#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hah n ASP 17 N 0.00 2.56 -4.72 3.42 8.00 -1.26 -5.00 116.55 119.55 3hah n ASP 17 Ca 0.00 -1.96 -0.41 0.00 0.71 0.00 0.00 54.79 53.13 3hah n ASP 17 Cb 0.00 -0.15 -0.04 0.00 -0.02 0.00 0.00 41.12 40.91 3hah n ASP 17 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3hah s SER 18 N -0.98 7.46 0.55 -2.24 0.15 -1.26 -4.91 113.70 112.46 3hah s SER 18 Ca 0.15 1.78 0.44 0.00 0.70 0.00 0.00 55.95 59.02 3hah s SER 18 Cb 0.08 -2.58 1.65 0.00 -1.71 0.00 0.00 66.02 63.46 3hah s SER 18 CO 0.11 -0.12 1.66 0.15 1.20 0.00 0.00 173.24 176.24 3hah h PHE 19 N 5.83 0.04 0.00 3.44 3.04 -1.96 0.25 116.94 127.58 3hah h PHE 19 Ca -0.42 0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.49 3hah h PHE 19 Cb 1.21 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.71 3hah h PHE 19 CO 0.65 -0.01 -0.17 -1.49 -2.02 0.00 0.00 178.31 175.27 3hah h TRP 20 N 0.01 0.00 -4.04 0.41 4.06 -1.92 -3.37 115.95 111.10 3hah h TRP 20 Ca 0.80 0.00 -0.53 0.00 2.06 0.00 0.00 58.89 61.22 3hah h TRP 20 Cb 3.16 0.00 0.10 0.00 -1.00 0.00 0.00 29.16 31.42 3hah h TRP 20 CO -0.00 0.17 0.52 -1.21 -3.56 0.00 0.00 178.44 174.36 3hah s GLU 21 N -3.25 3.36 0.05 0.49 0.41 0.88 -4.90 118.70 115.74 3hah s GLU 21 Ca 0.05 1.95 -0.30 0.00 -0.41 0.00 0.00 54.97 56.25 3hah s GLU 21 Cb 0.07 -2.24 -0.08 0.00 -1.78 0.00 0.00 34.13 30.09 3hah s GLU 21 CO 0.67 -0.92 1.77 0.08 -0.49 0.00 0.00 175.26 176.36 3hah s VAL 22 N -1.47 3.02 0.00 2.63 1.01 -1.26 -2.25 120.40 122.07 3hah s VAL 22 Ca 0.70 0.32 0.00 0.00 0.00 0.00 0.00 61.98 63.00 3hah s VAL 22 Cb -0.33 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 32.84 3hah s VAL 22 CO 0.39 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.09 3hah n GLY 23 N 4.20 1.96 0.13 4.51 0.00 -1.26 -4.94 105.19 109.79 3hah n GLY 23 Ca 0.17 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.29 3hah n GLY 23 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hah n ASN 24 N 0.00 0.40 0.06 1.61 4.13 -0.95 -2.56 115.26 117.94 3hah n ASN 24 Ca 0.00 -1.49 0.09 0.00 1.68 0.00 0.00 54.58 54.87 3hah n ASN 24 Cb 0.00 -0.02 0.39 0.00 -1.54 0.00 0.00 39.78 38.61 3hah n ASN 24 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3hah n TYR 25 N -0.52 0.38 0.05 3.10 0.18 -1.26 -3.45 117.16 115.63 3hah n TYR 25 Ca 0.14 0.15 0.06 0.00 1.88 0.00 0.00 57.90 60.13 3hah n TYR 25 Cb 0.13 -0.74 0.48 0.00 -0.38 0.00 0.00 39.34 38.83 3hah n TYR 25 CO 0.00 0.00 0.00 1.57 -2.08 0.00 0.00 176.86 176.35 3hah h LYS 26 N 0.00 0.40 -0.48 -3.48 -0.00 -1.89 -1.27 116.57 109.86 3hah h LYS 26 Ca 0.00 -0.02 0.01 0.00 -0.00 0.00 0.00 60.65 60.64 3hah h LYS 26 Cb 0.30 -0.09 -0.03 0.00 -0.00 0.00 0.00 32.23 32.42 3hah h LYS 26 CO 0.00 0.26 0.31 0.00 -0.00 0.00 0.00 179.45 180.02 3hah h ARG 27 N 0.41 0.60 0.00 0.07 3.08 -1.85 0.27 114.38 116.96 3hah h ARG 27 Ca 0.13 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 3hah h ARG 27 Cb 0.02 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 29.94 3hah h ARG 27 CO -0.03 0.40 -0.06 1.15 -1.07 0.00 0.00 179.97 180.36 3hah h THR 28 N 0.62 0.63 0.01 2.04 2.02 -1.49 -1.45 112.91 115.29 3hah h THR 28 Ca 0.18 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 67.12 3hah h THR 28 Cb -0.04 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 3hah h THR 28 CO -0.06 0.06 -0.00 0.58 0.37 0.00 0.00 175.52 176.47 3hah h VAL 29 N 0.00 1.62 -0.78 3.16 2.07 -0.49 -3.28 116.25 118.55 3hah h VAL 29 Ca -0.00 -1.98 0.16 0.00 0.82 0.00 0.00 66.70 65.70 3hah h VAL 29 Cb 0.14 2.95 -0.11 0.00 -1.52 0.00 0.00 31.29 32.76 3hah h VAL 29 CO 0.01 0.51 0.29 0.11 0.02 0.00 0.00 177.57 178.50 3hah h LYS 30 N -0.87 0.38 -1.30 1.57 6.56 -0.27 0.89 116.57 123.53 3hah h LYS 30 Ca -0.00 -0.02 0.45 0.00 -1.06 0.00 0.00 60.65 60.02 3hah h LYS 30 Cb 0.83 -0.09 -0.14 0.00 -0.57 0.00 0.00 32.23 32.27 3hah h LYS 30 CO 0.00 0.25 0.82 -0.09 -2.06 0.00 0.00 179.45 178.37 3hah h ARG 31 N 0.39 0.05 0.74 3.15 1.12 -1.33 0.51 114.38 119.02 3hah h ARG 31 Ca 0.45 -0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 59.28 3hah h ARG 31 Cb 0.74 -0.01 0.01 0.00 -0.01 0.00 0.00 29.97 30.70 3hah h ARG 31 CO -0.46 0.03 -0.36 0.82 -3.11 0.00 0.00 179.97 176.89 3hah h ILE 32 N 0.05 0.05 -0.61 1.20 1.08 -0.90 -2.44 117.51 115.94 3hah h ILE 32 Ca 0.85 -0.25 0.12 0.00 -0.39 0.00 0.00 64.86 65.19 3hah h ILE 32 Cb 2.62 0.07 -0.12 0.00 -3.07 0.00 0.00 36.82 36.32 3hah h ILE 32 CO -0.49 0.01 -0.22 0.44 -0.69 0.00 0.00 178.15 177.19 3hah h ASP 33 N -1.24 -0.78 -0.80 1.72 3.45 -1.22 -1.33 116.42 116.23 3hah h ASP 33 Ca -0.10 0.20 0.15 0.00 0.43 0.00 0.00 57.03 57.71 3hah h ASP 33 Cb 0.78 0.45 -0.15 0.00 -0.56 0.00 0.00 39.33 39.85 3hah h ASP 33 CO 0.17 -0.25 -0.26 0.44 -1.57 0.00 0.00 179.24 177.77 3hah h ASP 34 N -0.07 -0.93 -0.78 6.45 3.32 -0.88 -0.65 116.42 122.88 3hah h ASP 34 Ca 0.28 0.25 0.18 0.00 0.02 0.00 0.00 57.03 57.76 3hah h ASP 34 Cb 0.50 0.56 -0.12 0.00 0.22 0.00 0.00 39.33 40.49 3hah h ASP 34 CO -0.66 -0.28 0.20 1.23 -1.72 0.00 0.00 179.24 178.01 3hah h GLY 35 N -0.03 1.12 0.98 2.75 0.00 -0.73 0.36 103.07 107.52 3hah h GLY 35 Ca 0.36 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.65 3hah h GLY 35 CO -0.84 -0.24 0.18 0.84 0.00 0.00 0.00 176.54 176.48 3hah h HIS 36 N 0.27 0.38 0.07 5.60 -0.00 -1.15 -1.64 115.15 118.68 3hah h HIS 36 Ca 0.45 0.00 -0.00 0.00 -0.00 0.00 0.00 60.37 60.82 3hah h HIS 36 Cb 0.81 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 28.09 3hah h HIS 36 CO -0.26 0.28 -0.05 -0.09 -0.00 0.00 0.00 177.93 177.81 3hah h ARG 37 N 0.37 -0.12 -0.42 5.26 1.12 -0.51 -1.88 114.38 118.21 3hah h ARG 37 Ca 0.10 0.01 0.12 0.00 -1.11 0.00 0.00 59.98 59.10 3hah h ARG 37 Cb 0.00 0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 29.97 3hah h ARG 37 CO -0.02 -0.08 0.32 -0.07 -3.11 0.00 0.00 179.97 177.02 3hah h LEU 38 N -0.12 0.00 -0.06 3.80 3.38 -0.26 0.47 115.31 122.52 3hah h LEU 38 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3hah h LEU 38 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3hah h LEU 38 CO 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.50 3hah h ASN 40 N -0.26 -1.43 -0.47 0.00 4.21 -0.18 -1.31 115.58 116.13 3hah h ASN 40 Ca 0.01 0.21 0.09 0.00 1.21 0.00 0.00 56.30 57.82 3hah h ASN 40 Cb 0.47 0.61 -0.07 0.00 -1.12 0.00 0.00 38.32 38.21 3hah h ASN 40 CO 0.01 -0.38 0.02 0.44 -1.29 0.00 0.00 177.43 176.23 3hah h ASP 41 N -0.36 -0.15 -0.69 5.81 5.19 0.08 -0.91 116.42 125.39 3hah h ASP 41 Ca 0.12 0.10 0.01 0.00 -0.62 0.00 0.00 57.03 56.65 3hah h ASP 41 Cb 0.59 0.18 -0.04 0.00 0.18 0.00 0.00 39.33 40.24 3hah h ASP 41 CO -0.54 -0.04 0.45 0.25 -3.12 0.00 0.00 179.24 176.24 3hah h LEU 42 N 0.14 0.77 -0.36 1.55 6.46 -0.80 -0.84 115.31 122.23 3hah h LEU 42 Ca 0.23 -0.02 0.01 0.00 -0.12 0.00 0.00 57.88 57.99 3hah h LEU 42 Cb 0.34 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.06 3hah h LEU 42 CO -0.37 0.55 0.22 0.24 -0.62 0.00 0.00 178.44 178.46 3hah h MET 43 N 0.91 0.44 -0.11 1.25 2.86 -0.01 -1.10 114.93 119.16 3hah h MET 43 Ca 0.26 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 3hah h MET 43 Cb -0.08 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.48 3hah h MET 43 CO -0.07 0.29 0.02 -0.91 1.06 0.00 0.00 176.91 177.30 3hah h ASN 44 N 0.45 0.18 -0.52 1.22 2.35 -1.17 -0.82 115.58 117.26 3hah h ASN 44 Ca 0.14 -0.25 0.09 0.00 -0.55 0.00 0.00 56.30 55.73 3hah h ASN 44 Cb -0.01 -0.05 -0.10 0.00 0.05 0.00 0.00 38.32 38.21 3hah h ASN 44 CO -0.06 0.39 -0.38 0.00 -1.65 0.00 0.00 177.43 175.73 3hah h VAL 46 N -0.23 1.14 -0.49 0.00 2.07 -1.07 -2.32 116.25 115.34 3hah h VAL 46 Ca 0.19 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.46 3hah h VAL 46 Cb 0.56 0.69 -0.08 0.00 -1.52 0.00 0.00 31.29 30.94 3hah h VAL 46 CO -0.64 0.14 0.02 -0.61 0.02 0.00 0.00 177.57 176.50 3hah h GLN 47 N 0.48 0.13 -0.21 1.57 4.15 -0.17 -1.49 115.11 119.57 3hah h GLN 47 Ca 0.13 -0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.47 3hah h GLN 47 Cb 0.04 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 3hah h GLN 47 CO -0.02 0.09 -0.18 0.93 -1.93 0.00 0.00 178.83 177.72 3hah h GLU 48 N 0.13 0.36 -0.24 1.69 5.08 -0.37 -1.40 114.58 119.84 3hah h GLU 48 Ca 0.25 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 3hah h GLU 48 Cb 0.37 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3hah h GLU 48 CO -0.40 0.54 -0.28 -0.09 -1.00 0.00 0.00 179.01 177.77 3hah h ARG 49 N 0.33 0.46 -0.40 2.33 9.65 -0.87 -3.04 114.38 122.85 3hah h ARG 49 Ca 0.06 -0.18 -0.05 0.00 -1.10 0.00 0.00 59.98 58.71 3hah h ARG 49 Cb 0.51 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.05 3hah h ARG 49 CO 0.03 0.71 0.06 0.00 2.80 0.00 0.00 179.97 183.57 3hah h ALA 50 N 1.30 0.54 0.00 2.80 0.00 -0.26 -1.84 119.26 121.79 3hah h ALA 50 Ca 0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 3hah h ALA 50 Cb 0.71 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 3hah h ALA 50 CO 0.05 0.26 -0.08 -0.22 0.00 0.00 0.00 179.25 179.27 3hah h LYS 51 N 0.52 0.00 0.18 0.00 3.64 -1.34 -1.04 116.57 118.53 3hah h LYS 51 Ca 0.12 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.26 3hah h LYS 51 Cb 0.38 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 