46.19 45.44 2hrv s LEU 111 CO 0.00 -0.05 0.05 0.00 0.02 0.00 0.00 176.35 176.37 2hrv h LYS 113 N 0.00 0.00 0.00 0.00 2.10 -2.00 -3.12 116.57 113.56 2hrv h LYS 113 Ca -0.08 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.33 2hrv h LYS 113 Cb 0.26 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.55 2hrv h LYS 113 CO 0.13 0.00 -1.70 0.72 -2.00 0.00 0.00 179.45 176.60 2hrv n HIS 114 N -2.62 0.80 -3.53 0.07 8.25 -1.26 -5.09 115.22 111.84 2hrv n HIS 114 Ca 0.00 0.28 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 2hrv n HIS 114 Cb 0.21 -1.09 0.00 0.00 1.12 0.00 0.00 29.99 30.23 2hrv n HIS 114 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hrv n GLY 115 N 1.50 -0.51 3.66 -1.41 0.00 -1.18 -4.78 105.19 102.48 2hrv n GLY 115 Ca -0.16 -0.99 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 2hrv n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hrv s VAL 116 N -3.07 4.85 -0.46 1.61 1.01 -0.15 -1.31 120.40 122.88 2hrv s VAL 116 Ca 0.00 1.66 0.10 0.00 0.00 0.00 0.00 61.98 63.74 2hrv s VAL 116 Cb 0.00 -4.15 -0.11 0.00 0.00 0.00 0.00 36.38 32.12 2hrv s VAL 116 CO 0.00 -0.01 0.42 2.30 0.00 0.00 0.00 175.10 177.81 2hrv n ILE 117 N 4.90 0.00 -3.84 2.22 -5.35 0.17 -4.09 119.36 113.36 2hrv n ILE 117 Ca 0.05 -0.26 -0.01 0.00 -0.27 0.00 0.00 62.75 62.26 2hrv n ILE 117 Cb 0.48 0.99 0.01 0.00 -1.74 0.00 0.00 39.64 39.38 2hrv n ILE 117 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2hrv s GLY 118 N -1.96 -0.08 0.02 3.28 0.00 -1.06 0.53 107.32 108.05 2hrv s GLY 118 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 44.72 44.75 2hrv s GLY 118 CO 0.41 2.19 -0.06 -0.26 0.00 0.00 0.00 173.10 175.37 2hrv s ILE 119 N -2.39 0.46 0.19 0.90 -4.36 -1.16 -0.69 121.20 114.15 2hrv s ILE 119 Ca 0.20 -0.64 -0.33 0.00 -0.26 0.00 0.00 60.65 59.62 2hrv s ILE 119 Cb -0.01 -0.47 -0.13 0.00 1.25 0.00 0.00 42.46 43.11 2hrv s ILE 119 CO 0.02 -0.13 1.61 0.52 0.24 0.00 0.00 174.94 177.20 2hrv n VAL 120 N 2.22 0.15 0.00 8.37 0.31 0.18 -1.22 118.33 128.34 2hrv n VAL 120 Ca -0.18 -0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 2hrv n VAL 120 Cb 0.56 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 2hrv n VAL 120 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2hrv n THR 121 N 3.38 0.00 -3.56 2.52 5.66 -0.04 -0.95 114.28 121.29 2hrv n THR 121 Ca 0.16 -0.05 -0.07 0.00 -3.05 0.00 0.00 64.05 61.04 2hrv n THR 121 Cb 0.31 0.44 -0.02 0.00 -1.55 0.00 0.00 70.33 69.51 2hrv n THR 121 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2hrv s ALA 122 N -1.28 -1.82 0.14 1.79 0.00 -1.06 -5.00 121.76 114.53 2hrv s ALA 122 Ca 0.00 0.87 -0.26 0.00 0.00 0.00 0.00 51.96 52.57 2hrv s ALA 122 Cb 0.00 0.42 0.07 0.00 0.00 0.00 0.00 23.12 23.61 2hrv s ALA 122 CO 0.00 -0.76 0.98 0.20 0.00 0.00 0.00 175.76 176.18 2hrv s GLY 123 N -2.57 -0.25 0.00 0.00 0.00 -1.26 0.42 107.32 103.66 2hrv s GLY 123 Ca 0.07 0.19 0.00 0.00 0.00 0.00 0.00 44.72 44.98 2hrv s GLY 123 CO -0.06 0.02 0.00 0.61 0.00 0.00 0.00 173.10 173.67 2hrv n GLY 124 N -0.47 3.82 3.84 0.20 0.00 0.68 -4.99 105.19 108.26 2hrv n GLY 124 Ca -0.06 -0.72 -0.28 0.00 0.00 0.00 0.00 46.02 44.96 2hrv n GLY 124 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hrv n ASP 125 N 0.00 -2.21 -0.61 1.61 2.03 -1.26 -1.38 116.55 114.73 2hrv n ASP 125 Ca 0.00 -1.00 -0.08 0.00 0.52 0.00 0.00 54.79 54.23 2hrv n ASP 125 Cb 0.00 -3.23 -0.03 0.00 -0.72 0.00 0.00 41.12 37.13 2hrv n ASP 125 