#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hza s ARG 3 N 0.00 4.20 -0.16 -1.09 0.52 -1.26 -5.03 118.95 116.13 2hza s ARG 3 Ca 0.00 0.85 -0.01 0.00 -0.52 0.00 0.00 55.73 56.05 2hza s ARG 3 Cb 0.00 -3.62 -0.01 0.00 0.52 0.00 0.00 34.95 31.84 2hza s ARG 3 CO 0.00 -0.43 -0.12 0.54 0.02 0.00 0.00 175.30 175.31 2hza s VAL 4 N 2.53 2.95 -0.16 3.52 0.11 -1.26 -5.10 120.40 122.99 2hza s VAL 4 Ca 0.33 -0.67 -0.18 0.00 -2.93 0.00 0.00 61.98 58.53 2hza s VAL 4 Cb -0.16 -2.27 -0.04 0.00 -1.53 0.00 0.00 36.38 32.39 2hza s VAL 4 CO 0.09 0.50 0.47 -0.89 -3.33 0.00 0.00 175.10 171.94 2hza s THR 5 N 0.76 5.17 -0.06 5.04 2.01 -1.26 -5.07 115.64 122.23 2hza s THR 5 Ca -0.05 0.89 0.04 0.00 0.31 0.00 0.00 61.69 62.87 2hza s THR 5 Cb -0.15 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.54 2hza s THR 5 CO 0.01 0.26 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.42 2hza s ILE 6 N 1.09 2.89 -0.28 1.82 1.01 -1.26 -5.10 121.20 121.36 2hza s ILE 6 Ca 0.23 -0.78 -0.09 0.00 0.00 0.00 0.00 60.65 60.01 2hza s ILE 6 Cb -0.15 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 2hza s ILE 6 CO 0.09 0.58 0.14 0.28 0.00 0.00 0.00 174.94 176.03 2hza s THR 7 N -0.50 4.78 -0.00 2.92 -1.32 -1.26 -5.08 115.64 115.17 2hza s THR 7 Ca 0.07 -0.11 0.06 0.00 -1.21 0.00 0.00 61.69 60.50 2hza s THR 7 Cb -0.12 -3.31 -0.02 0.00 -1.51 0.00 0.00 72.50 67.55 2hza s THR 7 CO 0.01 0.23 -0.20 -0.76 -2.21 0.00 0.00 174.62 171.69 2hza s LEU 8 N 1.67 2.07 0.57 9.08 1.43 -1.26 -5.14 118.68 127.10 2hza s LEU 8 Ca 0.06 -0.40 -0.16 0.00 -1.03 0.00 0.00 54.13 52.60 2hza s LEU 8 Cb -0.16 -1.02 -0.05 0.00 0.03 0.00 0.00 46.19 44.99 2hza s LEU 8 CO 0.07 0.23 1.05 1.51 0.23 0.00 0.00 176.35 179.44 2hza s ASP 9 N -0.62 5.95 0.17 2.29 -4.77 -1.26 -4.85 116.67 113.58 2hza s ASP 9 Ca 0.08 1.80 -0.21 0.00 -3.30 0.00 0.00 52.55 50.93 2hza s ASP 9 Cb -0.08 -2.53 0.08 0.00 -1.09 0.00 0.00 42.92 39.30 2hza s ASP 9 CO -0.00 -1.05 1.62 0.44 0.70 0.00 0.00 175.17 176.88 2hza h ASP 10 N 0.64 -0.82 -0.34 2.11 3.45 -2.00 -1.70 116.42 117.75 2hza h ASP 10 Ca -0.47 0.17 0.07 0.00 0.43 0.00 0.00 57.03 57.22 2hza h ASP 10 Cb 1.22 0.41 -0.07 0.00 -0.56 0.00 0.00 39.33 40.33 2hza h ASP 10 CO 0.58 -0.27 -0.10 0.44 -1.57 0.00 0.00 179.24 178.33 2hza h ASP 11 N -0.18 -0.35 -0.51 6.45 3.32 -2.00 -1.41 116.42 121.74 2hza h ASP 11 Ca 0.18 0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.35 2hza h ASP 11 Cb 0.47 0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.22 2hza h ASP 11 CO -0.49 -0.13 0.33 0.25 -1.72 0.00 0.00 179.24 177.48 2hza h LEU 12 N -0.02 0.57 -1.05 1.55 5.85 -1.80 -1.93 115.31 118.47 2hza h LEU 12 Ca 0.17 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 2hza h LEU 12 Cb 0.27 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 2hza h LEU 12 CO -0.36 0.41 0.03 0.25 -0.34 0.00 0.00 178.44 178.43 2hza h LEU 13 N 0.68 0.67 -0.68 2.25 5.85 -0.93 -0.12 115.31 123.03 2hza h LEU 13 Ca 0.19 -0.14 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 2hza h LEU 13 Cb -0.07 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 2hza h LEU 13 CO -0.05 0.72 0.06 -0.33 -0.34 0.00 0.00 178.44 178.50 2hza h GLU 14 N 0.67 1.09 0.11 1.25 3.07 -0.88 0.24 114.58 120.12 2hza h GLU 14 Ca 0.14 -0.31 -0.01 0.00 -0.50 0.00 0.00 59.36 58.68 2hza h GLU 14 Cb 0.37 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 2hza h GLU 14 CO 0.01 1.02 -0.05 1.15 -1.40 0.00 0.00 179.01 179.74 2hza h THR 15 N 1.01 1.01 -0.79 1.13 2.02 -0.78 0.12 112.91 116.62 2hza h THR 15 Ca 0.19 -0.44 0.12 0.00 0.77 0.00 0.00 66.41 67.05 2hza h THR 15 Cb 0.49 1.29 -0.08 0.00 -1.74 0.00 0.00 68.15 68.11 2hza h THR 15 CO 0.02 0.11 0.40 0.25 0.37 0.00 0.00 175.52 176.67 2hza h LEU 16 N -0.34 0.50 0.63 2.58 5.85 -0.87 -0.40 115.31 123.26 2hza h LEU 16 Ca -0.01 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2hza h LEU 16 Cb 0.28 -0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.32 2hza h LEU 16 CO 0.02 0.25 -0.30 0.44 -0.34 0.00 0.00 178.44 178.51 2hza h ASP 17 N 0.62 -0.72 0.12 1.25 3.45 -0.51 -0.69 116.42 119.95 2hza h ASP 17 Ca 0.41 -0.01 0.01 0.00 0.43 0.00 0.00 57.03 57.87 2hza h ASP 17 Cb 0.52 0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 39.45 2hza h ASP 17 CO -0.32 -0.43 -0.19 -1.28 -1.57 0.00 0.00 179.24 175.45 2hza h SER 18 N -0.97 -0.51 -0.98 6.45 0.87 -0.39 -1.55 113.55 116.47 2hza