#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nvh s PRO 2 N 0.00 -0.58 0.46 0.00 0.04 -1.26 -4.97 135.00 128.69 2nvh s PRO 2 Ca 0.00 0.06 -0.24 0.00 0.04 0.00 0.00 61.00 60.86 2nvh s PRO 2 Cb 0.00 -1.66 -0.07 0.00 0.04 0.00 0.00 34.50 32.81 2nvh s PRO 2 CO 0.00 -3.31 1.29 0.54 0.04 0.00 0.00 177.00 175.56 2nvh s VAL 3 N -3.08 2.58 0.11 -0.36 0.11 -1.26 -4.99 120.40 113.50 2nvh s VAL 3 Ca 0.69 0.47 -0.10 0.00 -2.93 0.00 0.00 61.98 60.12 2nvh s VAL 3 Cb -0.12 -3.26 -0.06 0.00 -1.53 0.00 0.00 36.38 31.41 2nvh s VAL 3 CO 0.56 0.03 0.43 -0.13 -3.33 0.00 0.00 175.10 172.66 2nvh s ARG 4 N -2.55 3.78 0.11 1.54 0.52 -1.26 -4.98 118.95 116.10 2nvh s ARG 4 Ca 0.63 0.19 -0.01 0.00 -0.52 0.00 0.00 55.73 56.02 2nvh s ARG 4 Cb -0.36 -2.93 -0.04 0.00 0.52 0.00 0.00 34.95 32.13 2nvh s ARG 4 CO 0.45 0.51 0.02 -1.12 0.02 0.00 0.00 175.30 175.19 2nvh s SER 5 N -1.90 0.46 -0.00 0.23 0.01 -1.26 -1.74 113.70 109.50 2nvh s SER 5 Ca 0.36 -1.14 0.01 0.00 1.31 0.00 0.00 55.95 56.49 2nvh s SER 5 Cb -0.14 0.25 -0.00 0.00 0.21 0.00 0.00 66.02 66.34 2nvh s SER 5 CO 0.19 -0.67 -0.05 -0.76 0.41 0.00 0.00 173.24 172.37 2nvh s LEU 6 N -3.02 2.02 0.11 2.44 1.43 0.27 -4.93 118.68 116.99 2nvh s LEU 6 Ca 0.19 -0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 52.90 2nvh s LEU 6 Cb 0.07 -0.23 -0.06 0.00 0.03 0.00 0.00 46.19 46.01 2nvh s LEU 6 CO -0.02 0.05 0.92 0.20 0.23 0.00 0.00 176.35 177.73 2nvh s ASN 7 N -0.15 7.46 0.25 2.29 -0.87 -1.26 -0.66 114.94 122.00 2nvh s ASN 7 Ca 0.01 1.75 -0.22 0.00 -1.57 0.00 0.00 52.86 52.83 2nvh s ASN 7 Cb -0.02 -2.57 0.03 0.00 -0.02 0.00 0.00 41.25 38.67 2nvh s ASN 7 CO -0.00 -0.03 0.79 0.00 -2.57 0.00 0.00 177.10 175.29 2nvh s THR 9 N -3.68 2.07 0.05 0.00 -4.23 -0.25 -0.01 115.64 109.59 2nvh s THR 9 Ca 0.12 -2.21 0.08 0.00 -1.18 0.00 0.00 61.69 58.49 2nvh s THR 9 Cb -0.05 -2.10 -0.03 0.00 1.34 0.00 0.00 72.50 71.66 2nvh s THR 9 CO 0.06 -0.44 -0.21 -0.76 -0.54 0.00 0.00 174.62 172.73 2nvh s LEU 10 N -3.21 2.18 0.07 4.79 1.43 -1.26 -0.88 118.68 121.79 2nvh s LEU 10 Ca 0.24 -0.54 0.05 0.00 -1.03 0.00 0.00 54.13 52.84 2nvh s LEU 10 Cb -0.04 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 2nvh s LEU 10 CO 0.10 0.16 -0.13 -0.13 0.23 0.00 0.00 176.35 176.58 2nvh s ARG 11 N -1.25 0.76 0.93 1.70 0.52 -0.06 -4.03 118.95 117.52 2nvh s ARG 11 Ca 0.08 -0.92 -0.15 0.00 -0.52 0.00 0.00 55.73 54.23 2nvh s ARG 11 Cb -0.09 -0.72 0.17 0.00 0.52 0.00 0.00 34.95 34.83 2nvh s ARG 11 CO 0.02 0.16 1.24 0.16 0.02 0.00 0.00 175.30 176.90 2nvh s ASP 12 N -1.71 3.37 0.00 0.23 1.47 -0.27 -0.33 116.67 119.44 2nvh s ASP 12 Ca -0.04 0.52 0.16 0.00 1.18 0.00 0.00 52.55 54.37 2nvh s ASP 12 Cb -0.10 -0.77 0.68 0.00 -0.34 0.00 0.00 42.92 42.40 2nvh s ASP 12 CO 0.02 -2.59 1.50 -1.54 0.68 0.00 0.00 175.17 173.24 2nvh n SER 13 N -3.72 0.00 -1.15 2.11 3.41 -0.23 0.11 113.62 114.15 2nvh n SER 13 Ca 0.12 0.47 0.08 0.00 -0.26 0.00 0.00 58.87 59.27 2nvh n SER 13 Cb 0.60 -0.48 0.26 0.00 -0.26 0.00 0.00 64.21 64.32 2nvh n SER 13 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nvh n GLN 14 N -1.48 2.69 -2.03 4.33 6.02 -1.26 -4.92 117.38 120.73 2nvh n GLN 14 Ca 0.04 -2.07 -0.17 0.00 -0.01 0.00 0.00 57.00 54.79 2nvh n GLN 14 Cb 0.18 -1.59 -0.03 0.00 1.02 0.00 0.00 30.24 29.82 2nvh n GLN 14 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2nvh n GLN 15 N 0.95 -1.32 -2.99 -1.09 6.02 0.31 -4.99 117.38 114.26 2nvh n GLN 15 Ca 0.19 0.94 -0.39 0.00 -0.01 0.00 0.00 57.00 57.73 2nvh n GLN 15 Cb 0.59 -5.32 -0.06 0.00 1.02 0.00 0.00 30.24 26.47 2nvh n GLN 15 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2nvh s LYS 16 N -4.35 4.54 0.50 -1.09 1.02 -1.25 -4.68 119.74 114.43 2nvh s LYS 16 Ca 0.00 1.14 -0.04 0.00 0.02 0.00 0.00 55.97 57.08 2nvh s LYS 16 Cb 0.00 -3.23 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 2nvh s LYS 16 CO 0.00 0.56 0.79 -1.12 -0.92 0.00 0.00 175.35 174.65 2nvh s SER 17 N -1.19 6.04 -0.10 2.83 0.01 0.11 -1.12 113.70 120.28 2nvh s SER 17 Ca 0.36 0.77 0.00 0.00 1.31 0.00 0.00 55.95 58.39 2nvh s SER 17 Cb -0.23 -2.01 -0.02 0.00 0.21 0.00 0.00 66.02 63.97 2nvh s SER 17 CO 0.26 -0.70 -0.09 -0.76 0.41 0.00 0.00 173.24 172.36 2nvh s LEU 18 N -4.76 3.00 0.19 2.44 1.43 -1.26 -0.12 118.68 119.60 2nvh s LEU 18 Ca 0.49 -0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.45 2nvh s LEU 18 Cb -0.10 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.40 2nvh s LEU 18 CO 0.44 0.27 0.02 0.68 0.23 0.00 0.00 176.35 177.98 2nvh s VAL 19 N -0.25 0.69 0.42 -1.59 -7.23 -0.44 0.31 120.40 112.32 2nvh s VAL 19 Ca 0.03 -1.99 -0.23 0.00 -1.81 0.00 0.00 61.98 57.97 2nvh s VAL 19 Cb -0.13 -2.22 -0.09 0.00 0.56 0.00 0.00 36.38 34.50 2nvh s VAL 19 CO 0.03 -0.38 1.04 -0.04 -0.31 0.00 0.00 175.10 175.44 2nvh s MET 20 N -3.93 4.10 -0.45 4.82 1.00 -1.26 -0.70 119.30 122.88 2nvh s MET 20 Ca 0.27 1.47 0.03 0.00 0.00 0.00 0.00 55.69 57.45 2nvh s MET 20 Cb 0.06 -2.45 0.15 0.00 0.00 0.00 0.00 34.83 32.59 2nvh s MET 20 CO 0.06 -0.19 0.30 0.45 0.00 0.00 0.00 175.02 175.64 2nvh s SER 21 N -1.66 3.07 0.09 3.03 0.15 -0.16 -4.71 113.70 113.51 2nvh s SER 21 Ca 0.60 -2.84 0.00 0.00 0.70 0.00 0.00 55.95 54.40 2nvh s SER 21 Cb -0.21 -0.83 0.00 0.00 -1.71 0.00 0.00 66.02 63.27 2nvh s SER 21 CO 0.26 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.08 2nvh n GLY 22 N 3.22 -2.08 0.24 9.45 0.00 -1.26 -3.48 105.19 111.28 2nvh n GLY 22 Ca 0.17 -1.43 0.14 0.00 0.00 0.00 0.00 46.02 44.90 2nvh n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nvh h PRO 23 N 0.00 0.00 0.00 1.61 0.13 -2.03 -3.37 132.00 128.35 2nvh h PRO 23 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.13 2nvh h PRO 23 Cb 0.