#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hse h HIS 5 N 0.00 0.89 -0.20 7.33 -0.00 -2.04 1.02 115.15 122.15 3hse h HIS 5 Ca 0.00 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.38 3hse h HIS 5 Cb 0.00 -0.25 -0.01 0.00 -0.00 0.00 0.00 27.41 27.16 3hse h HIS 5 CO 0.00 -0.05 0.04 0.52 -0.00 0.00 0.00 177.93 178.44 3hse h MET 6 N 0.41 0.33 0.00 2.45 2.07 -2.05 -3.00 114.93 115.14 3hse h MET 6 Ca 0.69 -0.08 0.00 0.00 -2.07 0.00 0.00 59.70 58.23 3hse h MET 6 Cb 1.55 -0.04 0.00 0.00 -1.87 0.00 0.00 31.60 31.24 3hse h MET 6 CO -0.49 0.47 -0.79 0.66 1.07 0.00 0.00 176.91 177.82 3hse n TYR 7 N -4.76 0.12 -0.03 -0.22 4.01 0.32 -2.80 117.16 113.80 3hse n TYR 7 Ca -0.04 0.03 -0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3hse n TYR 7 Cb 0.18 -0.28 -0.00 0.00 -0.31 0.00 0.00 39.34 38.93 3hse n TYR 7 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3hse h LEU 8 N 0.00 -0.02 -1.23 7.72 3.38 -0.53 -2.88 115.31 121.75 3hse h LEU 8 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hse h LEU 8 Cb 0.59 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3hse h LEU 8 CO 0.00 0.37 0.22 0.28 0.09 0.00 0.00 178.44 179.40 3hse h SER 9 N -0.79 0.00 0.32 -0.43 0.02 -1.64 0.16 113.55 111.19 3hse h SER 9 Ca -0.00 0.00 -0.33 0.00 -0.84 0.00 0.00 61.79 60.62 3hse h SER 9 Cb 0.02 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 3hse h SER 9 CO 0.00 0.00 -1.84 1.17 -1.14 0.00 0.00 176.83 175.03 3hse n LYS 10 N -2.25 0.70 0.25 3.45 4.81 -1.12 -3.11 118.16 120.88 3hse n LYS 10 Ca -0.01 0.28 -0.13 0.00 -0.87 0.00 0.00 58.31 57.58 3hse n LYS 10 Cb 0.25 -1.76 -0.07 0.00 0.02 0.00 0.00 35.03 33.47 3hse n LYS 10 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 3hse h GLN 11 N 0.04 -0.64 -0.89 1.64 1.08 -0.49 -2.16 115.11 113.69 3hse h GLN 11 Ca -0.35 0.04 0.23 0.00 -1.45 0.00 0.00 58.65 57.12 3hse h GLN 11 Cb 2.02 0.15 -0.16 0.00 -0.05 0.00 0.00 27.48 29.44 3hse h GLN 11 CO 0.09 -0.35 0.05 -0.07 -0.95 0.00 0.00 178.83 177.60 3hse h LEU 12 N -1.04 -0.37 0.30 1.46 3.38 -1.45 0.55 115.31 118.14 3hse h LEU 12 Ca -0.07 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3hse h LEU 12 Cb 0.59 0.40 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 3hse h LEU 12 CO 0.11 -0.26 -0.32 0.00 0.09 0.00 0.00 178.44 178.07 3hse h PHE 14 N -0.65 1.13 -0.35 0.00 3.57 -0.28 -2.09 116.94 118.27 3hse h PHE 14 Ca -0.01 -0.10 -0.10 0.00 3.53 0.00 0.00 57.97 61.28 3hse h PHE 14 Cb 0.60 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 3hse h PHE 14 CO -0.20 0.89 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.52 3hse h LEU 15 N 1.04 0.77 -0.51 0.59 3.38 0.28 -0.79 115.31 120.07 3hse h LEU 15 Ca 0.23 -0.41 -0.10 0.00 0.09 0.00 0.00 57.88 57.69 3hse h LEU 15 Cb 0.27 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3hse h LEU 15 CO -0.01 1.01 -0.09 -0.26 0.09 0.00 0.00 178.44 179.18 3hse h PHE 16 N 0.53 1.07 0.89 1.13 0.04 0.40 -1.01 116.94 119.99 3hse h PHE 16 Ca 0.08 -0.22 -0.04 0.00 2.80 0.00 0.00 57.97 60.58 