h SER 18 Ca -0.09 0.06 0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2hza h SER 18 Cb 0.68 0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 62.78 2hza h SER 18 CO 0.14 -0.27 0.64 -0.07 -0.53 0.00 0.00 176.83 176.75 2hza h LEU 19 N -0.37 1.09 -0.27 2.23 3.38 -1.14 -2.47 115.31 117.76 2hza h LEU 19 Ca 0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2hza h LEU 19 Cb 0.38 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2hza h LEU 19 CO -0.09 0.77 0.17 0.28 0.09 0.00 0.00 178.44 179.66 2hza h SER 20 N 1.28 0.31 -0.68 -0.43 0.02 -0.69 -2.37 113.55 110.99 2hza h SER 20 Ca 0.38 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 61.23 2hza h SER 20 Cb -0.06 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 2hza h SER 20 CO -0.10 0.24 0.15 -0.61 -1.14 0.00 0.00 176.83 175.36 2hza h GLN 21 N 0.36 1.11 -0.82 3.45 4.15 -1.01 0.18 115.11 122.52 2hza h GLN 21 Ca 0.10 -0.27 -0.01 0.00 0.77 0.00 0.00 58.65 59.23 2hza h GLN 21 Cb -0.03 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 27.48 2hza h GLN 21 CO -0.02 0.99 0.47 0.00 -1.93 0.00 0.00 178.83 178.34 2hza h ARG 22 N 1.04 1.12 -0.44 1.69 3.08 -1.33 -2.00 114.38 117.53 2hza h ARG 22 Ca 0.21 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2hza h ARG 22 Cb 0.39 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2hza h ARG 22 CO 0.01 0.80 0.00 0.54 -1.07 0.00 0.00 179.97 180.25 2hza n ARG 23 N -4.36 1.83 -0.94 0.04 5.12 -0.90 -4.92 116.66 112.54 2hza n ARG 23 Ca 0.09 -0.98 0.00 0.00 -1.93 0.00 0.00 57.85 55.03 2hza n ARG 23 Cb 0.08 -1.38 0.00 0.00 -1.16 0.00 0.00 32.46 30.00 2hza n ARG 23 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2hza n GLY 24 N 0.69 0.67 3.70 -0.13 0.00 -0.75 -5.03 105.19 104.34 2hza n GLY 24 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2hza n GLY 24 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hza s TYR 25 N -2.58 3.56 -0.67 1.61 1.51 0.59 -4.95 117.35 116.42 2hza s TYR 25 Ca 0.00 1.34 0.23 0.00 -1.01 0.00 0.00 57.07 57.63 2hza s TYR 25 Cb 0.00 -2.91 0.10 0.00 -0.11 0.00 0.00 41.96 39.04 2hza s TYR 25 CO 0.00 -0.00 1.08 0.09 -1.11 0.00 0.00 175.55 175.60 2hza n ASN 26 N 4.12 0.63 -3.91 2.29 3.02 -1.26 -3.82 115.26 116.33 2hza n ASN 26 Ca 0.01 -0.22 -0.10 0.00 -0.03 0.00 0.00 54.58 54.25 2hza n ASN 26 Cb 0.51 0.70 -0.09 0.00 -0.61 0.00 0.00 39.78 40.29 2hza n ASN 26 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2hza s ASN 27 N -3.82 0.15 0.23 6.41 2.20 -1.26 -5.08 114.94 113.76 2hza s ASN 27 Ca 0.05 -0.51 -0.05 0.00 -0.94 0.00 0.00 52.86 51.40 2hza s ASN 27 Cb 0.15 0.24 0.22 0.00 -2.00 0.00 0.00 41.25 39.87 2hza s ASN 27 CO 0.79 -0.53 1.73 0.03 -2.94 0.00 0.00 177.10 176.17 2hza h ARG 28 N 3.56 0.95 -0.63 3.55 3.08 -1.98 -3.17 114.38 119.74 2hza h ARG 28 Ca -0.33 -0.26 -0.03 0.00 0.07 0.00 0.00 59.98 59.44 2hza h ARG 28 Cb 1.19 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 2hza h ARG 28 CO 0.51 0.91 0.27 0.66 -1.07 0.00 0.00 179.97 181.24 2hza h SER 29 N 0.89 0.86 -0.29 7.04 4.64 -1.98 0.88 113.55 125.57 2hza h SER 29 Ca 0.17 -0.16 -0.03 0.00 -0.47 0.00 0.00 61.79 61.31 2hza h SER 29 Cb 0.45 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 2hza h SER 29 CO 0.02 0.78 0.08 -0.08 -0.87 0.00 0.00 176.83 176.76 2hza h GLU 30 N 0.88 0.46 0.05 4.77 4.57 -1.99 0.10 114.58 123.42 2hza h GLU 30 Ca 0.21 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2hza h GLU 30 Cb 0.18 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 2hza h GLU 30 CO -0.02 0.52 -0.06 0.00 -1.18 0.00 0.00 179.01 178.27 2hza h ALA 31 N 0.91 -0.11 -0.69 2.92 0.00 -1.48 -0.75 119.26 120.06 2hza h ALA 31 Ca 0.09 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2hza h ALA 31 Cb 0.26 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2hza h ALA 31 CO -0.00 -0.57 0.33 0.82 0.00 0.00 0.00 179.25 179.82 2hza h ILE 32 N -0.14 1.22 -0.59 0.00 2.04 -0.65 -2.30 117.51 117.10 2hza h ILE 32 Ca 0.01 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 2hza h ILE 32 Cb 0.14 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 2hza h ILE 32 CO -0.03 0.27 0.22 -0.09 0.00 0.00 0.00 178.15 178.52 2hza h ARG 33 N 0.98 0.88 -0.62 2.37 2.43 -0.38 -1.03 114.38 119.02 2hza h ARG 33 Ca 0.24 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 2hza h ARG 33 Cb 0.11 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 2hza h