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.22 2nvh h PRO 23 CO 0.00 0.04 -0.19 0.66 -0.23 0.00 0.00 178.00 178.28 2nvh n TYR 24 N -3.12 0.00 -3.80 1.56 4.01 -1.26 -4.99 117.16 109.56 2nvh n TYR 24 Ca 0.02 -0.85 -0.11 0.00 -0.16 0.00 0.00 57.90 56.81 2nvh n TYR 24 Cb 0.44 -0.14 -0.08 0.00 -0.31 0.00 0.00 39.34 39.25 2nvh n TYR 24 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2nvh s GLU 25 N -2.26 0.75 0.19 -0.72 0.41 -1.23 -3.56 118.70 112.29 2nvh s GLU 25 Ca 0.27 -0.58 0.09 0.00 -0.41 0.00 0.00 54.97 54.33 2nvh s GLU 25 Cb 0.24 0.32 -0.04 0.00 -1.78 0.00 0.00 34.13 32.87 2nvh s GLU 25 CO 0.01 -0.23 -0.06 -0.51 -0.49 0.00 0.00 175.26 173.97 2nvh s LEU 26 N -2.10 3.06 0.15 1.80 1.43 -1.26 -0.99 118.68 120.77 2nvh s LEU 26 Ca -0.05 -0.56 0.05 0.00 -1.03 0.00 0.00 54.13 52.54 2nvh s LEU 26 Cb -0.01 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 2nvh s LEU 26 CO -0.04 0.08 -0.11 -0.54 0.23 0.00 0.00 176.35 175.97 2nvh s LYS 27 N -2.99 1.09 -0.07 1.70 1.02 0.12 -0.88 119.74 119.72 2nvh s LYS 27 Ca 0.26 -1.44 0.05 0.00 0.02 0.00 0.00 55.97 54.87 2nvh s LYS 27 Cb -0.08 -0.72 -0.01 0.00 -0.52 0.00 0.00 37.83 36.50 2nvh s LYS 27 CO 0.17 0.10 -0.24 0.00 -0.92 0.00 0.00 175.35 174.46 2nvh s ALA 28 N -3.12 2.21 0.06 5.17 0.00 -0.15 -1.33 121.76 124.60 2nvh s ALA 28 Ca 0.16 -1.01 -0.22 0.00 0.00 0.00 0.00 51.96 50.89 2nvh s ALA 28 Cb 0.01 -0.76 0.05 0.00 0.00 0.00 0.00 23.12 22.43 2nvh s ALA 28 CO 0.02 0.37 0.51 -0.48 0.00 0.00 0.00 175.76 176.18 2nvh s LEU 29 N 0.01 -0.05 -0.22 0.00 2.34 0.83 0.15 118.68 121.73 2nvh s LEU 29 Ca -0.08 0.11 -0.29 0.00 0.06 0.00 0.00 54.13 53.93 2nvh s LEU 29 Cb -0.15 2.12 -0.02 0.00 -0.56 0.00 0.00 46.19 47.58 2nvh s LEU 29 CO 0.05 -0.75 1.54 -1.00 -1.06 0.00 0.00 176.35 175.14 2nvh s HIS 30 N -2.67 2.24 -0.01 3.48 3.76 -1.26 0.04 115.29 120.87 2nvh s HIS 30 Ca -0.04 0.60 0.03 0.00 -0.15 0.00 0.00 55.06 55.51 2nvh s HIS 30 Cb -0.00 -3.93 -0.01 0.00 1.11 0.00 0.00 32.58 29.75 2nvh s HIS 30 CO -0.03 -2.71 -0.10 -0.51 -0.85 0.00 0.00 174.74 170.53 2nvh s LEU 31 N 4.86 1.99 0.05 0.89 1.43 -1.26 -4.97 118.68 121.67 2nvh s LEU 31 Ca 0.68 -0.19 -0.20 0.00 -1.03 0.00 0.00 54.13 53.39 2nvh s LEU 31 Cb -0.24 -0.55 0.04 0.00 0.03 0.00 0.00 46.19 45.47 2nvh s LEU 31 CO 0.27 0.12 0.46 -1.58 0.23 0.00 0.00 176.35 175.85 2nvh s GLN 32 N -0.19 0.97 3.84 1.70 0.74 -1.26 -4.88 119.66 120.59 2nvh s GLN 32 Ca 0.03 -0.32 0.00 0.00 0.05 0.00 0.00 55.36 55.12 2nvh s GLN 32 Cb -0.05 0.44 0.00 0.00 1.10 0.00 0.00 33.01 34.50 2nvh s GLN 32 CO -0.00 -0.34 0.00 0.41 -0.55 0.00 0.00 175.29 174.80 2nvh n GLY 33 N 0.44 0.37 0.26 2.59 0.00 -1.26 -3.79 105.19 103.80 2nvh n GLY 33 Ca -0.18 -0.92 -0.02 0.00 0.00 0.00 0.00 46.02 44.90 2nvh n GLY 33 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2nvh h GLN 34 N 0.00 0.68 -0.36 1.61 3.07 -2.05 -2.92 115.11 115.13 2nvh h GLN 34 Ca 0.00 -0.04 0.10 0.00 0.09 0.00 0.00 58.65 58.80 2nvh h GLN 34 Cb 0.00 -0.15 -0.01 0.00 0.08 0.00 0.00 27.48 27.39 2nvh h GLN 34 CO 0.00 0.45 0.40 -0.44 0.09 0.00 0.00 178.83 179.33 2nvh h ASP 35 N 0.70 0.00 0.42 0.06 3.32 -2.00 -1.94 116.42 116.98 2nvh h ASP 35 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2nvh h ASP 35 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2nvh h ASP 35 CO -0.18 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.57 2nvh n MET 36 N -3.71 0.02 0.32 3.56 2.81 -1.10 -1.43 117.12 117.59 2nvh n MET 36 Ca 0.06 0.32 0.21 0.00 -1.81 0.00 0.00 57.70 56.49 2nvh n MET 36 Cb 0.56 -1.55 1.11 0.00 -0.71 0.00 0.00 33.22 32.63 2nvh n MET 36 CO 0.00 0.00 0.00 1.05 1.51 0.00 0.00 175.97 178.53 2nvh h GLU 37 N 0.00 0.00 0.00 0.03 9.09 -1.58 0.07 114.58 122.19 2nvh h GLU 37 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2nvh h GLU 37 Cb 0.