#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hmk s ASN 4 N 0.00 6.26 0.00 4.38 3.84 -1.26 -4.93 114.94 123.23 2hmk s ASN 4 Ca 0.00 -0.73 0.25 0.00 0.21 0.00 0.00 52.86 52.59 2hmk s ASN 4 Cb 0.00 -2.32 1.15 0.00 -0.55 0.00 0.00 41.25 39.53 2hmk s ASN 4 CO 0.00 -0.94 1.83 2.30 -2.79 0.00 0.00 177.10 177.50 2hmk n ILE 5 N 5.76 0.23 0.09 -5.21 -5.35 -1.26 -0.51 119.36 113.11 2hmk n ILE 5 Ca -0.04 0.06 -0.06 0.00 -0.27 0.00 0.00 62.75 62.44 2hmk n ILE 5 Cb 0.46 -0.62 0.04 0.00 -1.74 0.00 0.00 39.64 37.77 2hmk n ILE 5 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2hmk h GLN 6 N 0.00 0.11 0.04 6.28 4.20 -1.93 -3.35 115.11 120.46 2hmk h GLN 6 Ca 0.00 -0.11 -0.21 0.00 0.06 0.00 0.00 58.65 58.38 2hmk h GLN 6 Cb 0.38 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 2hmk h GLN 6 CO 0.00 0.85 -1.15 0.93 -0.67 0.00 0.00 178.83 178.79 2hmk h GLU 7 N 0.07 0.08 -5.21 1.46 5.08 -1.83 -3.41 114.58 110.82 2hmk h GLU 7 Ca -0.02 -0.14 -0.70 0.00 -1.00 0.00 0.00 59.36 57.49 2hmk h GLU 7 Cb 1.39 0.05 -0.14 0.00 0.50 0.00 0.00 28.75 30.55 2hmk h GLU 7 CO 0.11 1.07 1.49 -0.51 -1.00 0.00 0.00 179.01 180.17 2hmk s ASP 8 N -6.81 6.88 0.57 1.42 -0.00 0.33 -4.84 116.67 114.22 2hmk s ASP 8 Ca -0.24 -2.54 0.34 0.00 -0.00 0.00 0.00 52.55 50.10 2hmk s ASP 8 Cb 0.04 -2.46 1.71 0.00 -0.00 0.00 0.00 42.92 42.21 2hmk s ASP 8 CO 0.67 -0.98 2.14 0.11 -0.00 0.00 0.00 175.17 177.10 2hmk h LYS 9 N 7.82 0.00 -0.01 8.23 1.57 -1.80 -2.29 116.57 130.09 2hmk h LYS 9 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 2hmk h LYS 9 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 2hmk h LYS 9 CO 1.29 0.06 -0.22 1.28 -0.57 0.00 0.00 179.45 181.29 2hmk n LEU 10 N -3.36 0.87 -4.75 2.94 4.77 -1.26 -4.91 117.00 111.30 2hmk n LEU 10 Ca -0.02 -0.18 -0.37 0.00 -0.03 0.00 0.00 56.01 55.41 2hmk n LEU 10 Cb 0.20 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.09 2hmk n LEU 10 CO 0.27 0.16 0.08 -0.69 -1.33 0.00 0.00 177.39 175.87 2hmk s VAL 11 N -2.51 5.21 0.46 4.08 1.01 -0.86 -5.07 120.40 122.72 2hmk s VAL 11 Ca 0.25 0.75 -0.16 0.00 0.00 0.00 0.00 61.98 62.82 2hmk s VAL 11 Cb 0.19 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.78 2hmk s VAL 11 CO 0.51 0.41 0.91 -0.94 0.00 0.00 0.00 175.10 175.99 2hmk s SER 12 N 0.19 6.68 0.23 3.32 1.04 -1.26 -4.87 113.70 119.02 2hmk s SER 12 Ca 0.21 1.48 -0.06 0.00 0.48 0.00 0.00 55.95 58.06 2hmk s SER 12 Cb -0.14 -2.46 0.33 0.00 0.10 0.00 0.00 66.02 63.84 2hmk s SER 12 CO 0.08 -0.47 1.82 0.00 0.98 0.00 0.00 173.24 175.65 2hmk h ALA 13 N 1.31 1.08 -0.17 5.32 0.00 -1.98 -1.67 119.26 123.15 2hmk h ALA 13 Ca -0.47 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.47 2hmk h ALA 13 Cb 1.18 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2hmk h ALA 13 CO 0.62 0.11 0.06 1.25 0.00 0.00 0.00 179.25 181.29 2hmk h HIS 14 N 0.78 0.10 -0.67 0.00 -0.00 -2.00 -1.60 115.15 111.76 2hmk h HIS 14 Ca 0.36 0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.71 2hmk h HIS 14 Cb 0.27 -0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.62 2hmk h HIS 14 CO -0.06 0.05 0.31 -0.44 -0.00 0.00 0.00 177.93 177.79 2hmk h ASP 15 N 0.14 0.86 -0.44 3.26 3.45 -1.84 -1.89 116.42 119.96 2hmk h ASP 15 Ca 0.07 -0.10 -0.08 0.00 0.43 0.00 0.00 57.03 57.36 2hmk h ASP 15 Cb 0.04 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.57 2hmk h ASP 15 CO -0.08 0.74 -0.01 0.00 -1.57 0.00 0.00 179.24 178.33 2hmk h ALA 16 N 1.39 1.04 -0.48 3.45 0.00 -1.00 -2.35 119.26 121.31 2hmk h ALA 16 Ca 0.23 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 2hmk h ALA 16 Cb 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2hmk h ALA 16 CO -0.03 0.60 0.10 0.93 0.00 0.00 0.00 179.25 180.85 2hmk h GLU 17 N 0.79 0.79 -0.29 0.00 5.08 -0.80 -2.73 114.58 117.42 2hmk h GLU 17 Ca 0.15 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.21 2hmk h GLU 17 Cb 0.49 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2hmk h GLU 17 CO 0.02 0.78 -0.26 0.93 -1.00 0.00 0.00 179.01 179.48 2hmk h GLU 18 N 0.67 0.56 -0.13 2.33 4.39 -1.18 -2.81 114.58 118.40 2hmk h GLU 18 Ca 0.15 -0.22 -0.16 0.00 0.34 0.00 0.00 59.36 59.47 2hmk h GLU 18 Cb 0.35 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2hmk h GLU 18 CO 0.00 0.77 -0.59 0.97 -1.16 0.00 0.00 179.01 179.00 2hmk h ILE 19 N 0.49 1.35 -0.60 3.13 2.10 -1.37 -2.75 117.51 119.86 2hmk h ILE 19 Ca 0.07 -1.90 0.12 0.00 1.08 0.00 0.00 64.86 64.23 2hmk h ILE 19 Cb 0.71 1.89 -0.03 0.00 -1.09 0.00 0.00 36.82 38.30 2hmk h ILE 19 CO 0.05 0.58 0.41 0.25 -1.08 0.00 0.00 178.15 178.36 2hmk h LEU 20 N 0.33 0.28 -1.65 2.19 5.85 -1.23 -2.09 115.31 119.00 2hmk h LEU 20 Ca -0.00 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2hmk h LEU 20 Cb 1.13 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 2hmk h LEU 20 CO 0.10 0.16 0.09 -0.09 -0.34 0.00 0.00 178.44 178.37 2hmk h ARG 21 N 0.31 0.32 0.00 1.25 2.43 -1.37 -3.27 114.38 114.05 2hmk h ARG 21 Ca 0.28 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 2hmk h ARG 21 Cb 0.69 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 2hmk h ARG 21 CO -0.07 0.27 -1.78 1.19 -1.51 0.00 0.00 179.97 178.07 2hmk n PHE 22 N -4.44 0.00 0.18 2.20 3.01 -0.81 -4.41 117.46 113.18 2hmk n PHE 22 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 57.45 58.52 2hmk n PHE 22 Cb 0.12 -0.41 0.24 0.00 -0.01 0.00 0.00 39.48 39.43 2hmk n PHE 22 CO 0.00 0.00 0.00 0.74 1.01 0.00 0.00 176.76 178.51 2hmk h PHE 23 N 0.00 0.00 0.30 1.38 -1.00 -1.54 -3.42 116.94 112.66 2hmk h PHE 23 Ca -0.03 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 2hmk h PHE 23 Cb 0.84 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.40 2hmk h PHE 23 CO 0.00 0.39 -0.15 -0.91 -1.61 0.00 0.00 178.31 176.03 2hmk h ASN 24 N 0.00 -0.34 -3.55 2.17 2.35 -1.77 -3.44 115.58 111.00 2hmk h ASN 24 Ca -0.00 0.01 -0.70 0.00 -0.55 0.00 0.00 56.30 55.05 2hmk h ASN 24 Cb 1.05 0.09 -0.30 0.00 0.05 0.00 0.00 38.32 39.21 2hmk h ASN 24 CO 0.05 0.03 -0.54 0.00 -1.65 0.00 0.00 177.43 175.32 2hmk s HIS 26 N 1.35 3.26 -0.36 0.00 2.46 -1.26 -4.91 115.29 115.82 2hmk s HIS 26 Ca 0.02 0.79 -0.02 0.00 0.47 0.00 0.00 55.06 56.32 2hmk s HIS 26 Cb -0.22 -2.92 0.08 0.00 -0.13 0.00 0.00 32.58 29.39 2hmk s HIS 26 CO 0.01 -0.39 0.12 0.34 -2.47 0.00 0.00 174.74 172.35 2hmk s ASP 27 N 1.51 5.10 0.28 9.88 -1.08 -1.26 -4.99 116.67 126.11 2hmk s ASP 27 Ca 0.27 -1.70 -0.02 0.00 -0.52 0.00 0.00 52.55 50.58 2hmk s ASP 27 Cb -0.15 -1.78 0.42 0.00 -1.46 0.00 0.00 42.92 39.95 2hmk s ASP 27 CO 0.09 -0.42 1.91 -1.28 0.52 0.00 0.00 175.17 176.00 2hmk h SER 28 N 8.02 1.01 -0.15 -0.34 