3hse h PHE 16 Cb 0.73 -0.26 0.01 0.00 2.20 0.00 0.00 35.95 38.62 3hse h PHE 16 CO 0.06 1.01 -0.43 -0.92 -0.60 0.00 0.00 178.31 177.43 3hse h TYR 17 N 0.82 -1.11 0.73 -0.55 3.20 -1.28 -2.84 116.97 115.95 3hse h TYR 17 Ca 0.13 -0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 3hse h TYR 17 Cb 0.65 0.37 0.01 0.00 1.54 0.00 0.00 36.73 39.29 3hse h TYR 17 CO 0.05 -0.68 -0.35 0.28 -1.64 0.00 0.00 178.16 175.81 3hse h VAL 18 N -1.24 0.21 -0.63 1.81 2.07 -1.19 0.11 116.25 117.39 3hse h VAL 18 Ca -0.12 -0.15 0.13 0.00 0.82 0.00 0.00 66.70 67.39 3hse h VAL 18 Cb 0.92 0.25 -0.11 0.00 -1.52 0.00 0.00 31.29 30.82 3hse h VAL 18 CO 0.20 0.01 -0.05 0.77 0.02 0.00 0.00 177.57 178.53 3hse h SER 19 N -1.09 -0.38 1.73 0.57 4.64 -1.30 0.48 113.55 118.20 3hse h SER 19 Ca -0.10 0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3hse h SER 19 Cb 0.77 0.32 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3hse h SER 19 CO 0.16 -0.15 0.00 0.77 -0.87 0.00 0.00 176.83 176.74 3hse h SER 20 N 0.07 0.00 -0.35 4.97 4.64 -1.53 -2.45 113.55 118.90 3hse h SER 20 Ca 0.32 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.52 3hse h SER 20 Cb 0.53 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 3hse h SER 20 CO -0.58 0.00 -0.25 0.50 -0.87 0.00 0.00 176.83 175.63 3hse h LYS 21 N 0.00 0.86 0.00 4.77 1.63 0.25 -2.31 116.57 121.77 3hse h LYS 21 Ca 0.00 -0.37 0.00 0.00 -0.85 0.00 0.00 60.65 59.43 3hse h LYS 21 Cb 0.87 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.47 3hse h LYS 21 CO 0.00 1.01 -0.30 0.93 -3.45 0.00 0.00 179.45 177.64 3hse h GLU 22 N 0.74 0.00 -0.02 1.90 5.08 -0.80 -3.05 114.58 118.43 3hse h GLU 22 Ca 0.09 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.40 3hse h GLU 22 Cb 0.79 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 3hse h GLU 22 CO 0.07 0.00 -0.20 0.82 -1.00 0.00 0.00 179.01 178.69 3hse h ILE 23 N 0.00 1.51 -0.38 3.13 2.04 -1.26 -2.74 117.51 119.81 3hse h ILE 23 Ca 0.00 -1.80 -0.02 0.00 1.00 0.00 0.00 64.86 64.04 3hse h ILE 23 Cb 0.89 2.62 -0.02 0.00 -0.74 0.00 0.00 36.82 39.57 3hse h ILE 23 CO 0.00 0.49 0.13 0.40 0.00 0.00 0.00 178.15 179.17 3hse h ILE 24 N -0.46 1.16 0.13 -0.67 2.04 -1.50 -1.64 117.51 116.56 3hse h ILE 24 Ca -0.02 -0.52 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 3hse h ILE 24 Cb 0.91 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.72 3hse h ILE 24 CO 0.04 0.19 -0.08 0.50 0.00 0.00 0.00 178.15 178.80 3hse h LYS 25 N 0.54 -0.20 -0.48 2.37 3.64 -1.47 0.22 116.57 121.19 3hse h LYS 25 Ca 0.13 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 3hse h LYS 25 Cb 0.15 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 3hse h LYS 25 CO -0.01 -0.13 0.14 0.87 -2.27 0.00 0.00 179.45 178.05 3hse h LYS 26 N -0.21 0.76 0.03 1.90 1.57 -1.23 -2.87 116.57 116.52 3hse h LYS 26 Ca -0.01 -0.17 0.03 0.00 -1.87 0.00 0.00 60.65 58.63 3hse h LYS 26 Cb 0.18 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.33 3hse h LYS 26 CO 0.01 0.72 -0.30 1.88 -0.57 0.00 0.00 179.45 