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.31 2nvh h GLU 37 CO 0.00 0.00 0.00 1.96 0.05 0.00 0.00 179.01 181.02 2nvh h GLN 38 N 0.00 0.00 -7.11 1.06 4.20 -1.49 -3.46 115.11 108.31 2nvh h GLN 38 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 2nvh h GLN 38 Cb 0.07 0.00 0.10 0.00 0.30 0.00 0.00 27.48 27.95 2nvh h GLN 38 CO 0.00 0.00 0.44 1.14 -0.67 0.00 0.00 178.83 179.74 2nvh s GLN 39 N -3.34 3.07 0.25 1.46 -2.07 0.01 -4.55 119.66 114.49 2nvh s GLN 39 Ca 0.05 1.70 -0.24 0.00 -1.82 0.00 0.00 55.36 55.05 2nvh s GLN 39 Cb 0.10 -1.96 -0.09 0.00 -1.09 0.00 0.00 33.01 29.97 2nvh s GLN 39 CO 0.48 -1.09 0.83 0.14 -1.32 0.00 0.00 175.29 174.33 2nvh s VAL 40 N -1.75 4.34 -0.19 3.63 -7.23 0.15 -4.95 120.40 114.40 2nvh s VAL 40 Ca 0.74 1.65 -0.07 0.00 -1.81 0.00 0.00 61.98 62.50 2nvh s VAL 40 Cb -0.27 -4.03 -0.04 0.00 0.56 0.00 0.00 36.38 32.61 2nvh s VAL 40 CO 0.32 0.29 0.06 -0.69 -0.31 0.00 0.00 175.10 174.77 2nvh s VAL 41 N -1.43 4.65 0.22 1.32 1.01 -1.26 -4.64 120.40 120.26 2nvh s VAL 41 Ca 0.43 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.39 2nvh s VAL 41 Cb -0.20 -3.10 -0.03 0.00 0.00 0.00 0.00 36.38 33.04 2nvh s VAL 41 CO 0.24 0.44 0.25 -0.36 0.00 0.00 0.00 175.10 175.67 2nvh s PHE 42 N 0.58 3.27 -0.28 5.22 0.08 0.99 -1.13 117.98 126.71 2nvh s PHE 42 Ca 0.03 -0.04 -0.02 0.00 0.12 0.00 0.00 56.93 57.02 2nvh s PHE 42 Cb -0.13 -1.51 0.04 0.00 -0.57 0.00 0.00 43.02 40.85 2nvh s PHE 42 CO 0.01 0.49 -0.02 0.45 -0.10 0.00 0.00 175.22 176.06 2nvh s SER 43 N -3.69 4.71 -0.32 1.36 0.15 0.12 -0.45 113.70 115.60 2nvh s SER 43 Ca 0.33 -1.12 -0.14 0.00 0.70 0.00 0.00 55.95 55.72 2nvh s SER 43 Cb -0.09 -1.70 -0.02 0.00 -1.71 0.00 0.00 66.02 62.49 2nvh s SER 43 CO 0.26 -0.21 0.30 -0.32 1.20 0.00 0.00 173.24 174.47 2nvh s MET 44 N 1.29 3.69 -0.09 5.44 1.75 0.16 -1.38 119.30 130.17 2nvh s MET 44 Ca -0.03 -0.38 -0.03 0.00 -1.25 0.00 0.00 55.69 54.00 2nvh s MET 44 Cb -0.19 -3.75 -0.04 0.00 2.84 0.00 0.00 34.83 33.69 2nvh s MET 44 CO -0.02 -0.40 0.06 -1.12 -0.65 0.00 0.00 175.02 172.89 2nvh s SER 45 N 1.72 5.69 -0.58 1.11 0.01 -0.69 -0.57 113.70 120.39 2nvh s SER 45 Ca 0.10 0.26 -0.19 0.00 1.31 0.00 0.00 55.95 57.43 2nvh s SER 45 Cb -0.17 -1.70 0.10 0.00 0.21 0.00 0.00 66.02 64.46 2nvh s SER 45 CO 0.11 0.37 0.70 -0.36 0.41 0.00 0.00 173.24 174.47 2nvh s PHE 46 N -0.98 3.00 0.55 2.43 0.40 -0.71 -0.68 117.98 121.99 2nvh s PHE 46 Ca 0.15 -0.91 0.06 0.00 -0.60 0.00 0.00 56.93 55.63 2nvh s PHE 46 Cb -0.12 -3.97 0.04 0.00 0.51 0.00 0.00 43.02 39.49 2nvh s PHE 46 CO 0.05 -1.27 0.43 0.14 0.70 0.00 0.00 175.22 175.26 2nvh s VAL 47 N 2.69 1.67 0.38 -0.44 -7.23 -1.05 -4.51 120.40 111.92 2nvh s VAL 47 Ca 0.12 -1.46 -0.26 0.00 -1.81 0.00 0.00 61.98 58.57 2nvh s VAL 47 Cb -0.24 -2.13 -0.09 0.00 0.56 0.00 0.00 36.38 34.49 2nvh s VAL 47 CO 0.07 0.00 1.16 -1.10 -0.31 0.00 0.00 175.10 174.92 2nvh s GLN 48 N -4.31 4.17 0.00 4.82 -0.21 0.84 -4.71 119.66 120.25 2nvh s GLN 48 Ca 0.36 1.84 0.00 0.00 0.02 0.00 0.00 55.36 57.57 2nvh s GLN 48 Cb -0.02 -2.77 0.00 0.00 1.00 0.00 0.00 33.01 31.22 2nvh s GLN 48 CO 0.22 -0.22 0.00 0.41 -2.12 0.00 0.00 175.29 173.58 2nvh n GLY 49 N 0.70 3.54 3.55 3.09 0.00 -1.26 -4.84 105.19 109.97 2nvh n GLY 49 Ca 0.03 -1.20 -0.59 0.00 0.00 0.00 0.00 46.02 44.26 2nvh n GLY 49 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2nvh n GLU 50 N -1.46 0.19 -3.99 1.61 4.07 -1.26 -4.79 120.64 115.02 2nvh n GLU 50 Ca 0.00 0.07 -0.08 0.00 -0.06 0.00 0.00 57.16 57.09 2nvh n GLU 50 Cb 0.00 -1.60 -0.10 0.00 -0.06 0.00 0.00 31.44 29.69 2nvh n GLU 50 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 2nvh s GLU 51 N 0.56 0.57 0.37 5.31 2.12 -1.26 -4.38 118.70 121.99 2nvh s GLU 51 Ca 0.92 -0.90 -0.05 0.00 0.36 0.00 0.00 54.97 55.29 2nvh s GLU 51 Cb -1.25 0.21 0.02 0.00 0.26 0.00 0.00 34.13 33.37 2nvh s GLU 51 CO 0.59 -0.13 0.58 -1.54 -0.54 0.00 0.00 175.26 174.22 2nvh s SER 52 N -2.34 0.78 0.20 -1.70 1.04 -0.71 -5.00 113.70 105.96 2nvh s SER 52 Ca -0.02 -1.45 -0.13 0.00 0.48 0.00 0.00 55.95 54.83 2nvh s SER 52 Cb 0.01 0.74 0.22 0.00 0.10 0.00 0.00 66.02 67.09 2nvh s SER 52 CO -0.06 -1.45 1.67 0.78 0.98 0.00 0.00 173.24 175.16 2nvh h ASN 53 N 2.05 -0.27 -0.24 7.02 2.35 -2.02 -2.94 115.58 121.54 2nvh h ASN 53 Ca -0.30 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 2nvh h ASN 53 Cb 1.24 0.25 0.00 0.00 0.05 0.00 0.00 38.32 39.86 2nvh h ASN 53 CO 0.39 -0.10 0.00 0.47 -1.65 0.00 0.00 177.43 176.55 2nvh n ASP 54 N -5.27 2.73 -3.96 5.81 8.00 -1.26 -4.88 116.55 117.73 2nvh n ASP 54 Ca 0.07 -1.81 -0.31 0.00 0.71 0.00 0.00 54.79 53.45 2nvh n ASP 54 Cb 0.30 -0.15 -0.15 0.00 -0.02 0.00 0.00 41.12 41.10 2nvh n ASP 54 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2nvh s LYS 55 N -1.13 1.55 -0.20 -1.24 2.20 -1.11 -1.15 119.74 118.67 2nvh s LYS 55 Ca 0.24 -1.33 -0.00 0.00 -0.36 0.00 0.00 55.97 54.52 2nvh s LYS 55 Cb 0.14 -2.74 0.02 0.00 -1.51 0.00 0.00 37.83 33.74 2nvh s LYS 55 CO 0.20 -0.75 -0.15 0.42 -0.36 0.00 0.00 175.35 174.70 2nvh s ILE 56 N 1.23 2.41 0.14 5.43 -1.09 0.06 -1.74 121.20 127.63 2nvh s ILE 56 Ca 0.01 -0.86 -0.31 0.00 -2.23 0.00 0.00 60.65 57.25 2nvh s ILE 56 Cb -0.19 -2.06 -0.09 0.00 -1.58 0.00 0.00 42.46 38.54 2nvh s ILE 56 CO -0.09 0.48 1.47 -2.16 -1.23 0.00 0.00 174.94 173.41 2nvh s PRO 57 N 1.33 4.27 0.12 2.79 0.04 -1.26 -0.58 135.00 141.71 2nvh s PRO 57 Ca 0.04 2.20 -0.03 0.00 0.04 0.00 0.00 61.00 63.26 2nvh s PRO 57 Cb -0.14 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.17 2nvh s PRO 57 CO -0.10 -0.51 0.09 0.14 0.04 0.00 0.00 177.00 176.66 2nvh s VAL 58 N 1.13 0.12 0.09 -0.36 -7.23 0.12 -2.51 120.40 111.76 2nvh s VAL 58 Ca 0.67 -1.75 0.07 0.00 -1.81 0.00 0.00 61.98 59.17 2nvh s VAL 58 Cb -0.40 -1.87 -0.04 0.00 0.56 0.00 0.00 36.38 34.63 2nvh s VAL 58 CO 