0.87 -1.97 -2.28 113.55 118.72 2hmk h SER 28 Ca -0.16 -0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.30 2hmk h SER 28 Cb 1.05 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 2hmk h SER 28 CO 0.62 0.68 -0.22 0.00 -0.53 0.00 0.00 176.83 177.38 2hmk h ALA 29 N 1.46 1.04 -0.50 6.23 0.00 -2.00 -2.44 119.26 123.05 2hmk h ALA 29 Ca 0.39 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2hmk h ALA 29 Cb 0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2hmk h ALA 29 CO -0.13 0.58 -0.03 1.25 0.00 0.00 0.00 179.25 180.92 2hmk h LEU 30 N 0.52 0.83 -0.83 0.00 5.85 -1.82 -0.97 115.31 118.89 2hmk h LEU 30 Ca 0.08 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.52 2hmk h LEU 30 Cb 0.66 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 2hmk h LEU 30 CO 0.05 0.91 0.21 -0.61 -0.34 0.00 0.00 178.44 178.65 2hmk h GLN 31 N 0.79 1.08 -0.26 1.25 -0.00 -1.02 -0.32 115.11 116.63 2hmk h GLN 31 Ca 0.15 -0.23 -0.05 0.00 -0.00 0.00 0.00 58.65 58.51 2hmk h GLN 31 Cb 0.51 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.82 2hmk h GLN 31 CO 0.03 0.93 -0.04 1.96 0.00 0.00 0.00 178.83 181.70 2hmk h GLN 32 N 1.04 0.49 -0.30 1.69 7.50 -1.16 -0.70 115.11 123.66 2hmk h GLN 32 Ca 0.23 -0.18 0.05 0.00 0.50 0.00 0.00 58.65 59.25 2hmk h GLN 32 Cb 0.30 -0.03 -0.05 0.00 0.05 0.00 0.00 27.48 27.75 2hmk h GLN 32 CO -0.01 0.69 0.01 1.49 -1.50 0.00 0.00 178.83 179.51 2hmk h GLU 33 N 0.25 0.09 -0.72 1.46 4.81 -0.99 -1.23 114.58 118.25 2hmk h GLU 33 Ca 0.07 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 2hmk h GLU 33 Cb 0.49 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.80 2hmk h GLU 33 CO 0.02 0.06 0.44 0.00 -0.73 0.00 0.00 179.01 178.81 2hmk h ALA 34 N 1.26 0.95 -0.40 2.92 0.00 -0.95 -0.98 119.26 122.07 2hmk h ALA 34 Ca 0.14 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2hmk h ALA 34 Cb 0.19 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2hmk h ALA 34 CO -0.24 0.20 0.23 1.15 0.00 0.00 0.00 179.25 180.60 2hmk h THR 35 N 0.85 1.13 -0.19 0.00 2.02 -0.60 -1.34 112.91 114.78 2hmk h THR 35 Ca 0.30 -0.32 0.01 0.00 0.77 0.00 0.00 66.41 67.17 2hmk h THR 35 Cb 0.07 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 2hmk h THR 35 CO -0.13 0.14 0.10 0.74 0.37 0.00 0.00 175.52 176.73 2hmk h THR 36 N 0.52 1.01 -0.41 3.16 2.02 -0.86 -0.21 112.91 118.14 2hmk h THR 36 Ca 0.14 -0.07 0.06 0.00 0.77 0.00 0.00 66.41 67.31 2hmk h THR 36 Cb 0.01 0.78 -0.05 0.00 -1.74 0.00 0.00 68.15 67.15 2hmk h THR 36 CO -0.03 0.04 0.11 -0.07 0.37 0.00 0.00 175.52 175.94 2hmk h LEU 37 N 0.21 0.08 -0.37 2.58 3.38 -0.96 -0.08 115.31 120.14 2hmk h LEU 37 Ca 0.07 0.06 -0.19 0.00 0.09 0.00 0.00 57.88 57.92 2hmk h LEU 37 Cb 0.01 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2hmk h LEU 37 CO -0.04 0.08 -0.73 -0.07 0.09 0.00 0.00 178.44 177.76 2hmk h LEU 38 N 0.26 0.55 -0.50 1.67 3.38 -1.07 -1.14 115.31 118.46 2hmk h LEU 38 Ca 0.20 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 2hmk h LEU 38 Cb 0.22 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 2hmk h LEU 38 CO -0.23 1.10 0.04 0.74 0.09 0.00 0.00 178.44 180.18 2hmk h THR 39 N 0.31 1.26 -0.50 0.22 2.02 -0.74 -1.01 112.91 114.48 2hmk h THR 39 Ca -0.03 -1.01 -0.11 0.00 0.77 0.00 0.00 66.41 66.02 2hmk h THR 39 Cb 1.32 0.94 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 2hmk h THR 39 CO 0.13 0.36 -0.13 1.56 0.37 0.00 0.00 175.52 177.81 2hmk h GLN 40 N 0.72 0.97 -0.21 6.66 4.20 -0.93 -1.07 115.11 125.44 2hmk h GLN 40 Ca 0.15 -0.38 0.01 0.00 0.06 0.00 0.00 58.65 58.49 2hmk h GLN 40 Cb 0.46 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 2hmk h GLN 40 CO 0.02 1.05 0.10 1.49 -0.67 0.00 0.00 178.83 180.82 2hmk h GLU 41 N 0.83 0.22 -0.44 1.46 4.81 -1.11 -1.91 114.58 118.44 2hmk h GLU 41 Ca 0.12 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.30 2hmk h GLU 41 Cb 0.70 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.01 2hmk h GLU 41 CO 0.05 0.14 0.09 0.00 -0.73 0.00 0.00 179.01 178.56 2hmk h ALA 42 N 1.11 1.34 -0.10 2.92 0.00 -1.00 -1.62 119.26 121.91 2hmk h ALA 42 Ca 0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2hmk h ALA 42 Cb 0.02 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2hmk h ALA 42 CO -0.06 0.47 0.03 1.25 0.00 0.00 0.00 179.25 180.94 2hmk h HIS 43 N 0.64 0.17 -0.52 0.00 -0.00 -0.82 0.84 115.15 115.46 2hmk h HIS 43 Ca 0.14 -0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.54 2hmk h HIS 43 Cb 0.27 -0.05 -0.05 0.00 -0.00 0.00 0.00 27.41 27.59 2hmk h HIS 43 CO 0.01 0.31 0.26 -0.07 -0.00 0.00 0.00 177.93 178.45 2hmk h LEU 44 N -0.03 0.38 -0.51 0.26 3.38 -1.09 -2.03 115.31 115.66 2hmk h LEU 44 Ca 0.03 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2hmk h LEU 44 Cb 0.23 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2hmk h LEU 44 CO -0.00 0.26 0.02 -0.07 0.09 0.00 0.00 178.44 178.74 2hmk h LEU 45 N 0.51 0.86 -1.33 1.67 3.38 -1.16 -0.83 115.31 118.40 2hmk h LEU 45 Ca 0.23 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 2hmk h LEU 45 Cb 0.14 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2hmk h LEU 45 CO -0.16 0.95 0.02 0.44 0.09 0.00 0.00 178.44 179.77 2hmk h ASP 46 N 0.76 0.43 -0.21 -0.43 3.32 -0.29 -0.87 116.42 119.12 2hmk h ASP 46 Ca 0.15 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2hmk h ASP 46 Cb 0.49 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2hmk h ASP 46 CO 0.02 0.48 0.00 2.30 -1.72 0.00 0.00 179.24 180.32 2hmk n ILE 47 N -4.32 0.28 -2.66 0.35 -5.35 -0.81 -4.27 119.36 102.58 2hmk n ILE 47 Ca 0.01 -0.37 -0.17 0.00 -0.27 0.00 0.00 62.75 61.95 2hmk n ILE 47 Cb 0.21 0.32 0.02 0.00 -1.74 0.00 0.00 39.64 38.45 2hmk n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2hmk n GLN 48 N 0.36 -2.92 -1.89 6.28 6.02 -0.33 -4.92 117.38 119.98 2hmk n GLN 48 Ca 0.15 0.72 -0.41 0.00 -0.01 0.00 0.00 57.00 57.45 2hmk n GLN 48 Cb 0.31 -5.13 -0.01 0.00 1.02 0.00 0.00 30.24 26.44 2hmk n GLN 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2hmk n ALA 49 N -2.68 6.43 0.02 -1.58 0.00 -0.34 -4.75 120.51 117.60 2hmk n ALA 49 Ca -0.12 -3.99 -0.03 0.00 0.00 0.00 0.00 53.44 49.29 2hmk n ALA 49 Cb 0.61 -3.07 0.21 0.00 0.00 0.00 0.00 19.45 17.19 2hmk n ALA 49 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2hmk h TYR 50 N 5.19 0.53 -0.38 0.00 0.99 -1.91 0.46 116.97 121.85 2hmk h TYR 50 Ca 0.64 -0.11 -0.07 0.00 2.00 0.00 0.00 58.73 61.19 2hmk h TYR 50 Cb 0.43 -0.13 -0.01 0.00 1.00 0.00 0.00 36.73 38.02 2hmk h TYR 50 CO 1.56 0.68 -0.04 0.00 -0.00 0.00 0.00 178.16 180.36 2hmk h ARG 51 N 0.42 0.69 -0.78 4.88 3.08 -1.95 -1.98 114.38 