32.23 3hah h LYS 51 CO 0.01 0.08 -1.07 0.82 -2.27 0.00 0.00 179.45 177.01 3hah h ILE 52 N 0.00 1.42 0.00 2.00 2.04 -1.36 -2.62 117.51 118.99 3hah h ILE 52 Ca -0.00 -2.58 -0.03 0.00 1.00 0.00 0.00 64.86 63.25 3hah h ILE 52 Cb 0.33 3.11 -0.00 0.00 -0.74 0.00 0.00 36.82 39.52 3hah h ILE 52 CO 0.01 0.75 -0.14 -0.33 0.00 0.00 0.00 178.15 178.43 3hah h GLU 53 N -0.15 0.00 0.21 2.37 4.39 -0.53 -2.53 114.58 118.34 3hah h GLU 53 Ca -0.18 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.24 3hah h GLU 53 Cb 1.84 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 30.52 3hah h GLU 53 CO 0.20 0.14 -1.20 -0.22 -1.16 0.00 0.00 179.01 176.78 3hah h LYS 54 N 0.00 0.44 -0.70 2.33 3.64 -1.26 -2.87 116.57 118.15 3hah h LYS 54 Ca -0.00 -0.75 -0.00 0.00 -1.27 0.00 0.00 60.65 58.63 3hah h LYS 54 Cb 0.41 0.28 -0.03 0.00 -0.41 0.00 0.00 32.23 32.47 3hah h LYS 54 CO 0.02 1.36 0.42 0.00 -2.27 0.00 0.00 179.45 178.98 3hah h ALA 55 N 0.12 1.42 -0.06 5.00 0.00 -1.17 0.67 119.26 125.24 3hah h ALA 55 Ca -0.21 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.41 3hah h ALA 55 Cb 1.94 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.45 3hah h ALA 55 CO 0.22 0.50 -0.81 -0.92 0.00 0.00 0.00 179.25 178.25 3hah h TYR 56 N 0.97 0.63 -0.00 0.00 3.20 -1.53 -2.04 116.97 118.20 3hah h TYR 56 Ca 0.25 -0.30 -0.16 0.00 3.14 0.00 0.00 58.73 61.66 3hah h TYR 56 Cb -0.03 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 3hah h TYR 56 CO 0.00 1.09 -0.77 0.78 -1.64 0.00 0.00 178.16 177.62 3hah h GLY 57 N 1.18 0.04 0.98 1.82 0.00 -1.22 -1.97 103.07 103.90 3hah h GLY 57 Ca -0.05 -0.06 -0.14 0.00 0.00 0.00 0.00 47.33 47.08 3hah h GLY 57 CO 0.14 0.06 -0.38 -1.61 0.00 0.00 0.00 176.54 174.75 3hah h GLN 58 N 0.02 0.69 -0.13 4.80 5.75 -0.81 -2.62 115.11 122.82 3hah h GLN 58 Ca -0.01 -0.41 -0.12 0.00 -0.15 0.00 0.00 58.65 57.96 3hah h GLN 58 Cb 1.36 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.93 3hah h GLN 58 CO 0.10 1.03 -0.43 1.96 -2.65 0.00 0.00 178.83 178.85 3hah h GLN 59 N 0.41 0.29 -0.65 1.69 4.20 -1.31 -1.77 115.11 117.97 3hah h GLN 59 Ca 0.02 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.54 3hah h GLN 59 Cb 0.97 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.72 3hah h GLN 59 CO 0.09 0.68 0.25 -0.07 -0.67 0.00 0.00 178.83 179.10 3hah h LEU 60 N 0.24 0.91 -0.41 1.46 3.38 -1.32 -2.07 115.31 117.50 3hah h LEU 60 Ca 0.02 -0.18 -0.16 0.00 0.09 0.00 0.00 57.88 57.65 3hah h LEU 60 Cb 0.86 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 3hah h LEU 60 CO 0.07 0.84 -0.45 0.71 0.09 0.00 0.00 178.44 179.71 3hah h THR 61 N 0.93 1.28 -0.22 0.22 1.35 -1.06 -1.03 112.91 114.38 3hah h THR 61 Ca 0.22 -1.63 0.00 0.00 -0.55 0.00 0.00 66.41 64.45 3hah h THR 61 Cb 0.23 1.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.14 3hah h THR 61 CO -0.02 0.53 0.15 0.44 -0.25 0.00 0.00 175.52 176.37 3hah h ASP 62 N 0.67 0.25 -0.78 5.36 5.19 -1.29 0.14 116.42 125.96 3hah h ASP 62 Ca 0.04 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.44 3hah h ASP 62 Cb 1.03 -0.06 -0.04 0.00 0.18 0.00 0.00 39.33 40.44 3hah h ASP 62 CO 0.10 0.19 0.50 -0.25 -3.12 0.00 0.00 179.24 176.66 3hah h TRP 63 N 0.30 1.01 -0.20 4.55 7.01 -1.30 0.31 115.95 127.62 3hah h TRP 63 Ca 0.08 0.01 -0.09 0.00 2.11 0.00 0.00 58.89 61.00 3hah h TRP 63 Cb -0.03 -0.34 -0.01 0.00 -2.10 0.00 0.00 29.16 26.68 3hah h TRP 63 CO -0.06 0.65 -0.28 0.00 -2.79 0.00 0.00 178.44 175.96 3hah h ALA 64 N 1.27 1.15 0.62 2.65 0.00 -0.59 -2.16 119.26 122.20 3hah h ALA 64 Ca 0.29 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3hah h ALA 64 Cb -0.09 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.60 3hah h ALA 64 CO -0.06 0.54 -0.30 -0.22 0.00 0.00 0.00 179.25 179.22 3hah h LYS 65 N 0.34 -0.80 -0.63 0.00 3.64 -0.08 -1.23 116.57 117.82 3hah h LYS 65 Ca 0.05 0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.54 3hah h LYS 65 Cb 0.67 0.18 -0.08 0.00 -0.41 0.00 0.00 32.23 32.60 3hah h LYS 65 CO 0.05 -0.49 -0.36 0.54 -2.27 0.00 0.00 179.45 176.92 3hah n ARG 66 N -5.35 -0.27 0.06 1.90 5.12 0.04 -2.36 116.66 115.79 3hah n ARG 66 Ca -0.11 0.95 0.01 0.00 -1.93 0.00 0.00 57.85 56.76 3hah n ARG 66 Cb 0.35 -1.39 -0.06 0.00 -1.16 0.00 0.00 32.46 30.20 3hah n ARG 66 CO 0.00 0.00 0.00 -1.49 -1.93 0.00 0.00 177.63 174.21 3hah h TRP 67 N 0.00 0.00 -0.74 -1.55 4.06 -1.38 -1.32 115.95 115.02 3hah h TRP 67 Ca 0.11 0.00 0.05 0.00 2.06 0.00 0.00 58.89 61.11 3hah h TRP 67 Cb 0.26 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.38 3hah h TRP 67 CO -0.64 0.56 0.49 -0.09 -3.56 0.00 0.00 178.44 175.20 3hah h ARG 68 N 0.00 0.81 0.01 0.49 2.43 -0.86 0.72 114.38 117.97 3hah h ARG 68 Ca -0.12 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 3hah h ARG 68 Cb 1.53 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 3hah h ARG 68 CO 0.05 0.54 -0.06 0.37 -1.51 0.00 0.00 179.97 179.36 3hah h GLN 69 N 0.83 0.03 0.00 0.20 4.15 -1.28 -2.72 115.11 116.33 3hah h GLN 69 Ca 0.31 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.65 3hah h GLN 69 Cb 0.17 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 3hah h GLN 69 CO -0.10 0.90 -0.20 -0.07 -1.93 0.00 0.00 178.83 177.44 3hah h LEU 70 N -0.82 0.00 0.11 -2.39 3.38 -1.06 -0.35 115.31 114.17 3hah h LEU 70 Ca -0.01 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 3hah h LEU 70 Cb 0.93 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.70 3hah h LEU 70 CO 0.01 0.20 -1.26 0.40 0.09 0.00 0.00 178.44 177.88 3hah h ILE 71 N 0.00 1.37 0.91 1.22 2.04 -0.96 -2.80 117.51 119.30 3hah h ILE 71 Ca -0.00 -2.71 -0.04 0.00 1.00 0.00 0.00 64.86 63.10 3hah h ILE 71 Cb 0.41 2.82 0.01 0.00 -0.74 0.00 0.00 36.82 39.31 3hah h ILE 71 CO 0.03 0.81 -0.44 -0.08 0.00 0.00 0.00 178.15 178.46 3hah h GLU 72 N 0.17 -1.18 0.00 2.37 4.57 -1.11 -3.14 114.58 116.26 3hah h GLU 72 Ca -0.17 0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 3hah h GLU 72 Cb 1.95 0.27 0.00 0.00 -0.16 0.00 0.00 28.75 30.81 3hah h GLU 72 CO 0.23 -0.79 0.00 1.63 -1.18 0.00 0.00 179.01 178.90 3hah n LYS 73 N -5.60 0.05 -2.45 1.92 5.02 -0.18 -4.80 118.16 112.11 3hah n LYS 73 Ca -0.16 0.34 -0.25 0.00 -2.02 0.00 0.00 58.31 56.22 3hah n LYS 73 Cb 0.49 -1.61 0.12 0.00 -0.02 0.00 0.00 35.03 34.01 3hah n LYS 73 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3hah s GLY 74 N -3.15 1.76 0.00 0.72 0.00 -1.06 -4.99 107.32 100.60 3hah s GLY 74 Ca 0.05 -1.61 0.24 0.00 0.00 0.00 0.00 44.72 43.41 3hah s GLY 74 CO 0.26 -1.00 1.84 -1.05 0.00 0.00 0.00 173.10 173.14 3hah n PRO 75 N -3.02 0.83 -2.63 2.90 -0.02 -1.26 -4.85 135.00 126.95 3hah n PRO 75 Ca 0.15 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.21 3hah n PRO 75 Cb 0.60 -1.46 -0.04 0.00 -0.02 0.00 0.00 33.50 32.59 3hah n PRO 75 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3hah s GLN 76 N -2.00 4.58 0.28 -0.52 2.00 -1.26 -5.01 119.66 117.73 3hah s GLN 76 Ca 0.36 1.54 0.01 0.00 -2.00 0.00 0.00 55.36 55.27 3hah s GLN 76 Cb 0.17 -3.39 -0.02 0.00 0.80 0.00 0.00 33.01 30.56 3hah s GLN 76 CO 0.28 0.01 0.29 1.52 -0.50 0.00 0.00 175.29 176.89 3hah s TYR 77 N 0.54 1.28 0.00 1.67 1.13 -1.26 -4.77 117.35 115.94 3hah s TYR 77 Ca 0.51 -1.40 0.00 0.00 -1.41 0.00 0.00 57.07 54.77 3hah s TYR 77 Cb -0.24 -0.45 0.00 0.00 -1.10 0.00 0.00 41.96 40.17 3hah s TYR 77 CO 0.30 -0.86 0.00 0.41 -2.51 0.00 0.00 175.55 172.89 3hah n GLY 78 N -0.47 -0.34 0.16 5.49 0.00 -1.26 -3.19 105.19 105.58 3hah n GLY 78 Ca 0.03 -1.07 -0.14 0.00 0.00 0.00 0.00 46.02 44.85 3hah n GLY 78 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hah h SER 79 N 6.85 0.56 0.44 1.61 4.64 -1.93 -3.11 113.55 122.60 3hah h SER 79 Ca 0.00 -0.45 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 3hah h SER 79 Cb 0.00 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 61.92 3hah h SER 79 CO 0.00 1.25 -0.06 -0.07 -0.87 0.00 0.00 176.83 177.09 3hah h LEU 80 N 0.23 0.00 -0.34 5.97 3.38 -1.87 0.22 115.31 122.91 3hah h LEU 80 Ca -0.09 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.71 3hah h LEU 80 Cb 1.60 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.35 3hah h LEU 80 CO 0.17 0.06 -0.52 -0.08 0.09 0.00 0.00 178.44 178.16 3hah h GLU 81 N 0.00 0.86 -0.22 1.13 4.81 -1.50 -2.36 114.58 117.30 3hah h GLU 81 Ca -0.00 -0.53 -0.06 0.00 -0.13 0.00 0.00 59.36 58.64 3hah h GLU 81 Cb 0.30 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 3hah h GLU 81 CO 0.01 1.16 -0.11 0.00 -0.73 0.00 0.00 179.01 179.34 3hah h ARG 82 N 0.67 0.46 -0.49 1.92 3.08 -0.99 -1.59 114.38 117.44 3hah h ARG 82 Ca 0.02 -0.20 0.04 0.00 0.07 0.00 0.00 59.98 59.91 3hah h ARG 82 Cb 1.12 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.11 3hah h ARG 82 CO 0.12 0.74 0.25 0.00 -1.07 0.00 0.00 179.97 180.01 3hah h ALA 83 N 0.71 0.63 -0.67 0.04 0.00 -0.71 0.12 119.26 119.38 3hah h ALA 83 Ca 0.05 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3hah h ALA 83 Cb 0.61 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3hah h ALA 83 CO 0.03 -0.10 0.40 2.35 0.00 0.00 0.00 179.25 181.93 3hah h TRP 84 N 0.49 0.89 0.00 0.00 7.01 -1.41 -2.07 115.95 120.86 3hah h TRP 84 Ca 0.22 -0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.21 3hah h TRP 84 Cb 0.12 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 26.89 3hah h TRP 84 CO -0.10 0.60 0.00 0.78 -2.79 0.00 0.00 178.44 176.93 3hah h GLY 85 N 0.97 0.00 2.00 2.65 0.00 -0.05 -2.89 103.07 105.75 3hah h GLY 85 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 3hah h GLY 85 CO -0.04 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.50 3hah h ALA 86 N 2.14 1.00 -0.07 3.60 0.00 -0.09 -2.89 119.26 122.95 3hah h ALA 86 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3hah h ALA 86 Cb 0.67 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.47 3hah h ALA 86 CO 0.00 0.00 -0.51 0.82 0.00 0.00 0.00 179.25 179.56 3hah h ILE 87 N 0.00 1.39 0.00 0.00 2.04 -1.58 -2.58 117.51 116.78 3hah h ILE 87 Ca 0.00 -1.89 0.00 0.00 1.00 0.00 0.00 64.86 63.97 3hah h ILE 87 Cb 0.38 2.