0.31 -0.54 -0.12 0.00 -0.31 0.00 0.00 175.10 174.44 2nvh s ALA 59 N -4.00 2.87 -0.33 1.32 0.00 0.15 -0.31 121.76 121.46 2nvh s ALA 59 Ca 0.19 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 50.93 2nvh s ALA 59 Cb 0.07 -0.85 0.09 0.00 0.00 0.00 0.00 23.12 22.43 2nvh s ALA 59 CO -0.01 0.62 0.04 -0.51 0.00 0.00 0.00 175.76 175.90 2nvh s LEU 60 N -2.07 4.55 0.24 0.00 1.43 -1.26 -1.70 118.68 119.87 2nvh s LEU 60 Ca 0.20 -1.96 0.06 0.00 -1.03 0.00 0.00 54.13 51.40 2nvh s LEU 60 Cb -0.11 -1.65 -0.03 0.00 0.03 0.00 0.00 46.19 44.43 2nvh s LEU 60 CO 0.12 -0.36 0.27 -0.83 0.23 0.00 0.00 176.35 175.78 2nvh s GLY 61 N 1.08 1.33 -0.07 -3.19 0.00 -0.48 -1.45 107.32 104.54 2nvh s GLY 61 Ca 0.06 -1.32 -0.27 0.00 0.00 0.00 0.00 44.72 43.19 2nvh s GLY 61 CO -0.07 -1.35 0.88 1.08 0.00 0.00 0.00 173.10 173.64 2nvh s LEU 62 N -3.88 4.30 0.04 0.66 1.02 -0.12 0.16 118.68 120.87 2nvh s LEU 62 Ca 0.33 1.42 -0.35 0.00 0.02 0.00 0.00 54.13 55.55 2nvh s LEU 62 Cb -0.08 -3.37 -0.14 0.00 0.02 0.00 0.00 46.19 42.61 2nvh s LEU 62 CO 0.27 -0.28 1.59 1.17 0.02 0.00 0.00 176.35 179.12 2nvh n LYS 63 N 4.29 1.76 -2.35 1.70 4.81 -0.28 -1.95 118.16 126.13 2nvh n LYS 63 Ca 0.04 0.64 -0.20 0.00 -0.87 0.00 0.00 58.31 57.92 2nvh n LYS 63 Cb 0.50 -2.37 -0.01 0.00 0.02 0.00 0.00 35.03 33.16 2nvh n LYS 63 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2nvh n GLU 64 N 3.98 -1.73 -4.02 1.64 -0.58 -1.26 -4.99 120.64 113.68 2nvh n GLU 64 Ca 0.19 0.98 -0.11 0.00 -0.42 0.00 0.00 57.16 57.80 2nvh n GLU 64 Cb 0.24 -5.61 -0.11 0.00 -0.57 0.00 0.00 31.44 25.39 2nvh n GLU 64 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2nvh s LYS 65 N -4.95 0.41 -1.20 3.49 1.02 -0.82 -5.04 119.74 112.63 2nvh s LYS 65 Ca 0.00 -0.69 -0.04 0.00 0.02 0.00 0.00 55.97 55.26 2nvh s LYS 65 Cb 0.00 -0.05 0.20 0.00 -0.52 0.00 0.00 37.83 37.46 2nvh s LYS 65 CO 0.00 -0.01 2.08 0.27 -0.92 0.00 0.00 175.35 176.77 2nvh n ASN 66 N 1.51 7.38 -3.83 2.83 6.94 -1.26 -4.44 115.26 124.40 2nvh n ASN 66 Ca -0.23 -3.34 -0.20 0.00 -0.02 0.00 0.00 54.58 50.79 2nvh n ASN 66 Cb 0.55 -1.30 -0.17 0.00 -2.36 0.00 0.00 39.78 36.50 2nvh n ASN 66 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2nvh s LEU 67 N -2.68 1.04 0.02 -4.53 1.43 -1.26 -1.57 118.68 111.13 2nvh s LEU 67 Ca 0.46 -0.07 0.05 0.00 -1.03 0.00 0.00 54.13 53.53 2nvh s LEU 67 Cb 0.17 -0.35 -0.02 0.00 0.03 0.00 0.00 46.19 46.02 2nvh s LEU 67 CO -0.08 -0.11 -0.14 -0.31 0.23 0.00 0.00 176.35 175.94 2nvh s TYR 68 N 1.26 1.23 0.35 0.29 1.51 -0.56 -0.94 117.35 120.48 2nvh s TYR 68 Ca -0.06 -0.30 -0.28 0.00 -1.01 0.00 0.00 57.07 55.42 2nvh s TYR 68 Cb -0.13 -0.75 -0.10 0.00 -0.11 0.00 0.00 41.96 40.87 2nvh s TYR 68 CO -0.02 0.01 1.24 -0.51 -1.11 0.00 0.00 175.55 175.16 2nvh s LEU 69 N -0.82 4.37 0.02 -1.29 1.43 -0.53 -1.07 118.68 120.78 2nvh s LEU 69 Ca 0.03 2.53 -0.16 0.00 -1.03 0.00 0.00 54.13 55.50 2nvh s LEU 69 Cb -0.07 -3.76 0.03 0.00 0.03 0.00 0.00 46.19 42.42 2nvh s LEU 69 CO 0.01 -0.53 0.35 -0.94 0.23 0.00 0.00 176.35 175.46 2nvh s SER 70 N -0.74 -0.21 -0.21 2.29 1.04 0.13 -4.51 113.70 111.49 2nvh s SER 70 Ca 0.51 0.01 -0.02 0.00 0.48 0.00 0.00 55.95 56.93 2nvh s SER 70 Cb -0.36 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.13 2nvh s SER 70 CO 0.47 -0.56 -0.10 0.00 0.98 0.00 0.00 173.24 174.02 2nvh s VAL 72 N 1.40 0.29 0.22 0.00 -7.23 -0.85 -4.58 120.40 109.64 2nvh s VAL 72 Ca 0.05 -1.85 -0.30 0.00 -1.81 0.00 0.00 61.98 58.07 2nvh s VAL 72 Cb -0.14 -1.66 -0.09 0.00 0.56 0.00 0.00 36.38 35.06 2nvh s VAL 72 CO -0.07 -0.87 0.95 -0.76 -0.31 0.00 0.00 175.10 174.04 2nvh s LEU 73 N -2.97 4.63 -0.04 1.32 1.43 -1.26 -0.56 118.68 121.23 2nvh s LEU 73 Ca 0.11 1.94 -0.01 0.00 -1.03 0.00 0.00 54.13 55.13 2nvh s LEU 73 Cb 0.07 -3.61 0.03 0.00 0.03 0.00 0.00 46.19 42.72 2nvh s LEU 73 CO -0.07 0.12 0.05 -0.75 0.23 0.00 0.00 176.35 175.94 2nvh s LYS 74 N -1.02 -0.04 -1.48 1.70 2.20 0.03 -4.75 119.74 116.39 2nvh s LYS 74 Ca 0.42 0.32 -0.06 0.00 -0.36 0.00 0.00 55.97 56.28 2nvh s LYS 74 Cb -0.26 -0.46 0.05 0.00 -1.51 0.00 0.00 37.83 35.65 2nvh s LYS 74 CO 0.32 -0.29 0.63 -3.47 -0.36 0.00 0.00 175.35 172.18 2nvh n ASP 75 N 5.00 -1.77 -0.66 1.43 2.03 -1.26 -1.05 116.55 120.27 2nvh n ASP 75 Ca -0.10 -0.94 -0.09 0.00 0.52 0.00 0.00 54.79 54.18 2nvh n ASP 75 Cb 0.50 -3.27 -0.04 0.00 -0.72 0.00 0.00 41.12 37.59 2nvh n ASP 75 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2nvh n ASP 76 N -2.90 -4.95 -4.10 1.67 8.00 -1.26 -4.99 116.55 108.02 2nvh n ASP 76 Ca -0.17 0.21 -0.24 0.00 0.71 0.00 0.00 54.79 55.30 2nvh n ASP 76 Cb 0.62 -3.20 -0.16 0.00 -0.02 0.00 0.00 41.12 38.36 2nvh n ASP 76 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2nvh s LYS 77 N -2.48 1.43 0.18 -1.24 2.20 -0.22 -5.06 119.74 114.55 2nvh s LYS 77 Ca 0.00 -0.52 -0.32 0.00 -0.36 0.00 0.00 55.97 54.77 2nvh s LYS 77 Cb 0.00 -1.29 -0.12 0.00 -1.51 0.00 0.00 37.83 34.91 2nvh s LYS 77 CO 0.00 0.24 1.75 -2.30 -0.36 0.00 0.00 175.35 174.68 2nvh n PRO 78 N 3.05 2.74 -3.93 4.03 -0.02 -1.26 -0.79 135.00 138.82 2nvh n PRO 78 Ca -0.17 0.99 -0.10 0.00 -2.02 0.00 0.00 