#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hve n ASN 3 N 0.00 0.00 -1.31 0.00 4.05 -1.26 -4.50 115.26 112.24 2hve n ASN 3 Ca 0.00 0.00 0.09 0.00 0.45 0.00 0.00 54.58 55.12 2hve n ASN 3 Cb 0.00 0.00 0.31 0.00 1.23 0.00 0.00 39.78 41.32 2hve n ASN 3 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2hve n GLU 5 N 0.94 1.87 -4.28 0.00 2.13 -1.26 -4.73 120.64 115.31 2hve n GLU 5 Ca 0.23 0.66 -0.21 0.00 0.66 0.00 0.00 57.16 58.50 2hve n GLU 5 Cb 0.77 -2.32 -0.12 0.00 0.27 0.00 0.00 31.44 30.04 2hve n GLU 5 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2hve s ARG 6 N -2.13 1.12 0.21 5.31 0.52 -1.26 -0.67 118.95 122.04 2hve s ARG 6 Ca 0.60 -1.24 0.03 0.00 -0.52 0.00 0.00 55.73 54.60 2hve s ARG 6 Cb -0.53 -1.18 -0.05 0.00 0.52 0.00 0.00 34.95 33.71 2hve s ARG 6 CO 0.58 0.25 0.00 -0.08 0.02 0.00 0.00 175.30 176.08 2hve s THR 7 N -1.73 0.91 -0.20 0.02 -1.32 -0.28 -4.67 115.64 108.37 2hve s THR 7 Ca 0.09 -2.02 -0.04 0.00 -1.21 0.00 0.00 61.69 58.51 2hve s THR 7 Cb -0.07 -2.29 -0.02 0.00 -1.51 0.00 0.00 72.50 68.61 2hve s THR 7 CO 0.04 -0.36 -0.02 0.12 -2.21 0.00 0.00 174.62 172.20 2hve s PHE 8 N -3.50 3.00 -0.09 9.09 5.36 -1.26 -2.37 117.98 128.20 2hve s PHE 8 Ca 0.27 -0.57 0.03 0.00 -0.96 0.00 0.00 56.93 55.71 2hve s PHE 8 Cb 0.06 -2.06 0.00 0.00 -0.34 0.00 0.00 43.02 40.68 2hve s PHE 8 CO 0.07 -0.29 -0.20 0.42 -1.46 0.00 0.00 175.22 173.76 2hve s ILE 9 N 1.01 1.78 -0.08 3.12 -1.09 -0.03 -1.64 121.20 124.26 2hve s ILE 9 Ca 0.01 -0.85 0.04 0.00 -2.23 0.00 0.00 60.65 57.61 2hve s ILE 9 Cb -0.14 -1.56 0.00 0.00 -1.58 0.00 0.00 42.46 39.18 2hve s ILE 9 CO 0.01 0.50 -0.20 0.00 -1.23 0.00 0.00 174.94 174.02 2hve s ALA 10 N 0.46 1.86 -0.13 9.38 0.00 0.00 0.26 121.76 133.60 2hve s ALA 10 Ca -0.17 -0.79 -0.26 0.00 0.00 0.00 0.00 51.96 50.74 2hve s ALA 10 Cb -0.17 -0.71 -0.02 0.00 0.00 0.00 0.00 23.12 22.22 2hve s ALA 10 CO 0.07 0.25 0.83 0.42 0.00 0.00 0.00 175.76 177.32 2hve s ILE 11 N 0.38 4.91 0.77 0.00 1.01 0.12 -0.57 121.20 127.82 2hve s ILE 11 Ca -0.16 1.65 -0.12 0.00 0.00 0.00 0.00 60.65 62.03 2hve s ILE 11 Cb -0.17 -4.14 0.05 0.00 0.01 0.00 0.00 42.46 38.21 2hve s ILE 11 CO 0.07 0.08 1.13 -0.54 0.00 0.00 0.00 174.94 175.68 2hve s LYS 12 N 1.77 2.31 0.44 2.79 1.02 -0.27 -1.55 119.74 126.25 2hve s LYS 12 Ca 0.40 0.36 0.10 0.00 0.02 0.00 0.00 55.97 56.85 2hve s LYS 12 Cb -0.17 -1.97 0.99 0.00 -0.52 0.00 0.00 37.83 36.16 2hve s LYS 12 CO 0.15 -1.40 2.07 -1.35 -0.92 0.00 0.00 175.35 173.91 2hve h PRO 13 N -0.92 0.38 -0.63 -1.68 0.11 -1.85 -0.95 132.00 126.46 2hve h PRO 13 Ca -0.46 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.54 2hve h PRO 13 Cb 1.29 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 2hve h PRO 13 CO 0.64 0.25 0.04 0.38 -0.21 0.00 0.00 178.00 179.10 2hve h ASP 14 N 0.39 1.06 -0.80 -2.05 2.03 -1.88 0.21 116.42 115.38 2hve h ASP 14 Ca 0.13 -0.29 0.06 0.00 -0.73 0.00 0.00 57.03 56.20 2hve h ASP 14 Cb 0.02 -0.28 -0.06 0.00 -0.83 0.00 0.00 39.33 38.18 2hve h ASP 14 CO -0.03 1.09 0.48 1.23 -1.03 0.00 0.00 179.24 180.98 2hve h GLY 15 N 1.00 1.19 0.58 7.15 0.00 -1.35 -0.64 103.07 111.00 2hve h GLY 15 Ca 0.19 -0.35 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 2hve h GLY 15 CO 0.02 0.24 -0.10 -2.08 0.00 0.00 0.00 176.54 174.62 2hve h VAL 16 N 0.89 1.41 -0.57 4.60 2.07 -1.07 -2.02 116.25 121.56 2hve h VAL 16 Ca 0.35 -1.39 0.01 0.00 0.82 0.00 0.00 66.70 66.49 2hve h VAL 16 Cb 0.16 2.20 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 2hve h VAL 16 CO -0.17 0.38 0.38 1.56 0.02 0.00 0.00 177.57 179.74 2hve h GLN 17 N -0.32 0.71 -0.55 1.57 1.08 -0.46 -2.01 115.11 115.14 2hve h GLN 17 Ca 0.00 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2hve h GLN 17 Cb 0.67 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 2hve h GLN 17 CO 0.02 0.47 0.00 0.54 -0.95 0.00 0.00 178.83 178.91 2hve n ARG 18 N -4.46 2.39 -2.58 1.46 1.74 -0.26 -4.94 116.66 110.01 2hve n ARG 18 Ca 0.06 -1.52 -0.12 0.00 -0.77 0.00 0.00 57.85 55.50 2hve n ARG 18 Cb 0.08 -1.55 0.01 0.00 -1.02 0.00 0.00 32.46 29.98 2hve n ARG 18 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hve n GLY 19 N 0.80 0.00 0.98 -0.13 0.00 -0.75 -4.93 105.19 101.15 2hve n GLY 19 Ca 0.14 -0.31 0.09 0.00 0.00 0.00 0.00 46.02 45.94 2hve n GLY 19 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hve n LEU 20 N -2.18 3.27 0.01 0.99 4.77 -0.77 -4.66 117.00 118.43 2hve n LEU 20 Ca -0.08 -1.71 -0.12 0.00 -0.03 0.00 0.00 56.01 54.08 2hve n LEU 20 Cb 0.57 -0.28 -0.07 0.00 -2.33 0.00 0.00 43.42 41.32 2hve n LEU 20 CO 0.24 0.76 0.82 0.58 -1.33 0.00 0.00 177.39 178.46 2hve h VAL 21 N 3.49 1.11 -0.47 4.08 2.07 -1.89 -2.27 116.25 122.36 2hve h VAL 21 Ca 0.00 -0.32 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 2hve h VAL 21 Cb 0.86 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 2hve h VAL 21 CO 0.00 0.09 -0.04 1.23 0.02 0.00 0.00 177.57 178.86 2hve h GLY 22 N -0.07 0.92 0.71 2.17 0.00 -1.97 -2.35 103.07 102.49 2hve h GLY 22 Ca 0.01 -0.71 0.06 0.00 0.00 0.00 0.00 