ARG 33 CO -0.03 0.77 0.29 -0.44 -1.51 0.00 0.00 179.97 179.05 2hza h ASP 34 N 0.81 0.81 -0.32 -3.80 3.32 -0.81 -0.24 116.42 116.19 2hza h ASP 34 Ca 0.19 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 2hza h ASP 34 Cb 0.22 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2hza h ASP 34 CO -0.01 0.72 0.17 0.40 -1.72 0.00 0.00 179.24 178.80 2hza h ILE 35 N 0.85 1.14 -0.28 0.35 2.04 -1.27 -1.28 117.51 119.06 2hza h ILE 35 Ca 0.21 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 2hza h ILE 35 Cb 0.13 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 2hza h ILE 35 CO -0.03 0.14 0.15 0.25 0.00 0.00 0.00 178.15 178.67 2hza h LEU 36 N 0.40 0.35 -0.17 1.44 5.85 -0.84 0.08 115.31 122.42 2hza h LEU 36 Ca 0.11 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2hza h LEU 36 Cb 0.08 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2hza h LEU 36 CO -0.02 0.34 0.09 0.03 -0.34 0.00 0.00 178.44 178.55 2hza h ARG 37 N 0.34 0.23 0.21 1.25 3.08 -0.98 0.58 114.38 119.09 2hza h ARG 37 Ca 0.10 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.13 2hza h ARG 37 Cb 0.07 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 2hza h ARG 37 CO -0.02 0.23 -0.30 1.03 -1.07 0.00 0.00 179.97 179.85 2hza h SER 38 N 0.18 -0.83 -0.28 7.04 0.87 -1.06 -0.04 113.55 119.42 2hza h SER 38 Ca 0.06 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2hza h SER 38 Cb 0.06 0.30 -0.01 0.00 -0.44 0.00 0.00 62.40 62.30 2hza h SER 38 CO -0.01 -0.41 0.18 0.00 -0.53 0.00 0.00 176.83 176.07 2hza h ALA 39 N 0.05 0.36 -0.16 6.23 0.00 -0.88 -1.96 119.26 122.91 2hza h ALA 39 Ca 0.01 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2hza h ALA 39 Cb 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2hza h ALA 39 CO -0.12 -0.16 -0.21 -0.07 0.00 0.00 0.00 179.25 178.70 2hza h LEU 40 N 0.38 0.27 -0.45 0.00 3.38 -0.80 -2.23 115.31 115.86 2hza h LEU 40 Ca 0.10 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2hza h LEU 40 Cb -0.02 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2hza h LEU 40 CO -0.02 0.50 0.24 0.00 0.09 0.00 0.00 178.44 179.24 2hza h ALA 41 N 1.53 0.57 -0.27 1.53 0.00 -0.50 -1.79 119.26 120.33 2hza h ALA 41 Ca 0.04 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2hza h ALA 41 Cb 0.52 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2hza h ALA 41 CO 0.03 0.10 0.03 1.96 0.00 0.00 0.00 179.25 181.37 2hza h GLN 42 N 0.58 0.47 -0.40 0.00 4.20 -1.04 -2.66 115.11 116.26 2hza h GLN 42 Ca 0.16 -0.14 0.06 0.00 0.06 0.00 0.00 58.65 58.79 2hza h GLN 42 Cb 0.07 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.74 2hza h GLN 42 CO -0.02 0.60 0.08 0.93 -0.67 0.00 0.00 178.83 179.75 2hza h GLU 43 N 0.27 0.20 0.00 1.46 4.39 -1.27 0.18 114.58 119.81 2hza h GLU 43 Ca 0.08 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 2hza h GLU 43 Cb 0.37 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.98 2hza h GLU 43 CO 0.01 0.13 -0.01 0.00 -1.16 0.00 0.00 179.01 177.98 2hza h ALA 44 N 1.30 1.16 0.00 3.43 0.00 -1.26 0.12 119.26 124.01 2hza h ALA 44 Ca 0.19 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 2hza h ALA 44 Cb 0.23 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2hza h ALA 44 CO -0.25 0.01 -0.34 1.15 0.00 0.00 0.00 179.25 179.83 2hza h THR 45 N 0.00 0.61 -0.92 0.00 2.02 -0.31 -3.32 112.91 110.99 2hza h THR 45 Ca -0.00 -1.75 -0.63 0.00 0.77 0.00 0.00 66.41 64.81 2hza h THR 45 Cb 0.07 2.21 -0.32 0.00 -1.74 0.00 0.00 68.15 68.38 2hza h THR 45 CO 0.00 0.33 0.46 0.00 0.37 0.00 0.00 175.52 176.68 2hza n GLN 46 N -3.22 2.84 -3.91 6.66 6.02 0.42 -4.62 117.38 121.56 2hza n GLN 46 Ca 0.02 -3.47 -0.36 0.00 -0.01 0.00 0.00 57.00 53.18 2hza n GLN 46 Cb 0.63 -2.27 -0.07 0.00 1.02 0.00 0.00 30.24 29.56 2hza n GLN 46 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2hza s GLN 47 N -3.73 3.57 0.76 -1.09 1.11 -1.24 -4.03 119.66 115.01 2hza s GLN 47 Ca 0.61 -0.19 -0.15 0.00 0.01 0.00 0.00 55.36 55.64 2hza s GLN 47 Cb 0.48 -3.19 0.04 0.00 -1.01 0.00 0.00 33.01 29.34 2hza s GLN 47 CO 0.01 0.65 1.14 0.72 0.01 0.00 0.00 175.29 177.82 2hza n HIS 48 N 2.39 1.19 0.00 0.91 8.25 -1.26 -3.43 115.22 123.26 2hza n HIS 48 Ca -0.19 0.40 0.00 0.00 -0.26 0.00 0.00 57.72 57.67 2hza n HIS 48 Cb 0.54 -2.13 0.00 0.00 1.12 0.00 0.00 29.99 29.53 2hza n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hza n GLY 49 N 0.78 1.47 3.28 -1.41 