118.75 2hmk h ARG 51 Ca 0.06 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 2hmk h ARG 51 Cb 0.65 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.61 2hmk h ARG 51 CO 0.05 0.82 0.45 0.00 -1.07 0.00 0.00 179.97 180.21 2hmk h ALA 52 N 0.85 1.33 -0.03 0.04 0.00 -1.88 -0.87 119.26 118.70 2hmk h ALA 52 Ca 0.10 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2hmk h ALA 52 Cb 0.53 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2hmk h ALA 52 CO 0.03 0.56 -0.03 2.35 0.00 0.00 0.00 179.25 182.17 2hmk h TRP 53 N 1.08 -0.06 -0.57 0.00 7.01 -0.72 0.71 115.95 123.40 2hmk h TRP 53 Ca 0.28 0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.32 2hmk h TRP 53 Cb -0.01 0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.04 2hmk h TRP 53 CO 0.01 -0.04 0.33 -0.07 -2.79 0.00 0.00 178.44 175.87 2hmk h LEU 54 N -0.03 0.51 -0.33 0.65 3.38 -0.92 0.14 115.31 118.71 2hmk h LEU 54 Ca 0.02 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 2hmk h LEU 54 Cb 0.06 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2hmk h LEU 54 CO -0.05 0.36 -0.45 -0.33 0.09 0.00 0.00 178.44 178.06 2hmk h GLU 55 N 0.64 0.88 0.00 1.13 5.08 -0.93 -3.05 114.58 118.33 2hmk h GLU 55 Ca 0.24 -0.51 -0.13 0.00 -1.00 0.00 0.00 59.36 57.95 2hmk h GLU 55 Cb 0.07 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2hmk h GLU 55 CO -0.12 1.15 -1.95 1.58 -1.00 0.00 0.00 179.01 178.67 2hmk n HIS 56 N -4.07 0.23 0.00 4.33 -0.00 0.22 -4.68 115.22 111.26 2hmk n HIS 56 Ca -0.04 0.07 0.01 0.00 0.46 0.00 0.00 57.72 58.23 2hmk n HIS 56 Cb 0.58 -0.77 -0.01 0.00 -0.12 0.00 0.00 29.99 29.66 2hmk n HIS 56 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2hmk s VAL 58 N -2.08 2.46 0.47 0.00 1.01 -1.15 0.08 120.40 121.19 2hmk s VAL 58 Ca -0.01 -0.83 -0.20 0.00 0.00 0.00 0.00 61.98 60.95 2hmk s VAL 58 Cb 0.01 -2.03 -0.10 0.00 0.00 0.00 0.00 36.38 34.26 2hmk s VAL 58 CO 0.07 0.52 0.98 -0.83 0.00 0.00 0.00 175.10 175.84 2hmk s GLY 59 N 0.95 2.33 0.53 4.51 0.00 0.49 -4.77 107.32 111.37 2hmk s GLY 59 Ca -0.03 0.39 0.19 0.00 0.00 0.00 0.00 44.72 45.27 2hmk s GLY 59 CO -0.03 0.68 2.14 1.48 0.00 0.00 0.00 173.10 177.37 2hmk h SER 60 N 1.57 0.00 -0.58 1.64 4.64 -1.95 -2.24 113.55 116.63 2hmk h SER 60 Ca -0.49 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.71 2hmk h SER 60 Cb 1.19 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.21 2hmk h SER 60 CO 0.61 0.00 0.15 -0.62 -0.87 0.00 0.00 176.83 176.10 2hmk n GLU 61 N -4.41 3.66 -1.92 4.77 -0.58 -1.26 -4.41 120.64 116.50 2hmk n GLU 61 Ca -0.01 -2.60 -0.38 0.00 -0.42 0.00 0.00 57.16 53.74 2hmk n GLU 61 Cb 0.16 -2.10 0.02 0.00 -0.57 0.00 0.00 31.44 28.95 2hmk n GLU 61 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2hmk s VAL 62 N -2.55 2.37 -0.19 2.62 0.11 -0.84 -4.88 120.40 117.02 2hmk s VAL 62 Ca 0.46 0.28 0.01 0.00 -2.93 0.00 0.00 61.98 59.80 2hmk s VAL 62 Cb 0.36 -3.15 0.02 0.00 -1.53 0.00 0.00 36.38 32.09 2hmk s VAL 62 CO 0.12 0.00 -0.18 -1.58 -3.33 0.00 0.00 175.10 170.13 2hmk s GLN 63 N -2.78 2.91 -0.34 1.54 0.74 -0.62 -4.14 119.66 116.97 2hmk s GLN 63 Ca 0.68 -0.89 -0.02 0.00 0.05 0.00 0.00 55.36 55.18 2hmk s GLN 63 Cb -0.37 -2.63 0.07 0.00 1.10 0.00 0.00 33.01 31.17 2hmk s GLN 63 CO 0.45 -0.26 0.07 -0.47 -0.55 0.00 0.00 175.29 174.53 2hmk s TYR 64 N 1.27 3.38 -0.06 1.67 5.04 -0.16 -1.37 117.35 127.12 2hmk s TYR 64 Ca 0.03 -2.03 0.02 0.00 -2.44 0.00 0.00 57.07 52.64 2hmk s TYR 64 Cb -0.14 -2.48 0.02 0.00 0.35 0.00 0.00 41.96 39.70 2hmk s TYR 64 CO -0.11 -0.85 -0.09 -1.14 -1.34 0.00 0.00 175.55 172.02 2hmk s GLN 65 N 1.22 1.33 -0.12 4.97 0.74 -0.02 -0.77 119.66 127.01 2hmk s GLN 65 Ca -0.00 -0.28 -0.00 0.00 0.05 0.00 0.00 55.36 55.13 2hmk s GLN 65 Cb -0.21 -1.18 0.02 0.00 1.10 0.00 0.00 33.01 32.74 2hmk s GLN 65 CO -0.02 -0.03 -0.09 0.08 -0.55 0.00 0.00 175.29 174.68 2hmk s VAL 66 N 0.83 1.13 0.24 1.34 1.01 -0.34 -1.22 120.40 123.39 2hmk s VAL 66 Ca -0.12 -0.36 0.08 0.00 0.00 0.00 0.00 61.98 61.57 2hmk s VAL 66 Cb -0.15 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 2hmk s VAL 66 CO 0.02 0.38 0.12 0.27 0.00 0.00 0.00 175.10 175.89 2hmk s ILE 67 N 1.67 4.13 -0.14 2.22 -4.36 0.22 -0.23 121.20 124.70 2hmk s ILE 67 Ca 0.05 -1.51 0.00 0.00 -0.26 0.00 0.00 60.65 58.93 2hmk s ILE 67 Cb -0.13 -3.21 0.02 0.00 1.25 0.00 0.00 42.46 40.40 2hmk s ILE 67 CO -0.09 -0.32 -0.14 -0.55 0.24 0.00 0.00 174.94 174.08 2hmk s SER 68 N -3.67 2.66 -0.11 4.36 0.15 -0.42 -1.04 113.70 115.63 2hmk s SER 68 Ca 0.32 -0.48 -0.15 0.00 0.70 0.00 0.00 55.95 56.34 2hmk s SER 68 Cb -0.08 -1.17 -0.05 0.00 -1.71 0.00 0.00 66.02 63.01 2hmk s SER 68 CO 0.23 -0.05 0.37 -0.60 1.20 0.00 0.00 173.24 174.40 2hmk s ARG 69 N 1.43 4.20 0.40 5.44 3.52 -1.26 -1.44 118.95 131.24 2hmk s ARG 69 Ca 0.04 0.27 -0.26 0.00 -0.13 0.00 0.00 55.73 55.65 2hmk s ARG 69 Cb -0.13 -3.38 -0.09 0.00 -1.56 0.00 0.00 34.95 29.79 2hmk s ARG 69 CO -0.10 0.31 1.33 -2.00 -0.81 0.00 0.00 175.30 174.03 2hmk s GLU 70 N 0.19 3.99 -0.19 5.12 2.12 -0.27 -4.94 118.70 124.73 2hmk s GLU 70 Ca 0.21 2.21 -0.29 0.00 0.36 0.00 0.00 54.97 57.46 2hmk s GLU 70 Cb -0.14 -2.79 -0.01 0.00 0.26 0.00 0.00 34.13 31.44 2hmk s GLU 70 CO 0.08 -0.49 1.28 -0.51 -0.54 0.00 0.00 175.26 175.08 2hmk s LEU 71 N -2.37 4.13 0.21 2.70 1.43 -1.26 -4.99 118.68 118.52 2hmk s LEU 71 Ca 0.56 1.62 0.07 0.00 -1.03 0.00 0.00 54.13 55.35 2hmk s LEU 71 Cb -0.39 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.24 2hmk s LEU 71 CO 0.51 -0.83 -0.13 -0.13 0.23 0.00 0.00 176.35 176.01 2hmk s ARG 72 N 3.64 1.33 0.39 1.70 1.81 -1.26 -5.12 118.95 121.43 2hmk s ARG 72 Ca 0.55 -1.60 -0.26 0.00 -1.72 0.00 0.00 55.73 52.70 2hmk s ARG 72 Cb -0.21 -1.07 -0.09 0.00 -0.45 0.00 0.00 34.95 33.13 2hmk s ARG 72 CO 0.16 0.15 1.26 0.00 -0.68 0.00 0.00 175.30 176.19 2hmk s ALA 73 N -3.02 3.26 0.47 2.13 0.00 -1.26 -4.89 121.76 118.46 2hmk s ALA 73 Ca 0.23 1.15 0.13 0.00 0.00 0.00 0.00 51.96 53.47 2hmk s ALA 73 Cb 0.00 -3.45 1.10 0.00 0.00 0.00 0.00 23.12 20.77 2hmk s ALA 73 CO 0.07 -0.70 2.10 0.00 0.00 0.00 0.00 175.76 177.24 2hmk h ALA 74 N 2.80 1.90 -0.19 0.00 0.00 -2.04 -1.50 119.26 120.23 2hmk h ALA 74 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2hmk h ALA 74 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2hmk h ALA 74 CO 0.63 0.08 0.00 -1.13 0.00 0.00 0.00 179.25 178.84 2hmk n SER 75 N -4.51 1.82 -4.72 0.00 3.41 -1.26 -4.96 113.62 103.39 2hmk n SER 75 Ca 0.00 -1.75 -0.42 0.00 -0.26 0.00 0.00 58.87 56.45 2hmk n SER 75 Cb 0.10 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 63.90 2hmk n SER 75 