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.78 3hah h ILE 87 CO 0.00 0.56 0.00 0.24 0.00 0.00 0.00 178.15 178.95 3hah h MET 88 N 0.02 0.00 -0.04 2.37 2.86 -1.67 -1.72 114.93 116.75 3hah h MET 88 Ca -0.04 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.57 3hah h MET 88 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 3hah h MET 88 CO 0.10 0.00 -0.08 1.15 1.06 0.00 0.00 176.91 179.15 3hah h THR 89 N 0.00 1.44 -0.80 2.22 2.02 -1.45 -1.91 112.91 114.42 3hah h THR 89 Ca 0.00 -1.41 0.05 0.00 0.77 0.00 0.00 66.41 65.83 3hah h THR 89 Cb 0.23 2.28 -0.05 0.00 -1.74 0.00 0.00 68.15 68.88 3hah h THR 89 CO 0.00 0.38 0.53 1.05 0.37 0.00 0.00 175.52 177.85 3hah h GLU 90 N -0.41 0.89 -0.70 6.66 -0.00 -1.01 0.27 114.58 120.28 3hah h GLU 90 Ca 0.00 -0.05 -0.01 0.00 -0.00 0.00 0.00 59.36 59.29 3hah h GLU 90 Cb 0.66 -0.20 -0.03 0.00 -0.00 0.00 0.00 28.75 29.17 3hah h GLU 90 CO 0.02 0.59 0.38 0.00 -0.00 0.00 0.00 179.01 179.99 3hah h ALA 91 N 1.55 1.35 0.45 1.06 0.00 -1.23 0.28 119.26 122.72 3hah h ALA 91 Ca 0.34 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 3hah h ALA 91 Cb 0.16 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3hah h ALA 91 CO -0.11 0.53 -0.21 -0.44 0.00 0.00 0.00 179.25 179.02 3hah h ASP 92 N 0.98 -0.51 -1.00 0.00 3.32 -0.55 -1.75 116.42 116.91 3hah h ASP 92 Ca 0.25 -0.09 0.06 0.00 0.02 0.00 0.00 57.03 57.27 3hah h ASP 92 Cb 0.03 0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 3hah h ASP 92 CO -0.04 -0.10 0.65 0.11 -1.72 0.00 0.00 179.24 178.14 3hah h LYS 93 N -1.01 1.17 -0.57 3.56 1.57 -0.62 -0.53 116.57 120.14 3hah h LYS 93 Ca -0.06 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.55 3hah h LYS 93 Cb 0.56 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 3hah h LYS 93 CO 0.10 0.78 -0.04 0.28 -0.57 0.00 0.00 179.45 180.00 3hah h VAL 94 N 1.21 1.26 -0.38 0.50 2.07 -0.53 -2.66 116.25 117.72 3hah h VAL 94 Ca 0.42 -1.18 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 3hah h VAL 94 Cb 0.11 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3hah h VAL 94 CO -0.16 0.42 0.21 -1.28 0.02 0.00 0.00 177.57 176.78 3hah h SER 95 N 0.92 0.47 -0.40 0.57 0.87 -0.19 -2.01 113.55 113.79 3hah h SER 95 Ca 0.16 -0.09 0.08 0.00 -1.23 0.00 0.00 61.79 60.71 3hah h SER 95 Cb 0.59 -0.12 -0.08 0.00 -0.44 0.00 0.00 62.40 62.34 3hah h SER 95 CO 0.04 0.43 -0.14 -0.08 -0.53 0.00 0.00 176.83 176.55 3hah h GLU 96 N 0.48 -0.05 -0.91 2.24 4.81 -1.16 0.11 114.58 120.10 3hah h GLU 96 Ca 0.13 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.47 3hah h GLU 96 Cb 0.06 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.39 3hah h GLU 96 CO -0.02 -0.03 0.58 -0.07 -0.73 0.00 0.00 179.01 178.74 3hah h LEU 97 N -0.05 0.80 -0.44 1.64 3.38 -1.07 0.65 115.31 120.22 3hah h LEU 97 Ca 0.20 0.03 -0.17 0.00 0.09 0.00 0.00 57.88 58.02 3hah h LEU 97 Cb 0.35 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3hah h LEU 97 CO -0.44 0.46 -0.77 0.45 0.09 0.00 0.00 178.44 178.23 3hah h HIS 98 N 0.88 0.26 0.00 1.13 3.86 -0.65 -0.74 115.15 119.88 3hah h HIS 98 Ca 0.43 -0.13 -0.12 0.00 -1.16 0.00 0.00 60.37 59.39 3hah h HIS 98 Cb 0.45 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 3hah h HIS 98 CO -0.00 0.88 -0.57 0.37 0.86 0.00 0.00 177.93 179.46 3hah h GLN 99 N 0.12 0.00 -0.30 2.45 5.75 0.66 -1.11 115.11 122.68 3hah h GLN 99 Ca -0.03 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.30 3hah h GLN 99 Cb 1.35 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.89 3hah h GLN 99 CO 0.12 0.57 -0.49 1.49 -2.65 0.00 0.00 178.83 177.87 3hah h GLU 100 N 0.00 0.84 -0.64 1.69 4.81 0.38 -2.86 114.58 118.79 3hah h GLU 100 Ca -0.01 -0.50 -0.05 0.00 -0.13 0.00 0.00 59.36 58.68 3hah h GLU 100 Cb 1.11 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.50 3hah h GLU 100 CO 0.07 1.13 0.19 0.28 -0.73 0.00 0.00 179.01 179.95 3hah h VAL 101 N 0.66 1.24 -0.14 0.32 2.07 -0.63 -1.33 116.25 118.44 3hah h VAL 101 Ca 0.03 -0.85 -0.05 0.00 0.82 0.00 0.00 66.70 66.65 3hah h VAL 101 Cb 1.08 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 3hah h VAL 101 CO 0.11 0.33 -0.14 0.50 0.02 0.00 0.00 177.57 178.38 3hah h LYS 102 N 0.95 0.23 0.06 1.57 3.64 -1.10 -2.47 116.57 119.45 3hah h LYS 102 Ca 0.21 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 3hah h LYS 102 Cb 0.29 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3hah h LYS 102 CO -0.01 0.38 -0.40 -0.91 -2.27 0.00 0.00 179.45 176.24 3hah h ASN 103 N 0.22 0.21 0.00 4.20 -0.26 -1.26 -2.71 115.58 115.97 3hah h ASN 103 Ca 0.04 -0.97 0.00 0.00 -0.56 0.00 0.00 56.30 54.82 3hah h ASN 103 Cb 0.39 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.58 3hah h ASN 103 CO 0.02 1.19 0.09 0.59 -1.06 0.00 0.00 177.43 178.26 3hah n ASN 104 N -4.38 0.00 -0.10 5.81 5.03 -0.53 -0.32 115.26 120.77 3hah n ASN 104 Ca -0.12 0.39 -0.11 0.00 0.87 0.00 0.00 54.58 55.60 3hah n ASN 104 Cb 0.64 -0.39 -0.15 0.00 -1.02 0.00 0.00 39.78 38.86 3hah n ASN 104 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3hah n LEU 105 N -1.38 0.54 -0.05 3.41 4.77 -0.94 -3.33 117.00 120.02 3hah n LEU 105 Ca 0.00 0.02 -0.03 0.00 -0.03 0.00 0.00 56.01 55.97 3hah n LEU 105 Cb 0.09 0.24 -0.15 0.00 -2.33 0.00 0.00 43.42 41.27 3hah n LEU 105 CO 0.00 0.56 -0.90 0.18 -1.33 0.00 0.00 177.39 175.90 3hah n LEU 106 N -2.86 0.17 -0.04 2.23 4.77 0.38 -0.65 117.00 120.99 3hah n LEU 106 Ca -0.33 0.07 0.01 0.00 -0.03 0.00 0.00 56.01 55.74 3hah n LEU 106 Cb 1.12 0.29 -0.15 0.00 -2.33 0.00 0.00 43.42 42.36 3hah n LEU 106 CO 0.41 0.31 -0.89 0.59 -1.33 0.00 0.00 177.39 176.48 3hah n ASN 107 N -2.65 0.58 -0.02 -1.43 3.02 0.56 -4.11 115.26 111.20 3hah n ASN 107 Ca -0.21 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.31 3hah n ASN 107 Cb 0.95 1.46 -0.04 0.00 -0.61 0.00 0.00 39.78 41.54 3hah n ASN 107 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hah n GLU 108 N -2.39 3.20 -0.12 3.52 1.02 -1.25 -4.56 120.64 120.05 3hah n GLU 108 Ca -0.15 -0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.72 3hah n GLU 108 Cb 0.77 -1.12 -0.09 0.00 -0.02 0.00 0.00 31.44 30.97 3hah n GLU 108 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3hah n ASP 109 N -2.18 1.75 0.26 1.62 8.00 -1.21 -3.52 116.55 121.27 3hah n ASP 109 Ca -0.08 0.30 0.10 0.00 0.71 0.00 0.00 54.79 55.83 3hah n ASP 109 Cb 0.66 -0.73 0.69 0.00 -0.02 0.00 0.00 41.12 41.71 3hah n ASP 109 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3hah h LEU 110 N -0.89 0.00 0.14 0.64 6.46 -1.10 -2.35 115.31 118.21 3hah h LEU 110 Ca -0.62 0.00 -0.28 0.00 -0.12 0.00 0.00 57.88 56.86 3hah h LEU 110 Cb 1.54 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 41.48 3hah h LEU 110 CO -0.38 0.09 -1.26 -0.33 -0.62 0.00 0.00 178.44 175.94 3hah h GLU 111 N 0.00 0.30 -0.50 1.25 4.39 -1.77 -2.02 114.58 116.22 3hah h GLU 111 Ca -0.00 -0.51 0.05 0.00 0.34 0.00 0.00 59.36 59.24 3hah h GLU 111 Cb 0.20 0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 28.99 3hah h GLU 111 CO 0.01 1.24 0.23 -0.22 -1.16 0.00 0.00 179.01 179.11 3hah h LYS 112 N 0.08 0.43 -0.35 2.33 3.64 -1.47 -1.67 116.57 119.56 3hah h LYS 112 Ca -0.14 -0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.09 3hah h LYS 112 Cb 1.99 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.70 3hah h LYS 112 CO 0.21 0.29 -0.28 0.28 -2.27 0.00 0.00 179.45 177.68 3hah h VAL 113 N 0.45 1.28 -0.73 2.00 2.07 -1.51 -2.46 116.25 117.34 3hah h VAL 113 Ca 0.23 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 3hah h VAL 113 Cb 0.18 1.31 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 3hah h VAL 113 CO -0.19 0.46 0.44 0.50 0.02 0.00 0.00 177.57 178.80 3hah h LYS 114 N 0.62 0.99 -0.00 1.57 3.64 -0.68 -0.32 116.57 122.40 3hah h LYS 114 Ca 0.08 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 3hah h LYS 114 Cb 0.79 -0.21 0.01 0.00 -0.41 0.00 0.00 32.23 32.41 3hah h LYS 114 CO 0.06 0.71 -0.28 -0.91 -2.27 0.00 0.00 179.45 176.76 3hah h ASN 115 N 1.00 0.25 0.01 4.20 2.35 -1.32 0.34 115.58 122.41 3hah h ASN 115 Ca 0.26 -0.77 0.03 0.00 -0.55 0.00 0.00 56.30 55.27 3hah h ASN 115 Cb -0.03 -0.08 -0.04 0.00 0.05 0.00 0.00 38.32 38.22 3hah h ASN 115 CO -0.05 0.99 -0.26 -0.25 -1.65 0.00 0.00 177.43 176.22 3hah h TRP 116 N -0.46 -0.69 -0.34 1.19 7.01 -1.46 -0.74 115.95 120.46 3hah h TRP 116 Ca -0.03 0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.06 3hah h TRP 116 Cb 1.04 0.31 -0.08 0.00 -2.10 0.00 0.00 29.16 28.32 3hah h TRP 