181.19 3hse h TYR 27 N 0.65 -0.82 -1.41 -1.35 -1.99 -1.04 -2.32 116.97 108.69 3hse h TYR 27 Ca 0.15 0.02 0.41 0.00 2.00 0.00 0.00 58.73 61.32 3hse h TYR 27 Cb 0.29 0.36 -0.06 0.00 2.00 0.00 0.00 36.73 39.31 3hse h TYR 27 CO 0.02 -0.40 1.00 1.15 -0.00 0.00 0.00 178.16 179.93 3hse h THR 28 N -0.47 0.29 0.05 -2.88 2.02 -0.35 0.41 112.91 111.98 3hse h THR 28 Ca 0.05 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 3hse h THR 28 Cb 0.54 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 3hse h THR 28 CO -0.23 0.01 -0.02 0.78 0.37 0.00 0.00 175.52 176.42 3hse h ASN 29 N 0.03 -0.05 -0.59 4.18 2.35 -1.27 -3.29 115.58 116.94 3hse h ASN 29 Ca 0.69 -0.48 0.09 0.00 -0.55 0.00 0.00 56.30 56.04 3hse h ASN 29 Cb 2.66 0.01 -0.07 0.00 0.05 0.00 0.00 38.32 40.97 3hse h ASN 29 CO -0.05 0.65 0.22 1.88 -1.65 0.00 0.00 177.43 178.49 3hse h TYR 30 N -0.96 0.39 0.00 1.19 0.05 -1.05 -1.39 116.97 115.20 3hse h TYR 30 Ca -0.01 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.80 3hse h TYR 30 Cb 0.54 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.19 3hse h TYR 30 CO 0.13 0.11 0.00 1.28 -1.05 0.00 0.00 178.16 178.63 3hse n LEU 31 N -4.99 0.00 -0.08 3.88 4.77 0.02 -2.41 117.00 118.19 3hse n LEU 31 Ca 0.08 0.15 -0.12 0.00 -0.03 0.00 0.00 56.01 56.09 3hse n LEU 31 Cb 0.25 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 3hse n LEU 31 CO 0.23 -0.13 0.70 0.11 -1.33 0.00 0.00 177.39 176.97 3hse h LYS 32 N 0.00 0.46 -0.31 3.23 1.57 -1.31 -0.86 116.57 119.34 3hse h LYS 32 Ca 0.00 -0.18 0.09 0.00 -1.87 0.00 0.00 60.65 58.69 3hse h LYS 32 Cb 0.02 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 3hse h LYS 32 CO 0.00 0.70 0.69 1.49 -0.57 0.00 0.00 179.45 181.76 3hse h GLU 33 N 0.19 0.00 -0.00 3.15 4.81 -1.66 0.25 114.58 121.31 3hse h GLU 33 Ca 0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3hse h GLU 33 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 3hse h GLU 33 CO 0.02 0.00 -0.04 0.66 -0.73 0.00 0.00 179.01 178.93 3hse n TYR 34 N -3.08 0.00 -3.39 0.92 4.01 -1.04 -5.01 117.16 109.56 3hse n TYR 34 Ca 0.06 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.63 3hse n TYR 34 Cb 0.81 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.92 3hse n TYR 34 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3hse n ASP 35 N -0.02 -4.10 -4.27 7.72 8.00 0.87 -5.02 116.55 119.73 3hse n ASP 35 Ca 0.02 -0.70 -0.22 0.00 0.71 0.00 0.00 54.79 54.60 3hse n ASP 35 Cb 0.10 -4.97 -0.12 0.00 -0.02 0.00 0.00 41.12 36.11 3hse n ASP 35 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hse s LEU 36 N -5.98 2.33 0.16 0.64 1.43 -0.41 -5.03 118.68 111.81 3hse s LEU 36 Ca 0.22 -0.72 -0.06 0.00 -1.03 0.00 0.00 54.13 52.54 3hse s LEU 36 Cb -0.03 -0.79 -0.06 0.00 0.03 0.00 0.00 46.19 45.34 3hse s LEU 36 CO 0.75 0.00 0.41 0.42 0.23 0.00 0.00 176.35 178.16 3hse s THR 37 N -1.43 5.12 0.26 5.49 -4.23 -1.26 -4.56 115.64 115.04 3hse s THR 37 Ca 0.07 0.13 -0.01 0.00 -1.18 0.00 0.00 61.69 60.70 3hse s THR 37 Cb -0.09 -3.62 0.25 0.00 