0.00 -1.26 -4.89 105.19 103.16 2hza n GLY 49 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2hza n GLY 49 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2hza s THR 50 N -2.39 1.91 0.50 2.61 2.01 -1.22 -5.13 115.64 113.92 2hza s THR 50 Ca 0.00 -1.09 -0.00 0.00 0.31 0.00 0.00 61.69 60.91 2hza s THR 50 Cb 0.00 -1.60 0.01 0.00 0.01 0.00 0.00 72.50 70.93 2hza s THR 50 CO 0.00 0.48 0.74 -1.10 -0.69 0.00 0.00 174.62 174.05 2hza s GLN 51 N -0.72 2.84 0.00 4.92 1.11 -1.26 -4.39 119.66 122.16 2hza s GLN 51 Ca 0.09 -0.55 0.00 0.00 0.01 0.00 0.00 55.36 54.91 2hza s GLN 51 Cb -0.09 -2.50 0.00 0.00 -1.01 0.00 0.00 33.01 29.41 2hza s GLN 51 CO -0.00 -0.49 0.00 0.41 0.01 0.00 0.00 175.29 175.22 2hza n GLY 52 N -2.24 -1.02 3.68 3.09 0.00 -0.76 0.05 105.19 108.00 2hza n GLY 52 Ca 0.04 -1.17 -0.29 0.00 0.00 0.00 0.00 46.02 44.60 2hza n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hza s PHE 53 N -3.00 2.30 0.10 1.61 0.08 -0.71 -1.78 117.98 116.58 2hza s PHE 53 Ca 0.00 -0.76 -0.23 0.00 0.12 0.00 0.00 56.93 56.06 2hza s PHE 53 Cb 0.00 -1.74 0.06 0.00 -0.57 0.00 0.00 43.02 40.77 2hza s PHE 53 CO 0.00 0.34 0.57 0.00 -0.10 0.00 0.00 175.22 176.04 2hza s ALA 54 N -2.76 -1.49 -0.16 5.36 0.00 0.72 0.60 121.76 124.03 2hza s ALA 54 Ca 0.26 0.58 0.01 0.00 0.00 0.00 0.00 51.96 52.80 2hza s ALA 54 Cb 0.07 0.63 0.02 0.00 0.00 0.00 0.00 23.12 23.84 2hza s ALA 54 CO 0.14 -0.64 -0.18 0.08 0.00 0.00 0.00 175.76 175.15 2hza s VAL 55 N -3.11 1.87 -0.22 0.00 1.01 -0.19 -0.75 120.40 119.01 2hza s VAL 55 Ca -0.02 -0.83 -0.00 0.00 0.00 0.00 0.00 61.98 61.13 2hza s VAL 55 Cb -0.00 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.69 2hza s VAL 55 CO -0.07 0.51 -0.12 -0.22 0.00 0.00 0.00 175.10 175.20 2hza s LEU 56 N 1.32 2.81 0.13 3.92 2.96 0.36 -1.74 118.68 128.44 2hza s LEU 56 Ca 0.04 -0.82 0.11 0.00 -0.22 0.00 0.00 54.13 53.24 2hza s LEU 56 Cb -0.13 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 2hza s LEU 56 CO -0.11 -0.08 -0.26 -0.94 -1.32 0.00 0.00 176.35 173.64 2hza s SER 57 N 1.30 3.19 -0.02 3.68 1.04 -0.76 0.54 113.70 122.67 2hza s SER 57 Ca 0.01 -0.74 -0.29 0.00 0.48 0.00 0.00 55.95 55.41 2hza s SER 57 Cb -0.16 -0.21 0.10 0.00 0.10 0.00 0.00 66.02 65.86 2hza s SER 57 CO -0.08 0.16 0.89 -0.72 0.98 0.00 0.00 173.24 174.47 2hza s TYR 58 N -1.08 -0.36 -0.08 5.02 -0.85 -0.37 -0.90 117.35 118.73 2hza s TYR 58 Ca 0.13 0.27 0.02 0.00 -0.52 0.00 0.00 57.07 56.97 2hza s TYR 58 Cb -0.10 0.53 -0.02 0.00 0.38 0.00 0.00 41.96 42.75 2hza s TYR 58 CO 0.06 -0.53 -0.14 0.08 -1.52 0.00 0.00 175.55 173.49 2hza s VAL 59 N -2.91 3.01 0.05 -3.49 1.01 -0.06 -0.82 120.40 117.18 2hza s VAL 59 Ca 0.04 -0.72 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 2hza s VAL 59 Cb -0.01 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 2hza s VAL 59 CO -0.08 0.56 0.10 -0.72 0.00 0.00 0.00 175.10 174.97 2hza s TYR 60 N -0.28 0.21 -0.38 5.22 1.13 -0.37 -0.43 117.35 122.45 2hza s TYR 60 Ca 0.02 -0.55 -0.20 0.00 -1.41 0.00 0.00 57.07 54.93 2hza s TYR 60 Cb -0.13 -0.15 0.01 0.00 -1.10 0.00 0.00 41.96 40.59 2hza s TYR 60 CO 0.03 -0.39 0.59 -1.83 -2.51 0.00 0.00 175.55 171.43 2hza s GLU 61 N -2.89 3.51 0.50 -3.49 1.03 -1.23 -0.24 118.70 115.89 2hza s GLU 61 Ca -0.03 -0.19 0.18 0.00 0.03 0.00 0.00 54.97 54.97 2hza s GLU 61 Cb 0.00 -3.86 1.24 0.00 -0.80 0.00 0.00 34.13 30.71 2hza s GLU 61 CO -0.06 -0.80 2.09 1.12 -1.33 0.00 0.00 175.26 176.29 2hza h HIS 62 N 8.60 0.00 -0.26 4.83 2.07 -1.91 -2.89 115.15 125.59 2hza h HIS 62 Ca -0.27 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.16 2hza h HIS 62 Cb 1.11 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.09 2hza h HIS 62 CO 0.73 0.08 -0.22 0.93 -3.07 0.00 0.00 177.93 176.38 2hza h GLU 63 N 0.00 0.61 0.00 5.12 3.07 -1.93 -3.31 114.58 118.14 2hza h GLU 63 Ca -0.00 -0.31 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 2hza h GLU 63 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 2hza h GLU 63 CO 0.01 0.90 0.00 1.63 -1.40 0.00 0.00 179.01 180.15 2hza n LYS 64 N -4.36 0.00 -0.10 2.33 5.02 -1.09 -1.97 118.16 117.99 2hza n LYS 64 Ca -0.04 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.26 2hza n LYS 64 Cb 0.42 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.48 2hza n LYS 64 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2hza n ARG 65 N 0.00 1.42 -2.64 1.97 1.85 -1.26 -4.51 116.66 