116 CO 0.18 -0.35 -0.20 0.37 -2.79 0.00 0.00 178.44 175.64 3hah h GLN 117 N -0.40 -0.15 -0.78 2.65 4.15 -1.08 0.50 115.11 119.99 3hah h GLN 117 Ca 0.06 0.01 0.17 0.00 0.77 0.00 0.00 58.65 59.66 3hah h GLN 117 Cb 0.48 0.04 -0.14 0.00 0.21 0.00 0.00 27.48 28.07 3hah h GLN 117 CO -0.22 -0.10 -0.07 -0.22 -1.93 0.00 0.00 178.83 176.28 3hah h LYS 118 N -0.16 0.05 0.00 1.69 1.63 -0.41 -2.48 116.57 116.89 3hah h LYS 118 Ca 0.17 -0.00 -0.19 0.00 -0.85 0.00 0.00 60.65 59.78 3hah h LYS 118 Cb 0.42 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.01 3hah h LYS 118 CO -0.43 0.03 -1.42 -0.44 -3.45 0.00 0.00 179.45 173.74 3hah h ASP 119 N 0.05 0.00 0.78 4.20 3.32 -0.51 -3.37 116.42 120.90 3hah h ASP 119 Ca 0.41 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 57.21 3hah h ASP 119 Cb 0.70 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.23 3hah h ASP 119 CO -0.74 0.67 -1.20 0.00 -1.72 0.00 0.00 179.24 176.25 3hah h ALA 120 N 1.33 0.30 -3.23 3.45 0.00 -0.78 -3.44 119.26 116.89 3hah h ALA 120 Ca -0.18 -0.97 -0.66 0.00 0.00 0.00 0.00 54.91 53.10 3hah h ALA 120 Cb 1.67 -0.00 -0.29 0.00 0.00 0.00 0.00 17.79 19.17 3hah h ALA 120 CO 0.06 1.18 -0.79 0.71 0.00 0.00 0.00 179.25 180.41 3hah s TYR 121 N -2.67 2.79 -0.24 0.00 2.02 -0.95 -4.98 117.35 113.32 3hah s TYR 121 Ca -0.02 -0.88 -0.03 0.00 -0.37 0.00 0.00 57.07 55.77 3hah s TYR 121 Cb 0.09 -1.88 0.01 0.00 -0.40 0.00 0.00 41.96 39.78 3hah s TYR 121 CO 0.84 -0.37 -0.04 -1.01 -1.57 0.00 0.00 175.55 173.40 3hah s HIS 122 N 0.66 3.04 0.56 2.71 3.76 -1.26 -4.72 115.29 120.03 3hah s HIS 122 Ca -0.07 -1.32 -0.16 0.00 -0.15 0.00 0.00 55.06 53.36 3hah s HIS 122 Cb -0.16 -2.09 -0.06 0.00 1.11 0.00 0.00 32.58 31.39 3hah s HIS 122 CO 0.02 -0.66 1.02 0.21 -0.85 0.00 0.00 174.74 174.48 3hah s LYS 123 N 1.39 3.63 -0.23 1.40 2.20 -1.26 -1.72 119.74 125.15 3hah s LYS 123 Ca 0.02 1.05 -0.19 0.00 -0.36 0.00 0.00 55.97 56.49 3hah s LYS 123 Cb -0.16 -2.08 -0.03 0.00 -1.51 0.00 0.00 37.83 34.05 3hah s LYS 123 CO -0.04 -0.54 0.55 -0.65 -0.36 0.00 0.00 175.35 174.31 3hah s GLN 124 N -4.16 4.13 0.56 4.03 -0.21 -0.50 -4.72 119.66 118.79 3hah s GLN 124 Ca 0.61 0.42 0.46 0.00 0.02 0.00 0.00 55.36 56.87 3hah s GLN 124 Cb -0.13 -3.61 1.64 0.00 1.00 0.00 0.00 33.01 31.92 3hah s GLN 124 CO 0.36 -0.27 1.61 0.82 -2.12 0.00 0.00 175.29 175.68 3hah h ILE 125 N 5.27 0.10 0.19 1.08 1.08 -1.93 1.52 117.51 124.83 3hah h ILE 125 Ca -0.31 0.00 -0.29 0.00 -0.39 0.00 0.00 64.86 63.87 3hah h ILE 125 Cb 1.14 0.10 0.02 0.00 -3.07 0.00 0.00 36.82 35.02 3hah h ILE 125 CO 0.74 0.00 -1.35 0.24 -0.69 0.00 0.00 178.15 177.09 3hah h MET 126 N 0.00 0.41 0.00 2.37 2.86 -2.03 -3.50 114.93 115.04 3hah h MET 126 Ca 0.82 -0.70 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3hah h MET 126 Cb 3.37 0.26 0.00 0.00 0.06 0.00 0.00 31.60 35.29 3hah h MET 126 CO -0.01 1.34 0.00 0.41 1.06 0.00 0.00 176.91 179.71 3hah n GLY 127 N 1.74 1.96 7.00 8.32 0.00 0.52 -5.18 105.19 119.55 3hah n GLY 127 Ca -0.19 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3hah n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hah n GLY 128 N -0.68 -0.18 3.69 -0.02 0.00 -1.26 -3.73 105.19 103.01 3hah n GLY 128 Ca 0.00 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 3hah n GLY 128 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hah s PHE 129 N 0.00 3.07 0.54 1.61 0.40 -1.26 -1.41 117.98 120.93 3hah s PHE 129 Ca 0.00 0.06 0.26 0.00 -0.60 0.00 0.00 56.93 56.65 3hah s PHE 129 Cb 0.00 -1.65 1.61 0.00 0.51 0.00 0.00 43.02 43.49 3hah s PHE 129 CO 0.00 0.47 2.19 -0.22 0.70 0.00 0.00 175.22 178.36 3hah h LYS 130 N 4.11 0.00 0.14 0.44 3.64 -1.62 -2.15 116.57 121.14 3hah h LYS 130 Ca -0.49 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 58.61 3hah h LYS 130 Cb 1.17 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.00 3hah h LYS 130 CO 0.58 0.03 -1.26 0.93 -2.27 0.00 0.00 179.45 177.47 3hah h GLU 131 N 0.00 0.34 -0.16 1.90 3.07 -1.94 -2.63 114.58 115.16 3hah h GLU 131 Ca -0.00 -0.56 -0.07 0.00 -0.50 0.00 0.00 59.36 58.23 3hah h GLU 131 Cb 0.07 0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 28.18 3hah h GLU 131 CO 0.00 1.26 -0.17 1.15 -1.40 0.00 0.00 179.01 179.84 3hah h THR 132 N 0.11 1.34 0.23 1.13 2.02 -1.85 -3.04 112.91 112.85 3hah h THR 132 Ca -0.15 -1.35 0.01 0.00 0.77 0.00 0.00 66.41 65.69 3hah h THR 132 Cb 1.97 1.85 -0.04 0.00 -1.74 0.00 0.00 68.15 70.19 3hah h THR 132 CO 0.21 0.40 -0.50 0.50 0.37 0.00 0.00 175.52 176.50 3hah h LYS 133 N 0.05 -0.78 -0.95 6.66 3.11 -1.48 -0.13 116.57 123.05 3hah h LYS 133 Ca 0.02 0.05 0.23 0.00 -2.81 0.00 0.00 60.65 58.14 3hah h LYS 133 Cb 0.72 0.18 -0.12 0.00 -1.00 0.00 0.00 32.23 32.00 3hah h LYS 133 CO 0.04 -0.52 0.51 0.93 -2.81 0.00 0.00 179.45 177.60 3hah h GLU 134 N -0.81 0.51 -0.03 1.90 5.08 -1.54 0.54 114.58 120.22 3hah h GLU 134 Ca -0.02 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.20 3hah h GLU 134 Cb 0.78 -0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.92 3hah h GLU 134 CO -0.22 0.34 -0.42 0.00 -1.00 0.00 0.00 179.01 177.71 3hah h ALA 135 N 1.71 0.10 -0.90 3.43 0.00 -1.36 -1.66 119.26 120.57 3hah h ALA 135 Ca 0.59 -0.50 0.10 0.00 0.00 0.00 0.00 54.91 55.11 3hah h ALA 135 Cb 1.10 0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.82 3hah h ALA 135 CO -0.48 0.24 0.54 1.49 0.00 0.00 0.00 179.25 181.04 3hah h GLU 136 N -0.19 0.86 -0.27 0.00 4.57 0.10 -0.92 114.58 118.74 3hah h GLU 136 Ca -0.04 -0.05 -0.13 0.00 -1.18 0.00 0.00 59.36 57.95 3hah h GLU 136 Cb 1.11 -0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 29.51 3hah h GLU 136 CO 0.08 0.57 -0.34 -0.44 -1.18 0.00 0.00 179.01 177.70 3hah h ASP 137 N 0.88 0.77 -0.19 1.04 3.32 0.07 -2.65 116.42 119.66 3hah h ASP 137 Ca 0.44 -0.50 -0.15 0.00 0.02 0.00 0.00 57.03 56.84 3hah h ASP 137 Cb 0.41 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3hah h ASP 137 CO -0.25 1.11 -0.42 1.23 -1.72 0.00 0.00 179.24 179.18 3hah h GLY 138 N 0.44 0.81 0.90 2.75 0.00 -1.01 -2.03 103.07 104.94 3hah h GLY 138 Ca 0.03 -0.84 -0.01 0.00 0.00 0.00 0.00 47.33 46.51 3hah h GLY 138 CO 0.08 0.76 0.10 0.74 0.00 0.00 0.00 176.54 178.22 3hah h PHE 139 N 0.60 0.35 -0.75 5.60 0.05 -1.19 -0.15 116.94 121.45 3hah h PHE 139 Ca 0.04 -0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.79 3hah h PHE 139 Cb 0.98 -0.11 -0.04 0.00 2.00 0.00 0.00 35.95 38.79 3hah h PHE 139 CO 0.05 0.37 0.39 -0.09 -0.18 0.00 0.00 178.31 178.86 3hah h ARG 140 N 0.23 1.05 -0.17 1.51 2.43 -1.40 0.15 114.38 118.18 3hah h ARG 140 Ca 0.08 -0.12 -0.10 0.00 -0.81 0.00 0.00 59.98 59.02 3hah h ARG 140 Cb 0.17 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3hah h ARG 140 CO -0.01 0.78 -0.30 -0.22 -1.51 0.00 0.00 179.97 178.71 3hah h LYS 141 N 1.05 0.50 -0.64 0.20 3.64 -1.26 -0.50 116.57 119.56 3hah h LYS 141 Ca 0.26 -0.31 0.13 0.00 -1.27 0.00 0.00 60.65 59.46 3hah h LYS 141 Cb 0.05 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 3hah h LYS 141 CO -0.04 0.92 0.43 0.00 -2.27 0.00 0.00 179.45 178.49 3hah h ALA 142 N 0.58 2.19 -0.01 5.00 0.00 -0.30 -2.52 119.26 124.21 3hah h ALA 142 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hah h ALA 142 Cb 0.89 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3hah h ALA 142 CO 0.07 -0.36 -0.63 0.94 0.00 0.00 0.00 179.25 179.27 3hah n GLN 143 N -4.45 0.59 0.05 0.00 7.27 0.47 -4.60 117.38 116.71 3hah n GLN 143 Ca 0.12 -0.46 -0.15 0.00 0.07 0.00 0.00 57.00 56.58 3hah n GLN 143 Cb 0.50 -1.49 -0.10 0.00 2.41 0.00 0.00 30.24 31.56 3hah n GLN 143 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 3hah h LYS 144 N 1.11 -0.63 -0.24 3.69 3.64 -0.63 0.78 116.57 124.29 3hah h LYS 144 Ca 0.00 0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3hah h LYS 144 Cb 0.60 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 3hah h LYS 144 CO 0.00 -0.42 0.07 -1.35 -2.27 0.00 0.00 179.45 175.48 3hah h PRO 145 N -0.65 0.37 -0.99 1.90 0.11 -1.81 -2.09 132.00 128.84 3hah h PRO 145 Ca 0.01 -0.08 0.14 0.00 0.11 0.00 0.00 66.00 66.18 3hah h PRO 145 Cb 0.70 -0.05 -0.09 0.00 0.11 0.00 0.00 31.00 31.67 3hah h PRO 145 CO -0.36 0.46 0.62 2.35 -0.21 0.00 0.00 178.00 180.86 3hah h TRP 146 N 0.22 1.08 -0.47 0.65 2.91 -1.78 1.00 115.95 119.55 3hah h TRP 146 Ca 0.08 0.03 -0.14 0.00 1.13 0.00 0.00 58.89 59.99 3hah h TRP 146 Cb 0.25 -0.34 -0.01 0.00 -0.51 0.00 0.00 29.16 28.55 3hah h TRP 146 CO 0.01 0.37 -0.23 0.00 -1.03 0.00 0.00 178.44 177.56 3hah h ALA 147 N 1.58 0.66 0.92 2.65 0.00 -0.62 0.15 119.26 124.60 3hah h ALA 147 Ca 0.51 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3hah h ALA 147 Cb 0.64 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.28 3hah h ALA 147 CO -0.29 0.67 -0.45 -0.22 0.00 0.00 0.00 179.25 178.96 3hah h LYS 148 N 0.84 -1.20 -0.80 0.00 3.64 -0.38 -2.35 116.57 116.32 3hah h LYS 148 Ca 0.10 0.08 0.17 0.00 -1.27 0.00 0.00 60.65 59.73 3hah h LYS 148 Cb 0.82 0.27 -0.10 0.00 -0.41 0.00 0.00 32.23 32.80 3hah h LYS 148 CO 0.07 -0.80 0.33 0.87 -2.27 0.00 0.00 179.45 177.65 3hah h LYS 149 N -1.24 0.42 0.00 1.90 6.56 -0.88 0.65 116.57 123.98 3hah h LYS 149 Ca -0.13 -0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.44 3hah h LYS 149 Cb 0.96 -0.10 -0.00 0.00 -0.57 0.00 0.00 32.23 32.52 3hah h LYS 149 CO 0.20 0.28 -0.01 1.98 -2.06 0.00 0.00 179.45 179.84 3hah h MET 150 N 0.44 0.00 0.08 3.15 4.05 -0.62 0.15 114.93 122.18 3hah h MET 150 Ca 0.46 0.00 -0.34 0.00 -0.28 0.00 0.00 59.70 59.54 3hah h MET 150 Cb 0.75 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.52 3hah h MET 150 CO -0.45 0.01 -1.94 0.36 0.23 0.00 0.00 176.91 175.12 3hah n LYS 151 N -3.18 0.71 0.25 0.39 2.85 0.10 -3.00 118.16 116.29 3hah n LYS 151 Ca -0.02 0.26 0.17 0.00 -1.05 0.00 0.00 58.31 57.67 3hah n LYS 151 Cb 0.12 -1.72 0.85 0.00 -0.65 0.00 0.00 35.03 33.63 3hah n LYS 151 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 3hah h GLU 152 N 0.04 0.00 0.00 -1.58 5.08 0.13 0.14 114.58 118.40 3hah h GLU 152 Ca -0.39 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 57.87 3hah h GLU 152 Cb 2.