47.33 46.68 2hve h GLY 22 CO -0.00 0.65 0.41 -2.09 0.00 0.00 0.00 176.54 175.51 2hve h GLU 23 N 0.70 0.73 -0.01 4.80 4.57 -1.84 -0.43 114.58 123.11 2hve h GLU 23 Ca 0.13 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.26 2hve h GLU 23 Cb 0.57 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2hve h GLU 23 CO 0.03 0.49 -0.01 0.82 -1.18 0.00 0.00 179.01 179.16 2hve h ILE 24 N 0.76 1.35 -0.69 2.32 2.04 -1.28 -2.54 117.51 119.46 2hve h ILE 24 Ca 0.31 -1.04 0.07 0.00 1.00 0.00 0.00 64.86 65.19 2hve h ILE 24 Cb 0.16 2.03 -0.06 0.00 -0.74 0.00 0.00 36.82 38.22 2hve h ILE 24 CO -0.17 0.27 0.38 0.40 0.00 0.00 0.00 178.15 179.04 2hve h ILE 25 N -0.41 0.95 -0.81 -0.67 2.04 -1.35 -1.40 117.51 115.86 2hve h ILE 25 Ca 0.00 -0.24 0.17 0.00 1.00 0.00 0.00 64.86 65.80 2hve h ILE 25 Cb 0.45 0.20 -0.11 0.00 -0.74 0.00 0.00 36.82 36.62 2hve h ILE 25 CO 0.00 0.13 0.31 0.50 0.00 0.00 0.00 178.15 179.09 2hve h LYS 26 N 0.69 0.39 -0.65 2.37 3.64 -0.96 -0.72 116.57 121.32 2hve h LYS 26 Ca 0.32 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.63 2hve h LYS 26 Cb 0.23 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 2hve h LYS 26 CO -0.20 0.26 0.22 0.00 -2.27 0.00 0.00 179.45 177.46 2hve h ARG 27 N 0.40 1.00 -0.35 1.90 3.08 -0.82 -0.37 114.38 119.23 2hve h ARG 27 Ca 0.47 -0.20 -0.16 0.00 0.07 0.00 0.00 59.98 60.16 2hve h ARG 27 Cb 0.80 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 2hve h ARG 27 CO -0.47 0.87 -0.41 0.74 -1.07 0.00 0.00 179.97 179.62 2hve h PHE 28 N 0.94 1.04 0.00 3.04 -1.00 -1.25 -2.96 116.94 116.76 2hve h PHE 28 Ca 0.21 -0.32 -0.00 0.00 2.81 0.00 0.00 57.97 60.67 2hve h PHE 28 Cb 0.27 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 39.61 2hve h PHE 28 CO 0.02 1.13 -0.00 0.93 -1.61 0.00 0.00 178.31 178.77 2hve h GLU 29 N 0.70 -0.00 0.00 1.51 5.08 -0.81 -2.86 114.58 118.21 2hve h GLU 29 Ca 0.05 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 2hve h GLU 29 Cb 0.99 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 2hve h GLU 29 CO 0.10 0.05 -0.34 -0.56 -1.00 0.00 0.00 179.01 177.26 2hve h GLN 30 N -0.06 0.00 -0.10 2.33 3.07 -1.14 -1.84 115.11 117.36 2hve h GLN 30 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.71 2hve h GLN 30 Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.61 2hve h GLN 30 CO 0.00 0.34 -0.05 -0.22 0.09 0.00 0.00 178.83 178.99 2hve h LYS 31 N 0.00 0.15 0.00 0.06 1.63 -1.50 -3.47 116.57 113.44 2hve h LYS 31 Ca -0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 2hve h LYS 31 Cb 0.66 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.27 2hve h LYS 31 CO 0.04 0.22 0.00 0.41 -3.45 0.00 0.00 179.45 176.67 2hve n GLY 32 N -1.18 0.97 3.78 5.01 0.00 -0.69 -5.10 105.19 107.98 2hve n GLY 32 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 2hve n GLY 32 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hve s PHE 33 N -2.00 3.25 -0.12 1.61 0.08 -1.09 -5.01 117.98 114.71 2hve s PHE 33 Ca 0.00 1.64 -0.17 0.00 0.12 0.00 0.00 56.93 58.51 2hve s PHE 33 Cb 0.00 -3.13 -0.04 0.00 -0.57 0.00 0.00 43.02 39.28 2hve s PHE 33 CO 0.00 -0.64 0.45 0.50 -0.10 0.00 0.00 175.22 175.43 2hve s ARG 34 N -2.54 4.31 -0.06 0.44 3.52 -0.57 -4.51 118.95 119.54 2hve s ARG 34 Ca 0.58 0.41 -0.30 0.00 -0.13 0.00 0.00 55.73 56.29 2hve s ARG 34 Cb -0.22 -3.42 -0.04 0.00 -1.56 0.00 0.00 34.95 29.71 2hve s ARG 34 CO 0.27 0.20 1.39 -1.17 -0.81 0.00 0.00 175.30 175.18 2hve s LEU 35 N 0.51 4.28 -0.15 -0.88 0.20 -1.26 -1.22 118.68 120.16 2hve s LEU 35 Ca 0.25 2.00 0.00 0.00 0.69 0.00 0.00 54.13 57.07 2hve s LEU 35 Cb -0.15 -3.55 -0.10 0.00 -0.43 0.00 0.00 46.19 41.96 2hve s LEU 35 CO 0.10 -0.75 -0.14 0.52 -0.29 0.00 0.00 176.35 175.78 2hve n VAL 36 N 4.99 0.88 -3.85 1.68 0.31 -0.00 -4.90 118.33 117.44 2hve n VAL 36 Ca 0.14 -0.33 -0.12 0.00 -0.01 0.00 0.00 64.34 64.02 2hve n VAL 36 Cb 0.44 -1.11 -0.13 0.00 -0.91 0.00 0.00 33.84 32.13 2hve n VAL 36 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2hve s GLY 37 N -5.47 -0.04 -0.28 2.92 0.00 -0.89 -0.32 107.32 103.24 2hve s GLY 37 Ca -0.21 0.18 -0.01 0.00 0.00 0.00 0.00 44.72 44.68 2hve s GLY 37 CO 0.35 0.13 0.51 -2.27 0.00 0.00 0.00 173.10 171.82 2hve s LEU 38 N -0.18 -1.09 0.25 0.66 2.96 -1.26 -1.08 118.68 118.94 2hve s LEU 38 Ca -0.02 0.53 0.05 0.00 -0.22 0.00 0.00 54.13 54.47 2hve s LEU 38 Cb -0.02 1.72 -0.05 0.00 0.50 0.00 0.00 46.19 48.33 2hve s LEU 38 CO 0.00 -0.28 -0.03 -1.59 -1.32 0.00 0.00 176.35 173.13 2hve s LYS 39 N 2.73 1.42 -0.08 1.98 -2.85 -0.03 -5.00 119.74 117.91 2hve s LYS 39 Ca 0.17 -1.72 0.01 0.00 -1.00 0.00 0.00 55.97 53.42 2hve s LYS 39 Cb -0.15 -0.84 0.02 0.00 -2.06 0.00 0.00 37.83 34.80 2hve s LYS 39 CO -0.20 -0.04 -0.08 0.12 0.10 0.00 0.00 175.35 175.25 2hve s PHE 40 N -3.25 1.31 -0.13 1.78 5.36 -1.26 -0.40 117.98 121.38 2hve s PHE 40 Ca 0.29 -0.54 -0.29 0.00 -0.96 0.00 0.00 56.93 55.43 2hve s PHE 40 Cb 0.05 -1.05 0.07 0.00 -0.34 0.00 0.00 43.02 41.75 2hve s PHE 40 CO 0.10 -0.36 0.71 0.00 -1.46 0.00 0.00 175.22 174.21 2hve s MET 41 N 1.20 0.96 -0.39 