63.50 62.20 2nvh n PRO 78 Cb 0.54 -2.85 -0.11 0.00 -0.02 0.00 0.00 33.50 31.06 2nvh n PRO 78 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2nvh s THR 79 N 1.66 0.08 -0.07 3.45 -1.32 0.28 -4.84 115.64 114.87 2nvh s THR 79 Ca 0.78 -0.64 -0.13 0.00 -1.21 0.00 0.00 61.69 60.49 2nvh s THR 79 Cb -0.51 -0.24 -0.05 0.00 -1.51 0.00 0.00 72.50 70.19 2nvh s THR 79 CO 0.34 -0.35 0.33 -0.22 -2.21 0.00 0.00 174.62 172.51 2nvh s LEU 80 N -1.06 4.39 0.21 9.08 2.96 -1.26 -2.01 118.68 130.99 2nvh s LEU 80 Ca -0.12 0.74 -0.07 0.00 -0.22 0.00 0.00 54.13 54.46 2nvh s LEU 80 Cb -0.07 -2.44 -0.02 0.00 0.50 0.00 0.00 46.19 44.16 2nvh s LEU 80 CO -0.00 0.27 0.30 0.00 -1.32 0.00 0.00 176.35 175.59 2nvh s GLN 81 N -0.58 1.32 -0.25 1.98 -2.07 0.13 -4.85 119.66 115.34 2nvh s GLN 81 Ca 0.20 -1.38 -0.06 0.00 -1.82 0.00 0.00 55.36 52.31 2nvh s GLN 81 Cb -0.15 0.37 -0.01 0.00 -1.09 0.00 0.00 33.01 32.13 2nvh s GLN 81 CO 0.09 -0.49 0.02 -0.51 -1.32 0.00 0.00 175.29 173.08 2nvh s LEU 82 N -3.06 3.27 -0.06 2.60 1.43 -1.23 0.20 118.68 121.83 2nvh s LEU 82 Ca 0.27 -0.39 0.05 0.00 -1.03 0.00 0.00 54.13 53.03 2nvh s LEU 82 Cb 0.03 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2nvh s LEU 82 CO 0.08 -0.06 -0.20 -0.70 0.23 0.00 0.00 176.35 175.70 2nvh s GLU 83 N 1.53 2.54 0.37 1.70 2.12 -0.23 -4.87 118.70 121.86 2nvh s GLU 83 Ca 0.05 -0.81 -0.24 0.00 0.36 0.00 0.00 54.97 54.33 2nvh s GLU 83 Cb -0.15 -2.27 -0.10 0.00 0.26 0.00 0.00 34.13 31.87 2nvh s GLU 83 CO 0.00 0.48 0.97 -1.54 -0.54 0.00 0.00 175.26 174.63 2nvh s SER 84 N -0.39 7.11 0.26 -1.70 1.04 -1.26 -1.50 113.70 117.26 2nvh s SER 84 Ca 0.04 1.84 0.02 0.00 0.48 0.00 0.00 55.95 58.33 2nvh s SER 84 Cb -0.12 -2.57 -0.04 0.00 0.10 0.00 0.00 66.02 63.39 2nvh s SER 84 CO 0.02 -0.24 0.16 0.68 0.98 0.00 0.00 173.24 174.84 2nvh s VAL 85 N -1.77 0.16 -0.35 5.02 -7.23 -0.61 -4.97 120.40 110.65 2nvh s VAL 85 Ca 0.55 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.43 2nvh s VAL 85 Cb -0.17 -2.52 -0.00 0.00 0.56 0.00 0.00 36.38 34.25 2nvh s VAL 85 CO 0.22 0.00 1.47 -0.62 -0.31 0.00 0.00 175.10 175.86 2nvh s ASP 86 N -3.27 6.35 0.56 4.85 -1.08 -1.26 -4.83 116.67 117.99 2nvh s ASP 86 Ca 0.38 1.08 0.38 0.00 -0.52 0.00 0.00 52.55 53.87 2nvh s ASP 86 Cb 0.06 -2.54 1.94 0.00 -1.46 0.00 0.00 42.92 40.92 2nvh s ASP 86 CO 0.16 -1.37 2.14 1.55 0.52 0.00 0.00 175.17 178.17 2nvh h PRO 87 N 10.69 0.00 0.00 4.34 0.13 -1.92 -0.82 132.00 144.43 2nvh h PRO 87 Ca -0.29 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.81 2nvh h PRO 87 Cb 1.12 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 2nvh h PRO 87 CO 1.06 0.00 -0.16 1.57 -0.23 0.00 0.00 178.00 180.24 2nvh h LYS 88 N 0.00 0.00 -0.11 0.86 2.10 -2.02 -3.33 116.57 114.06 2nvh h LYS 88 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2nvh h LYS 88 Cb 0.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.44 2nvh h LYS 88 CO 0.00 0.16 0.00 0.09 -2.00 0.00 0.00 179.45 177.70 2nvh n ASN 89 N -3.26 2.36 -4.24 7.07 3.02 -0.32 -5.00 115.26 114.89 2nvh n ASN 89 Ca 0.01 -1.66 -0.19 0.00 -0.03 0.00 0.00 54.58 52.71 2nvh n ASN 89 Cb 0.44 -0.07 -0.11 0.00 -0.61 0.00 0.00 39.78 39.43 2nvh n ASN 89 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2nvh s TYR 90 N -1.08 1.42 0.96 3.10 1.51 -1.21 -4.36 117.35 117.69 2nvh s TYR 90 Ca 0.19 -0.53 -0.15 0.00 -1.01 0.00 0.00 57.07 55.56 2nvh s TYR 90 Cb 0.12 -0.75 0.18 0.00 -0.11 0.00 0.00 41.96 41.40 2nvh s TYR 90 CO 0.17 0.14 1.25 -1.25 -1.11 0.00 0.00 175.55 174.75 2nvh s PRO 91 N -2.49 0.66 0.09 -1.71 0.04 -1.26 -4.91 135.00 125.42 2nvh s PRO 91 Ca 0.07 -0.19 -0.12 0.00 0.04 0.00 0.00 61.00 60.81 2nvh s PRO 91 Cb -0.06 -1.83 0.02 0.00 0.04 0.00 0.00 34.50 32.67 2nvh s PRO 91 CO 0.03 -2.44 0.28 -1.59 0.04 0.00 0.00 177.00 173.33 2nvh s LYS 92 N -5.69 0.90 0.22 4.56 -2.85 -1.26 -4.86 119.74 110.75 2nvh s LYS 92 Ca 0.70 -0.75 -0.08 0.00 -1.00 0.00 0.00 55.97 54.84 2nvh s LYS 92 Cb -0.07 0.38 0.18 0.00 -2.06 0.00 0.00 37.83 36.25 2nvh s LYS 92 CO 0.53 -0.31 1.83 0.87 0.10 0.00 0.00 175.35 178.37 2nvh h LYS 93 N 2.78 1.16 -3.24 1.78 1.57 -1.95 -3.25 116.57 115.42 2nvh h LYS 93 Ca -0.33 -0.14 -0.79 0.00 -1.87 0.00 0.00 60.65 57.52 2nvh h LYS 93 Cb 1.22 -0.22 -0.23 0.00 0.08 0.00 0.00 32.23 33.08 2nvh h LYS 93 CO 0.50 0.86 1.30 1.63 -0.57 0.00 0.00 179.45 183.17 2nvh n LYS 94 N -4.38 4.07 -2.55 3.15 5.02 -1.26 -0.12 118.16 122.09 2nvh n LYS 94 Ca 0.08 -4.11 -0.35 0.00 -2.02 0.00 0.00 58.31 51.91 2nvh n LYS 94 Cb 0.10 -2.70 -0.04 0.00 -0.02 0.00 0.00 35.03 32.38 2nvh n LYS 94 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2nvh s MET 95 N -1.31 3.96 0.59 1.97 -1.94 -1.23 -5.00 119.30 116.33 2nvh s MET 95 Ca 0.35 1.42 -0.20 0.00 -1.71 0.00 0.00 55.69 55.55 2nvh s MET 95 Cb 0.06 -2.28 -0.03 0.00 2.01 0.00 0.00 34.83 34.58 2nvh s MET 95 CO 0.06 -0.30 1.34 0.39 -0.01 0.00 0.00 175.02 176.50 2nvh n GLU 96 N -0.59 1.49 -0.28 2.03 4.71 -1.26 -4.87 120.64 121.88 2nvh n GLU 96 Ca 0.07 0.56 0.09 0.00 -0.01 0.00 0.00 57.16 57.87 2nvh n GLU 96 Cb 0.51 -2.57 0.24 0.00 -1.01 0.00 0.00 31.44 28.61 2nvh n