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.26 3hah h GLU 152 CO 0.08 0.00 -1.53 -0.11 -1.00 0.00 0.00 179.01 176.44 3hah n LEU 153 N -2.69 0.56 0.12 1.33 0.00 0.37 -3.34 117.00 113.35 3hah n LEU 153 Ca -0.01 0.23 -0.13 0.00 0.00 0.00 0.00 56.01 56.09 3hah n LEU 153 Cb 0.11 0.06 -0.08 0.00 0.00 0.00 0.00 43.42 43.50 3hah n LEU 153 CO 0.17 0.04 0.66 -0.08 0.00 0.00 0.00 177.39 178.19 3hah h GLU 154 N 0.00 -0.29 0.55 1.96 4.57 -0.88 -2.92 114.58 117.57 3hah h GLU 154 Ca -0.11 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 3hah h GLU 154 Cb 1.33 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.98 3hah h GLU 154 CO 0.02 -0.02 -0.34 0.00 -1.18 0.00 0.00 179.01 177.48 3hah h ALA 155 N 0.19 -1.16 0.00 2.92 0.00 -1.58 -1.41 119.26 118.21 3hah h ALA 155 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3hah h ALA 155 Cb 0.39 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3hah h ALA 155 CO 0.05 -1.13 0.11 0.00 0.00 0.00 0.00 179.25 178.28 3hah n ALA 156 N -2.54 0.81 -0.09 0.00 0.00 -1.21 0.21 120.51 117.69 3hah n ALA 156 Ca -0.10 0.04 -0.23 0.00 0.00 0.00 0.00 53.44 53.15 3hah n ALA 156 Cb 0.35 -0.86 -0.12 0.00 0.00 0.00 0.00 19.45 18.81 3hah n ALA 156 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3hah n LYS 157 N -1.59 0.63 0.40 0.00 4.81 -1.08 -3.74 118.16 117.59 3hah n LYS 157 Ca -0.00 0.37 -0.19 0.00 -0.87 0.00 0.00 58.31 57.62 3hah n LYS 157 Cb 0.12 -1.65 -0.09 0.00 0.02 0.00 0.00 35.03 33.42 3hah n LYS 157 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 3hah h LYS 158 N -0.59 -1.06 -0.26 1.64 1.63 0.89 0.62 116.57 119.45 3hah h LYS 158 Ca -0.48 0.07 0.07 0.00 -0.85 0.00 0.00 60.65 59.47 3hah h LYS 158 Cb 1.64 0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 33.50 3hah h LYS 158 CO -0.16 -0.71 0.42 0.00 -3.45 0.00 0.00 179.45 175.55 3hah h ALA 159 N -0.94 1.83 0.00 5.00 0.00 -0.93 0.14 119.26 124.37 3hah h ALA 159 Ca -0.09 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 3hah h ALA 159 Cb 0.89 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 3hah h ALA 159 CO 0.10 -0.56 -1.07 -0.92 0.00 0.00 0.00 179.25 176.80 3hah h TYR 160 N 0.00 0.00 0.00 0.00 5.03 -1.43 -2.94 116.97 117.64 3hah h TYR 160 Ca 0.12 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.43 3hah h TYR 160 Cb 0.97 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.25 3hah h TYR 160 CO 0.00 1.42 0.00 0.45 -1.32 0.00 0.00 178.16 178.71 3hah h HIS 161 N -0.99 0.00 0.15 -3.82 3.86 0.85 0.50 115.15 115.70 3hah h HIS 161 Ca -0.30 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.57 3hah h HIS 161 Cb 1.26 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.73 3hah h HIS 161 CO 0.13 0.00 -1.80 1.25 0.86 0.00 0.00 177.93 178.37 3hah h LEU 162 N 0.00 0.50 -0.77 2.43 5.85 -0.87 -3.01 115.31 119.44 3hah h LEU 162 Ca 0.00 -0.84 0.00 0.00 0.84 0.00 0.00 57.88 57.88 3hah h LEU 162 Cb 0.10 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.97 3hah h LEU 162 CO 0.00 1.73 0.00 0.00 -0.34 0.00 0.00 178.44 179.83 3hah h ALA 163 N 0.20 1.00 0.04 1.25 0.00 -1.15 -2.09 119.26 118.51 3hah h ALA 163 Ca -0.35 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3hah h ALA 163 Cb 2.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.86 3hah h ALA 163 CO 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 179.25 179.38 3hah n LYS 165 N -4.74 0.22 -0.08 0.00 0.00 -1.14 -1.62 118.16 110.79 3hah n LYS 165 Ca -0.08 0.12 -0.11 0.00 0.00 0.00 0.00 58.31 58.24 3hah n LYS 165 Cb 0.34 -1.50 -0.15 0.00 0.00 0.00 0.00 35.03 33.71 3hah n LYS 165 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3hah n GLU 166 N -1.32 0.68 0.20 1.64 -0.58 -0.79 -4.07 120.64 116.40 3hah n GLU 166 Ca 0.08 0.07 0.09 0.00 -0.42 0.00 0.00 57.16 56.99 3hah n GLU 166 Cb 0.16 -1.58 0.16 0.00 -0.57 0.00 0.00 31.44 29.62 3hah n GLU 166 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 3hah h GLU 167 N 0.00 0.00 -0.77 3.49 4.22 -1.11 -2.52 114.58 117.88 3hah h GLU 167 Ca -0.50 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 58.94 3hah h GLU 167 Cb 2.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.41 3hah h GLU 167 CO 0.03 0.16 0.00 1.63 -2.18 0.00 0.00 179.01 178.66 3hah n LYS 168 N -3.15 3.16 -0.04 1.92 4.76 -0.64 -3.96 118.16 120.21 3hah n LYS 168 Ca 0.03 -1.75 -0.09 0.00 -2.87 0.00 0.00 58.31 53.63 3hah n LYS 168 Cb 0.58 -1.93 -0.03 0.00 -1.84 0.00 0.00 35.03 31.81 3hah n LYS 168 CO 0.00 0.00 0.00 -0.11 -1.37 0.00 0.00 177.40 175.92 3hah n LEU 169 N 0.34 0.62 -0.07 -0.35 -0.00 -0.97 -4.56 117.00 112.02 3hah n LEU 169 Ca 0.16 0.11 0.00 0.00 -0.00 0.00 0.00 56.01 56.27 3hah n LEU 169 Cb 0.78 -0.26 0.00 0.00 -0.00 0.00 0.00 43.42 43.95 3hah n LEU 169 CO 0.18 0.15 0.21 0.00 -0.00 0.00 0.00 177.39 177.94 3hah n ALA 170 N -3.40 1.92 -3.62 1.96 0.00 -1.09 -5.12 120.51 111.17 3hah n ALA 170 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.97 3hah n ALA 170 Cb 0.60 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.97 3hah n ALA 170 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 3hah n MET 171 N -0.40 2.47 0.00 0.00 2.81 -1.26 -5.11 117.12 115.64 3hah n MET 171 Ca 0.00 -4.56 0.00 0.00 -1.81 0.00 0.00 57.70 51.33 3hah n MET 171 Cb 0.02 -2.33 0.00 0.00 -0.71 0.00 0.00 33.22 30.20 3hah n MET 171 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3hah n ASP 196 N 1.64 0.00 0.30 7.83 9.92 -1.26 -5.04 116.55 129.93 3hah n ASP 196 Ca 0.24 0.00 0.19 0.00 -0.53 0.00 0.00 54.79 54.69 3hah n ASP 196 Cb 0.37 0.00 1.03 0.00 -0.64 0.00 0.00 41.12 41.88 3hah n ASP 196 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 3hah h LYS 197 N 0.00 0.00 -0.08 -1.24 1.57 -2.01 -0.41 116.57 114.40 3hah h LYS 197 Ca 0.00 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 3hah h LYS 197 Cb 0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 3hah h LYS 197 CO 0.00 0.00 -0.87 0.00 -0.57 0.00 0.00 179.45 178.01 3hah h LYS 199 N 0.42 0.00 -0.22 0.00 1.57 -1.43 -2.86 116.57 114.04 3hah h LYS 199 Ca -0.08 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.57 3hah h LYS 199 Cb 1.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.81 3hah h LYS 199 CO 0.17 0.40 -0.39 0.37 -0.57 0.00 0.00 179.45 179.43 3hah h GLN 200 N 0.00 0.65 0.00 3.15 4.15 -1.41 -2.98 115.11 118.67 3hah h GLN 200 Ca -0.00 -0.41 0.00 0.00 0.77 0.00 0.00 58.65 59.01 3hah h GLN 200 Cb 0.90 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.64 3hah h GLN 200 CO 0.05 1.02 0.00 -0.44 -1.93 0.00 0.00 178.83 177.54 3hah h ASP 201 N 0.35 0.00 1.16 -0.69 5.19 -1.34 -2.05 116.42 119.04 3hah h ASP 201 Ca 0.01 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.30 3hah h ASP 201 Cb 0.98 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.47 3hah h ASP 201 CO 0.09 0.00 -0.88 1.62 -3.12 0.00 0.00 179.24 176.94 3hah h VAL 202 N 0.00 0.65 0.00 -1.35 3.04 -1.44 -2.54 116.25 114.60 3hah h VAL 202 Ca 0.00 -2.03 -0.13 0.00 -1.01 0.00 0.00 66.70 63.53 3hah h VAL 202 Cb 0.30 2.20 -0.02 0.00 -2.01 0.00 0.00 31.29 31.77 3hah h VAL 202 CO 0.00 0.37 -0.62 0.06 -1.01 0.00 0.00 177.57 176.37 3hah h GLN 203 N 0.00 0.00 0.08 4.17 3.07 -1.23 -2.01 115.11 119.19 3hah h GLN 203 Ca -0.07 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.51 3hah h GLN 203 Cb 1.43 0.00 0.02 0.00 0.08 0.00 0.00 27.48 29.01 3hah h GLN 203 CO 0.05 0.62 -0.69 0.87 0.09 0.00 0.00 178.83 179.77 3hah h LYS 204 N 0.00 0.32 -0.19 0.06 1.57 -1.46 -2.73 116.57 114.14 3hah h LYS 204 Ca -0.01 -0.46 -0.10 0.00 -1.87 0.00 0.00 60.65 58.22 3hah h LYS 204 Cb 1.33 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.79 3hah h LYS 204 CO 0.08 1.17 -0.28 1.79 -0.57 0.00 0.00 179.45 181.65 3hah h THR 205 N -0.31 1.34 -0.93 -0.16 1.35 -1.55 -2.65 112.91 109.99 3hah h THR 205 Ca -0.11 -1.49 0.04 0.00 -0.55 0.00 0.00 66.41 64.31 3hah h THR 205 Cb 1.48 1.84 -0.06 0.00 -1.73 0.00 0.00 68.15 69.69 3hah h THR 205 CO 0.13 0.45 0.60 -0.61 -0.25 0.00 0.00 175.52 175.84 3hah h GLN 206 N 0.18 1.10 0.01 4.72 4.15 -1.49 -0.04 115.11 123.74 3hah h GLN 206 Ca 0.02 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 3hah h GLN 206 Cb 0.85 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 28.29 3hah h GLN 206 CO 0.06 0.73 -0.00 1.49 -1.93 0.00 0.00 178.83 179.18 3hah h GLU 207 N 1.14 -0.01 0.52 1.69 4.81 -1.43 -1.31 114.58 119.99 3hah h GLU 207 Ca 0.38 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.59 