10.12 0.23 -0.56 -4.98 119.30 125.88 2hve s MET 41 Ca -0.05 0.53 -0.25 0.00 -1.03 0.00 0.00 55.69 54.88 2hve s MET 41 Cb -0.14 0.46 0.02 0.00 -1.53 0.00 0.00 34.83 33.63 2hve s MET 41 CO -0.02 -0.24 0.90 -1.14 -2.03 0.00 0.00 175.02 172.48 2hve s GLN 42 N -0.61 3.75 -0.09 3.16 0.74 -1.26 -0.08 119.66 125.28 2hve s GLN 42 Ca -0.07 0.43 -0.30 0.00 0.05 0.00 0.00 55.36 55.48 2hve s GLN 42 Cb -0.02 -3.83 -0.02 0.00 1.10 0.00 0.00 33.01 30.24 2hve s GLN 42 CO 0.06 -0.99 1.08 0.00 -0.55 0.00 0.00 175.29 174.90 2hve s ALA 43 N 3.46 3.44 0.54 1.58 0.00 -1.26 -5.01 121.76 124.50 2hve s ALA 43 Ca 0.36 0.47 -0.21 0.00 0.00 0.00 0.00 51.96 52.58 2hve s ALA 43 Cb -0.12 -3.47 -0.05 0.00 0.00 0.00 0.00 23.12 19.48 2hve s ALA 43 CO 0.20 -0.67 1.31 -1.54 0.00 0.00 0.00 175.76 175.06 2hve s SER 44 N 1.25 5.38 0.35 0.00 1.04 -1.26 -4.60 113.70 115.85 2hve s SER 44 Ca 0.51 2.65 0.08 0.00 0.48 0.00 0.00 55.95 59.67 2hve s SER 44 Cb -0.21 -2.63 0.79 0.00 0.10 0.00 0.00 66.02 64.07 2hve s SER 44 CO 0.19 -1.49 1.87 -0.33 0.98 0.00 0.00 173.24 174.47 2hve h GLU 45 N 1.46 0.71 0.36 4.02 5.08 -1.95 -1.47 114.58 122.79 2hve h GLU 45 Ca -0.51 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 57.80 2hve h GLU 45 Cb 1.29 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2hve h GLU 45 CO 0.57 0.47 -0.26 -0.44 -1.00 0.00 0.00 179.01 178.35 2hve h ASP 46 N 0.73 -0.68 -0.46 1.42 3.32 -1.99 -0.75 116.42 118.01 2hve h ASP 46 Ca 0.45 0.05 0.06 0.00 0.02 0.00 0.00 57.03 57.61 2hve h ASP 46 Cb 0.67 0.21 -0.05 0.00 0.22 0.00 0.00 39.33 40.38 2hve h ASP 46 CO -0.21 -0.40 0.16 0.25 -1.72 0.00 0.00 179.24 177.32 2hve h LEU 47 N -0.62 0.16 -1.53 1.55 5.85 -1.75 0.15 115.31 119.12 2hve h LEU 47 Ca -0.03 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 2hve h LEU 47 Cb 0.53 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 2hve h LEU 47 CO 0.00 0.12 0.13 -0.07 -0.34 0.00 0.00 178.44 178.29 2hve h LEU 48 N 0.33 0.39 -0.11 2.25 3.38 -1.19 0.21 115.31 120.57 2hve h LEU 48 Ca 0.22 -0.03 -0.20 0.00 0.09 0.00 0.00 57.88 57.95 2hve h LEU 48 Cb 0.22 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 40.88 2hve h LEU 48 CO -0.23 0.36 -0.71 0.11 0.09 0.00 0.00 178.44 178.06 2hve h LYS 49 N 0.44 0.68 -0.22 1.13 1.57 -0.13 -0.83 116.57 119.21 2hve h LYS 49 Ca 0.11 -0.58 -0.09 0.00 -1.87 0.00 0.00 60.65 58.22 2hve h LYS 49 Cb 0.09 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2hve h LYS 49 CO -0.01 1.19 -0.23 1.49 -0.57 0.00 0.00 179.45 181.32 2hve h GLU 50 N 0.35 0.41 0.04 3.15 4.57 -0.70 -1.39 114.58 121.01 2hve h GLU 50 Ca -0.06 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 57.98 2hve h GLU 50 Cb 1.36 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.92 2hve h GLU 50 CO 0.15 0.62 -0.02 1.25 -1.18 0.00 0.00 179.01 179.83 2hve h HIS 51 N 0.36 -0.05 -0.33 0.92 2.76 -0.59 -3.24 115.15 114.99 2hve h HIS 51 Ca 0.06 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.19 2hve h HIS 51 Cb 0.61 0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.57 2hve h HIS 51 CO 0.02 0.48 0.05 0.66 -1.30 0.00 0.00 177.93 177.84 2hve n TYR 52 N -4.85 1.16 -0.26 5.26 4.01 -0.32 -4.68 117.16 117.48 2hve n TYR 52 Ca -0.09 -0.50 0.07 0.00 -0.16 0.00 0.00 57.90 57.22 2hve n TYR 52 Cb 0.28 -0.36 0.20 0.00 -0.31 0.00 0.00 39.34 39.15 2hve n TYR 52 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 2hve h VAL 53 N 1.84 0.46 0.00 -0.72 3.04 -1.27 -1.02 116.25 118.58 2hve h VAL 53 Ca 0.05 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 2hve h VAL 53 Cb 1.38 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.84 2hve h VAL 53 CO 0.31 0.05 0.00 0.47 -1.01 0.00 0.00 177.57 177.38 2hve n ASP 54 N -5.17 0.17 -1.19 3.17 10.43 -1.26 -2.46 116.55 120.23 2hve n ASP 54 Ca 0.16 0.55 -0.02 0.00 2.57 0.00 0.00 54.79 58.05 2hve n ASP 54 Cb 0.51 -0.58 0.22 0.00 1.84 0.00 0.00 41.12 43.10 2hve n ASP 54 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2hve n LEU 55 N -1.70 4.33 0.00 0.64 4.77 -0.39 -4.70 117.00 119.95 2hve n LEU 55 Ca 0.02 -3.52 -0.12 0.00 -0.03 0.00 0.00 56.01 52.35 2hve n LEU 55 Cb 0.14 -0.63 -0.08 0.00 -2.33 0.00 0.00 43.42 40.52 2hve n LEU 55 CO 0.12 1.06 0.73 0.50 -1.33 0.00 0.00 177.39 178.47 2hve h LYS 56 N 1.28 0.02 -0.90 3.23 3.64 -1.60 -3.11 116.57 119.12 2hve h LYS 56 Ca 0.19 -0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.75 2hve h LYS 56 Cb 1.72 -0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 33.43 2hve h LYS 56 CO 0.41 0.30 0.46 0.38 -2.27 0.00 0.00 179.45 178.74 2hve h ASP 57 N -0.26 0.51 -4.22 4.20 -0.00 -1.86 -3.45 116.42 111.34 2hve h ASP 57 Ca 0.00 0.12 -0.52 0.00 -0.00 0.00 0.00 57.03 56.63 2hve h ASP 57 Cb 0.29 0.05 0.15 0.00 -0.00 0.00 0.00 39.33 39.82 2hve h ASP 57 CO 0.00 0.14 0.34 -0.13 -0.00 0.00 0.00 179.24 179.59 2hve s ARG 58 N -5.90 2.01 0.00 4.15 0.52 -1.18 -4.94 118.95 113.61 2hve s ARG 58 Ca -0.12 1.57 0.29 0.00 -0.52 0.00 0.00 55.73 56.96 2hve s ARG 58 Cb 0.24 -1.84 1.26 0.00 0.52 0.00 0.00 34.95 35.14 2hve s ARG 58 CO 0.78 -1.90 1.94 -0.35 0.02 0.00 0.00 175.30 175.80 2hve n PRO 59 N -3.12 0.05 -0.04 3.54 -0.04 -1.26 -3.15 135.00 130.97 2hve n PRO 59 Ca 0.12 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.70 2hve n PRO 59 Cb 0.51 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.63 2hve n PRO 59 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2hve n PHE 60 N -1.48 0.11 -0.15 0.54 1.16 -1.26 -4.45 117.46 111.93 2hve n PHE 60 Ca 0.08 -0.05 0.01 0.00 -1.87 0.00 0.00 57.45 55.62 2hve n PHE 60 Cb 0.33 0.00 0.30 0.00 -1.61 0.00 0.00 39.48 38.49 2hve n PHE 60 CO 0.00 0.00 0.00 0.35 -1.87 0.00 0.00 176.76 175.24 2hve h PHE 61 N 4.44 0.81 0.63 2.97 3.57 -1.78 -1.27 116.94 126.32 2hve h PHE 61 Ca 0.00 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 2hve h PHE 61 Cb 0.95 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 39.43 2hve h PHE 61 CO 0.05 0.52 -0.30 0.00 -2.23 0.00 0.00 178.31 176.35 2hve h ALA 62 N 1.58 -0.85 0.00 2.41 0.00 -1.83 -2.86 119.26 117.71 2hve h ALA 62 Ca 0.23 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2hve h ALA 62 Cb -0.07 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2hve h ALA 62 CO -0.05 -0.95 -0.31 0.78 0.00 0.00 0.00 179.25 178.73 2hve h GLY 63 N -0.92 0.00 0.80 0.00 0.00 -1.86 -3.28 103.07 97.81 2hve h GLY 63 Ca -0.09 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.20 2hve h GLY 63 CO 0.14 0.00 -0.38 -2.00 0.00 0.00 0.00 176.54 174.30 2hve h LEU 64 N 0.00 -0.90 -0.59 3.11 5.85 -1.07 -1.81 115.31 119.90 2hve h LEU 64 Ca -0.00 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.82 2hve h LEU 64 Cb 0.71 0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.91 2hve h LEU 64 CO 0.04 -0.64 0.26 0.58 -0.34 0.00 0.00 178.44 178.33 2hve h VAL 65 N -1.07 0.85 -0.30 1.05 2.07 -1.60 -0.31 116.25 116.95 2hve h VAL 65 Ca -0.11 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 67.28 2hve h VAL 65 Cb 0.82 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 2hve h VAL 65 CO 0.18 0.09 0.09 0.50 0.02 0.00 0.00 177.57 178.45 2hve h LYS 66 N 0.48 0.21 -0.44 1.57 3.64 -1.61 -1.11 116.57 119.31 2hve h LYS 66 Ca 0.28 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.54 2hve h LYS 66 Cb 0.28 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.04 2hve h LYS 66 CO -0.24 0.14 -0.17 -0.92 -2.27 0.00 0.00 179.45 175.99 2hve h TYR 67 N 0.22 0.94 0.00 1.91 5.03 -0.71 -0.77 116.97 123.59 2hve h TYR 67 Ca 0.14 -0.20 0.00 0.00 2.58 0.00 0.00 58.73 61.25 2hve h TYR 67 Cb 0.11 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 38.16 2hve h TYR 67 CO -0.14 0.94 0.00 -1.33 -1.32 0.00 0.00 178.16 176.31 2hve n MET 68 N -4.13 0.18 -0.00 1.82 2.81 -0.18 -2.48 117.12 115.14 2hve n MET 68 Ca 0.01 0.09 0.06 0.00 -1.81 0.00 0.00 57.70 56.05 2hve n MET 68 Cb 0.41 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.35 2hve n MET 68 CO 0.00 0.00 0.00 1.58 1.51 0.00 0.00 175.97 179.06 2hve n HIS 69 N -1.38 0.00 0.97 2.03 -0.00 -0.44 -4.52 115.22 111.88 2hve n HIS 69 Ca 0.08 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.94 2hve n HIS 69 Cb 0.22 -0.02 0.59 0.00 -0.00 0.00 0.00 29.99 30.79 2hve n HIS 69 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 2hve n SER 70 N -1.34 0.00 -2.09 0.26 3.41 -0.33 -4.85 113.62 108.67 2hve n SER 70 Ca 0.02 0.45 -0.06 0.00 -0.26 0.00 0.00 58.87 59.03 2hve n SER 70 Cb 0.21 -0.48 0.02 0.00 -0.26 0.00 0.00 64.21 63.69 2hve n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2hve n GLY 71 N 1.31 1.41 3.85 5.00 0.00 -1.26 -5.09 105.19 110.42 2hve n GLY 71 Ca 0.07 -1.17 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 2hve n GLY 71 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2hve s PRO 72 N -2.07 3.90 0.07 1.61 0.04 -1.26 -4.54 135.00 132.75 2hve s PRO 72 Ca 0.10 0.83 0.08 0.00 0.04 0.00 0.00 61.00 62.06 2hve s PRO 72 Cb -0.03 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 2hve s PRO 72 CO 0.07 -0.22 -0.23 0.14 0.04 0.00 0.00 177.00 176.81 2hve s VAL 73 N -2.57 1.84 -0.39 -0.36 -7.23 0.89 -3.17 120.40 109.40 2hve s VAL 73 Ca 0.57 -1.42 -0.16 0.00 -1.81 0.00 0.00 61.98 59.17 2hve s VAL 73 Cb -0.10 -1.62 0.01 0.00 0.56 0.00 0.00 36.38 35.23 2hve s VAL 73 CO 0.32 0.13 0.35 -0.69 -0.31 0.00 0.00 175.10 174.90 2hve s VAL 74 N -0.95 5.18 -0.17 1.32 1.01 -0.60 -1.50 120.40 124.70 2hve s VAL 74 Ca 0.09 -0.38 -0.11 0.00 0.00 0.00 0.00 61.98 61.58 2hve s VAL 74 Cb -0.10 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 2hve s VAL 74 CO 0.03 -0.28 0.18 0.00 0.00 0.00 0.00 175.10 175.03 2hve s ALA 75 N 1.91 3.69 0.04 5.51 0.00 0.46 0.12 121.76 133.48 2hve s ALA 75 Ca 0.09 -0.61 0.02 0.00 0.00 0.00 0.00 51.96 51.46 2hve s ALA 75 Cb -0.18 -2.21 -0.02 0.00 0.00 0.00 0.00 23.12 20.71 2hve s ALA 75 CO 0.12 0.20 -0.08 -1.64 0.00 0.00 0.00 175.76 174.36 2hve s MET 76 N 0.19 0.53 -0.13 0.00 -1.94 0.14 -0.85 119.30 117.24 2hve s MET 76 Ca 0.12 -0.71 0.02 0.00 -1.71 0.00 0.00 55.69 53.40 2hve s MET 76 Cb -0.12 -0.32 0.01 0.00 2.01 0.00 0.00 34.83 36.42 2hve s MET 76 CO 0.01 0.06 -0.19 