GLU 96 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 2nvh h LYS 97 N 1.10 0.37 -0.53 3.49 1.63 -1.96 -0.55 116.57 120.12 2nvh h LYS 97 Ca -0.51 -0.02 0.15 0.00 -0.85 0.00 0.00 60.65 59.42 2nvh h LYS 97 Cb 1.32 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 32.84 2nvh h LYS 97 CO 0.56 0.25 0.48 0.07 -3.45 0.00 0.00 179.45 177.35 2nvh h ARG 98 N 0.38 0.00 0.00 1.90 0.11 -1.91 -0.12 114.38 114.75 2nvh h ARG 98 Ca 0.48 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.56 2nvh h ARG 98 Cb 0.83 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.91 2nvh h ARG 98 CO -0.49 0.00 -0.58 1.19 0.10 0.00 0.00 179.97 180.19 2nvh n PHE 99 N -3.93 0.12 -3.31 4.08 3.72 -0.22 0.31 117.46 118.24 2nvh n PHE 99 Ca 0.10 0.03 -0.38 0.00 -0.05 0.00 0.00 57.45 57.15 2nvh n PHE 99 Cb 0.69 -0.33 -0.06 0.00 -0.94 0.00 0.00 39.48 38.84 2nvh n PHE 99 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2nvh s VAL 100 N -3.05 5.09 -0.05 -4.37 1.01 -0.06 -4.36 120.40 114.62 2nvh s VAL 100 Ca 0.09 1.02 0.07 0.00 0.00 0.00 0.00 61.98 63.16 2nvh s VAL 100 Cb 0.16 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 2nvh s VAL 100 CO 0.72 0.39 -0.25 -0.36 0.00 0.00 0.00 175.10 175.59 2nvh s PHE 101 N 0.16 2.42 -0.53 5.22 0.40 0.57 -1.24 117.98 124.98 2nvh s PHE 101 Ca 0.27 -0.62 -0.24 0.00 -0.60 0.00 0.00 56.93 55.74 2nvh s PHE 101 Cb -0.16 -1.57 0.04 0.00 0.51 0.00 0.00 43.02 41.83 2nvh s PHE 101 CO 0.13 -0.15 0.90 -0.80 0.70 0.00 0.00 175.22 176.00 2nvh s ASN 102 N -0.31 6.35 -0.44 1.36 0.01 0.24 0.15 114.94 122.31 2nvh s ASN 102 Ca 0.01 -0.32 -0.29 0.00 -0.71 0.00 0.00 52.86 51.55 2nvh s ASN 102 Cb -0.13 -2.42 0.02 0.00 0.41 0.00 0.00 41.25 39.13 2nvh s ASN 102 CO 0.02 -1.16 1.27 -0.75 -1.51 0.00 0.00 177.10 174.98 2nvh s LYS 103 N 3.78 3.66 -0.17 -0.60 2.20 0.25 -1.66 119.74 127.21 2nvh s LYS 103 Ca 0.30 0.77 -0.03 0.00 -0.36 0.00 0.00 55.97 56.65 2nvh s LYS 103 Cb -0.13 -3.96 -0.02 0.00 -1.51 0.00 0.00 37.83 32.22 2nvh s LYS 103 CO 0.20 -1.46 -0.07 0.42 -0.36 0.00 0.00 175.35 174.08 2nvh s ILE 104 N 4.91 3.41 -0.29 5.43 1.01 0.85 -0.76 121.20 135.76 2nvh s ILE 104 Ca 0.54 -0.51 -0.15 0.00 0.00 0.00 0.00 60.65 60.54 2nvh s ILE 104 Cb -0.10 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 2nvh s ILE 104 CO 0.32 0.48 0.36 -1.61 0.00 0.00 0.00 174.94 174.48 2nvh s GLU 105 N 0.77 3.89 -0.03 2.79 2.02 -0.30 -1.34 118.70 126.51 2nvh s GLU 105 Ca -0.03 -0.10 -0.00 0.00 0.02 0.00 0.00 54.97 54.85 2nvh s GLU 105 Cb -0.15 -3.70 0.03 0.00 0.10 0.00 0.00 34.13 30.41 2nvh s GLU 105 CO 0.02 -0.34 0.03 0.42 0.02 0.00 0.00 175.26 175.40 2nvh s ILE 106 N 2.05 -0.01 -1.48 -1.63 -1.09 0.14 -4.90 121.20 114.27 2nvh s ILE 106 Ca 0.14 0.23 -0.00 0.00 -2.23 0.00 0.00 60.65 58.78 2nvh s ILE 106 Cb -0.16 -0.14 0.00 0.00 -1.58 0.00 0.00 42.46 40.59 2nvh s ILE 106 CO 0.11 0.12 0.23 0.59 -1.23 0.00 0.00 174.94 174.75 2nvh n ASN 107 N 4.39 0.25 0.00 3.58 4.13 -1.26 0.72 115.26 127.07 2nvh n ASN 107 Ca -0.23 -1.14 0.00 0.00 1.68 0.00 0.00 54.58 54.89 2nvh n ASN 107 Cb 0.50 -2.35 0.00 0.00 -1.54 0.00 0.00 39.78 36.39 2nvh n ASN 107 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2nvh n ASN 108 N -2.93 -4.81 -4.44 6.41 3.02 -1.26 -4.97 115.26 106.27 2nvh n ASN 108 Ca -0.31 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.02 2nvh n ASN 108 Cb 0.69 -2.33 -0.10 0.00 -0.61 0.00 0.00 39.78 37.43 2nvh n ASN 108 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2nvh s LYS 109 N -1.22 1.58 -0.01 3.52 -0.14 0.22 -4.95 119.74 118.74 2nvh s LYS 109 Ca 0.00 -1.78 0.07 0.00 -1.36 0.00 0.00 55.97 52.90 2nvh s LYS 109 Cb 0.00 -1.32 -0.02 0.00 -1.68 0.00 0.00 37.83 34.80 2nvh s LYS 109 CO 0.00 0.11 -0.24 -0.51 -0.76 0.00 0.00 175.35 173.95 2nvh s LEU 110 N -3.46 2.21 0.04 3.17 1.43 0.14 -0.69 118.68 121.52 2nvh s LEU 110 Ca 0.29 -0.44 0.09 0.00 -1.03 0.00 0.00 54.13 53.04 2nvh s LEU 110 Cb 0.02 -1.38 -0.03 0.00 0.03 0.00 0.00 46.19 44.83 2nvh s LEU 110 CO 0.12 0.31 -0.25 -1.61 0.23 0.00 0.00 176.35 175.16 2nvh s GLU 111 N -0.78 1.70 -0.48 1.70 2.02 -0.45 0.59 118.70 123.00 2nvh s GLU 111 Ca 0.11 -1.06 0.02 0.00 0.02 0.00 0.00 54.97 54.05 2nvh s GLU 111 Cb -0.10 -1.86 0.13 0.00 0.10 0.00 0.00 34.13 32.40 2nvh s GLU 111 CO 0.00 0.48 0.24 -0.06 0.02 0.00 0.00 175.26 175.94 2nvh s PHE 112 N -0.80 3.43 -0.02 1.61 0.08 -1.26 -0.11 117.98 120.92 2nvh s PHE 112 Ca 0.11 -2.94 -0.16 0.00 0.12 0.00 0.00 56.93 54.06 2nvh s PHE 112 Cb -0.10 -2.98 -0.05 0.00 -0.57 0.00 0.00 43.02 39.31 2nvh s PHE 112 CO 0.02 -0.85 0.44 -2.00 -0.10 0.00 0.00 175.22 172.74 2nvh s GLU 113 N 0.25 4.07 0.11 0.44 2.12 -0.66 -0.58 118.70 124.45 2nvh s GLU 113 Ca 0.14 0.46 -0.31 0.00 0.36 0.00 0.00 54.97 55.62 2nvh s GLU 113 Cb -0.23 -3.28 -0.10 0.00 0.26 0.00 0.00 34.13 30.79 2nvh s GLU 113 CO -0.03 0.55 1.72 0.45 -0.54 0.00 0.00 175.26 177.41 2nvh s SER 114 N -0.65 6.51 0.25 -1.70 0.15 0.17 0.82 113.70 119.24 2nvh s SER 114 Ca 0.25 2.65 -0.04 0.00 0.70 0.00 0.00 55.95 59.50 2nvh s SER 114 Cb -0.17 -2.57 0.28 0.00 -1.71 0.00 0.00 66.02 61.85 2nvh s SER 114 CO 0.13 -0.94 