3hah h GLU 207 Cb 0.06 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.44 3hah h GLU 207 CO -0.14 0.09 -0.27 0.87 -0.73 0.00 0.00 179.01 178.83 3hah h LYS 208 N -0.10 -0.70 -0.84 1.92 6.56 -1.28 -2.15 116.57 119.98 3hah h LYS 208 Ca -0.00 0.05 0.16 0.00 -1.06 0.00 0.00 60.65 59.80 3hah h LYS 208 Cb 0.10 0.16 -0.16 0.00 -0.57 0.00 0.00 32.23 31.77 3hah h LYS 208 CO 0.00 -0.47 -0.26 -0.92 -2.06 0.00 0.00 179.45 175.75 3hah h TYR 209 N -0.73 -0.61 0.00 -1.35 -0.00 -0.94 0.20 116.97 113.54 3hah h TYR 209 Ca -0.07 0.08 -0.07 0.00 -0.00 0.00 0.00 58.73 58.68 3hah h TYR 209 Cb 0.57 0.40 -0.01 0.00 -0.00 0.00 0.00 36.73 37.69 3hah h TYR 209 CO -0.06 -0.38 -0.31 0.93 -0.00 0.00 0.00 178.16 178.34 3hah h GLU 210 N -0.02 0.00 -0.61 1.82 5.08 -1.02 -2.40 114.58 117.42 3hah h GLU 210 Ca 0.38 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.64 3hah h GLU 210 Cb 0.61 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 3hah h GLU 210 CO -0.87 0.31 0.00 0.87 -1.00 0.00 0.00 179.01 178.32 3hah h LYS 211 N 0.00 1.08 -0.45 2.33 1.57 0.03 -1.65 116.57 119.48 3hah h LYS 211 Ca -0.00 -0.35 -0.08 0.00 -1.87 0.00 0.00 60.65 58.35 3hah h LYS 211 Cb 0.68 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 3hah h LYS 211 CO 0.04 1.05 -0.03 0.28 -0.57 0.00 0.00 179.45 180.22 3hah h VAL 212 N 0.99 1.27 -0.96 0.50 2.07 -0.88 -0.94 116.25 118.29 3hah h VAL 212 Ca 0.17 -1.11 0.15 0.00 0.82 0.00 0.00 66.70 66.73 3hah h VAL 212 Cb 0.56 1.07 -0.09 0.00 -1.52 0.00 0.00 31.29 31.31 3hah h VAL 212 CO 0.03 0.38 0.58 -0.07 0.02 0.00 0.00 177.57 178.51 3hah h LEU 213 N 0.67 0.79 -0.15 2.57 -0.00 -1.39 -0.70 115.31 117.09 3hah h LEU 213 Ca 0.12 0.07 -0.00 0.00 -0.00 0.00 0.00 57.88 58.08 3hah h LEU 213 Cb 0.55 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 41.12 3hah h LEU 213 CO 0.03 0.36 0.09 -0.33 -0.00 0.00 0.00 178.44 178.59 3hah h GLU 214 N 0.83 0.20 0.30 1.13 5.08 -0.22 -2.48 114.58 119.42 3hah h GLU 214 Ca 0.51 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.84 3hah h GLU 214 Cb 0.64 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 3hah h GLU 214 CO -0.32 0.17 -0.21 -0.44 -1.00 0.00 0.00 179.01 177.22 3hah h ASP 215 N 0.17 -0.53 -1.32 1.42 3.32 -0.44 -1.94 116.42 117.11 3hah h ASP 215 Ca 0.05 0.03 0.39 0.00 0.02 0.00 0.00 57.03 57.53 3hah h ASP 215 Cb 0.02 0.16 -0.09 0.00 0.22 0.00 0.00 39.33 39.64 3hah h ASP 215 CO -0.01 -0.30 0.90 -0.37 -1.72 0.00 0.00 179.24 177.74 3hah h VAL 216 N -0.48 0.29 0.00 -1.35 -1.51 -1.20 1.19 116.25 113.20 3hah h VAL 216 Ca -0.04 -0.04 -0.00 0.00 -1.23 0.00 0.00 66.70 65.39 3hah h VAL 216 Cb 0.39 0.15 0.00 0.00 -2.13 0.00 0.00 31.29 29.70 3hah h VAL 216 CO 0.02 0.02 -0.00 1.23 -1.23 0.00 0.00 177.57 177.61 3hah h GLY 217 N 0.12 -0.01 1.05 5.19 0.00 -1.07 0.13 103.07 108.48 3hah h GLY 217 Ca 0.71 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.96 3hah h GLY 217 CO -0.20 -0.00 0.07 0.50 0.00 0.00 0.00 176.54 176.91 3hah h LYS 218 N -0.27 1.02 0.00 4.80 1.57 0.21 -2.75 116.57 121.15 3hah h LYS 218 Ca -0.00 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 3hah h LYS 218 Cb 0.26 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3hah h LYS 218 CO 0.00 0.97 0.00 0.00 -0.57 0.00 0.00 179.45 179.85 3hah h THR 219 N 0.93 0.00 -0.88 -0.16 1.03 -0.74 -3.36 112.91 109.73 3hah h THR 219 Ca 0.18 -0.73 0.04 0.00 -0.01 0.00 0.00 66.41 65.89 3hah h THR 219 Cb 0.46 1.71 -0.05 0.00 -1.07 0.00 0.00 68.15 69.20 3hah h THR 219 CO 0.02 0.00 0.58 0.00 -0.01 0.00 0.00 175.52 176.10 3hah h THR 220 N 0.00 1.15 -0.33 0.00 1.03 -0.41 -2.65 112.91 111.70 3hah h THR 220 Ca 0.00 -0.37 -0.11 0.00 -0.01 0.00 0.00 66.41 65.91 3hah h THR 220 Cb 0.77 -0.04 -0.01 0.00 -1.07 0.00 0.00 68.15 67.80 3hah h THR 220 CO 0.00 0.20 -0.23 -0.65 -0.01 0.00 0.00 175.52 174.83 3hah h PRO 221 N 1.09 0.73 -0.38 0.00 0.11 -1.73 -2.61 132.00 129.21 3hah h PRO 221 Ca 0.35 -0.35 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 3hah h PRO 221 Cb 0.02 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 3hah h PRO 221 CO -0.10 0.96 -0.04 0.37 -0.21 0.00 0.00 178.00 178.98 3hah h GLN 222 N 0.50 0.62 0.12 1.05 5.75 -1.77 -1.31 115.11 120.06 3hah h GLN 222 Ca 0.06 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.41 3hah h GLN 222 Cb 0.78 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.24 3hah h GLN 222 CO 0.06 0.67 -0.16 -0.92 -2.65 0.00 0.00 178.83 175.83 3hah h TYR 223 N 0.58 -0.41 -0.81 3.99 3.20 -1.44 0.23 116.97 122.31 3hah h TYR 223 Ca 0.12 0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.00 3hah h TYR 223 Cb 0.43 0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.82 3hah h TYR 223 CO 0.02 -0.24 0.54 0.52 -1.64 0.00 0.00 178.16 177.36 3hah h MET 224 N -0.32 1.07 -0.13 1.82 2.86 -1.05 -0.19 114.93 118.98 3hah h MET 224 Ca 0.02 -0.06 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 3hah h MET 224 Cb 0.32 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.72 3hah h MET 224 CO -0.07 0.71 0.00 1.49 1.06 0.00 0.00 176.91 180.10 3hah h GLU 225 N 1.10 0.05 0.07 1.72 4.81 -0.92 -0.29 114.58 121.12 3hah h GLU 225 Ca 0.30 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.54 3hah h GLU 225 Cb -0.13 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 3hah h GLU 225 CO -0.06 0.03 -0.13 -0.91 -0.73 0.00 0.00 179.01 177.20 3hah h ASN 226 N 0.05 -0.37 -0.56 1.04 -0.26 0.52 -1.89 115.58 114.11 3hah h ASN 226 Ca 0.06 0.05 -0.09 0.00 -0.56 0.00 0.00 56.30 55.76 3hah h ASN 226 Cb 0.07 0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.45 3hah h ASN 226 CO -0.10 -0.19 0.01 0.24 -1.06 0.00 0.00 177.43 176.32 3hah h MET 227 N -0.26 1.01 -0.88 0.81 2.86 -1.02 -2.28 114.93 115.16 3hah h MET 227 Ca 0.02 -0.30 0.15 0.00 -2.06 0.00 0.00 59.70 57.52 3hah h MET 227 Cb 0.28 -0.10 -0.07 0.00 0.06 0.00 0.00 31.60 31.77 3hah h MET 227 CO -0.08 0.98 0.57 1.49 1.06 0.00 0.00 176.91 180.93 3hah h GLU 228 N 0.93 0.60 -0.19 1.72 4.57 -0.68 -0.73 114.58 120.80 3hah h GLU 228 Ca 0.17 -0.04 -0.12 0.00 -1.18 0.00 0.00 59.36 58.19 3hah h GLU 228 Cb 0.52 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 3hah h GLU 228 CO 0.03 0.40 -0.35 0.37 -1.18 0.00 0.00 179.01 178.28 3hah h GLN 229 N 0.62 0.58 -0.08 1.92 4.15 -0.76 -1.22 115.11 120.31 3hah h GLN 229 Ca 0.44 -0.36 -0.05 0.00 0.77 0.00 0.00 58.65 59.45 3hah h GLN 229 Cb 0.80 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.53 3hah h GLN 229 CO -0.20 0.97 -0.14 0.28 -1.93 0.00 0.00 178.83 177.81 3hah h VAL 230 N 0.24 1.41 -0.65 2.39 2.07 -1.29 -2.99 116.25 117.42 3hah h VAL 230 Ca 0.01 -1.43 0.12 0.00 0.82 0.00 0.00 66.70 66.22 3hah h VAL 230 Cb 0.94 2.17 -0.09 0.00 -1.52 0.00 0.00 31.29 32.79 3hah h VAL 230 CO 0.08 0.40 0.17 0.15 0.02 0.00 0.00 177.57 178.39 3hah h PHE 231 N -0.24 0.28 0.00 1.57 3.04 -1.14 -0.48 116.94 119.96 3hah h PHE 231 Ca 0.00 0.04 -0.02 0.00 3.98 0.00 0.00 57.97 61.97 3hah h PHE 231 Cb 0.72 -0.02 -0.00 0.00 2.56 0.00 0.00 35.95 39.21 3hah h PHE 231 CO 0.11 -0.02 -0.08 1.49 -2.02 0.00 0.00 178.31 177.80 3hah h GLU 232 N 0.30 0.00 0.08 1.11 4.57 -1.17 -0.73 114.58 118.75 3hah h GLU 232 Ca 0.35 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 58.28 3hah h GLU 232 Cb 0.53 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.12 3hah h GLU 232 CO -0.42 0.08 -1.15 0.37 -1.18 0.00 0.00 179.01 176.71 3hah h GLN 233 N 0.00 0.19 -0.72 1.92 5.75 -0.96 -2.82 115.11 118.46 3hah h GLN 233 Ca -0.00 -0.32 -0.06 0.00 -0.15 0.00 0.00 58.65 58.12 3hah h GLN 233 Cb 0.35 0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.99 3hah h GLN 233 CO 0.01 1.14 0.22 0.00 -2.65 0.00 0.00 178.83 177.55 3hah h GLN 235 N 1.07 0.37 -0.72 0.00 1.08 -1.18 -1.75 115.11 113.98 3hah h GLN 235 Ca 0.23 -0.09 0.13 0.00 -1.45 0.00 0.00 58.65 57.47 3hah h GLN 235 Cb 0.31 -0.05 -0.05 0.00 -0.05 0.00 0.00 27.48 27.65 3hah h GLN 235 CO -0.01 0.49 0.48 1.96 -0.95 0.00 0.00 178.83 180.80 3hah h GLN 236 N 0.19 0.45 0.19 1.46 4.20 -1.44 0.55 115.11 120.70 3hah h GLN 236 Ca 0.07 -0.03 -0.25 0.00 0.06 0.00 0.00 58.65 58.50 3hah h GLN 236 Cb 0.29 -0.10 0.03 0.00 0.30 0.00 0.00 27.48 27.99 3hah h GLN 236 CO 0.00 0.30 -1.11 0.35 -0.67 0.00 0.00 178.83 177.70 3hah h PHE 237 N 0.46 0.76 -0.34 2.96 3.04 -1.43 -2.83 116.94 119.56 3hah h PHE 237 Ca 0.35 -0.55 -0.05 0.00 3.98 0.00 0.00 57.97 61.70 3hah h PHE 237 Cb 0.71 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.17 3hah h PHE 237 CO -0.00 1.42 0.00 1.49 -2.02 0.00 0.00 178.31 179.21 3hah h GLU 238 N -0.11 0.52 -0.27 1.11 4.57 -0.54 -2.27 114.58 117.59 3hah h GLU 238 Ca -0.19 -0.11 -0.08 0.00 -1.18 0.00 0.00 59.36 57.81 3hah h GLU 238 Cb 1.87 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 30.37 3hah h GLU 238 CO 0.21 0.54 -0.16 1.49 -1.18 0.00 0.00 179.01 179.91 3hah h GLU 239 N 0.50 0.46 0.00 1.92 4.81 0.05 -0.85 114.58 121.48 3hah h GLU 239 Ca 0.11 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 3hah h GLU 239 Cb 0.32 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3hah h GLU 239 CO 0.01 0.61 -0.19 0.87 -0.73 0.00 0.00 179.01 179.58 3hah h LYS 240 N 0.42 0.00 0.00 1.92 1.57 -1.15 -1.51 116.57 117.82 3hah h LYS 240 Ca 0.07 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 