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2hrv n ASN 126 N -2.86 -5.24 -4.26 1.67 3.02 -1.26 -4.98 115.26 101.34 2hrv n ASN 126 Ca -0.23 0.20 -0.21 0.00 -0.03 0.00 0.00 54.58 54.30 2hrv n ASN 126 Cb 0.65 -3.44 -0.12 0.00 -0.61 0.00 0.00 39.78 36.26 2hrv n ASN 126 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2hrv s HIS 127 N -1.87 1.61 0.00 3.10 3.76 -0.48 -1.62 115.29 119.79 2hrv s HIS 127 Ca 0.00 -0.46 0.03 0.00 -0.15 0.00 0.00 55.06 54.48 2hrv s HIS 127 Cb 0.00 -0.86 -0.01 0.00 1.11 0.00 0.00 32.58 32.82 2hrv s HIS 127 CO 0.00 0.19 -0.09 0.54 -0.85 0.00 0.00 174.74 174.53 2hrv s VAL 128 N -1.54 0.72 0.12 -0.90 0.11 -0.64 -0.23 120.40 118.03 2hrv s VAL 128 Ca 0.07 -0.49 0.10 0.00 -2.93 0.00 0.00 61.98 58.74 2hrv s VAL 128 Cb -0.08 -0.62 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 2hrv s VAL 128 CO 0.04 0.13 -0.24 0.00 -3.33 0.00 0.00 175.10 171.71 2hrv s ALA 129 N -0.35 2.47 0.04 1.54 0.00 0.17 -2.00 121.76 123.62 2hrv s ALA 129 Ca 0.02 -1.42 0.02 0.00 0.00 0.00 0.00 51.96 50.59 2hrv s ALA 129 Cb -0.04 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.58 2hrv s ALA 129 CO -0.00 0.56 -0.08 -0.06 0.00 0.00 0.00 175.76 176.18 2hrv s PHE 130 N -1.07 0.69 0.11 0.00 0.40 0.18 -0.86 117.98 117.43 2hrv s PHE 130 Ca 0.15 -0.48 -0.30 0.00 -0.60 0.00 0.00 56.93 55.70 2hrv s PHE 130 Cb -0.10 -0.41 -0.06 0.00 0.51 0.00 0.00 43.02 42.95 2hrv s PHE 130 CO 0.07 -0.07 1.16 0.42 0.70 0.00 0.00 175.22 177.50 2hrv s ILE 131 N -1.31 3.94 -0.67 0.64 1.01 -0.36 -1.23 121.20 123.22 2hrv s ILE 131 Ca -0.09 1.50 -0.23 0.00 0.00 0.00 0.00 60.65 61.83 2hrv s ILE 131 Cb -0.10 -3.96 0.06 0.00 0.01 0.00 0.00 42.46 38.48 2hrv s ILE 131 CO 0.00 0.18 1.01 -0.62 0.00 0.00 0.00 174.94 175.51 2hrv s ASP 132 N 0.59 6.17 0.55 3.58 -1.08 0.27 -3.01 116.67 123.75 2hrv s ASP 132 Ca 0.55 -0.92 0.34 0.00 -0.52 0.00 0.00 52.55 52.00 2hrv s ASP 132 Cb -0.30 -2.44 1.47 0.00 -1.46 0.00 0.00 42.92 40.19 2hrv s ASP 132 CO 0.32 -1.50 2.03 -0.07 0.52 0.00 0.00 175.17 176.47 2hrv h LEU 133 N 11.59 0.00 -1.81 -1.34 3.38 -0.24 -2.99 115.31 123.89 2hrv h LEU 133 Ca -0.29 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.78 2hrv h LEU 133 Cb 1.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2hrv h LEU 133 CO 1.20 0.04 0.32 0.03 0.09 0.00 0.00 178.44 180.11 2hrv h ARG 134 N 0.00 0.21 0.00 1.13 3.08 -1.82 0.52 114.38 117.50 2hrv h ARG 134 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2hrv h ARG 134 Cb 0.46 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2hrv h ARG 134 CO 0.00 0.14 0.00 0.45 -1.07 0.00 0.00 179.97 179.50 2hrv h HIS 135 N 0.22 0.00 -0.39 3.04 3.86 -1.88 -3.16 115.15 116.84 2hrv h HIS 135 Ca 0.22 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.38 2hrv h HIS 135 Cb 0.57 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.01 2hrv h HIS 135 CO -0.00 0.00 0.03 1.19 0.86 0.00 0.00 177.93 180.01 2hrv n PHE 136 N -2.46 1.37 -3.77 2.45 3.01 0.17 -4.93 117.46 113.30 2hrv n PHE 136 Ca 0.03 -0.96 -0.14 0.00 1.01 0.00 0.00 57.45 57.39 2hrv n PHE 136 Cb 0.33 -0.42 -0.15 0.00 -0.01 0.00 0.00 39.48 39.23 2hrv n PHE 136 CO 0.00 0.00 0.00 -1.58 1.01 0.00 0.00 176.76 176.19 2hrv s HIS 137 N -2.88 -0.09 -0.14 1.38 5.04 -1.19 -5.11 115.29 112.29 2hrv s HIS 137 Ca 0.46 0.32 -0.29 0.00 -1.54 0.00 0.00 55.06 54.01 2hrv s HIS 137 Cb 0.38 -0.11 -0.02 0.00 0.04 0.00 0.00 32.58 32.86 2hrv s HIS 137 CO 0.10 -0.12 1.31 0.00 -2.34 0.00 0.00 174.74 173.69