113.49 2hza n ARG 65 Ca 0.00 -0.34 -0.11 0.00 -1.00 0.00 0.00 57.85 56.40 2hza n ARG 65 Cb 0.00 -1.57 0.02 0.00 -1.05 0.00 0.00 32.46 29.85 2hza n ARG 65 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2hza n ASP 66 N 0.06 -3.83 -0.35 2.89 8.00 -0.83 -4.84 116.55 117.65 2hza n ASP 66 Ca 0.03 -0.14 0.25 0.00 0.71 0.00 0.00 54.79 55.64 2hza n ASP 66 Cb 0.35 -2.72 0.53 0.00 -0.02 0.00 0.00 41.12 39.25 2hza n ASP 66 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2hza h LEU 67 N -0.70 0.42 -0.42 0.64 5.85 -1.75 0.11 115.31 119.46 2hza h LEU 67 Ca -0.27 0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.64 2hza h LEU 67 Cb 1.18 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 42.16 2hza h LEU 67 CO 0.28 0.03 -0.22 0.00 -0.34 0.00 0.00 178.44 178.19 2hza h ALA 68 N 1.63 0.07 -0.49 1.25 0.00 -1.85 0.29 119.26 120.17 2hza h ALA 68 Ca 0.64 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.63 2hza h ALA 68 Cb 1.70 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 19.99 2hza h ALA 68 CO -0.34 -0.58 0.03 0.77 0.00 0.00 0.00 179.25 179.13 2hza h SER 69 N -0.14 0.81 -0.46 0.00 0.02 -1.13 -2.67 113.55 109.99 2hza h SER 69 Ca 0.20 -0.29 -0.10 0.00 -0.84 0.00 0.00 61.79 60.76 2hza h SER 69 Cb 0.45 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2hza h SER 69 CO -0.50 0.90 -0.12 0.03 -1.14 0.00 0.00 176.83 175.99 2hza h ARG 70 N 0.70 0.89 -0.75 3.45 3.08 -1.12 0.36 114.38 120.99 2hza h ARG 70 Ca 0.14 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 2hza h ARG 70 Cb 0.47 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.43 2hza h ARG 70 CO 0.02 0.99 0.39 0.82 -1.07 0.00 0.00 179.97 181.12 2hza h ILE 71 N 0.73 1.23 -0.03 2.04 2.04 -0.42 0.12 117.51 123.22 2hza h ILE 71 Ca 0.11 -0.60 -0.15 0.00 1.00 0.00 0.00 64.86 65.22 2hza h ILE 71 Cb 0.67 0.24 0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2hza h ILE 71 CO 0.05 0.26 -0.58 0.58 0.00 0.00 0.00 178.15 178.46 2hza h VAL 72 N 1.05 1.41 -0.58 1.67 2.07 -1.25 -2.28 116.25 118.33 2hza h VAL 72 Ca 0.26 -2.02 0.04 0.00 0.82 0.00 0.00 66.70 65.81 2hza h VAL 72 Cb 0.06 2.50 -0.04 0.00 -1.52 0.00 0.00 31.29 32.28 2hza h VAL 72 CO -0.04 0.59 0.33 0.28 0.02 0.00 0.00 177.57 178.75 2hza h SER 73 N -0.05 0.51 -0.56 0.57 0.02 -0.05 0.15 113.55 114.14 2hza h SER 73 Ca -0.07 0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 60.87 2hza h SER 73 Cb 1.27 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.70 2hza h SER 73 CO 0.12 0.35 0.22 0.74 -1.14 0.00 0.00 176.83 177.12 2hza h THR 74 N 0.64 1.22 -0.73 -2.27 2.02 -0.81 0.48 112.91 113.46 2hza h THR 74 Ca 0.25 -0.69 0.03 0.00 0.77 0.00 0.00 66.41 66.76 2hza h THR 74 Cb 0.10 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.09 2hza h THR 74 CO -0.14 0.27 0.46 1.56 0.37 0.00 0.00 175.52 178.04 2hza h GLN 75 N 0.77 0.89 -0.20 6.66 4.20 -0.76 -1.11 115.11 125.55 2hza h GLN 75 Ca 0.19 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 2hza h GLN 75 Cb 0.20 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2hza h GLN 75 CO -0.02 0.59 -0.19 0.45 -0.67 0.00 0.00 178.83 179.00 2hza h HIS 76 N 0.91 0.38 -0.57 2.96 3.86 -0.49 0.35 115.15 122.55 2hza h HIS 76 Ca 0.29 -0.06 0.10 0.00 -1.16 0.00 0.00 60.37 59.54 2hza h HIS 76 Cb -0.00 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.33 2hza h HIS 76 CO -0.04 0.52 0.39 0.45 0.86 0.00 0.00 177.93 180.11 2hza h HIS 77 N 0.32 0.37 -0.14 2.45 3.86 0.40 -2.29 115.15 120.12 2hza h HIS 77 Ca 0.06 0.01 -0.12 0.00 -1.16 0.00 0.00 60.37 59.16 2hza h HIS 77 Cb 0.52 -0.12 -0.13 0.00 1.06 0.00 0.00 27.41 28.74 2hza h HIS 77 CO 0.01 0.18 -0.63 0.72 0.86 0.00 0.00 177.93 179.07 2hza n HIS 78 N -4.46 0.51 0.00 2.45 8.25 -0.87 -4.88 115.22 116.22 2hza n HIS 78 Ca 0.09 -1.54 0.00 0.00 -0.26 0.00 0.00 57.72 56.02 2hza n HIS 78 Cb 0.39 -0.25 0.00 0.00 1.12 0.00 0.00 29.99 31.25 2hza n HIS 78 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2hza n HIS 79 N -0.87 0.00 0.21 4.41 -0.00 0.06 0.56 115.22 119.60 2hza n HIS 79 Ca 0.22 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 58.05 2hza n HIS 79 Cb 0.79 -0.20 0.22 0.00 -0.00 0.00 0.00 29.99 30.80 2hza n HIS 79 CO 0.00 0.00 0.00 0.38 -0.00 0.00 0.00 176.34 176.72 2hza h ASP 80 N 0.00 0.00 0.75 4.39 2.03 -1.87 -3.07 116.42 118.66 2hza h ASP 80 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2hza h ASP 80 Cb 