3hah h LYS 240 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 3hah h LYS 240 CO 0.03 0.19 -0.30 -0.09 -0.57 0.00 0.00 179.45 178.71 3hah h ARG 241 N 0.00 0.00 -0.38 3.15 2.43 -1.16 -2.91 114.38 115.51 3hah h ARG 241 Ca -0.00 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.24 3hah h ARG 241 Cb 0.35 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.83 3hah h ARG 241 CO 0.02 0.63 -0.05 -0.07 -1.51 0.00 0.00 179.97 179.00 3hah h LEU 242 N -1.00 -0.25 -0.83 3.80 3.38 -1.15 0.26 115.31 119.52 3hah h LEU 242 Ca -0.07 0.10 0.12 0.00 0.09 0.00 0.00 57.88 58.12 3hah h LEU 242 Cb 0.75 0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.61 3hah h LEU 242 CO -0.04 -0.08 0.45 0.58 0.09 0.00 0.00 178.44 179.43 3hah h VAL 243 N 0.05 0.83 -0.02 1.22 2.07 -1.40 0.11 116.25 119.11 3hah h VAL 243 Ca 0.18 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 67.36 3hah h VAL 243 Cb 0.27 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 3hah h VAL 243 CO -0.35 0.13 -0.47 0.15 0.02 0.00 0.00 177.57 177.05 3hah h PHE 244 N 0.71 0.05 0.09 1.57 3.04 -1.04 -2.32 116.94 119.04 3hah h PHE 244 Ca 0.42 -0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.35 3hah h PHE 244 Cb 0.49 -0.01 0.00 0.00 2.56 0.00 0.00 35.95 38.99 3hah h PHE 244 CO -0.08 0.51 -0.05 1.25 -2.02 0.00 0.00 178.31 177.93 3hah h LEU 245 N 0.04 -0.11 -0.86 0.59 6.46 0.18 -0.92 115.31 120.69 3hah h LEU 245 Ca -0.00 -0.33 0.11 0.00 -0.12 0.00 0.00 57.88 57.54 3hah h LEU 245 Cb 0.85 0.03 -0.08 0.00 -0.73 0.00 0.00 40.66 40.73 3hah h LEU 245 CO 0.06 0.28 0.49 0.50 -0.62 0.00 0.00 178.44 179.16 3hah h LYS 246 N -0.52 0.77 0.02 1.25 3.64 -0.84 -0.08 116.57 120.81 3hah h LYS 246 Ca -0.01 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3hah h LYS 246 Cb 0.43 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 3hah h LYS 246 CO 0.02 0.51 -0.01 1.49 -2.27 0.00 0.00 179.45 179.19 3hah h GLU 247 N 0.79 -0.02 0.00 1.90 4.81 -1.24 -2.28 114.58 118.54 3hah h GLU 247 Ca 0.42 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.64 3hah h GLU 247 Cb 0.44 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.82 3hah h GLU 247 CO -0.27 0.16 -0.08 0.28 -0.73 0.00 0.00 179.01 178.37 3hah h VAL 248 N -0.20 0.87 -0.14 0.32 2.07 -0.44 -2.17 116.25 116.56 3hah h VAL 248 Ca -0.00 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 3hah h VAL 248 Cb 0.19 1.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 3hah h VAL 248 CO 0.00 0.07 -0.14 -0.07 0.02 0.00 0.00 177.57 177.46 3hah h LEU 249 N 0.00 0.37 -2.04 2.57 3.38 -0.77 -2.37 115.31 116.45 3hah h LEU 249 Ca -0.00 -0.48 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 3hah h LEU 249 Cb 0.15 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3hah h LEU 249 CO 0.01 0.77 -0.01 -0.07 0.09 0.00 0.00 178.44 179.23 3hah h LEU 250 N -0.03 0.00 -0.66 1.67 4.07 -1.04 -1.92 115.31 117.39 3hah h LEU 250 Ca 0.02 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.87 3hah h LEU 250 Cb 0.67 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.39 3hah h LEU 250 CO 0.03 0.01 -0.19 0.44 -1.08 0.00 0.00 178.44 177.65 3hah h ASP 251 N 0.00 0.85 -0.01 -0.43 5.19 -1.07 -2.57 116.42 118.38 3hah h ASP 251 Ca -0.00 -0.30 -0.12 0.00 -0.62 0.00 0.00 57.03 55.99 3hah h ASP 251 Cb 0.02 -0.23 0.01 0.00 0.18 0.00 0.00 39.33 39.31 3hah h ASP 251 CO 0.00 1.02 -0.45 0.40 -3.12 0.00 0.00 179.24 177.09 3hah h ILE 252 N 0.74 1.47 -1.02 0.35 2.04 -0.90 -2.32 117.51 117.86 3hah h ILE 252 Ca 0.11 -2.00 0.28 0.00 1.00 0.00 0.00 64.86 64.25 3hah h ILE 252 Cb 0.72 2.63 -0.06 0.00 -0.74 0.00 0.00 36.82 39.37 3hah h ILE 252 CO 0.06 0.57 0.71 0.50 0.00 0.00 0.00 178.15 179.99 3hah h LYS 253 N -0.25 0.15 0.00 2.37 3.11 -1.40 0.19 116.57 120.74 3hah h LYS 253 Ca -0.05 -0.01 -0.21 0.00 -2.81 0.00 0.00 60.65 57.57 3hah h LYS 253 Cb 1.17 -0.03 -0.03 0.00 -1.00 0.00 0.00 32.23 32.34 3hah h LYS 253 CO 0.09 0.10 -0.99 0.00 -2.81 0.00 0.00 179.45 175.84 3hah h ARG 254 N 0.15 0.00 0.00 1.90 3.08 -1.15 -2.88 114.38 115.48 3hah h ARG 254 Ca 0.52 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.57 3hah h ARG 254 Cb 1.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.82 3hah h ARG 254 CO -0.10 0.99 -0.55 0.72 -1.07 0.00 0.00 179.97 179.96 3hah n HIS 255 N -3.35 0.15 -0.00 3.04 8.25 0.07 -3.59 115.22 119.79 3hah n HIS 255 Ca 0.00 0.04 -0.01 0.00 -0.26 0.00 0.00 57.72 57.50 3hah n HIS 255 Cb 0.93 -0.37 -0.11 0.00 1.12 0.00 0.00 29.99 31.57 3hah n HIS 255 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hah n LEU 256 N -1.68 0.59 -4.57 2.41 4.77 0.43 -4.67 117.00 114.28 3hah n LEU 256 Ca 0.05 0.26 -0.42 0.00 -0.03 0.00 0.00 56.01 55.87 3hah n LEU 256 Cb 0.37 0.15 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 3hah n LEU 256 CO 0.35 0.20 1.21 0.21 -1.33 0.00 0.00 177.39 178.03 3hah s ASN 257 N -5.57 6.19 0.10 -1.43 2.47 -1.09 -4.85 114.94 110.76 3hah s ASN 257 Ca -0.05 0.16 0.03 0.00 0.42 0.00 0.00 52.86 53.42 3hah s ASN 257 Cb 0.09 -2.55 -0.23 0.00 -1.45 0.00 0.00 41.25 37.10 3hah s ASN 257 CO 0.83 -1.68 1.21 -0.07 -3.72 0.00 0.00 177.10 173.66 3hah h LEU 258 N 12.87 0.14-10.48 3.21 3.38 -1.89 -3.42 115.31 119.11 3hah h LEU 258 Ca -0.26 -0.15 -0.44 0.00 0.09 0.00 0.00 57.88 57.11 3hah h LEU 258 Cb 1.08 -0.05 0.16 0.00 0.09 0.00 0.00 40.66 41.94 3hah h LEU 258 CO 1.19 1.12 0.24 0.00 0.09 0.00 0.00 178.44 181.09 3hah s ALA 259 N -2.69 1.30 -1.23 1.53 0.00 -1.26 -2.84 121.76 116.57 3hah s ALA 259 Ca -0.01 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.24 3hah s ALA 259 Cb 0.09 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.24 3hah s ALA 259 CO 0.84 -2.83 0.00 -0.85 0.00 0.00 0.00 175.76 172.92 3hah n GLU 260 N -4.16 -1.55 -4.67 0.00 0.00 -1.26 -4.92 120.64 104.08 3hah n GLU 260 Ca 0.09 0.80 -0.28 0.00 0.00 0.00 0.00 57.16 57.78 3hah n GLU 260 Cb 0.59 -5.03 -0.17 0.00 0.00 0.00 0.00 31.44 26.83 3hah n GLU 260 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 3hah s ASN 261 N -2.15 2.31 0.54 -1.84 2.47 -1.13 -5.03 114.94 110.12 3hah s ASN 261 Ca 0.00 -0.40 0.27 0.00 0.42 0.00 0.00 52.86 53.14 3hah s ASN 261 Cb 0.00 -1.05 1.56 0.00 -1.45 0.00 0.00 41.25 40.31 3hah s ASN 261 CO 0.00 0.05 2.15 0.28 -3.72 0.00 0.00 177.10 175.86 3hah h SER 262 N 7.09 0.00 -0.16 -4.21 0.02 -1.91 -3.14 113.55 111.23 3hah h SER 262 Ca -0.28 0.00 -0.15 0.00 -0.84 0.00 0.00 61.79 60.52 3hah h SER 262 Cb 1.19 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 3hah h SER 262 CO 0.48 0.07 -0.43 0.28 -1.14 0.00 0.00 176.83 176.09 3hah h SER 263 N 0.00 0.77 0.28 3.07 0.02 -1.96 0.18 113.55 115.91 3hah h SER 263 Ca -0.00 -0.36 -0.01 0.00 -0.84 0.00 0.00 61.79 60.58 3hah h SER 263 Cb 0.18 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.50 3hah h SER 263 CO 0.01 1.09 -0.13 0.22 -1.14 0.00 0.00 176.83 176.88 3hah h TYR 264 N 0.58 -0.35 -0.48 3.45 3.20 -1.71 -2.98 116.97 118.67 3hah h TYR 264 Ca 0.04 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3hah h TYR 264 Cb 0.98 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 39.34 3hah h TYR 264 CO 0.05 0.00 0.31 0.82 -1.64 0.00 0.00 178.16 177.70 3hah h ILE 265 N -0.80 1.13 -0.36 1.81 2.04 -1.61 -2.14 117.51 117.59 3hah h ILE 265 Ca -0.04 -0.26 -0.08 0.00 1.00 0.00 0.00 64.86 65.48 3hah h ILE 265 Cb 0.51 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.01 3hah h ILE 265 CO 0.06 0.13 -0.11 -0.74 0.00 0.00 0.00 178.15 177.49 3hah h HIS 266 N 0.66 0.68 -0.38 1.37 2.76 -0.65 -2.76 115.15 116.83 3hah h HIS 266 Ca 0.18 -0.11 -0.02 0.00 -2.20 0.00 0.00 60.37 58.21 3hah h HIS 266 Cb -0.05 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 28.71 3hah h HIS 266 CO 0.00 0.72 0.15 -0.39 -1.30 0.00 0.00 177.93 177.11 3hah h VAL 267 N 0.57 1.15 0.00 5.26 -1.51 -1.22 -1.28 116.25 119.22 3hah h VAL 267 Ca 0.10 -0.46 -0.01 0.00 -1.23 0.00 0.00 66.70 65.10 3hah h VAL 267 Cb 0.53 0.69 -0.00 0.00 -2.13 0.00 0.00 31.29 30.39 3hah h VAL 267 CO 0.03 0.18 -0.39 1.88 -1.23 0.00 0.00 177.57 178.04 3hah h TYR 268 N 0.54 0.00 -0.61 5.19 0.05 -1.60 0.65 116.97 121.19 3hah h TYR 268 Ca 0.13 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.82 3hah h TYR 268 Cb 0.11 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.83 3hah h TYR 268 CO 0.00 0.05 0.01 0.00 -1.05 0.00 0.00 178.16 177.18 3hah h ARG 269 N 0.00 1.07 0.04 4.88 2.47 -1.08 -1.86 114.38 119.91 3hah h ARG 269 Ca -0.01 -0.34 -0.00 0.00 -1.26 0.00 0.00 59.98 58.37 3hah h ARG 269 Cb 1.04 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 3hah h ARG 269 CO 0.01 1.04 -0.02 1.49 0.56 0.00 0.00 179.97 183.05 3hah h GLU 270 N 0.98 -0.05 -0.09 0.04 4.81 -1.10 -1.49 114.58 117.67 3hah h GLU 270 Ca 0.17 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.44 3hah h GLU 270 Cb 0.55 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.88 3hah h GLU 270 CO 0.03 0.46 -0.45 1.25 -0.73 0.00 0.00 179.01 179.57 3hah h LEU 271 N -0.60 -1.41 -1.66 1.64 6.46 -0.91 0.12 115.31 118.95 3hah h LEU 271 Ca -0.01 0.18 0.15 0.00 -0.12 0.00 0.00 57.88 58.08 3hah h LEU 271 Cb 0.54 0.56 -0.04 0.00 -0.73 0.00 0.00 40.66 40.98 3hah h LEU 271 CO 0.01 -0.45 0.48 -0.08 -0.62 0.00 0.00 178.44 177.78 3hah h GLU 272 N -0.54 0.33 -0.15 1.25 4.81 -1.31 -0.43 114.58 118.53 3hah h GLU 272 Ca 0.06 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.17 3hah h GLU 272 Cb 0.65 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.96 3hah h GLU 272 CO -0.39 0.22 -0.31 0.37 -0.73 0.00 0.00 179.01 178.17 3hah h GLN 273 N 0.33 0.47 -0.86 1.92 4.15 -0.32 -1.74 115.11 119.06 3hah h GLN 273 Ca 0.35 -0.31 0.10 0.00 0.77 0.00 0.00 58.65 59.56 3hah h GLN 273 Cb 0.89 0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.56 3hah h GLN 273 CO -0.10 0.92 0.56 0.00 -1.93 0.00 0.00 178.83 178.28 3hah h ALA 274 N 0.55 1.68 0.08 3.38 0.00 0.73 -1.19 119.26 124.49 3hah h ALA 274 Ca 0.00 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 3hah h ALA 274 Cb 0.91 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3hah h ALA 274 CO 0.07 0.14 -0.87 0.82 0.00 0.00 0.00 179.25 179.40 3hah h ILE 275 N 0.83 1.35 0.00 0.00 2.04 -1.15 -3.17 117.51 117.41 3hah h ILE 275 Ca 0.40 -2.40 0.00 0.00 1.00 0.00 0.00 64.86 63.86 3hah h ILE 275 Cb 0.44 2.96 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 3hah h ILE 275 CO -0.17 0.63 0.00 0.03 0.00 0.00 0.00 178.15 178.65 3hah h ARG 276 N -0.58 0.00 0.45 2.37 3.08 -1.23 -1.62 114.38 116.85 3hah h ARG 276 Ca -0.19 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 3hah h ARG 276 Cb 1.