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2hmk s GLU 76 N -1.75 4.32 0.00 4.33 2.56 -0.57 -4.89 118.70 122.69 2hmk s GLU 76 Ca 0.32 2.13 0.00 0.00 0.00 0.00 0.00 54.97 57.43 2hmk s GLU 76 Cb 0.18 -3.21 0.00 0.00 2.00 0.00 0.00 34.13 33.10 2hmk s GLU 76 CO 0.26 -0.42 0.01 2.89 -0.56 0.00 0.00 175.26 177.45 2hmk n ARG 77 N 3.46 0.33 -0.11 4.30 0.00 -1.26 -4.94 116.66 118.45 2hmk n ARG 77 Ca 0.10 -0.01 -0.18 0.00 -0.00 0.00 0.00 57.85 57.76 2hmk n ARG 77 Cb 0.42 -0.19 -0.09 0.00 -0.00 0.00 0.00 32.46 32.60 2hmk n ARG 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2hmk n ARG 78 N -0.05 0.51 -2.20 2.89 1.74 -1.26 -4.92 116.66 113.37 2hmk n ARG 78 Ca 0.00 0.16 -0.43 0.00 -0.77 0.00 0.00 57.85 56.81 2hmk n ARG 78 Cb 0.07 -1.38 -0.02 0.00 -1.02 0.00 0.00 32.46 30.10 2hmk n ARG 78 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2hmk s TYR 79 N -2.42 2.21 -0.51 -1.55 5.04 -1.26 -4.90 117.35 113.95 2hmk s TYR 79 Ca -0.30 0.65 0.06 0.00 -2.44 0.00 0.00 57.07 55.04 2hmk s TYR 79 Cb 0.09 -4.09 0.22 0.00 0.35 0.00 0.00 41.96 38.53 2hmk s TYR 79 CO 0.46 -2.49 0.55 1.63 -1.34 0.00 0.00 175.55 174.36 2hmk n LYS 80 N 7.89 1.30 -4.45 4.97 5.02 -1.26 -5.06 118.16 126.57 2hmk n LYS 80 Ca 0.18 -3.82 -0.22 0.00 -2.02 0.00 0.00 58.31 52.44 2hmk n LYS 80 Cb 0.46 -1.76 -0.10 0.00 -0.02 0.00 0.00 35.03 33.61 2hmk n LYS 80 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2hmk s LEU 81 N -1.35 2.53 -0.36 -0.35 1.43 -1.26 -5.07 118.68 114.24 2hmk s LEU 81 Ca 0.35 -1.19 -0.34 0.00 -1.03 0.00 0.00 54.13 51.92 2hmk s LEU 81 Cb 0.11 -0.72 -0.14 0.00 0.03 0.00 0.00 46.19 45.47 2hmk s LEU 81 CO -0.11 -0.31 1.25 0.59 0.23 0.00 0.00 176.35 178.00 2hmk n ASN 82 N -0.62 0.81 0.13 2.29 3.02 -1.26 -4.83 115.26 114.80 2hmk n ASN 82 Ca -0.05 0.79 0.01 0.00 -0.03 0.00 0.00 54.58 55.29 2hmk n ASN 82 Cb 0.63 -0.64 0.07 0.00 -0.61 0.00 0.00 39.78 39.23 2hmk n ASN 82 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2hmk h GLU 83 N 4.24 0.00 -3.92 3.52 5.08 -1.97 -3.47 114.58 118.06 2hmk h GLU 83 Ca -0.27 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.00 2hmk h GLU 83 Cb 1.00 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.11 2hmk h GLU 83 CO 0.73 0.60 -0.45 0.00 -1.00 0.00 0.00 179.01 178.89 2hmk s ALA 84 N -3.09 -0.04 0.26 3.43 0.00 -1.26 -1.11 121.76 119.96 2hmk s ALA 84 Ca 0.02 -0.77 0.10 0.00 0.00 0.00 0.00 51.96 51.31 2hmk s ALA 84 Cb 0.09 0.43 -0.04 0.00 0.00 0.00 0.00 23.12 23.60 2hmk s ALA 84 CO 0.75 -0.47 -0.07 0.00 0.00 0.00 0.00 175.76 175.96 2hmk s MET 85 N -3.88 2.08 -0.47 0.00 0.23 -0.52 -4.97 119.30 111.77 2hmk s MET 85 Ca 0.06 -1.51 -0.17 0.00 -1.03 0.00 0.00 55.69 53.03 2hmk s MET 85 Cb 0.06 -2.04 0.06 0.00 -1.53 0.00 0.00 34.83 31.37 2hmk s MET 85 CO -0.11 0.36 0.50 -0.80 -2.03 0.00 0.00 175.02 172.94 2hmk s ASN 86 N -3.53 6.19 0.10 -1.18 0.01 -1.26 -1.30 114.94 113.97 2hmk s ASN 86 Ca 0.30 -1.01 -0.17 0.00 -0.71 0.00 0.00 52.86 51.27 2hmk s ASN 86 Cb -0.06 -2.24 -0.06 0.00 0.41 0.00 0.00 41.25 39.30 2hmk s ASN 86 CO 0.18 -0.73 1.53 0.58 -1.51 0.00 0.00 177.10 177.15 2hmk h VAL 87 N 5.79 1.26 -4.20 1.60 2.07 -0.93 -3.43 116.25 118.41 2hmk h VAL 87 Ca -0.28 -0.97 -0.52 0.00 0.82 0.00 0.00 66.70 65.76 2hmk h VAL 87 Cb 1.10 1.28 -0.28 0.00 -1.52 0.00 0.00 31.29 31.88 2hmk h VAL 87 CO 0.89 0.31 -0.82 -0.31 0.02 0.00 0.00 177.57 177.67 2hmk s TYR 88 N -4.96 1.46 -0.48 1.57 1.51 -0.83 -4.94 117.35 110.67 2hmk s TYR 88 Ca -0.13 -0.31 0.06 0.00 -1.01 0.00 0.00 57.07 55.68 2hmk s TYR 88 Cb 0.08 -0.91 0.21 0.00 -0.11 0.00 0.00 41.96 41.23 2hmk s TYR 88 CO 0.77 0.01 0.73 -1.71 -1.11 0.00 0.00 175.55 174.23 2hmk n ASN 89 N 2.36 -2.57 -4.56 2.29 5.15 -1.20 -1.20 115.26 115.53 2hmk n ASN 89 Ca -0.16 -2.98 -0.34 0.00 -0.60 0.00 0.00 54.58 50.50 2hmk n ASN 89 Cb 0.54 1.30 -0.11 0.00 -0.53 0.00 0.00 39.78 40.98 2hmk n ASN 89 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2hmk s GLU 90 N 0.51 3.10 0.84 1.20 0.41 0.05 -4.88 118.70 119.93 2hmk s GLU 90 Ca 0.32 -0.53 -0.07 0.00 -0.41 0.00 0.00 54.97 54.28 2hmk s GLU 90 Cb 0.11 -2.72 0.17 0.00 -1.78 0.00 0.00 34.13 29.91 2hmk s GLU 90 CO -0.15 0.52 1.15 0.54 -0.49 0.00 0.00 175.26 176.83 2hmk s ASN 91 N -0.40 3.68 0.18 -0.19 2.20 -1.26 -0.99 114.94 118.15 2hmk s ASN 91 Ca 0.06 -0.23 -0.14 0.00 -0.94 0.00 0.00 52.86 51.62 2hmk s ASN 91 Cb -0.12 0.07 0.09 0.00 -2.00 0.00 0.00 41.25 39.29 2hmk s ASN 91 CO 0.02 -2.33 1.82 0.15 -2.94 0.00 0.00 177.10 173.82 2hmk h PHE 92 N -1.05 0.61 -0.82 1.54 3.04 -1.77 -0.93 116.94 117.56 2hmk h PHE 92 Ca -0.38 0.02 0.08 0.00 3.98 0.00 0.00 57.97 61.66 2hmk h PHE 92 Cb 1.24 -0.20 -0.07 0.00 2.56 0.00 0.00 35.95 39.49 2hmk h PHE 92 CO -0.73 0.36 0.49 0.37 -2.02 0.00 0.00 178.31 176.78 2hmk h GLN 93 N 0.66 0.83 -0.32 1.11 -0.00 -1.95 0.85 115.11 116.29 2hmk h GLN 93 Ca 0.21 -0.05 -0.17 0.00 -0.00 0.00 0.00 58.65 58.64 2hmk h GLN 93 Cb -0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 27.48 27.28 2hmk h GLN 93 CO -0.08 0.55 -0.47 1.96 0.00 0.00 0.00 178.83 180.79 2hmk h GLN 94 N 0.86 0.88 -0.73 1.69 4.20 -1.81 -1.26 115.11 118.94 2hmk h GLN 94 Ca 0.38 -0.52 0.01 0.00 0.06 0.00 0.00 58.65 58.58 2hmk h GLN 94 Cb 0.26 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.05 2hmk h GLN 94 CO -0.21 1.16 0.48 -0.07 -0.67 0.00 0.00 178.83 179.53 2hmk h LEU 95 N 0.68 0.82 -0.87 1.46 3.38 -0.80 -1.91 115.31 118.07 2hmk h LEU 95 Ca 0.03 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2hmk h LEU 95 Cb 1.07 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.58 2hmk h LEU 95 CO 0.11 0.59 0.57 0.50 0.09 0.00 0.00 178.44 180.30 2hmk h LYS 96 N 0.97 1.11 -0.58 1.13 1.63 -0.52 0.36 116.57 120.68 2hmk h LYS 96 Ca 0.27 -0.07 0.04 0.00 -0.85 0.00 0.00 60.65 60.05 2hmk h LYS 96 Cb -0.09 -0.25 -0.05 0.00 -0.60 0.00 0.00 32.23 31.24 2hmk h LYS 96 CO -0.07 0.74 0.32 0.28 -3.45 0.00 0.00 179.45 177.27 2hmk h VAL 97 N 1.15 0.99 -0.26 2.00 2.07 -0.85 0.32 116.25 121.66 2hmk h VAL 97 Ca 0.33 -0.21 -0.09 0.00 0.82 0.00 0.00 66.70 67.55 2hmk h VAL 97 Cb -0.08 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 2hmk h VAL 97 CO -0.09 0.11 -0.21 0.03 0.02 0.00 0.00 177.57 177.44 2hmk h ARG 98 N 0.62 0.48 -0.39 1.57 3.08 -0.54 -1.10 114.38 118.10 2hmk h ARG 98 Ca 0.25 -0.16 -0.12 0.00 0.07 0.00 0.00 59.98 60.01 2hmk h ARG 98 Cb 0.11 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2hmk h ARG 98 CO -0.15 0.66 -0.24 0.28 -1.07 0.00 0.00 179.97 179.46 2hmk h VAL 99 N 0.43 1.28 -0.45 2.04 2.07 -0.37 -1.82 116.25 119.43 2hmk h VAL 99 Ca 0.07 -1.39 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 