1.79 0.00 1.20 0.00 0.00 173.24 175.42 2nvh h ALA 115 N 8.14 1.11 -0.21 5.45 0.00 -1.45 -3.04 119.26 129.26 2nvh h ALA 115 Ca -0.44 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.11 2nvh h ALA 115 Cb 1.21 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 2nvh h ALA 115 CO 0.94 0.60 -0.45 0.37 0.00 0.00 0.00 179.25 180.71 2nvh h GLN 116 N 0.94 0.51 -3.44 0.00 5.75 -1.75 -3.40 115.11 113.74 2nvh h GLN 116 Ca 0.21 -0.28 -0.60 0.00 -0.15 0.00 0.00 58.65 57.83 2nvh h GLN 116 Cb 0.31 0.01 -0.40 0.00 1.07 0.00 0.00 27.48 28.47 2nvh h GLN 116 CO -0.00 0.86 -0.75 -0.06 -2.65 0.00 0.00 178.83 176.23 2nvh s PHE 117 N -4.15 2.01 0.21 3.99 0.08 -1.15 -5.09 117.98 113.87 2nvh s PHE 117 Ca -0.07 -2.13 -0.32 0.00 0.12 0.00 0.00 56.93 54.53 2nvh s PHE 117 Cb 0.12 -1.90 -0.14 0.00 -0.57 0.00 0.00 43.02 40.54 2nvh s PHE 117 CO 0.82 -0.85 1.41 -2.30 -0.10 0.00 0.00 175.22 174.21 2nvh n PRO 118 N 4.28 1.91 -1.08 0.24 -0.02 -1.25 -2.01 135.00 137.07 2nvh n PRO 118 Ca 0.03 0.68 -0.03 0.00 -2.02 0.00 0.00 63.50 62.16 2nvh n PRO 118 Cb 0.39 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.51 2nvh n PRO 118 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2nvh n ASN 119 N 2.43 -3.97 -4.72 2.55 4.13 -1.26 -5.01 115.26 109.41 2nvh n ASN 119 Ca 0.13 0.07 -0.35 0.00 1.68 0.00 0.00 54.58 56.11 2nvh n ASN 119 Cb 0.29 -1.72 -0.09 0.00 -1.54 0.00 0.00 39.78 36.73 2nvh n ASN 119 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2nvh s TRP 120 N -1.90 3.32 0.06 3.10 0.52 -0.85 -3.27 118.94 119.92 2nvh s TRP 120 Ca 0.00 0.24 0.02 0.00 0.02 0.00 0.00 56.10 56.38 2nvh s TRP 120 Cb 0.00 -1.95 -0.03 0.00 -1.15 0.00 0.00 33.47 30.34 2nvh s TRP 120 CO 0.00 0.42 -0.08 0.71 0.02 0.00 0.00 176.95 178.02 2nvh s TYR 121 N -0.41 0.77 0.19 -1.98 1.51 0.29 -0.66 117.35 117.06 2nvh s TYR 121 Ca 0.10 -0.65 -0.32 0.00 -1.01 0.00 0.00 57.07 55.19 2nvh s TYR 121 Cb -0.12 -0.45 -0.11 0.00 -0.11 0.00 0.00 41.96 41.16 2nvh s TYR 121 CO 0.02 -0.10 1.71 0.42 -1.11 0.00 0.00 175.55 176.48 2nvh s ILE 122 N -2.18 2.20 0.07 2.71 1.01 0.25 -0.02 121.20 125.24 2nvh s ILE 122 Ca -0.02 0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.75 2nvh s ILE 122 Cb -0.05 -3.07 -0.04 0.00 0.01 0.00 0.00 42.46 39.32 2nvh s ILE 122 CO -0.01 0.01 -0.06 -0.44 0.00 0.00 0.00 174.94 174.44 2nvh s SER 123 N 1.36 0.88 0.14 3.58 0.01 0.22 -4.57 113.70 115.33 2nvh s SER 123 Ca 0.75 -0.91 0.05 0.00 1.31 0.00 0.00 55.95 57.15 2nvh s SER 123 Cb -0.48 0.11 -0.04 0.00 0.21 0.00 0.00 66.02 65.82 2nvh s SER 123 CO 0.32 -0.45 -0.12 0.42 0.41 0.00 0.00 173.24 173.83 2nvh s THR 124 N -3.23 1.26 0.49 1.44 -4.23 -0.41 -0.35 115.64 110.61 2nvh s THR 124 Ca 0.06 -1.96 -0.07 0.00 -1.18 0.00 0.00 61.69 58.54 2nvh s THR 124 Cb 0.03 -1.75 -0.04 0.00 1.34 0.00 0.00 72.50 72.08 2nvh s THR 124 CO -0.05 -0.63 0.83 -0.44 -0.54 0.00 0.00 174.62 173.79 2nvh s SER 125 N -2.94 6.31 0.16 3.99 0.01 -1.26 -0.82 113.70 119.15 2nvh s SER 125 Ca 0.14 1.07 -0.06 0.00 1.31 0.00 0.00 55.95 58.42 2nvh s SER 125 Cb -0.00 -2.31 0.02 0.00 0.21 0.00 0.00 66.02 63.95 2nvh s SER 125 CO 0.02 -0.60 1.44 1.56 0.41 0.00 0.00 173.24 176.07 2nvh h GLN 126 N 0.31 0.61 -7.15 12.44 1.08 -1.97 -3.45 115.11 116.98 2nvh h GLN 126 Ca -0.46 -0.43 -0.54 0.00 -1.45 0.00 0.00 58.65 55.76 2nvh h GLN 126 Cb 1.20 0.07 0.18 0.00 -0.05 0.00 0.00 27.48 28.87 2nvh h GLN 126 CO 0.62 1.05 0.36 0.00 -0.95 0.00 0.00 178.83 179.91 2nvh n ALA 127 N -2.54 0.25 -1.88 3.87 0.00 -1.26 -4.97 120.51 113.98 2nvh n ALA 127 Ca -0.04 -0.23 -0.35 0.00 0.00 0.00 0.00 53.44 52.81 2nvh n ALA 127 Cb 0.66 -2.26 -0.06 0.00 0.00 0.00 0.00 19.45 17.79 2nvh n ALA 127 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2nvh s GLU 128 N -3.85 4.39 -1.36 0.00 2.56 -1.26 -4.23 118.70 114.95 2nvh s GLU 128 Ca 0.76 1.14 -0.03 0.00 0.00 0.00 0.00 54.97 56.84 2nvh s GLU 128 Cb -0.32 -2.64 0.02 0.00 2.00 0.00 0.00 34.13 33.19 2nvh s GLU 128 CO 0.48 0.22 0.73 -1.71 -0.56 0.00 0.00 175.26 174.41 2nvh n ASN 129 N 0.23 -1.74 -4.62 -1.70 4.05 0.12 -5.00 115.26 106.60 2nvh n ASN 129 Ca 0.02 -0.83 -0.23 0.00 0.45 0.00 0.00 54.58 53.99 2nvh n ASN 129 Cb 0.51 -3.94 -0.08 0.00 1.23 0.00 0.00 39.78 37.51 2nvh n ASN 129 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 177.26 174.17 2nvh s MET 130 N -6.15 2.20 0.69 1.20 -1.94 -1.24 -4.83 119.30 109.24 2nvh s MET 130 Ca 0.12 -1.44 -0.15 0.00 -1.71 0.00 0.00 55.69 52.51 2nvh s MET 130 Cb -0.06 -2.12 0.02 0.00 2.01 0.00 0.00 34.83 34.68 2nvh s MET 130 CO 0.82 0.37 1.16 -2.14 -0.01 0.00 0.00 175.02 175.22 2nvh s PRO 131 N -3.56 2.47 0.06 2.03 0.02 -1.26 -0.98 135.00 133.77 2nvh s PRO 131 Ca 0.31 1.57 -0.25 0.00 0.02 0.00 0.00 61.00 62.64 2nvh s PRO 131 Cb -0.06 -1.89 -0.06 0.00 0.02 0.00 0.00 34.50 32.51 2nvh s PRO 131 CO 0.19 -1.54 0.78 0.08 -0.33 0.00 0.00 177.00 176.17 2nvh s VAL 132 N -2.17 4.70 0.32 3.83 1.01 -0.06 -4.43 120.40 123.60 2nvh s VAL 132 Ca 0.70 1.66 0.02 0.00 0.00 0.00 0.00 61.98 64.37 2nvh s VAL 132 Cb -0.25 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 31.99 2nvh s VAL 132 CO 0.43 0.37 