0.24 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.74 2hza h ASP 80 CO 0.00 0.09 -0.73 0.18 -1.03 0.00 0.00 179.24 177.75 2hza n LEU 81 N -3.13 0.67 -4.76 0.15 4.77 0.19 -4.84 117.00 110.06 2hza n LEU 81 Ca 0.03 0.17 -0.37 0.00 -0.03 0.00 0.00 56.01 55.81 2hza n LEU 81 Cb 0.53 -0.16 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 2hza n LEU 81 CO 0.34 -0.03 0.01 -0.55 -1.33 0.00 0.00 177.39 175.83 2hza s SER 82 N -4.15 6.51 -0.10 -1.43 0.15 -1.16 -1.01 113.70 112.51 2hza s SER 82 Ca 0.06 0.60 -0.08 0.00 0.70 0.00 0.00 55.95 57.23 2hza s SER 82 Cb 0.14 -2.19 -0.03 0.00 -1.71 0.00 0.00 66.02 62.23 2hza s SER 82 CO 0.74 0.15 -0.15 0.52 1.20 0.00 0.00 173.24 175.70 2hza n VAL 83 N 3.16 0.88 -3.49 4.45 0.31 -0.34 -4.92 118.33 118.38 2hza n VAL 83 Ca -0.13 0.31 -0.09 0.00 -0.01 0.00 0.00 64.34 64.43 2hza n VAL 83 Cb 0.52 -2.03 -0.02 0.00 -0.91 0.00 0.00 33.84 31.40 2hza n VAL 83 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hza s ALA 84 N -2.88 -1.80 -0.10 3.52 0.00 -1.23 -5.03 121.76 114.24 2hza s ALA 84 Ca -0.13 0.96 0.02 0.00 0.00 0.00 0.00 51.96 52.81 2hza s ALA 84 Cb 0.02 0.45 0.02 0.00 0.00 0.00 0.00 23.12 23.60 2hza s ALA 84 CO 0.19 -0.69 -0.14 0.99 0.00 0.00 0.00 175.76 176.11 2hza s THR 85 N -3.16 1.40 -0.09 0.00 2.01 -1.26 -1.24 115.64 113.30 2hza s THR 85 Ca 0.04 -0.59 -0.15 0.00 0.31 0.00 0.00 61.69 61.30 2hza s THR 85 Cb -0.01 -1.29 -0.05 0.00 0.01 0.00 0.00 72.50 71.16 2hza s THR 85 CO -0.09 0.42 0.38 -0.22 -0.69 0.00 0.00 174.62 174.42 2hza s LEU 86 N 0.99 4.34 -0.07 4.42 2.96 -0.21 -4.94 118.68 126.16 2hza s LEU 86 Ca -0.07 0.75 0.03 0.00 -0.22 0.00 0.00 54.13 54.62 2hza s LEU 86 Cb -0.15 -2.53 0.01 0.00 0.50 0.00 0.00 46.19 44.02 2hza s LEU 86 CO -0.01 0.16 -0.14 -2.28 -1.32 0.00 0.00 176.35 172.75 2hza s HIS 87 N -0.05 1.65 -0.14 5.38 5.65 -1.26 -0.90 115.29 125.61 2hza s HIS 87 Ca 0.22 -0.62 0.01 0.00 0.25 0.00 0.00 55.06 54.91 2hza s HIS 87 Cb -0.15 -1.18 0.02 0.00 -1.18 0.00 0.00 32.58 30.09 2hza s HIS 87 CO 0.09 -0.30 -0.15 0.08 -0.65 0.00 0.00 174.74 173.81 2hza s VAL 88 N 0.59 1.61 -0.89 0.89 1.01 0.46 -4.98 120.40 119.08 2hza s VAL 88 Ca -0.15 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 60.91 2hza s VAL 88 Cb -0.16 -1.49 0.03 0.00 0.00 0.00 0.00 36.38 34.76 2hza s VAL 88 CO 0.05 0.46 1.44 -1.00 0.00 0.00 0.00 175.10 176.06 2hza s HIS 89 N 1.35 2.34 0.12 5.22 3.76 -1.26 -0.67 115.29 126.15 2hza s HIS 89 Ca 0.02 -0.36 -0.24 0.00 -0.15 0.00 0.00 55.06 54.33 2hza s HIS 89 Cb -0.13 -4.60 -0.05 0.00 1.11 0.00 0.00 32.58 28.91 2hza s HIS 89 CO -0.09 -2.00 1.67 0.82 -0.85 0.00 0.00 174.74 174.29 2hza h ILE 90 N 6.56 0.58 -1.56 0.60 2.04 -1.71 -3.47 117.51 120.55 2hza h ILE 90 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2hza h ILE 90 Cb 1.03 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2hza h ILE 90 CO 1.35 0.00 0.00 -0.46 0.00 0.00 0.00 178.15 179.04 2hza n ASN 91 N -5.30 0.00 0.23 1.72 0.23 -1.21 -5.00 115.26 105.93 2hza n ASN 91 Ca -0.05 -0.56 0.07 0.00 -0.53 0.00 0.00 54.58 53.52 2hza n ASN 91 Cb 0.22 0.00 0.61 0.00 -2.08 0.00 0.00 39.78 38.53 2hza n ASN 91 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 2hza h HIS 92 N 0.56 0.06 0.00 -2.53 3.86 -2.04 -3.33 115.15 111.73 2hza h HIS 92 Ca 0.00 0.00 -0.31 0.00 -1.16 0.00 0.00 60.37 58.90 2hza h HIS 92 Cb 0.00 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.40 2hza h HIS 92 CO 0.00 0.04 -2.16 -0.25 0.86 0.00 0.00 177.93 176.42 2hza n ASP 93 N -4.52 2.31 -4.85 2.45 8.00 -1.26 -5.00 116.55 113.68 2hza n ASP 93 Ca -0.02 -0.10 -0.31 0.00 0.71 0.00 0.00 54.79 55.06 2hza n ASP 93 Cb 0.09 -0.24 -0.05 0.00 -0.02 0.00 0.00 41.12 40.90 2hza n ASP 93 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2hza s ASP 94 N -5.92 5.95 -0.09 -2.24 1.01 -1.25 -3.05 116.67 111.09 2hza s ASP 94 Ca -0.26 0.15 0.03 0.00 0.71 0.00 0.00 52.55 53.18 2hza s ASP 94 Cb 0.07 -1.74 0.00 0.00 1.01 0.00 0.00 42.92 42.27 2hza s ASP 94 CO 0.49 0.19 -0.20 0.00 0.21 0.00 0.00 175.17 175.85 2hza s LEU 96 N 0.44 4.10 0.01 0.00 2.96 0.15 -1.23 118.68 125.10 2hza s LEU 96 Ca -0.18 0.28 0.07 0.00 -0.22 0.00 0.00 54.13 54.09 2hza s LEU 96 Cb -0.17 -2.33 -0.02 0.00 0.50 0.00 0.00 46.19 44.17 2hza s LEU 96 CO 0.07 -0.06 -0.23 -1.61 -1.32 0.00 0.00 176.35 173.21 2hza s GLU 97 N 1.49 1.72 -0.21 1.98 2.02 0.00 -0.40 118.70 125.29 2hza s GLU 