2hmk h VAL 99 Cb 0.61 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 2hmk h VAL 99 CO 0.04 0.46 0.02 -0.33 0.02 0.00 0.00 177.57 177.79 2hmk h GLU 100 N 0.65 0.73 -0.66 1.57 4.39 -0.67 -1.78 114.58 118.81 2hmk h GLU 100 Ca 0.08 -0.18 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 2hmk h GLU 100 Cb 0.81 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.33 2hmk h GLU 100 CO 0.07 0.73 0.40 1.25 -1.16 0.00 0.00 179.01 180.29 2hmk h HIS 101 N 0.69 0.87 -0.55 4.33 2.76 -1.06 -1.37 115.15 120.83 2hmk h HIS 101 Ca 0.14 -0.00 -0.04 0.00 -2.20 0.00 0.00 60.37 58.26 2hmk h HIS 101 Cb 0.39 -0.29 -0.03 0.00 1.55 0.00 0.00 27.41 29.04 2hmk h HIS 101 CO 0.02 0.59 0.16 1.96 -1.30 0.00 0.00 177.93 179.36 2hmk h GLN 102 N 0.90 0.82 -0.00 5.26 1.08 -0.69 -3.14 115.11 119.34 2hmk h GLN 102 Ca 0.24 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 2hmk h GLN 102 Cb -0.03 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.27 2hmk h GLN 102 CO -0.04 0.72 -0.41 1.28 -0.95 0.00 0.00 178.83 179.43 2hmk n LEU 103 N -4.29 0.47 -4.73 1.46 4.32 -0.73 -4.91 117.00 108.59 2hmk n LEU 103 Ca 0.04 0.05 -0.42 0.00 -0.02 0.00 0.00 56.01 55.66 2hmk n LEU 103 Cb 0.21 -0.27 -0.03 0.00 -1.62 0.00 0.00 43.42 41.70 2hmk n LEU 103 CO 0.39 0.11 1.13 -0.62 -1.22 0.00 0.00 177.39 177.18 2hmk s ASP 104 N -2.95 6.70 0.00 -1.43 3.68 -0.55 -4.88 116.67 117.23 2hmk s ASP 104 Ca 0.13 2.53 0.12 0.00 2.13 0.00 0.00 52.55 57.46 2hmk s ASP 104 Cb 0.18 -2.60 0.55 0.00 -1.45 0.00 0.00 42.92 39.59 2hmk s ASP 104 CO 0.66 -0.72 1.38 -0.81 0.13 0.00 0.00 175.17 175.82 2hmk n PRO 105 N 3.37 0.03 -0.65 4.34 -0.04 -1.26 -1.35 135.00 139.45 2hmk n PRO 105 Ca 0.10 0.27 0.09 0.00 -0.04 0.00 0.00 63.50 63.92 2hmk n PRO 105 Cb 0.40 -1.50 0.35 0.00 -0.04 0.00 0.00 33.50 32.72 2hmk n PRO 105 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2hmk n GLN 106 N -1.47 3.89 -2.54 0.54 6.02 -1.26 -4.77 117.38 117.80 2hmk n GLN 106 Ca 0.03 -2.92 -0.41 0.00 -0.01 0.00 0.00 57.00 53.70 2hmk n GLN 106 Cb 0.14 -1.94 -0.03 0.00 1.02 0.00 0.00 30.24 29.42 2hmk n GLN 106 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2hmk s ASN 107 N -0.97 6.46 0.46 1.08 3.84 -0.45 -4.84 114.94 120.53 2hmk s ASN 107 Ca 0.50 -1.45 0.17 0.00 0.21 0.00 0.00 52.86 52.30 2hmk s ASN 107 Cb 0.34 -2.57 1.10 0.00 -0.55 0.00 0.00 41.25 39.57 2hmk s ASN 107 CO 0.22 -1.55 2.01 -0.50 -2.79 0.00 0.00 177.10 174.49 2hmk h TRP 108 N 9.79 0.00 0.00 0.43 4.06 -1.88 -1.56 115.95 126.79 2hmk h TRP 108 Ca 0.20 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.15 2hmk h TRP 108 Cb 1.01 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.17 2hmk h TRP 108 CO 1.28 0.18 0.00 0.41 -3.56 0.00 0.00 178.44 176.75 2hmk n GLY 109 N -0.92 -1.33 0.84 1.49 0.00 -1.26 -2.24 105.19 101.77 2hmk n GLY 109 Ca -0.02 0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.13 2hmk n GLY 109 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2hmk n ASN 110 N -2.27 2.42 -3.83 1.61 3.02 -0.59 -4.76 115.26 110.86 2hmk n ASN 110 Ca 0.02 -2.15 -0.25 0.00 -0.03 0.00 0.00 54.58 52.17 2hmk n ASN 110 Cb 0.25 -0.36 -0.17 0.00 -0.61 0.00 0.00 39.78 38.89 2hmk n ASN 110 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2hmk s SER 111 N -0.80 1.94 0.70 6.41 0.15 -0.95 -2.93 113.70 118.21 2hmk s SER 111 Ca 0.25 -0.23 -0.14 0.00 0.70 0.00 0.00 55.95 56.54 2hmk s SER 111 Cb 0.15 -0.64 0.02 0.00 -1.71 0.00 0.00 66.02 63.84 2hmk s SER 111 CO 0.14 -0.16 1.12 -2.16 1.20 0.00 0.00 173.24 173.37 2hmk s PRO 112 N 1.84 2.57 0.27 5.44 0.04 -1.26 -5.01 135.00 138.89 2hmk s PRO 112 Ca 0.05 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.17 2hmk s PRO 112 Cb -0.13 -1.92 -0.13 0.00 0.04 0.00 0.00 34.50 32.36 2hmk s PRO 112 CO -0.07 -1.43 1.37 1.17 0.04 0.00 0.00 177.00 178.08 2hmk n LYS 113 N -2.73 2.09 -1.16 4.56 4.81 -1.15 -4.82 118.16 119.76 2hmk n LYS 113 Ca 0.10 0.74 -0.31 0.00 -0.87 0.00 0.00 58.31 57.98 2hmk n LYS 113 Cb 0.52 -2.37 0.12 0.00 0.02 0.00 0.00 35.03 33.31 2hmk n LYS 113 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2hmk s LEU 114 N -0.27 2.71 -0.12 3.14 1.02 -1.26 -4.88 118.68 119.02 2hmk s LEU 114 Ca 0.64 1.75 0.01 0.00 0.02 0.00 0.00 54.13 56.55 2hmk s LEU 114 Cb -0.62 -4.30 0.02 0.00 0.02 0.00 0.00 46.19 41.31 2hmk s LEU 114 CO 0.54 -2.40 -0.14 -0.13 0.02 0.00 0.00 176.35 174.24 2hmk s ARG 115 N -4.88 2.17 -0.01 1.70 1.81 -0.43 -5.01 118.95 114.30 2hmk s ARG 115 Ca 0.63 -0.53 0.05 0.00 -1.72 0.00 0.00 55.73 54.16 2hmk s ARG 115 Cb -0.18 -1.90 -0.03 0.00 -0.45 0.00 0.00 34.95 32.39 2hmk s ARG 115 CO 0.57 -0.12 -0.16 -0.06 -0.68 0.00 0.00 175.30 174.85 2hmk s PHE 116 N 1.17 2.64 -0.07 -0.53 0.40 -1.26 -0.80 117.98 119.52 2hmk s PHE 116 Ca -0.03 -0.21 -0.03 0.00 -0.60 0.00 0.00 56.93 56.07 2hmk s PHE 116 Cb -0.14 -1.56 0.04 0.00 0.51 0.00 0.00 43.02 41.88 2hmk s PHE 116 CO -0.04 0.21 0.15 0.99 0.70 0.00 0.00 175.22 177.22 2hmk s THR 117 N -0.82 -0.20 -0.05 0.64 2.01 -0.42 -4.80 115.64 112.00 2hmk s THR 117 Ca 0.13 0.32 0.03 0.00 0.31 0.00 0.00 61.69 62.48 2hmk s THR 117 Cb -0.11 -0.27 -0.03 0.00 0.01 0.00 0.00 72.50 72.11 2hmk s THR 117 CO 0.03 0.13 -0.12 -0.13 -0.69 0.00 0.00 174.62 173.84 2hmk s ARG 118 N 2.00 2.56 -0.24 4.92 0.52 -1.26 -0.87 118.95 126.58 2hmk s ARG 118 Ca 0.00 -0.66 0.01 0.00 -0.52 0.00 0.00 55.73 54.56 2hmk s ARG 118 Cb -0.12 -2.43 0.06 0.00 0.52 0.00 0.00 34.95 32.98 2hmk s ARG 118 CO -0.06 0.63 -0.07 -0.06 0.02 0.00 0.00 175.30 175.77 2hmk s PHE 119 N -0.77 2.59 -0.19 -0.53 0.08 0.29 -4.99 117.98 114.46 2hmk s PHE 119 Ca 0.12 -1.87 -0.06 0.00 0.12 0.00 0.00 56.93 55.24 2hmk s PHE 119 Cb -0.11 -1.66 -0.03 0.00 -0.57 0.00 0.00 43.02 40.65 2hmk s PHE 119 CO 0.01 -0.80 0.04 0.42 -0.10 0.00 0.00 175.22 174.79 2hmk s ILE 120 N 1.33 4.41 0.29 0.64 -1.09 -1.26 -1.11 121.20 124.41 2hmk s ILE 120 Ca -0.06 -0.16 0.04 0.00 -2.23 0.00 0.00 60.65 58.24 2hmk s ILE 120 Cb -0.19 -2.99 -0.03 0.00 -1.58 0.00 0.00 42.46 37.67 2hmk s ILE 120 CO -0.06 0.44 0.25 0.42 -1.23 0.00 0.00 174.94 174.76 2hmk s THR 121 N 0.69 0.00 -1.44 2.92 -4.23 -0.30 -4.94 115.64 108.34 2hmk s THR 121 Ca 0.02 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.45 2hmk s THR 121 Cb -0.14 -2.50 0.04 0.00 1.34 0.00 0.00 72.50 71.24 2hmk s THR 121 CO 0.02 0.00 1.10 0.59 -0.54 0.00 0.00 174.62 175.79 2hmk n ASN 122 N -1.14 -5.67 -4.71 3.99 4.13 -1.26 -1.08 115.26 109.51 2hmk n ASN 122 Ca 0.05 -0.65 -0.42 0.00 1.68 0.00 0.00 54.58 55.25 2hmk n ASN 122 Cb 0.63 -4.53 -0.03 0.00 -1.54 0.00 0.00 39.78 34.31 2hmk n ASN 122 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2hmk