0.08 -0.01 0.00 0.00 175.02 174.96 2hve s VAL 77 N -1.27 1.84 0.07 -6.03 1.01 -0.24 -0.85 120.40 114.93 2hve s VAL 77 Ca -0.09 -0.85 0.09 0.00 0.00 0.00 0.00 61.98 61.14 2hve s VAL 77 Cb -0.09 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 2hve s VAL 77 CO 0.00 0.51 -0.25 0.26 0.00 0.00 0.00 175.10 175.62 2hve s TRP 78 N 0.86 2.15 0.06 5.22 0.52 -1.00 -0.82 118.94 125.93 2hve s TRP 78 Ca -0.08 -0.40 0.09 0.00 0.02 0.00 0.00 56.10 55.74 2hve s TRP 78 Cb -0.15 -1.24 -0.03 0.00 -1.15 0.00 0.00 33.47 30.89 2hve s TRP 78 CO -0.01 0.18 -0.26 -2.00 0.02 0.00 0.00 176.95 174.88 2hve s GLU 79 N -1.50 1.68 0.00 4.98 2.12 -0.35 -1.12 118.70 124.50 2hve s GLU 79 Ca 0.11 -1.14 0.00 0.00 0.36 0.00 0.00 54.97 54.29 2hve s GLU 79 Cb -0.10 -1.91 0.00 0.00 0.26 0.00 0.00 34.13 32.38 2hve s GLU 79 CO 0.03 0.49 0.00 0.41 -0.54 0.00 0.00 175.26 175.65 2hve n GLY 80 N 1.60 2.32 3.69 -1.50 0.00 0.15 -1.51 105.19 109.94 2hve n GLY 80 Ca -0.17 -1.16 -0.55 0.00 0.00 0.00 0.00 46.02 44.14 2hve n GLY 80 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2hve n LEU 81 N 0.00 2.44 -3.35 0.99 7.94 -1.25 -1.97 117.00 121.80 2hve n LEU 81 Ca 0.00 1.07 -0.23 0.00 -1.11 0.00 0.00 56.01 55.74 2hve n LEU 81 Cb 0.00 -1.18 -0.00 0.00 0.53 0.00 0.00 43.42 42.76 2hve n LEU 81 CO 0.00 -0.46 -0.04 0.59 -1.11 0.00 0.00 177.39 176.37 2hve n ASN 82 N 5.11 -3.69 -0.28 1.96 3.02 -1.26 -4.86 115.26 115.26 2hve n ASN 82 Ca 0.25 -0.38 0.04 0.00 -0.03 0.00 0.00 54.58 54.45 2hve n ASN 82 Cb 0.16 -3.06 0.17 0.00 -0.61 0.00 0.00 39.78 36.44 2hve n ASN 82 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2hve h VAL 83 N -0.95 0.83 0.66 2.41 2.07 -1.68 -1.23 116.25 118.36 2hve h VAL 83 Ca -0.43 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 2hve h VAL 83 Cb 1.29 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2hve h VAL 83 CO 0.53 0.12 -0.41 0.58 0.02 0.00 0.00 177.57 178.41 2hve h VAL 84 N 0.67 0.17 0.14 2.57 2.07 -1.86 0.94 116.25 120.96 2hve h VAL 84 Ca 0.40 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.91 2hve h VAL 84 Cb 0.45 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2hve h VAL 84 CO -0.29 0.00 -0.07 0.50 0.02 0.00 0.00 177.57 177.73 2hve h LYS 85 N -1.01 -0.18 -0.71 1.57 3.11 -1.81 -2.36 116.57 115.18 2hve h LYS 85 Ca -0.08 0.01 -0.06 0.00 -2.81 0.00 0.00 60.65 57.71 2hve h LYS 85 Cb 0.82 0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 32.06 2hve h LYS 85 CO 0.08 0.08 0.22 1.15 -2.81 0.00 0.00 179.45 178.18 2hve h THR 86 N -0.43 1.26 -0.69 1.00 2.02 -1.24 -2.60 112.91 112.23 2hve h THR 86 Ca -0.02 -0.89 0.12 0.00 0.77 0.00 0.00 66.41 66.39 2hve h THR 86 Cb 0.35 0.48 -0.09 0.00 -1.74 0.00 0.00 68.15 67.15 2hve h THR 86 CO 0.03 0.35 0.26 1.23 0.37 0.00 0.00 175.52 177.76 2hve h GLY 87 N 1.05 1.00 1.68 2.16 0.00 1.00 -0.11 103.07 109.85 2hve h GLY 87 Ca 0.23 -0.12 -0.07 0.00 0.00 0.00 0.00 47.33 47.37 2hve h GLY 87 CO -0.01 -0.07 -0.16 3.21 0.00 0.00 0.00 176.54 179.51 2hve h ARG 88 N 0.41 0.39 -0.37 4.80 3.08 -1.08 -1.65 114.38 119.96 2hve h ARG 88 Ca 0.37 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 60.22 2hve h ARG 88 Cb 0.52 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2hve h ARG 88 CO -0.37 0.55 -0.08 0.28 -1.07 0.00 0.00 179.97 179.27 2hve h VAL 89 N 0.36 1.27 -0.75 2.04 2.07 -0.94 -2.03 116.25 118.28 2hve h VAL 89 Ca 0.07 -1.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.42 2hve h VAL 89 Cb 0.50 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 2hve h VAL 89 CO 0.03 0.38 0.40 0.24 0.02 0.00 0.00 177.57 178.65 2hve h MET 90 N 0.52 1.04 -0.50 1.57 2.86 -0.82 -2.46 114.93 117.14 2hve h MET 90 Ca 0.10 -0.12 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 2hve h MET 90 Cb 0.59 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 2hve h MET 90 CO 0.04 0.77 -0.02 -0.07 1.06 0.00 0.00 176.91 178.68 2hve h LEU 91 N 1.05 0.82 0.00 1.22 4.07 -1.20 0.29 115.31 121.55 2hve h LEU 91 Ca 0.26 -0.21 0.00 0.00 0.08 0.00 0.00 57.88 58.01 2hve h LEU 91 Cb 0.03 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.56 2hve h LEU 91 CO -0.04 0.89 0.00 0.61 -1.08 0.00 0.00 178.44 178.82 2hve n GLY 92 N -0.56 -3.55 3.77 0.83 0.00 -0.77 -1.16 105.19 103.74 2hve n GLY 92 Ca 0.02 -2.03 -0.38 0.00 0.00 0.00 0.00 46.02 43.64 2hve n GLY 92 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hve s GLU 93 N -0.76 3.67 0.28 1.61 0.41 -1.26 -4.75 118.70 117.90 2hve s GLU 93 Ca 0.00 1.94 -0.06 0.00 -0.41 0.00 0.00 54.97 56.44 2hve s GLU 93 Cb 0.00 -2.45 0.52 0.00 -1.78 0.00 0.00 34.13 30.42 2hve s GLU 93 CO 0.00 -0.67 1.58 1.15 -0.49 0.00 0.00 175.26 176.82 2hve h THR 94 N 1.90 0.07 -3.31 3.63 2.02 -1.94 -3.35 112.91 111.93 2hve h THR 94 Ca -0.50 -0.00 -0.60 0.00 0.77 0.00 0.00 66.41 66.08 2hve h THR 94 Cb 1.26 0.06 -0.09 0.00 -1.74 0.00 0.00 68.15 67.64 2hve h THR 94 CO 0.60 0.00 0.47 0.21 0.37 0.00 0.00 175.52 177.17 2hve s ASN 95 N -5.19 6.81 0.61 4.18 2.47 -1.26 -4.77 114.94 117.80 2hve s ASN 95 Ca -0.14 0.98 0.34 0.00 0.42 0.00 0.00 52.86 