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.54 3hah h ARG 276 CO 0.04 0.00 -0.21 0.78 -1.07 0.00 0.00 179.97 179.51 3hah h GLY 277 N 0.14 -0.62 -4.56 0.04 0.00 -1.19 -3.45 103.07 93.43 3hah h GLY 277 Ca 0.00 0.23 -0.61 0.00 0.00 0.00 0.00 47.33 46.96 3hah h GLY 277 CO 0.00 -0.23 -0.18 0.00 0.00 0.00 0.00 176.54 176.13 3hah n ALA 278 N -2.52 -2.84 -3.94 3.60 0.00 -0.61 -4.96 120.51 109.23 3hah n ALA 278 Ca -0.11 0.43 -0.29 0.00 0.00 0.00 0.00 53.44 53.48 3hah n ALA 278 Cb 0.30 -1.40 -0.17 0.00 0.00 0.00 0.00 19.45 18.19 3hah n ALA 278 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3hah s ASP 279 N -0.40 2.50 0.05 0.00 2.15 -1.26 -4.99 116.67 114.72 3hah s ASP 279 Ca 0.65 -0.43 -0.32 0.00 0.43 0.00 0.00 52.55 52.88 3hah s ASP 279 Cb -0.92 -1.07 -0.18 0.00 -0.30 0.00 0.00 42.92 40.45 3hah s ASP 279 CO 0.47 -0.07 1.45 0.00 -0.17 0.00 0.00 175.17 176.85 3hah h ALA 280 N 8.01 -0.99 -0.28 3.66 0.00 -2.00 -2.68 119.26 124.99 3hah h ALA 280 Ca -0.35 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.37 3hah h ALA 280 Cb 1.14 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 19.24 3hah h ALA 280 CO 0.49 -1.00 -0.54 1.96 0.00 0.00 0.00 179.25 180.16 3hah h GLN 281 N -1.09 -0.46 -1.11 0.00 1.08 -1.99 0.14 115.11 111.69 3hah h GLN 281 Ca -0.10 0.03 0.41 0.00 -1.45 0.00 0.00 58.65 57.54 3hah h GLN 281 Cb 0.78 0.10 -0.16 0.00 -0.05 0.00 0.00 27.48 28.15 3hah h GLN 281 CO 0.17 -0.30 0.64 1.49 -0.95 0.00 0.00 178.83 179.87 3hah h GLU 282 N -0.47 0.07 -0.27 1.46 4.81 -1.99 0.75 114.58 118.93 3hah h GLU 282 Ca 0.05 -0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 59.14 3hah h GLU 282 Cb 0.62 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 3hah h GLU 282 CO -0.51 0.05 -0.37 -0.44 -0.73 0.00 0.00 179.01 177.00 3hah h ASP 283 N 0.07 0.80 0.34 1.04 5.19 -0.41 -1.99 116.42 121.47 3hah h ASP 283 Ca 0.83 -0.50 -0.02 0.00 -0.62 0.00 0.00 57.03 56.72 3hah h ASP 283 Cb 2.28 -0.23 0.00 0.00 0.18 0.00 0.00 39.33 41.57 3hah h ASP 283 CO -0.64 1.15 -0.16 -0.07 -3.12 0.00 0.00 179.24 176.39 3hah h LEU 284 N 0.48 -0.39 -1.31 1.55 3.38 0.14 -2.19 115.31 116.97 3hah h LEU 284 Ca 0.03 -0.05 0.26 0.00 0.09 0.00 0.00 57.88 58.21 3hah h LEU 284 Cb 0.96 0.10 -0.10 0.00 0.09 0.00 0.00 40.66 41.72 3hah h LEU 284 CO 0.09 -0.20 0.65 0.03 0.09 0.00 0.00 178.44 179.10 3hah h ARG 285 N -0.56 0.42 0.00 1.13 3.08 -0.70 0.17 114.38 117.93 3hah h ARG 285 Ca -0.05 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 59.92 3hah h ARG 285 Cb 0.41 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 3hah h ARG 285 CO 0.08 0.28 -0.29 2.35 -1.07 0.00 0.00 179.97 181.32 3hah h TRP 286 N 0.44 0.00 0.00 3.04 7.01 -0.88 -1.78 115.95 123.77 3hah h TRP 286 Ca 0.60 0.00 -0.07 0.00 2.11 0.00 0.00 58.89 61.52 3hah h TRP 286 Cb 1.43 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 28.48 3hah h TRP 286 CO -0.00 0.29 -0.47 0.35 -2.79 0.00 0.00 178.44 175.82 3hah h PHE 287 N 0.00 0.00 -0.57 2.65 3.04 -0.17 -2.64 116.94 119.26 3hah h PHE 287 Ca -0.00 0.00 0.06 0.00 3.98 0.00 0.00 57.97 62.00 3hah h PHE 287 Cb 0.87 0.00 -0.08 0.00 2.56 0.00 0.00 35.95 39.30 3hah h PHE 287 CO 0.00 0.89 -0.45 -0.09 -2.02 0.00 0.00 178.31 176.64 3hah h ARG 288 N -1.00 -0.13 -0.63 1.11 2.43 -1.02 0.87 114.38 116.00 3hah h ARG 288 Ca -0.11 0.01 0.16 0.00 -0.81 0.00 0.00 59.98 59.22 3hah h ARG 288 Cb 0.89 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 3hah h ARG 288 CO -0.07 -0.09 0.44 1.03 -1.51 0.00 0.00 179.97 179.77 3hah h SER 289 N -0.14 0.15 -0.01 -3.80 0.87 -1.45 0.00 113.55 109.18 3hah h SER 289 Ca 0.09 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3hah h SER 289 Cb 0.38 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 3hah h SER 289 CO -0.61 0.08 -0.04 0.35 -0.53 0.00 0.00 176.83 176.08 3hah n THR 290 N -4.41 0.00 -0.78 2.23 -2.24 -0.23 -3.34 114.28 105.50 3hah n THR 290 Ca 0.12 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 3hah n THR 290 Cb 0.59 1.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 3hah n THR 290 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3hah n SER 291 N 0.29 0.00 0.00 3.42 7.64 0.29 -4.96 113.62 120.30 3hah n SER 291 Ca 0.04 -0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.67 3hah n SER 291 Cb 0.20 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 3hah n SER 291 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hah n GLY 292 N 0.00 7.33 0.10 0.23 0.00 -0.05 -4.95 105.19 107.85 3hah n GLY 292 Ca 0.00 -1.98 0.04 0.00 0.00 0.00 0.00 46.02 44.09 3hah n GLY 292 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hah n PRO 293 N 0.00 0.06 0.16 1.61 -0.02 -1.25 -1.09 135.00 134.46 3hah n PRO 293 Ca 0.00 0.48 0.04 0.00 -2.02 0.00 0.00 63.50 62.00 3hah n PRO 293 Cb 0.00 -1.91 0.09 0.00 -0.02 0.00 0.00 33.50 31.66 3hah n PRO 293 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3hah h GLY 294 N 0.00 0.00 -5.10 -1.23 0.00 -1.74 -3.45 103.07 91.54 3hah h GLY 294 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.71 3hah h GLY 294 CO 0.00 0.00 0.59 1.03 0.00 0.00 0.00 176.54 178.16 3hah n MET 295 N -3.25 1.66 -1.49 4.80 2.81 -0.25 -4.80 117.12 116.60 3hah n MET 295 Ca 0.02 0.60 -0.37 0.00 -1.81 0.00 0.00 57.70 56.13 3hah n MET 295 Cb 0.68 -2.28 0.06 0.00 -0.71 0.00 0.00 33.22 30.97 3hah n MET 295 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 3hah n PRO 296 N 2.71 0.64 -3.84 0.03 -0.04 -1.26 -5.04 135.00 128.20 3hah n PRO 296 Ca 0.16 0.26 -0.12 0.00 -0.04 0.00 0.00 63.50 63.76 3hah n PRO 296 Cb 0.25 -2.00 -0.13 0.00 -0.04 0.00 0.00 33.50 31.59 3hah n PRO 296 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 3hah s MET 297 N -2.66 0.16 -0.83 0.54 1.75 -1.26 -5.10 119.30 111.90 3hah s MET 297 Ca 0.73 0.08 -0.16 0.00 -1.25 0.00 0.00 55.69 55.09 3hah s MET 297 Cb -0.40 0.07 0.17 0.00 2.84 0.00 0.00 34.83 37.52 3hah s MET 297 CO 0.51 -0.02 0.88 -0.80 -0.65 0.00 0.00 175.02 174.93 3hah s ASN 298 N -0.10 6.64 0.73 1.11 0.01 -1.26 -5.06 114.94 117.01 3hah s ASN 298 Ca -0.02 -2.32 -0.12 0.00 -0.71 0.00 0.00 52.86 49.69 3hah s ASN 298 Cb -0.02 -2.28 0.04 0.00 0.41 0.00 0.00 41.25 39.40 3hah s ASN 298 CO 0.00 -0.80 1.10 0.26 -1.51 0.00 0.00 177.10 176.15 3hah s TRP 299 N 1.32 2.56 0.12 2.20 0.52 -1.26 -4.93 118.94 119.47 3hah s TRP 299 Ca 0.22 1.56 -0.33 0.00 0.02 0.00 0.00 56.10 57.57 3hah s TRP 299 Cb -0.10 -3.11 -0.18 0.00 -1.15 0.00 0.00 33.47 28.93 3hah s TRP 299 CO -0.07 -1.80 0.85 -2.30 0.02 0.00 0.00 176.95 173.65 3hah n PRO 300 N -3.09 0.24 -3.78 4.98 -0.02 -1.26 -5.01 135.00 127.06 3hah n PRO 300 Ca 0.10 0.09 -0.10 0.00 -2.02 0.00 0.00 63.50 61.56 3hah n PRO 300 Cb 0.52 -1.37 -0.07 0.00 -0.02 0.00 0.00 33.50 32.56 3hah n PRO 300 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 3hah s GLN 301 N -0.54 0.84 0.38 -0.52 0.74 -1.26 -5.14 119.66 114.15 3hah s GLN 301 Ca 0.75 -0.69 -0.28 0.00 0.05 0.00 0.00 55.36 55.19 3hah s GLN 301 Cb -1.04 0.35 -0.10 0.00 1.10 0.00 0.00 33.01 33.32 3hah s GLN 301 CO 0.56 -0.27 1.44 0.12 -0.55 0.00 0.00 175.29 176.58 3hah s PHE 302 N -3.13 2.68 -0.19 1.67 2.19 -1.26 -5.00 117.98 114.94 3hah s PHE 302 Ca -0.01 1.24 0.01 0.00 0.33 0.00 0.00 56.93 58.50 3hah s PHE 302 Cb 0.01 -3.93 0.04 0.00 -1.31 0.00 0.00 43.02 37.83 3hah s PHE 302 CO -0.07 -2.72 -0.12 -1.21 1.83 0.00 0.00 175.22 172.94 3hah s GLU 303 N -2.07 2.15 0.81 10.12 2.02 -1.26 -5.13 118.70 125.33 3hah s GLU 303 Ca 0.53 -0.80 -0.12 0.00 0.02 0.00 0.00 54.97 54.61 3hah s GLU 303 Cb -0.44 -2.37 0.08 0.00 0.10 0.00 0.00 34.13 31.49 3hah s GLU 303 CO 0.60 -0.38 1.10 -1.21 0.02 0.00 0.00 175.26 175.39 3hah s GLU 304 N 1.40 1.96 0.00 1.61 0.41 -1.26 -5.36 118.70 117.46 3hah s GLU 304 Ca 0.00 0.63 0.00 0.00 -0.41 0.00 0.00 54.97 55.20 3hah s GLU 304 Cb -0.15 -1.90 0.00 0.00 -1.78 0.00 0.00 34.13 30.29 3hah s GLU 304 CO -0.09 -1.71 0.00 0.91 -0.49 0.00 0.00 175.26 173.88