s VAL 123 N -3.31 3.71 0.02 2.41 1.01 -1.26 -4.27 120.40 118.70 2hmk s VAL 123 Ca 0.62 1.22 0.04 0.00 0.00 0.00 0.00 61.98 63.86 2hmk s VAL 123 Cb -0.29 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 2hmk s VAL 123 CO 0.77 0.09 -0.12 -1.10 0.00 0.00 0.00 175.10 174.75 2hmk s GLN 124 N 1.13 0.83 -0.00 2.72 -0.21 0.04 -4.99 119.66 119.17 2hmk s GLN 124 Ca 0.61 -0.61 0.00 0.00 0.02 0.00 0.00 55.36 55.38 2hmk s GLN 124 Cb -0.33 -0.80 0.00 0.00 1.00 0.00 0.00 33.01 32.89 2hmk s GLN 124 CO 0.29 0.20 -0.00 0.00 -2.12 0.00 0.00 175.29 173.67 2hmk s ALA 125 N -0.70 0.03 -0.13 6.09 0.00 -1.26 -0.72 121.76 125.07 2hmk s ALA 125 Ca 0.01 0.01 -0.11 0.00 0.00 0.00 0.00 51.96 51.87 2hmk s ALA 125 Cb -0.07 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.06 2hmk s ALA 125 CO 0.01 -0.00 0.33 0.00 0.00 0.00 0.00 175.76 176.09 2hmk s ALA 126 N 0.09 -0.82 0.43 0.00 0.00 -0.16 -4.72 121.76 116.57 2hmk s ALA 126 Ca -0.01 0.97 -0.24 0.00 0.00 0.00 0.00 51.96 52.69 2hmk s ALA 126 Cb -0.01 -0.57 -0.08 0.00 0.00 0.00 0.00 23.12 22.46 2hmk s ALA 126 CO -0.00 -0.16 1.13 -1.64 0.00 0.00 0.00 175.76 175.08 2hmk s MET 127 N 0.30 3.94 0.37 0.00 -1.94 -1.26 -0.59 119.30 120.11 2hmk s MET 127 Ca -0.01 1.70 -0.27 0.00 -1.71 0.00 0.00 55.69 55.40 2hmk s MET 127 Cb -0.03 -2.50 -0.09 0.00 2.01 0.00 0.00 34.83 34.22 2hmk s MET 127 CO -0.01 -0.38 1.28 0.34 -0.01 0.00 0.00 175.02 176.24 2hmk s ASP 128 N -1.39 6.57 0.09 3.03 2.15 0.05 -4.86 116.67 122.32 2hmk s ASP 128 Ca 0.61 2.61 -0.16 0.00 0.43 0.00 0.00 52.55 56.04 2hmk s ASP 128 Cb -0.27 -2.64 -0.08 0.00 -0.30 0.00 0.00 42.92 39.63 2hmk s ASP 128 CO 0.33 -0.67 1.46 0.58 -0.17 0.00 0.00 175.17 176.70 2hmk h VAL 129 N 2.71 1.30 0.11 1.11 2.07 -1.94 -3.35 116.25 118.25 2hmk h VAL 129 Ca -0.49 -1.25 -0.31 0.00 0.82 0.00 0.00 66.70 65.48 2hmk h VAL 129 Cb 1.23 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 2hmk h VAL 129 CO 0.64 0.40 -1.60 0.78 0.02 0.00 0.00 177.57 177.80 2hmk h ASN 130 N 0.35 0.37 -3.40 0.57 2.35 -1.98 -3.41 115.58 110.43 2hmk h ASN 130 Ca 0.06 -0.85 -0.76 0.00 -0.55 0.00 0.00 56.30 54.20 2hmk h ASN 130 Cb 0.67 -0.12 -0.26 0.00 0.05 0.00 0.00 38.32 38.65 2hmk h ASN 130 CO 0.04 1.69 -0.18 -0.62 -1.65 0.00 0.00 177.43 176.72 2hmk s ASP 131 N -7.05 6.18 0.00 5.81 -1.08 -1.26 -4.94 116.67 114.34 2hmk s ASP 131 Ca -0.21 -2.13 0.12 0.00 -0.52 0.00 0.00 52.55 49.81 2hmk s ASP 131 Cb 0.05 -2.14 0.67 0.00 -1.46 0.00 0.00 42.92 40.04 2hmk s ASP 131 CO 0.76 -0.71 1.26 0.29 0.52 0.00 0.00 175.17 177.29 2hmk n LYS 132 N 4.71 0.26 -0.11 4.34 5.02 -1.26 -1.17 118.16 129.95 2hmk n LYS 132 Ca -0.04 0.11 0.09 0.00 -2.02 0.00 0.00 58.31 56.45 2hmk n LYS 132 Cb 0.42 -1.50 0.15 0.00 -0.02 0.00 0.00 35.03 34.07 2hmk n LYS 132 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2hmk n GLU 133 N -1.18 2.03 -3.79 1.97 1.02 -1.26 -4.88 120.64 114.55 2hmk n GLU 133 Ca 0.07 -1.91 -0.36 0.00 -0.02 0.00 0.00 57.16 54.94 2hmk n GLU 133 Cb 0.08 -1.39 -0.11 0.00 -0.02 0.00 0.00 31.44 30.01 2hmk n GLU 133 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2hmk s LEU 134 N -1.31 3.81 -0.24 -4.62 0.20 -0.31 -4.28 118.68 111.92 2hmk s LEU 134 Ca 0.28 -0.01 -0.07 0.00 0.69 0.00 0.00 54.13 55.02 2hmk s LEU 134 Cb 0.17 -2.01 -0.03 0.00 -0.43 0.00 0.00 46.19 43.90 2hmk s LEU 134 CO 0.24 0.05 0.05 -0.22 -0.29 0.00 0.00 176.35 176.19 2hmk s LEU 135 N 1.10 3.36 -0.08 -0.68 2.96 0.13 -0.77 118.68 124.71 2hmk s LEU 135 Ca 0.06 -0.23 -0.26 0.00 -0.22 0.00 0.00 54.13 53.48 2hmk s LEU 135 Cb -0.14 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 2hmk s LEU 135 CO 0.04 -0.03 0.82 -1.00 -1.32 0.00 0.00 176.35 174.86 2hmk s HIS 136 N 1.55 3.55 -0.07 5.38 3.76 0.24 -0.36 115.29 129.33 2hmk s HIS 136 Ca 0.06 1.37 0.02 0.00 -0.15 0.00 0.00 55.06 56.36 2hmk s HIS 136 Cb -0.15 -2.96 0.02 0.00 1.11 0.00 0.00 32.58 30.60 2hmk s HIS 136 CO 0.03 -0.05 -0.11 0.42 -0.85 0.00 0.00 174.74 174.18 2hmk s ILE 137 N 1.32 1.07 -0.08 0.60 1.01 -0.40 -0.99 121.20 123.73 2hmk s ILE 137 Ca 0.42 -0.42 0.01 0.00 0.00 0.00 0.00 60.65 60.66 2hmk s ILE 137 Cb -0.18 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 2hmk s ILE 137 CO 0.19 0.35 -0.10 -0.60 0.00 0.00 0.00 174.94 174.78 2hmk s ARG 138 N 0.85 2.84 0.12 2.79 3.52 0.10 -0.56 118.95 128.60 2hmk s ARG 138 Ca -0.11 -0.61 -0.19 0.00 -0.13 0.00 0.00 55.73 54.68 2hmk s ARG 138 Cb -0.15 -2.56 0.05 0.00 -1.56 0.00 0.00 34.95 30.73 2hmk s ARG 138 CO 0.01 0.56 0.48 -1.54 -0.81 0.00 0.00 175.30 174.00 2hmk s SER 139 N -0.53 -0.38 0.07 -2.12 1.04 -0.97 -0.78 113.70 110.03 2hmk s SER 139 Ca 0.08 -0.12 0.06 0.00 0.48 0.00 0.00 55.95 56.44 2hmk s SER 139 Cb -0.12 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.48 2hmk s SER 139 CO 0.02 -0.86 -0.08 0.20 0.98 0.00 0.00 173.24 173.50 2hmk s ASN 140 N -2.60 4.51 -0.03 7.02 0.01 -0.24 0.11 114.94 123.71 2hmk s ASN 140 Ca 0.00 -0.28 0.03 0.00 -0.71 0.00 0.00 52.86 51.90 2hmk s ASN 140 Cb 0.00 -0.95 0.00 0.00 0.41 0.00 0.00 41.25 40.72 2hmk s ASN 140 CO -0.10 0.22 -0.12 0.54 -1.51 0.00 0.00 177.10 176.13 2hmk s VAL 141 N -1.14 0.99 -0.19 1.60 0.11 0.25 -1.15 120.40 120.88 2hmk s VAL 141 Ca 0.20 -0.47 -0.06 0.00 -2.93 0.00 0.00 61.98 58.72 2hmk s VAL 141 Cb -0.11 -0.87 -0.03 0.00 -1.53 0.00 0.00 36.38 33.83 2hmk s VAL 141 CO 0.12 0.30 0.03 -0.63 -3.33 0.00 0.00 175.10 171.59 2hmk s ILE 142 N 0.19 4.39 -0.15 7.04 1.01 -0.26 -1.51 121.20 131.91 2hmk s ILE 142 Ca -0.04 -0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.44 2hmk s ILE 142 Cb -0.10 -2.98 0.02 0.00 0.01 0.00 0.00 42.46 39.41 2hmk s ILE 142 CO 0.01 0.44 -0.15 -0.22 0.00 0.00 0.00 174.94 175.02 2hmk s LEU 143 N 0.71 1.75 -0.22 2.97 0.20 0.27 -0.54 118.68 123.82 2hmk s LEU 143 Ca 0.02 -0.50 -0.07 0.00 0.69 0.00 0.00 54.13 54.27 2hmk s LEU 143 Cb -0.14 -1.21 -0.03 0.00 -0.43 0.00 0.00 46.19 44.38 2hmk s LEU 143 CO 0.02 -0.04 0.05 -2.28 -0.29 0.00 0.00 176.35 173.82 2hmk s HIS 144 N 1.39 3.10 -0.16 5.38 5.65 -0.05 -0.53 115.29 130.09 2hmk s HIS 144 Ca 0.03 -0.32 0.02 0.00 0.25 0.00 0.00 55.06 55.04 2hmk s HIS 144 Cb -0.13 -2.17 0.02 0.00 -1.18 0.00 0.00 32.58 29.11 2hmk s HIS 144 CO -0.10 -0.23 -0.20 0.50 -0.65 0.00 0.00 174.74 174.06 2hmk s ARG 145 N 1.23 2.91 -0.05 2.88 3.52 0.10 -1.31 118.95 128.23 2hmk s ARG 145 Ca 0.04 -0.81 0.05 0.00 -0.13 0.00 0.00 55.73 54.89 2hmk s ARG 145 Cb -0.14 -2.44 -0.01 0.00 -1.56 0.00 0.00 34.95 30.80 2hmk s ARG 145 CO 0.03 -0.11 -0.22 0.00 -0.81 0.00 0.00 175.30 174.18 2hmk s ALA 146 N 1.06 1.94 0.04 6.12 0.00 0.02 -1.15 121.76 129.79 2hmk s ALA 146 