54.45 2hve s ASN 95 Cb 0.26 -2.43 1.98 0.00 -1.45 0.00 0.00 41.25 39.61 2hve s ASN 95 CO 0.77 -0.54 2.28 -0.65 -3.72 0.00 0.00 177.10 175.24 2hve h PRO 96 N 7.76 0.00 0.00 0.43 0.11 -1.77 -1.60 132.00 136.93 2hve h PRO 96 Ca -0.23 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.82 2hve h PRO 96 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2hve h PRO 96 CO 0.88 0.00 -0.26 0.00 -0.21 0.00 0.00 178.00 178.41 2hve h ALA 97 N 1.98 1.41 -0.10 -0.75 0.00 -1.89 -2.19 119.26 117.72 2hve h ALA 97 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2hve h ALA 97 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2hve h ALA 97 CO -0.00 0.33 0.00 -0.25 0.00 0.00 0.00 179.25 179.33 2hve n ASP 98 N -4.00 2.32 -4.67 0.00 10.43 -0.61 -4.93 116.55 115.08 2hve n ASP 98 Ca -0.02 -1.78 -0.41 0.00 2.57 0.00 0.00 54.79 55.16 2hve n ASP 98 Cb 0.33 -0.05 -0.05 0.00 1.84 0.00 0.00 41.12 43.19 2hve n ASP 98 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 2hve s SER 99 N -1.86 6.86 0.39 -2.24 0.01 -0.83 -4.60 113.70 111.44 2hve s SER 99 Ca 0.34 1.05 -0.25 0.00 1.31 0.00 0.00 55.95 58.40 2hve s SER 99 Cb 0.20 -2.41 -0.09 0.00 0.21 0.00 0.00 66.02 63.94 2hve s SER 99 CO 0.31 -0.30 1.15 -0.54 0.41 0.00 0.00 173.24 174.27 2hve s LYS 100 N 1.82 4.12 0.54 12.44 3.01 -1.26 -4.38 119.74 136.02 2hve s LYS 100 Ca 0.35 1.81 -0.21 0.00 -1.01 0.00 0.00 55.97 56.91 2hve s LYS 100 Cb -0.16 -2.71 -0.06 0.00 -1.01 0.00 0.00 37.83 33.89 2hve s LYS 100 CO 0.13 -0.26 1.05 -2.30 0.51 0.00 0.00 175.35 174.48 2hve n PRO 101 N 0.15 1.18 0.00 -1.68 -0.02 -1.26 -1.83 135.00 131.54 2hve n PRO 101 Ca 0.04 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 2hve n PRO 101 Cb 0.47 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2hve n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hve n GLY 102 N 1.16 3.07 3.87 -1.23 0.00 -1.26 -4.99 105.19 105.81 2hve n GLY 102 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2hve n GLY 102 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2hve s THR 103 N -2.43 4.42 0.08 2.61 -4.23 -0.76 -4.92 115.64 110.42 2hve s THR 103 Ca 0.00 0.79 -0.25 0.00 -1.18 0.00 0.00 61.69 61.05 2hve s THR 103 Cb 0.00 -3.77 -0.16 0.00 1.34 0.00 0.00 72.50 69.91 2hve s THR 103 CO 0.00 -1.03 1.68 0.40 -0.54 0.00 0.00 174.62 175.13 2hve h ILE 104 N -0.41 0.91 -0.39 2.99 2.04 -0.95 -0.52 117.51 121.18 2hve h ILE 104 Ca -0.44 -0.08 -0.12 0.00 1.00 0.00 0.00 64.86 65.22 2hve h ILE 104 Cb 1.20 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 2hve h ILE 104 CO 0.62 0.02 -0.23 0.03 0.00 0.00 0.00 178.15 178.59 2hve h ARG 105 N -0.20 0.78 -0.30 2.37 3.08 -1.40 -1.71 114.38 117.00 2hve h ARG 105 Ca -0.02 -0.32 -0.05 0.00 0.07 0.00 0.00 59.98 59.67 2hve h ARG 105 Cb 0.16 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2hve h ARG 105 CO 0.03 0.94 -0.01 0.78 -1.07 0.00 0.00 179.97 180.64 2hve h GLY 106 N 0.96 0.50 1.18 0.04 0.00 -1.71 -2.71 103.07 101.34 2hve h GLY 106 Ca 0.09 -0.29 -0.29 0.00 0.00 0.00 0.00 47.33 46.85 2hve h GLY 106 CO 0.06 0.27 -1.57 -0.55 0.00 0.00 0.00 176.54 174.75 2hve h ASP 107 N 0.45 0.10 0.00 0.19 3.32 -0.98 -3.43 116.42 116.08 2hve h ASP 107 Ca 0.10 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2hve h ASP 107 Cb 0.31 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2hve h ASP 107 CO 0.01 1.15 0.00 0.49 -1.72 0.00 0.00 179.24 179.17 2hve n PHE 108 N -3.21 0.00 -4.00 4.55 3.72 -0.66 -5.08 117.46 112.78 2hve n PHE 108 Ca -0.15 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.15 2hve n PHE 108 Cb 1.03 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.50 2hve n PHE 108 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2hve n ILE 110 N -0.30 0.41 -4.56 0.00 5.41 -1.26 -4.70 119.36 114.36 2hve n ILE 110 Ca -0.04 0.07 -0.33 0.00 1.00 0.00 0.00 62.75 63.45 2hve n ILE 110 Cb 0.63 -1.56 -0.11 0.00 -0.71 0.00 0.00 39.64 37.89 2hve n ILE 110 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 2hve s GLN 111 N -2.05 2.72 0.44 0.38 0.74 -1.26 -4.00 119.66 116.63 2hve s GLN 111 Ca -0.03 -0.58 0.19 0.00 0.05 0.00 0.00 55.36 54.98 2hve s GLN 111 Cb 0.01 -2.58 1.13 0.00 1.10 0.00 0.00 33.01 32.67 2hve s GLN 111 CO 0.04 0.65 1.90 -0.24 -0.55 0.00 0.00 175.29 177.09 2hve h VAL 112 N 4.10 0.72 0.00 1.34 3.04 -1.95 0.12 116.25 123.62 2hve h VAL 112 Ca -0.49 -0.12 -0.03 0.00 -1.01 0.00 0.00 66.70 65.05 2hve h VAL 112 Cb 1.17 0.35 -0.00 0.00 -2.01 0.00 0.00 31.29 30.80 2hve h VAL 112 CO 0.53 0.06 -0.15 1.23 -1.01 0.00 0.00 177.57 178.23 2hve h GLY 113 N 0.34 0.00 -5.64 3.17 0.00 -1.96 -3.19 103.07 95.80 2hve h GLY 113 Ca 0.41 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 47.16 2hve h GLY 113 CO -0.12 0.00 -0.73 0.54 0.00 0.00 0.00 176.54 176.22 2hve n ARG 114 N -3.41 2.62 -0.77 4.80 5.12 0.41 -4.91 116.66 120.52 2hve n ARG 114 Ca -0.01 -4.52 -0.04 0.00 -1.93 0.00 0.00 57.85 51.35 2hve n ARG 114 Cb 0.34 -2.11 0.24 0.00 -1.16 0.00 0.00 32.46 29.76 2hve n ARG 114 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2hve