97 Ca 0.13 -0.88 -0.02 0.00 0.02 0.00 0.00 54.97 54.22 2hza s GLU 97 Cb -0.15 -1.74 0.06 0.00 0.10 0.00 0.00 34.13 32.41 2hza s GLU 97 CO 0.08 0.47 0.02 0.42 0.02 0.00 0.00 175.26 176.26 2hza s ILE 98 N -0.63 0.80 -0.18 -1.63 1.01 -0.07 -1.23 121.20 119.26 2hza s ILE 98 Ca 0.09 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 59.87 2hza s ILE 98 Cb -0.09 -1.27 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 2hza s ILE 98 CO 0.00 -0.22 0.06 0.00 0.00 0.00 0.00 174.94 174.78 2hza s ALA 99 N 1.72 3.38 -0.22 9.38 0.00 0.19 -1.04 121.76 135.17 2hza s ALA 99 Ca -0.01 -0.77 -0.11 0.00 0.00 0.00 0.00 51.96 51.07 2hza s ALA 99 Cb -0.18 -1.92 -0.05 0.00 0.00 0.00 0.00 23.12 20.98 2hza s ALA 99 CO -0.09 0.14 0.20 0.08 0.00 0.00 0.00 175.76 176.09 2hza s VAL 100 N 0.43 5.34 0.27 0.00 1.01 -0.37 -0.48 120.40 126.60 2hza s VAL 100 Ca 0.03 0.29 0.11 0.00 0.00 0.00 0.00 61.98 62.41 2hza s VAL 100 Cb -0.13 -3.54 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 2hza s VAL 100 CO 0.01 0.35 -0.19 -0.76 0.00 0.00 0.00 175.10 174.51 2hza s LEU 101 N 0.91 2.59 0.07 3.92 1.43 0.07 -1.20 118.68 126.47 2hza s LEU 101 Ca 0.10 -1.03 -0.08 0.00 -1.03 0.00 0.00 54.13 52.09 2hza s LEU 101 Cb -0.13 -1.05 -0.00 0.00 0.03 0.00 0.00 46.19 45.04 2hza s LEU 101 CO 0.04 0.02 0.17 -1.59 0.23 0.00 0.00 176.35 175.22 2hza s LYS 102 N -3.53 0.78 0.00 1.70 -2.85 -0.18 -0.20 119.74 115.46 2hza s LYS 102 Ca 0.29 -0.87 0.00 0.00 -1.00 0.00 0.00 55.97 54.39 2hza s LYS 102 Cb -0.04 0.31 0.00 0.00 -2.06 0.00 0.00 37.83 36.04 2hza s LYS 102 CO 0.14 -0.23 0.00 0.41 0.10 0.00 0.00 175.35 175.77 2hza n GLY 103 N 0.20 0.41 0.00 0.59 0.00 -0.73 -4.40 105.19 101.25 2hza n GLY 103 Ca -0.16 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.04 2hza n GLY 103 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2hza n ASP 104 N 0.00 0.00 0.00 1.61 -0.08 -1.26 -1.82 116.55 115.00 2hza n ASP 104 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2hza n ASP 104 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2hza n ASP 104 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2hza n GLY 106 N 5.00 0.00 0.17 0.27 0.00 -1.24 -0.89 105.19 108.49 2hza n GLY 106 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2hza n GLY 106 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2hza h ASP 107 N 0.00 0.47 -0.47 1.61 3.32 -1.93 -0.71 116.42 118.71 2hza h ASP 107 Ca 0.00 -0.23 0.06 0.00 0.02 0.00 0.00 57.03 56.88 2hza h ASP 107 Cb 0.00 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.37 2hza h ASP 107 CO 0.00 0.58 0.16 0.58 -1.72 0.00 0.00 179.24 178.84 2hza h VAL 108 N 0.34 0.84 -0.13 -1.35 2.07 -1.39 0.82 116.25 117.45 2hza h VAL 108 Ca 0.10 -0.11 0.03 0.00 0.82 0.00 0.00 66.70 67.53 2hza h VAL 108 Cb 0.30 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 2hza h VAL 108 CO 0.00 0.06 -0.06 -0.61 0.02 0.00 0.00 177.57 176.98 2hza h GLN 109 N 0.33 -0.05 -0.79 1.57 -0.00 -1.71 0.84 115.11 115.30 2hza h GLN 109 Ca 0.22 0.00 0.01 0.00 -0.00 0.00 0.00 58.65 58.88 2hza h GLN 109 Cb 0.23 0.01 -0.04 0.00 0.00 0.00 0.00 27.48 27.69 2hza h GLN 109 CO -0.23 -0.03 0.52 0.45 0.00 0.00 0.00 178.83 179.53 2hza h HIS 110 N -0.05 1.00 -0.14 3.99 3.86 -0.48 -2.18 115.15 121.16 2hza h HIS 110 Ca 0.07 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.29 2hza h HIS 110 Cb 0.16 -0.34 -0.01 0.00 1.06 0.00 0.00 27.41 28.29 2hza h HIS 110 CO -0.20 0.64 0.03 0.35 0.86 0.00 0.00 177.93 179.62 2hza h PHE 111 N 1.08 0.24 -0.43 2.45 3.04 -0.02 -2.52 116.94 120.78 2hza h PHE 111 Ca 0.29 -0.03 0.08 0.00 3.98 0.00 0.00 57.97 62.30 2hza h PHE 111 Cb -0.12 -0.07 -0.08 0.00 2.56 0.00 0.00 35.95 38.25 2hza h PHE 111 CO 0.00 0.38 -0.06 0.00 -2.02 0.00 0.00 178.31 176.61 2hza h ALA 112 N 0.83 0.33 -0.79 2.41 0.00 -0.35 -1.37 119.26 120.31 2hza h ALA 112 Ca 0.04 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2hza h ALA 112 Cb 0.26 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.28 2hza h ALA 112 CO 0.00 -0.43 0.51 -0.44 0.00 0.00 0.00 179.25 178.89 2hza h ASP 113 N 0.04 0.83 -0.32 0.00 3.45 -1.37 0.55 116.42 119.61 2hza h ASP 113 Ca 0.21 -0.00 0.04 0.00 0.43 0.00 0.00 57.03 57.71 2hza h ASP 113 Cb 0.31 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 38.89 2hza h ASP 113 CO -0.41 0.57 0.22 0.44 -1.57 0.00 0.00 179.24 178.49 2hza h ASP 114 N 0.98 0.21 0.00 6.45 3.32 -0.82 