Ca -0.01 -0.92 -0.20 0.00 0.00 0.00 0.00 51.96 50.83 2hmk s ALA 146 Cb -0.14 -0.61 0.04 0.00 0.00 0.00 0.00 23.12 22.41 2hmk s ALA 146 CO -0.07 0.37 0.46 -0.98 0.00 0.00 0.00 175.76 175.53 2hmk s ARG 147 N -0.09 0.95 -1.40 0.00 1.70 -0.66 -1.32 118.95 118.13 2hmk s ARG 147 Ca -0.04 -0.29 -0.10 0.00 -0.47 0.00 0.00 55.73 54.84 2hmk s ARG 147 Cb -0.13 0.43 0.03 0.00 -0.57 0.00 0.00 34.95 34.71 2hmk s ARG 147 CO 0.03 -0.33 1.12 0.54 -1.08 0.00 0.00 175.30 175.58 2hmk n ARG 148 N 0.52 -7.25 0.00 3.89 1.74 -1.26 -1.91 116.66 112.40 2hmk n ARG 148 Ca -0.19 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.66 2hmk n ARG 148 Cb 0.60 -5.77 0.00 0.00 -1.02 0.00 0.00 32.46 26.27 2hmk n ARG 148 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hmk n GLY 149 N -1.89 1.88 0.24 -0.13 0.00 -1.26 -4.24 105.19 99.79 2hmk n GLY 149 Ca 0.00 -0.21 0.02 0.00 0.00 0.00 0.00 46.02 45.84 2hmk n GLY 149 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2hmk n ASN 150 N 3.62 0.67 -4.67 1.61 0.23 -1.24 -5.02 115.26 110.46 2hmk n ASN 150 Ca 0.00 -1.96 -0.39 0.00 -0.53 0.00 0.00 54.58 51.70 2hmk n ASN 150 Cb 0.00 -0.17 -0.07 0.00 -2.08 0.00 0.00 39.78 37.46 2hmk n ASN 150 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 2hmk s GLN 151 N -0.66 4.20 -0.05 -3.83 0.74 -0.80 -5.02 119.66 114.24 2hmk s GLN 151 Ca 0.06 0.35 -0.01 0.00 0.05 0.00 0.00 55.36 55.81 2hmk s GLN 151 Cb 0.05 -3.54 0.03 0.00 1.10 0.00 0.00 33.01 30.66 2hmk s GLN 151 CO 0.01 -0.07 0.04 0.08 -0.55 0.00 0.00 175.29 174.79 2hmk s VAL 152 N 1.40 0.06 -0.07 1.34 1.01 -1.26 -1.65 120.40 121.23 2hmk s VAL 152 Ca 0.23 0.30 0.03 0.00 0.00 0.00 0.00 61.98 62.54 2hmk s VAL 152 Cb -0.15 -0.27 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2hmk s VAL 152 CO 0.09 0.19 -0.16 -1.81 0.00 0.00 0.00 175.10 173.41 2hmk s ASP 153 N 1.94 2.20 -0.13 3.32 1.01 -0.30 -5.00 116.67 119.71 2hmk s ASP 153 Ca 0.03 -0.38 0.01 0.00 0.71 0.00 0.00 52.55 52.92 2hmk s ASP 153 Cb -0.12 -0.95 0.02 0.00 1.01 0.00 0.00 42.92 42.88 2hmk s ASP 153 CO -0.03 0.09 -0.16 -0.69 0.21 0.00 0.00 175.17 174.58 2hmk s VAL 154 N 0.46 1.64 0.04 -1.27 1.01 -1.26 -0.73 120.40 120.30 2hmk s VAL 154 Ca -0.14 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.16 2hmk s VAL 154 Cb -0.16 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2hmk s VAL 154 CO 0.05 0.47 0.01 -0.36 0.00 0.00 0.00 175.10 175.27 2hmk s PHE 155 N 1.10 3.07 -0.04 5.22 0.40 0.31 -4.95 117.98 123.09 2hmk s PHE 155 Ca -0.03 0.05 0.00 0.00 -0.60 0.00 0.00 56.93 56.35 2hmk s PHE 155 Cb -0.14 -1.63 0.03 0.00 0.51 0.00 0.00 43.02 41.79 2hmk s PHE 155 CO -0.05 0.48 -0.01 0.71 0.70 0.00 0.00 175.22 177.06 2hmk s TYR 156 N -1.20 0.45 0.04 0.36 1.51 -1.26 -0.56 117.35 116.69 2hmk s TYR 156 Ca 0.23 -0.06 -0.27 0.00 -1.01 0.00 0.00 57.07 55.96 2hmk s TYR 156 Cb -0.12 -0.53 0.08 0.00 -0.11 0.00 0.00 41.96 41.28 2hmk s TYR 156 CO 0.14 -0.17 0.69 0.00 -1.11 0.00 0.00 175.55 175.10 2hmk s ALA 157 N 1.19 -1.71 -0.12 3.71 0.00 -0.57 -4.50 121.76 119.75 2hmk s ALA 157 Ca -0.07 0.93 -0.05 0.00 0.00 0.00 0.00 51.96 52.77 2hmk s ALA 157 Cb -0.13 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 2hmk s ALA 157 CO -0.02 -0.58 0.08 0.00 0.00 0.00 0.00 175.76 175.24 2hmk s ALA 158 N -2.53 3.58 -0.15 0.00 0.00 -1.26 -0.58 121.76 120.82 2hmk s ALA 158 Ca -0.03 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2hmk s ALA 158 Cb -0.01 -1.80 -0.00 0.00 0.00 0.00 0.00 23.12 21.31 2hmk s ALA 158 CO -0.03 0.51 -0.15 1.03 0.00 0.00 0.00 175.76 177.12 2hmk s ARG 159 N -0.67 3.25 -0.39 0.00 0.52 0.12 -4.43 118.95 117.34 2hmk s ARG 159 Ca 0.12 -0.74 -0.11 0.00 -0.52 0.00 0.00 55.73 54.48 2hmk s ARG 159 Cb -0.12 -2.63 0.04 0.00 0.52 0.00 0.00 34.95 32.76 2hmk s ARG 159 CO 0.02 0.05 0.23 -1.21 0.02 0.00 0.00 175.30 174.42 2hmk s GLU 160 N 0.73 2.80 0.15 3.54 2.02 -0.07 -2.29 118.70 125.59 2hmk s GLU 160 Ca -0.06 -1.15 0.08 0.00 0.02 0.00 0.00 54.97 53.85 2hmk s GLU 160 Cb -0.15 -3.78 -0.04 0.00 0.10 0.00 0.00 34.13 30.25 2hmk s GLU 160 CO 0.01 -0.76 -0.09 -0.51 0.02 0.00 0.00 175.26 173.93 2hmk s ASP 161 N 1.70 4.33 -0.09 -0.19 1.01 0.27 -0.73 116.67 122.97 2hmk s ASP 161 Ca 0.02 -0.49 0.04 0.00 0.71 0.00 0.00 52.55 52.83 2hmk s ASP 161 Cb -0.20 -0.78 0.00 0.00 1.01 0.00 0.00 42.92 42.95 2hmk s ASP 161 CO 0.06 0.13 -0.21 -0.54 0.21 0.00 0.00 175.17 174.83 2hmk s LYS 162 N -2.59 2.63 0.05 8.23 1.02 0.26 -1.28 119.74 128.06 2hmk s LYS 162 Ca 0.23 -0.74 0.09 0.00 0.02 0.00 0.00 55.97 55.57 2hmk s LYS 162 Cb -0.10 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.16 2hmk s LYS 162 CO 0.15 0.15 -0.24 -1.58 -0.92 0.00 0.00 175.35 172.90 2hmk s TRP 163 N 0.41 2.07 -0.01 3.18 0.52 0.51 -0.56 118.94 125.06 2hmk s TRP 163 Ca -0.17 -0.39 -0.05 0.00 0.02 0.00 0.00 56.10 55.51 2hmk s TRP 163 Cb -0.17 -1.22 0.00 0.00 -1.15 0.00 0.00 33.47 30.93 2hmk s TRP 163 CO 0.07 0.13 0.11 0.21 0.02 0.00 0.00 176.95 177.49 2hmk s LYS 164 N -1.31 0.34 0.10 4.98 2.20 0.11 -0.69 119.74 125.47 2hmk s LYS 164 Ca 0.10 -0.24 -0.31 0.00 -0.36 0.00 0.00 55.97 55.16 2hmk s LYS 164 Cb -0.09 0.14 -0.08 0.00 -1.51 0.00 0.00 37.83 36.28 2hmk s LYS 164 CO 0.02 -0.07 1.49 1.03 -0.36 0.00 0.00 175.35 177.46 2hmk s ARG 165 N -0.90 4.26 0.00 4.03 0.52 -1.26 -0.98 118.95 124.62 2hmk s ARG 165 Ca -0.10 2.19 0.00 0.00 -0.52 0.00 0.00 55.73 57.30 2hmk s ARG 165 Cb -0.06 -3.33 0.00 0.00 0.52 0.00 0.00 34.95 32.08 2hmk s ARG 165 CO 0.01 -0.56 0.00 0.41 0.02 0.00 0.00 175.30 175.18 2hmk n GLY 166 N 3.68 5.21 3.60 -3.53 0.00 0.65 -4.90 105.19 109.90 2hmk n GLY 166 Ca 0.13 -1.60 -0.51 0.00 0.00 0.00 0.00 46.02 44.04 2hmk n GLY 166 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hmk n GLU 167 N 0.00 1.30 -1.24 1.61 1.02 -1.26 -0.96 120.64 121.10 2hmk n GLU 167 Ca 0.00 0.47 -0.08 0.00 -0.02 0.00 0.00 57.16 57.52 2hmk n GLU 167 Cb 0.00 -2.13 -0.04 0.00 -0.02 0.00 0.00 31.44 29.25 2hmk n GLU 167 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2hmk n GLY 168 N 2.69 0.96 2.33 0.62 0.00 -1.26 -2.40 105.19 108.12 2hmk n GLY 168 Ca 0.18 -0.26 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 2hmk n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hmk n GLY 169 N -1.04 0.82 3.70 -0.02 0.00 -0.14 -5.00 105.19 103.52 2hmk n GLY 169 Ca -0.08 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.11 2hmk n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hmk s VAL 170 N -2.08 4.91 0.08 1.61 1.01 -1.01 -4.63 120.40 120.28 2hmk s VAL 170 Ca 0.00 1.84 -0.31 0.00 0.00 0.00 0.00 61.98 63.51 2hmk s VAL 170 Cb 0.00 -4.22 -0.07 0.00 0.00 0.00 