0.35 0.72 0.00 0.00 0.00 175.10 176.97 2nvh s PHE 133 N -0.11 1.39 -0.33 5.22 -0.71 0.52 -4.77 117.98 119.18 2nvh s PHE 133 Ca 0.39 -1.47 -0.19 0.00 -1.04 0.00 0.00 56.93 54.62 2nvh s PHE 133 Cb -0.21 -0.42 -0.01 0.00 -1.21 0.00 0.00 43.02 41.17 2nvh s PHE 133 CO 0.24 -0.96 0.57 -1.17 -1.34 0.00 0.00 175.22 172.56 2nvh s LEU 134 N -3.29 4.24 -0.03 -1.99 2.96 -1.26 0.72 118.68 120.02 2nvh s LEU 134 Ca 0.36 0.19 0.01 0.00 -0.22 0.00 0.00 54.13 54.47 2nvh s LEU 134 Cb 0.02 -2.70 -0.03 0.00 0.50 0.00 0.00 46.19 43.97 2nvh s LEU 134 CO 0.23 -0.49 -0.03 -0.83 -1.32 0.00 0.00 176.35 173.91 2nvh s GLY 135 N 1.72 1.80 0.00 7.98 0.00 0.97 -4.83 107.32 114.97 2nvh s GLY 135 Ca 0.22 -0.92 0.00 0.00 0.00 0.00 0.00 44.72 44.02 2nvh s GLY 135 CO 0.13 -0.75 0.80 0.61 0.00 0.00 0.00 173.10 173.90 2nvh n GLY 136 N 1.78 -0.37 3.49 0.20 0.00 -1.26 0.11 105.19 109.14 2nvh n GLY 136 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 2nvh n GLY 136 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2nvh s THR 137 N -1.76 0.00 -2.62 2.61 -1.32 -1.20 -4.70 115.64 106.65 2nvh s THR 137 Ca 0.00 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.72 2nvh s THR 137 Cb 0.00 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.38 2nvh s THR 137 CO 0.00 0.00 1.48 2.29 -2.21 0.00 0.00 174.62 176.18 2nvh n LYS 138 N -0.00 2.07 0.00 7.08 2.85 -1.26 -4.71 118.16 124.18 2nvh n LYS 138 Ca -0.12 -1.58 0.00 0.00 -1.05 0.00 0.00 58.31 55.56 2nvh n LYS 138 Cb 0.61 -1.46 0.00 0.00 -0.65 0.00 0.00 35.03 33.53 2nvh n LYS 138 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2nvh n GLY 139 N 1.29 1.55 6.92 2.58 0.00 -1.26 -4.89 105.19 111.39 2nvh n GLY 139 Ca 0.17 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2nvh n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nvh n GLY 140 N 5.00 -1.82 0.15 -0.02 0.00 -1.26 -4.51 105.19 102.74 2nvh n GLY 140 Ca 0.00 -1.32 0.08 0.00 0.00 0.00 0.00 46.02 44.78 2nvh n GLY 140 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2nvh h GLN 141 N 0.00 0.00 -7.57 1.61 4.15 -1.99 -3.46 115.11 107.85 2nvh h GLN 141 Ca 0.00 0.00 -0.48 0.00 0.77 0.00 0.00 58.65 58.94 2nvh h GLN 141 Cb 0.00 0.00 0.10 0.00 0.21 0.00 0.00 27.48 27.79 2nvh h GLN 141 CO 0.00 0.14 0.40 -0.51 -1.93 0.00 0.00 178.83 176.94 2nvh s ASP 142 N -5.94 4.67 -0.20 -0.69 1.01 -1.26 -4.70 116.67 109.56 2nvh s ASP 142 Ca 0.03 0.89 -0.09 0.00 0.71 0.00 0.00 52.55 54.09 2nvh s ASP 142 Cb 0.07 -1.47 -0.05 0.00 1.01 0.00 0.00 42.92 42.49 2nvh s ASP 142 CO 0.74 -1.81 0.10 -0.63 0.21 0.00 0.00 175.17 173.78 2nvh s ILE 143 N -3.49 5.11 0.00 0.77 1.01 0.00 -4.93 121.20 119.67 2nvh s ILE 143 Ca 0.61 0.08 0.00 0.00 0.00 0.00 0.00 60.65 61.34 2nvh s ILE 143 Cb -0.11 -3.33 0.00 0.00 0.01 0.00 0.00 42.46 39.03 2nvh s ILE 143 CO 0.50 0.44 0.72 0.35 0.00 0.00 0.00 174.94 176.95 2nvh n THR 144 N 3.64 0.51 -4.33 2.92 -2.24 -1.26 -1.29 114.28 112.23 2nvh n THR 144 Ca -0.16 -0.57 -0.33 0.00 -2.27 0.00 0.00 64.05 60.71 2nvh n THR 144 Cb 0.52 0.82 -0.09 0.00 -2.10 0.00 0.00 70.33 69.48 2nvh n THR 144 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2nvh s ASP 145 N -0.51 5.15 0.18 3.42 1.01 -1.26 -4.38 116.67 120.28 2nvh s ASP 145 Ca 0.00 0.05 -0.00 0.00 0.71 0.00 0.00 52.55 53.31 2nvh s ASP 145 Cb 0.00 -1.38 -0.04 0.00 1.01 0.00 0.00 42.92 42.50 2nvh s ASP 145 CO 0.00 0.32 0.08 -0.36 0.21 0.00 0.00 175.17 175.42 2nvh s PHE 146 N -1.01 1.11 0.14 4.23 0.40 0.20 -1.07 117.98 121.98 2nvh s PHE 146 Ca 0.17 -1.25 0.08 0.00 -0.60 0.00 0.00 56.93 55.33 2nvh s PHE 146 Cb -0.11 -0.60 -0.04 0.00 0.51 0.00 0.00 43.02 42.78 2nvh s PHE 146 CO 0.07 -0.50 -0.18 0.95 0.70 0.00 0.00 175.22 176.27 2nvh s THR 147 N -3.99 1.69 -0.04 0.64 -4.23 0.56 -0.69 115.64 109.58 2nvh s THR 147 Ca 0.31 -1.79 0.04 0.00 -1.18 0.00 0.00 61.69 59.07 2nvh s THR 147 Cb 0.07 -1.71 -0.03 0.00 1.34 0.00 0.00 72.50 72.18 2nvh s THR 147 CO 0.07 -0.27 -0.14 -0.32 -0.54 0.00 0.00 174.62 173.42 2nvh s MET 148 N -2.55 2.49 -0.05 3.99 1.75 -1.26 -0.88 119.30 122.79 2nvh s MET 148 Ca 0.12 -0.71 0.06 0.00 -1.25 0.00 0.00 55.69 53.91 2nvh s MET 148 Cb -0.07 -2.39 -0.01 0.00 2.84 0.00 0.00 34.83 35.21 2nvh s MET 148 CO 0.05 0.62 -0.23 -0.65 -0.65 0.00 0.00 175.02 174.16 2nvh s GLN 149 N -0.83 2.35 0.02 4.11 1.11 -0.06 -4.99 119.66 121.38 2nvh s GLN 149 Ca 0.12 -0.83 -0.28 0.00 0.01 0.00 0.00 55.36 54.39 2nvh s GLN 149 Cb -0.11 -2.00 -0.04 0.00 -1.01 0.00 0.00 33.01 29.85 2nvh s GLN 149 CO 0.01 0.34 0.88 -0.06 0.01 0.00 0.00 175.29 176.48 2nvh s PHE 150 N -0.10 3.69 -0.06 0.91 0.40 -1.26 -1.09 117.98 120.46 2nvh s PHE 150 Ca -0.04 1.59 0.05 0.00 -0.60 0.00 0.00 56.93 57.93 2nvh s PHE 150 Cb -0.13 -2.99 -0.02 0.00 0.51 0.00 0.00 43.02 40.39 2nvh s PHE 150 CO 0.03 0.11 -0.21 0.08 0.70 0.00 0.00 175.22 175.94 2nvh s VAL 151 N 0.54 2.47 -0.08 -0.44 1.01 -0.92 -4.93 120.40 118.05 2nvh s VAL 151 Ca 0.46 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2nvh s VAL 151 Cb -0.21 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.24 2nvh s VAL 151 CO 0.26 0.57 0.02 -1.54 0.00 0.00 0.00 175.10 174.41