0.54 116.42 127.10 2hza h ASP 114 Ca 0.32 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.31 2hza h ASP 114 Cb 0.02 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2hza h ASP 114 CO -0.12 0.14 -0.33 0.58 -1.72 0.00 0.00 179.24 177.80 2hza h VAL 115 N 0.24 1.37 0.00 -1.35 2.07 -0.32 -3.32 116.25 114.95 2hza h VAL 115 Ca 0.14 -2.15 -0.01 0.00 0.82 0.00 0.00 66.70 65.50 2hza h VAL 115 Cb 0.24 2.71 -0.00 0.00 -1.52 0.00 0.00 31.29 32.72 2hza h VAL 115 CO -0.03 0.47 -0.05 0.40 0.02 0.00 0.00 177.57 178.38 2hza h ILE 116 N -1.00 0.80 0.31 4.57 2.04 0.20 -3.07 117.51 121.35 2hza h ILE 116 Ca -0.09 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 2hza h ILE 116 Cb 0.98 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2hza h ILE 116 CO -0.05 0.05 -0.15 0.00 0.00 0.00 0.00 178.15 178.00 2hza h ALA 117 N 1.95 -0.41 -0.85 1.87 0.00 -1.03 -3.46 119.26 117.33 2hza h ALA 117 Ca -0.00 -0.17 -0.30 0.00 0.00 0.00 0.00 54.91 54.43 2hza h ALA 117 Cb 0.10 0.16 0.08 0.00 0.00 0.00 0.00 17.79 18.13 2hza h ALA 117 CO 0.01 -0.59 -0.48 1.04 0.00 0.00 0.00 179.25 179.22 2hza n GLN 118 N -5.15 0.00 -2.72 0.00 6.02 -1.16 -4.87 117.38 109.50 2hza n GLN 118 Ca -0.10 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.55 2hza n GLN 118 Cb 0.25 -0.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.96 2hza n GLN 118 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2hza s ARG 119 N -0.49 4.18 0.00 -1.09 1.04 -1.26 -3.42 118.95 117.90 2hza s ARG 119 Ca 0.29 1.26 0.00 0.00 -1.04 0.00 0.00 55.73 56.24 2hza s ARG 119 Cb -0.30 -2.30 0.00 0.00 -2.04 0.00 0.00 34.95 30.31 2hza s ARG 119 CO 0.31 -0.09 0.00 0.41 -0.04 0.00 0.00 175.30 175.89 2hza n GLY 120 N -0.25 3.19 3.55 3.88 0.00 -1.26 -4.89 105.19 109.41 2hza n GLY 120 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2hza n GLY 120 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hza s VAL 121 N -2.40 4.98 0.37 1.61 1.01 -1.22 -3.48 120.40 121.27 2hza s VAL 121 Ca 0.00 0.34 0.07 0.00 0.00 0.00 0.00 61.98 62.40 2hza s VAL 121 Cb 0.00 -4.01 -0.07 0.00 0.00 0.00 0.00 36.38 32.30 2hza s VAL 121 CO 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 175.10 174.81 2hza s ARG 122 N 2.48 1.86 -2.04 2.72 1.70 0.42 -4.76 118.95 121.33 2hza s ARG 122 Ca 0.20 -2.02 0.00 0.00 -0.47 0.00 0.00 55.73 53.44 2hza s ARG 122 Cb -0.15 -1.53 0.00 0.00 -0.57 0.00 0.00 34.95 32.70 2hza s ARG 122 CO 0.14 -0.01 0.00 0.72 -1.08 0.00 0.00 175.30 175.07 2hza n HIS 123 N -0.86 -0.01 -1.73 5.89 8.25 -1.26 -0.89 115.22 124.62 2hza n HIS 123 Ca -0.05 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.02 2hza n HIS 123 Cb 0.66 -3.25 0.04 0.00 1.12 0.00 0.00 29.99 28.55 2hza n HIS 123 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hza n GLY 124 N -0.61 0.65 3.63 -1.41 0.00 -1.26 -4.52 105.19 101.68 2hza n GLY 124 Ca -0.19 0.06 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 2hza n GLY 124 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2hza s HIS 125 N -1.28 -1.01 -0.04 1.61 5.04 -0.08 -4.98 115.29 114.56 2hza s HIS 125 Ca 0.69 2.08 0.04 0.00 -1.54 0.00 0.00 55.06 56.33 2hza s HIS 125 Cb -0.44 0.56 -0.03 0.00 0.04 0.00 0.00 32.58 32.71 2hza s HIS 125 CO 0.51 -0.50 -0.13 -1.17 -2.34 0.00 0.00 174.74 171.11 2hza s LEU 126 N 1.38 2.80 -0.23 8.88 2.96 -1.26 -1.84 118.68 131.38 2hza s LEU 126 Ca -0.08 -0.20 -0.03 0.00 -0.22 0.00 0.00 54.13 53.60 2hza s LEU 126 Cb -0.05 -1.59 0.07 0.00 0.50 0.00 0.00 46.19 45.13 2hza s LEU 126 CO -0.16 0.33 0.08 -1.58 -1.32 0.00 0.00 176.35 173.71 2hza s GLN 127 N -0.87 0.41 -0.01 1.98 0.74 -0.71 -5.00 119.66 116.21 2hza s GLN 127 Ca 0.12 -0.46 -0.20 0.00 0.05 0.00 0.00 55.36 54.87 2hza s GLN 127 Cb -0.11 -1.82 -0.05 0.00 1.10 0.00 0.00 33.01 32.13 2hza s GLN 127 CO 0.02 -0.78 0.59 0.00 -0.55 0.00 0.00 175.29 174.56 2hza s LEU 129 N -0.16 4.76 0.40 0.00 1.43 0.20 -4.93 118.68 120.37 2hza s LEU 129 Ca 0.31 -3.81 -0.26 0.00 -1.03 0.00 0.00 54.13 49.34 2hza s LEU 129 Cb -0.18 -1.62 -0.10 0.00 0.03 0.00 0.00 46.19 44.31 2hza s LEU 129 CO 0.17 -0.09 1.32 -2.65 0.23 0.00 0.00 176.35 175.32 2hza n PRO 130 N 2.04 2.10 0.00 1.29 -0.02 -1.26 -1.74 135.00 137.40 2hza n PRO 130 Ca 0.19 0.74 0.07 0.00 -2.02 0.00 0.00 63.50 62.48 2hza n PRO 130 Cb 0.35 -2.43 0.40 0.00 -0.02 0.00 0.00 33.50 31.80 2hza n PRO 130 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84