n ASN 115 N 0.17 4.16 0.00 0.55 6.94 -1.13 -4.42 115.26 121.53 2hve n ASN 115 Ca 0.29 -2.90 0.00 0.00 -0.02 0.00 0.00 54.58 51.95 2hve n ASN 115 Cb 0.44 -0.69 0.00 0.00 -2.36 0.00 0.00 39.78 37.17 2hve n ASN 115 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 2hve n ILE 116 N -0.01 0.00 -3.56 1.53 -5.35 -1.26 -4.77 119.36 105.94 2hve n ILE 116 Ca 0.30 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.64 2hve n ILE 116 Cb 1.13 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 38.98 2hve n ILE 116 CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 2hve s ILE 117 N 0.00 0.03 0.01 7.28 2.07 -1.26 -1.11 121.20 128.21 2hve s ILE 117 Ca 0.00 -0.21 0.04 0.00 -1.41 0.00 0.00 60.65 59.06 2hve s ILE 117 Cb 0.00 -0.98 -0.01 0.00 0.13 0.00 0.00 42.46 41.60 2hve s ILE 117 CO 0.00 -0.12 -0.11 -2.28 -1.91 0.00 0.00 174.94 170.52 2hve s HIS 118 N -2.47 1.02 0.03 3.50 5.65 0.26 -4.90 115.29 118.38 2hve s HIS 118 Ca -0.05 -0.24 0.03 0.00 0.25 0.00 0.00 55.06 55.04 2hve s HIS 118 Cb -0.01 -0.64 -0.02 0.00 -1.18 0.00 0.00 32.58 30.74 2hve s HIS 118 CO -0.02 -0.01 -0.08 0.20 -0.65 0.00 0.00 174.74 174.18 2hve s GLY 119 N -0.56 0.48 0.34 1.59 0.00 -1.26 -0.82 107.32 107.10 2hve s GLY 119 Ca 0.03 -0.61 -0.29 0.00 0.00 0.00 0.00 44.72 43.85 2hve s GLY 119 CO 0.00 -0.62 1.53 -0.32 0.00 0.00 0.00 173.10 173.69 2hve s GLY 120 N -1.06 2.59 0.13 0.20 0.00 -0.65 -4.93 107.32 103.59 2hve s GLY 120 Ca -0.04 1.57 0.25 0.00 0.00 0.00 0.00 44.72 46.50 2hve s GLY 120 CO 0.00 2.38 1.45 2.09 0.00 0.00 0.00 173.10 179.02 2hve n ASP 121 N 1.20 0.69 -3.88 1.64 3.85 -1.26 -4.82 116.55 113.97 2hve n ASP 121 Ca 0.04 0.21 -0.09 0.00 -0.71 0.00 0.00 54.79 54.24 2hve n ASP 121 Cb 0.38 -0.07 -0.05 0.00 -1.35 0.00 0.00 41.12 40.04 2hve n ASP 121 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 2hve s SER 122 N -4.18 -0.15 0.26 -1.12 1.04 -1.26 -4.97 113.70 103.32 2hve s SER 122 Ca 0.08 -0.72 -0.03 0.00 0.48 0.00 0.00 55.95 55.76 2hve s SER 122 Cb 0.14 0.57 0.40 0.00 0.10 0.00 0.00 66.02 67.23 2hve s SER 122 CO 0.69 -1.08 1.87 0.58 0.98 0.00 0.00 173.24 176.28 2hve h VAL 123 N 2.26 1.07 0.62 5.02 2.07 -1.92 0.05 116.25 125.43 2hve h VAL 123 Ca -0.27 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 2hve h VAL 123 Cb 1.25 -0.16 0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2hve h VAL 123 CO 0.37 0.21 -0.30 -0.08 0.02 0.00 0.00 177.57 177.79 2hve h GLU 124 N 1.13 -0.81 -0.98 1.57 4.81 -1.97 -1.99 114.58 116.34 2hve h GLU 124 Ca 0.43 0.06 0.08 0.00 -0.13 0.00 0.00 59.36 59.79 2hve h GLU 124 Cb 0.19 0.18 -0.07 0.00 0.63 0.00 0.00 28.75 29.68 2hve h GLU 124 CO -0.18 -0.52 0.62 0.77 -0.73 0.00 0.00 179.01 178.97 2hve h SER 125 N -0.88 0.98 0.54 1.04 0.02 -1.90 -1.86 113.55 111.48 2hve h SER 125 Ca -0.09 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2hve h SER 125 Cb 0.66 -0.19 0.01 0.00 0.14 0.00 0.00 62.40 63.02 2hve h SER 125 CO 0.14 0.61 -0.26 0.00 -1.14 0.00 0.00 176.83 176.18 2hve h ALA 126 N 1.46 -0.72 -0.66 3.77 0.00 -0.85 0.23 119.26 122.49 2hve h ALA 126 Ca 0.44 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.23 2hve h ALA 126 Cb 0.23 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2hve h ALA 126 CO -0.19 -0.87 0.44 0.93 0.00 0.00 0.00 179.25 179.55 2hve h GLU 127 N -0.79 0.66 0.38 0.00 4.39 -1.27 0.33 114.58 118.29 2hve h GLU 127 Ca -0.07 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.57 2hve h GLU 127 Cb 0.58 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2hve h GLU 127 CO 0.12 0.44 -0.18 -0.22 -1.16 0.00 0.00 179.01 178.01 2hve h LYS 128 N 0.68 -0.49 -0.73 2.33 3.64 -0.97 -1.75 116.57 119.27 2hve h LYS 128 Ca 0.28 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.79 2hve h LYS 128 Cb 0.24 0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.11 2hve h LYS 128 CO -0.09 -0.22 0.38 0.93 -2.27 0.00 0.00 179.45 178.18 2hve h GLU 129 N -0.72 0.62 -0.17 1.90 5.08 0.02 -1.20 114.58 120.12 2hve h GLU 129 Ca -0.05 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2hve h GLU 129 Cb 0.50 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 2hve h GLU 129 CO 0.09 0.41 0.01 0.82 -1.00 0.00 0.00 179.01 179.34 2hve h ILE 130 N 0.64 0.90 -0.44 3.13 2.04 -0.33 -0.21 117.51 123.25 2hve h ILE 130 Ca 0.36 -0.03 0.05 0.00 1.00 0.00 0.00 64.86 66.24 2hve h ILE 130 Cb 0.36 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 2hve h ILE 130 CO -0.26 0.01 0.29 1.23 0.00 0.00 0.00 178.15 179.43 2hve h GLY 131 N 0.07 0.48 0.95 5.37 0.00 -0.83 -1.33 103.07 107.78 2hve h GLY 131 Ca 0.08 -0.16 -0.20 0.00 0.00 0.00 0.00 47.33 47.05 2hve h GLY 131 CO -0.12 0.13 -0.78 -2.00 0.00 0.00 0.00 176.54 173.77 2hve h LEU 132 N 0.40 0.68 0.00 3.11 5.85 -0.53 -3.39 115.31 121.44 2hve h LEU 132 Ca 0.18 -0.75 -0.23 0.00 0.84 0.00 0.00 57.88 57.92 2hve h LEU 132 Cb 0.23 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 2hve h LEU 132 CO -0.04 1.35 -1.82 0.79 -0.34 0.00 0.00 178.44 178.38 2hve n TRP 133 N -4.07 0.59 -4.45 1.25 7.02 -0.16 -4.95 117.44 