0.00 36.38 32.09 2hmk s VAL 170 CO 0.00 0.15 1.39 -0.13 0.00 0.00 0.00 175.10 176.50 2hmk s ARG 171 N 1.23 4.31 0.09 2.72 1.81 -1.26 -0.25 118.95 127.60 2hmk s ARG 171 Ca 0.46 2.03 0.04 0.00 -1.72 0.00 0.00 55.73 56.53 2hmk s ARG 171 Cb -0.19 -3.36 -0.04 0.00 -0.45 0.00 0.00 34.95 30.91 2hmk s ARG 171 CO 0.22 -0.47 -0.10 0.15 -0.68 0.00 0.00 175.30 174.41 2hmk s LYS 172 N 1.53 0.84 -0.06 3.54 1.02 -0.16 -4.80 119.74 121.65 2hmk s LYS 172 Ca 0.64 -1.14 -0.30 0.00 0.02 0.00 0.00 55.97 55.20 2hmk s LYS 172 Cb -0.35 -0.54 -0.04 0.00 -0.52 0.00 0.00 37.83 36.38 2hmk s LYS 172 CO 0.29 0.08 1.37 -1.17 -0.92 0.00 0.00 175.35 175.01 2hmk s LEU 173 N -2.39 4.27 -0.01 3.17 2.96 0.11 -0.71 118.68 126.09 2hmk s LEU 173 Ca 0.05 1.97 0.10 0.00 -0.22 0.00 0.00 54.13 56.03 2hmk s LEU 173 Cb -0.03 -3.55 -0.15 0.00 0.50 0.00 0.00 46.19 42.96 2hmk s LEU 173 CO 0.00 -0.74 0.28 1.33 -1.32 0.00 0.00 176.35 175.90 2hmk n VAL 174 N 4.97 0.00 -3.70 1.68 0.24 0.28 -0.38 118.33 121.43 2hmk n VAL 174 Ca 0.14 -0.24 -0.11 0.00 -2.04 0.00 0.00 64.34 62.08 2hmk n VAL 174 Cb 0.44 0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 33.18 2hmk n VAL 174 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2hmk s GLN 175 N -2.51 0.50 -0.05 7.34 0.74 -0.92 -1.59 119.66 123.18 2hmk s GLN 175 Ca -0.02 0.78 0.03 0.00 0.05 0.00 0.00 55.36 56.20 2hmk s GLN 175 Cb 0.07 0.13 0.01 0.00 1.10 0.00 0.00 33.01 34.32 2hmk s GLN 175 CO 0.43 -0.11 -0.14 0.50 -0.55 0.00 0.00 175.29 175.41 2hmk s ARG 176 N 0.89 1.66 -0.09 1.67 3.52 -0.47 -0.58 118.95 125.55 2hmk s ARG 176 Ca -0.05 -0.48 0.01 0.00 -0.13 0.00 0.00 55.73 55.08 2hmk s ARG 176 Cb -0.06 -1.41 0.02 0.00 -1.56 0.00 0.00 34.95 31.94 2hmk s ARG 176 CO -0.07 0.12 -0.12 0.12 -0.81 0.00 0.00 175.30 174.54 2hmk s PHE 177 N 0.36 1.58 -0.07 5.12 5.36 0.09 -0.85 117.98 129.58 2hmk s PHE 177 Ca -0.09 -0.68 0.02 0.00 -0.96 0.00 0.00 56.93 55.22 2hmk s PHE 177 Cb -0.13 -1.19 0.01 0.00 -0.34 0.00 0.00 43.02 41.37 2hmk s PHE 177 CO 0.03 -0.39 -0.13 0.08 -1.46 0.00 0.00 175.22 173.35 2hmk s VAL 178 N 1.02 1.20 -0.52 3.12 1.01 -0.36 -0.89 120.40 124.98 2hmk s VAL 178 Ca -0.07 -0.52 -0.14 0.00 0.00 0.00 0.00 61.98 61.24 2hmk s VAL 178 Cb -0.15 -1.09 0.13 0.00 0.00 0.00 0.00 36.38 35.27 2hmk s VAL 178 CO -0.01 0.37 0.46 -0.62 0.00 0.00 0.00 175.10 175.30 2hmk s ASP 179 N 0.62 6.06 0.16 3.32 -1.08 -1.26 -0.61 116.67 123.87 2hmk s ASP 179 Ca -0.14 -1.81 -0.31 0.00 -0.52 0.00 0.00 52.55 49.76 2hmk s ASP 179 Cb -0.16 -2.16 -0.09 0.00 -1.46 0.00 0.00 42.92 39.05 2hmk s ASP 179 CO 0.04 -0.81 1.48 -0.47 0.52 0.00 0.00 175.17 175.93 2hmk s TYR 180 N 1.54 3.13 -0.10 -5.34 5.04 -0.20 -4.83 117.35 116.58 2hmk s TYR 180 Ca 0.04 0.82 0.24 0.00 -2.44 0.00 0.00 57.07 55.73 2hmk s TYR 180 Cb -0.29 -3.81 0.69 0.00 0.35 0.00 0.00 41.96 38.90 2hmk s TYR 180 CO 0.02 -2.88 1.73 -1.00 -1.34 0.00 0.00 175.55 172.07 2hmk h PRO 181 N 6.48 0.00 -5.10 4.97 0.13 -1.90 -3.43 132.00 133.15 2hmk h PRO 181 Ca -0.43 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.08 2hmk h PRO 181 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 2hmk h PRO 181 CO 0.87 0.16 -0.41 -1.21 -0.23 0.00 0.00 178.00 177.18 2hmk s GLU 182 N -3.40 4.04 0.04 0.86 2.02 -1.26 -5.00 118.70 116.01 2hmk s GLU 182 Ca 0.03 -0.15 -0.20 0.00 0.02 0.00 0.00 54.97 54.68 2hmk s GLU 182 Cb 0.08 -3.59 -0.15 0.00 0.10 0.00 0.00 34.13 30.56 2hmk s GLU 182 CO 0.64 -0.08 1.30 -0.09 0.02 0.00 0.00 175.26 177.05 2hmk h ARG 183 N 7.85 0.41 -4.80 1.61 9.65 -1.92 -3.40 114.38 123.78 2hmk h ARG 183 Ca -0.36 -0.26 -0.67 0.00 -1.10 0.00 0.00 59.98 57.59 2hmk h ARG 183 Cb 1.17 0.03 -0.23 0.00 -1.39 0.00 0.00 29.97 29.55 2hmk h ARG 183 CO 0.63 0.85 -0.57 0.42 2.80 0.00 0.00 179.97 184.11 2hmk s ILE 184 N -4.06 4.52 0.25 1.20 1.01 -1.26 -5.02 121.20 117.85 2hmk s ILE 184 Ca -0.14 -0.41 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 2hmk s ILE 184 Cb 0.05 -3.29 -0.09 0.00 0.01 0.00 0.00 42.46 39.14 2hmk s ILE 184 CO 0.78 0.10 1.20 -0.76 0.00 0.00 0.00 174.94 176.25 2hmk s LEU 185 N 1.60 4.48 -0.24 2.97 1.43 -1.26 -4.93 118.68 122.73 2hmk s LEU 185 Ca 0.05 2.36 0.10 0.00 -1.03 0.00 0.00 54.13 55.60 2hmk s LEU 185 Cb -0.17 -3.62 0.44 0.00 0.03 0.00 0.00 46.19 42.86 2hmk s LEU 185 CO 0.06 -0.34 1.23 0.00 0.23 0.00 0.00 176.35 177.52 2hmk n GLN 186 N 1.73 2.13 -0.13 1.70 6.02 -1.26 -4.64 117.38 122.92 2hmk n GLN 186 Ca 0.02 -3.52 0.08 0.00 -0.01 0.00 0.00 57.00 53.56 2hmk n GLN 186 Cb 0.44 -1.80 0.11 0.00 1.02 0.00 0.00 30.24 30.00 2hmk n GLN 186 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2hmk n THR 187 N -1.01 1.51 0.00 5.09 -2.24 -1.26 -4.98 114.28 111.38 2hmk n THR 187 Ca 0.26 -1.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.24 2hmk n THR 187 Cb 0.78 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 2hmk n THR 187 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2hmk n HIS 188 N -1.13 0.00 -3.84 4.78 8.25 -1.26 -4.76 115.22 117.26 2hmk n HIS 188 Ca 0.12 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.53 2hmk n HIS 188 Cb 0.62 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.75 2hmk n HIS 188 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2hmk s ASN 189 N 0.00 -0.04 -0.38 0.41 2.20 -1.26 -5.04 114.94 110.83 2hmk s ASN 189 Ca 0.00 -0.76 0.05 0.00 -0.94 0.00 0.00 52.86 51.21 2hmk s ASN 189 Cb 0.00 0.61 0.47 0.00 -2.00 0.00 0.00 41.25 40.33 2hmk s ASN 189 CO 0.00 -1.20 1.46 -0.11 -2.94 0.00 0.00 177.10 174.31 2hmk n LEU 190 N -0.60 5.34 -2.27 3.54 0.00 -1.26 -4.90 117.00 116.85 2hmk n LEU 190 Ca -0.05 -4.39 -0.18 0.00 0.00 0.00 0.00 56.01 51.39 2hmk n LEU 190 Cb 0.60 -0.57 -0.14 0.00 0.00 0.00 0.00 43.42 43.31 2hmk n LEU 190 CO 0.21 1.74 1.95 0.23 0.00 0.00 0.00 177.39 181.52 2hmk n MET 191 N -0.87 2.35 -4.11 1.96 2.81 -1.26 -4.78 117.12 113.22 2hmk n MET 191 Ca 0.45 -1.30 -0.15 0.00 -1.81 0.00 0.00 57.70 54.89 2hmk n MET 191 Cb 0.91 -2.16 -0.12 0.00 -0.71 0.00 0.00 33.22 31.14 2hmk n MET 191 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2hmk s VAL 192 N 1.03 0.68 -0.56 2.03 -7.23 -1.26 -5.11 120.40 109.98 2hmk s VAL 192 Ca 0.67 -1.05 -0.23 0.00 -1.81 0.00 0.00 61.98 59.56 2hmk s VAL 192 Cb 0.30 -0.71 0.05 0.00 0.56 0.00 0.00 36.38 36.58 2hmk s VAL 192 CO -0.02 -0.29 0.90 -0.36 -0.31 0.00 0.00 175.10 175.02 2hmk s PHE 193 N -1.23 2.81 -2.00 2.82 2.99 -1.26 -5.16 117.98 116.96 2hmk s PHE 193 Ca -0.07 -0.19 0.26 0.00 0.00 0.00 0.00 56.93 56.93 2hmk s PHE 193 Cb -0.09 -4.03 1.56 0.00 0.00 0.00 0.00 43.02 40.45 2hmk s PHE 193 CO 0.01 -1.36 1.91 1.28 -0.00 0.00 0.00 175.22 177.06