112.67 2hve n TRP 133 Ca -0.11 0.20 -0.29 0.00 -1.02 0.00 0.00 57.50 56.28 2hve n TRP 133 Cb 0.76 -1.01 -0.13 0.00 -2.42 0.00 0.00 31.31 28.51 2hve n TRP 133 CO 0.00 0.00 0.00 -0.06 -2.02 0.00 0.00 177.69 175.61 2hve s PHE 134 N -2.81 2.40 0.11 -5.99 0.08 -0.51 -5.09 117.98 106.17 2hve s PHE 134 Ca -0.06 -0.34 -0.16 0.00 0.12 0.00 0.00 56.93 56.49 2hve s PHE 134 Cb 0.08 -1.32 -0.07 0.00 -0.57 0.00 0.00 43.02 41.15 2hve s PHE 134 CO 0.83 0.32 0.55 -1.01 -0.10 0.00 0.00 175.22 175.81 2hve s HIS 135 N -1.04 3.68 0.28 0.36 3.76 -1.26 -4.53 115.29 116.53 2hve s HIS 135 Ca 0.15 1.14 0.01 0.00 -0.15 0.00 0.00 55.06 56.21 2hve s HIS 135 Cb -0.10 -2.42 0.64 0.00 1.11 0.00 0.00 32.58 31.82 2hve s HIS 135 CO 0.07 0.50 1.68 -1.35 -0.85 0.00 0.00 174.74 174.78 2hve h PRO 136 N 3.96 0.30 0.00 8.40 0.11 -1.94 0.15 132.00 142.98 2hve h PRO 136 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2hve h PRO 136 Cb 1.20 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2hve h PRO 136 CO 0.65 0.20 0.00 1.05 -0.21 0.00 0.00 178.00 179.68 2hve h GLU 137 N 0.31 0.00 0.00 1.05 9.09 -2.04 -2.08 114.58 120.91 2hve h GLU 137 Ca 0.52 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.93 2hve h GLU 137 Cb 0.97 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.07 2hve h GLU 137 CO -0.56 0.00 -0.16 0.39 0.05 0.00 0.00 179.01 178.73 2hve n GLU 138 N -2.52 0.15 -2.91 1.06 1.02 0.52 -4.76 120.64 113.20 2hve n GLU 138 Ca -0.01 0.10 -0.42 0.00 -0.02 0.00 0.00 57.16 56.82 2hve n GLU 138 Cb 0.10 -1.65 -0.04 0.00 -0.02 0.00 0.00 31.44 29.83 2hve n GLU 138 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2hve s LEU 139 N -3.82 4.09 -0.15 -4.62 1.43 -0.78 -4.60 118.68 110.23 2hve s LEU 139 Ca 0.11 1.03 -0.08 0.00 -1.03 0.00 0.00 54.13 54.16 2hve s LEU 139 Cb 0.15 -3.16 -0.04 0.00 0.03 0.00 0.00 46.19 43.17 2hve s LEU 139 CO 0.61 -0.48 0.13 -0.69 0.23 0.00 0.00 176.35 176.14 2hve s VAL 140 N 2.71 5.40 -0.12 -1.59 1.01 0.56 -5.01 120.40 123.35 2hve s VAL 140 Ca 0.34 0.18 -0.04 0.00 0.00 0.00 0.00 61.98 62.46 2hve s VAL 140 Cb -0.15 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 2hve s VAL 140 CO 0.08 0.55 0.03 -0.62 0.00 0.00 0.00 175.10 175.14 2hve s ASP 141 N -0.48 5.43 -0.08 3.32 -1.08 -1.26 -4.68 116.67 117.84 2hve s ASP 141 Ca 0.12 0.14 -0.32 0.00 -0.52 0.00 0.00 52.55 51.97 2hve s ASP 141 Cb -0.12 -1.72 0.12 0.00 -1.46 0.00 0.00 42.92 39.75 2hve s ASP 141 CO 0.02 0.30 1.20 -0.72 0.52 0.00 0.00 175.17 176.49 2hve s TYR 142 N -0.42 -0.11 -0.20 -5.34 1.13 -1.26 -5.16 117.35 106.00 2hve s TYR 142 Ca 0.09 0.01 -0.03 0.00 -1.41 0.00 0.00 57.07 55.72 2hve s TYR 142 Cb -0.12 0.54 -0.01 0.00 -1.10 0.00 0.00 41.96 41.27 2hve s TYR 142 CO 0.02 -0.31 -0.05 0.99 -2.51 0.00 0.00 175.55 173.69 2hve s THR 143 N -2.54 3.45 0.18 -3.49 2.01 -1.26 -5.09 115.64 108.90 2hve s THR 143 Ca 0.11 -0.48 -0.33 0.00 0.31 0.00 0.00 61.69 61.30 2hve s THR 143 Cb 0.01 -2.54 -0.15 0.00 0.01 0.00 0.00 72.50 69.83 2hve s THR 143 CO -0.04 0.44 1.30 -0.24 -0.69 0.00 0.00 174.62 175.40 2hve n SER 144 N 4.43 1.99 0.31 3.53 2.88 -1.26 -4.88 113.62 120.62 2hve n SER 144 Ca -0.18 1.13 0.19 0.00 -1.33 0.00 0.00 58.87 58.68 2hve n SER 144 Cb 0.51 -1.30 0.98 0.00 -0.75 0.00 0.00 64.21 63.65 2hve n SER 144 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2hve n ALA 146 N -2.15 2.48 -0.32 0.00 0.00 -1.26 -4.72 120.51 114.55 2hve n ALA 146 Ca -0.02 -0.70 0.05 0.00 0.00 0.00 0.00 53.44 52.77 2hve n ALA 146 Cb 0.16 -0.95 0.13 0.00 0.00 0.00 0.00 19.45 18.78 2hve n ALA 146 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2hve h GLN 147 N 3.68 0.01 0.00 0.00 5.75 -1.80 0.16 115.11 122.91 2hve h GLN 147 Ca 0.00 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 2hve h GLN 147 Cb 0.79 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.34 2hve h GLN 147 CO 0.00 0.00 0.00 0.09 -2.65 0.00 0.00 178.83 176.27 2hve n ASN 148 N -5.56 0.22 -0.23 -0.69 3.02 -1.26 -1.53 115.26 109.22 2hve n ASN 148 Ca 0.14 0.55 0.10 0.00 -0.03 0.00 0.00 54.58 55.35 2hve n ASN 148 Cb 0.47 -0.60 -0.07 0.00 -0.61 0.00 0.00 39.78 38.98 2hve n ASN 148 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2hve n TRP 149 N -1.74 0.00 -0.09 3.10 7.02 0.53 -4.36 117.44 121.91 2hve n TRP 149 Ca 0.03 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.42 2hve n TRP 149 Cb 0.21 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 28.97 2hve n TRP 149 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2hve n ILE 150 N -0.80 1.18 -4.37 -0.99 5.41 -0.88 -5.00 119.36 113.91 2hve n ILE 150 Ca 0.06 -0.70 -0.19 0.00 1.00 0.00 0.00 62.75 62.92 2hve n ILE 150 Cb 0.40 -0.62 -0.14 0.00 -0.71 0.00 0.00 39.64 38.57 2hve n ILE 150 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2hve s TYR 151 N -2.42 1.06 -2.00 1.39 2.02 -0.59 -5.04 117.35 111.78 2hve s TYR 151 Ca -0.11 -0.29 0.18 0.00 -0.37 0.00 0.00 57.07 56.49 2hve s TYR 151 Cb 0.05 -0.65 1.10 0.00 -0.40 0.00 0.00 41.96 42.07 2hve s TYR 151 CO 0.68 0.00 1.50 0.39 -1.57 0.00 0.00 175.55 176.55