1.34 0.00 0.00 72.50 70.38 3hse s THR 37 CO 0.04 0.03 1.74 0.22 -0.54 0.00 0.00 174.62 176.11 3hse h TYR 38 N 2.81 0.65 -0.69 3.99 3.20 -1.93 0.37 116.97 125.37 3hse h TYR 38 Ca -0.46 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.44 3hse h TYR 38 Cb 1.17 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 39.24 3hse h TYR 38 CO 0.61 0.09 0.41 1.15 -1.64 0.00 0.00 178.16 178.78 3hse h THR 39 N 0.51 1.20 -0.61 1.81 2.02 -2.00 -1.10 112.91 114.74 3hse h THR 39 Ca 0.47 -0.47 0.03 0.00 0.77 0.00 0.00 66.41 67.21 3hse h THR 39 Cb 0.74 0.26 -0.04 0.00 -1.74 0.00 0.00 68.15 67.37 3hse h THR 39 CO -0.42 0.22 0.37 1.23 0.37 0.00 0.00 175.52 177.29 3hse h GLY 40 N 0.95 0.88 0.43 2.16 0.00 -0.82 -1.70 103.07 104.96 3hse h GLY 40 Ca 0.25 -0.28 0.02 0.00 0.00 0.00 0.00 47.33 47.32 3hse h GLY 40 CO -0.04 0.23 -0.32 -1.82 0.00 0.00 0.00 176.54 174.59 3hse h TYR 41 N 0.73 -0.87 -0.53 5.60 3.20 0.25 -1.90 116.97 123.45 3hse h TYR 41 Ca 0.25 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.25 3hse h TYR 41 Cb 0.04 0.37 -0.09 0.00 1.54 0.00 0.00 36.73 38.58 3hse h TYR 41 CO -0.06 -0.42 -0.04 0.82 -1.64 0.00 0.00 178.16 176.82 3hse h ILE 42 N -0.54 0.53 -0.40 1.81 1.08 -0.90 -0.31 117.51 118.79 3hse h ILE 42 Ca 0.03 -0.03 0.06 0.00 -0.39 0.00 0.00 64.86 64.53 3hse h ILE 42 Cb 0.57 0.45 -0.05 0.00 -3.07 0.00 0.00 36.82 34.72 3hse h ILE 42 CO -0.19 0.01 0.11 0.58 -0.69 0.00 0.00 178.15 177.97 3hse h VAL 43 N 0.07 0.83 0.43 1.67 2.07 -0.98 -1.93 116.25 118.42 3hse h VAL 43 Ca 0.27 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.69 3hse h VAL 43 Cb 0.42 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 3hse h VAL 43 CO -0.49 0.05 -0.47 -0.07 0.02 0.00 0.00 177.57 176.61 3hse h LEU 44 N 0.26 -1.31 -1.77 2.57 3.38 -0.30 0.30 115.31 118.43 3hse h LEU 44 Ca 0.19 0.11 0.31 0.00 0.09 0.00 0.00 57.88 58.59 3hse h LEU 44 Cb 0.20 0.44 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 3hse h LEU 44 CO -0.22 -0.62 0.77 0.24 0.09 0.00 0.00 178.44 178.70 3hse h MET 45 N -0.92 0.13 0.05 1.13 2.86 -1.06 0.12 114.93 117.23 3hse h MET 45 Ca -0.05 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3hse h MET 45 Cb 0.82 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.45 3hse h MET 45 CO -0.09 0.09 -0.03 0.00 1.06 0.00 0.00 176.91 177.94 3hse h ALA 46 N 1.50 -0.07 -0.98 6.32 0.00 -0.64 -3.21 119.26 122.17 3hse h ALA 46 Ca 0.57 -0.24 0.31 0.00 0.00 0.00 0.00 54.91 55.55 3hse h ALA 46 Cb 1.97 0.03 -0.15 0.00 0.00 0.00 0.00 17.79 19.64 3hse h ALA 46 CO -0.11 -0.09 0.48 0.82 0.00 0.00 0.00 179.25 180.34 3hse h ILE 47 N -0.97 0.27 0.00 0.00 1.08 0.17 -1.34 117.51 116.72 3hse h ILE 47 Ca -0.01 -0.09 -0.07 0.00 -0.39 0.00 0.00 64.86 64.30 3hse h ILE 47 Cb 0.50 -0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.23 3hse h ILE 47 CO 0.01 0.05 -0.37 1.05 -0.69 0.00 0.00 178.15 178.20 3hse h GLU 48 N 0.27 0.00 0.00 2.37 -0.00 -0.95 0.87 114.58 117.14 3hse h GLU 48 Ca 0.70 0.00 -0.18 0.00 -0.00 0.00 0.00 59.36 59.88 3hse h GLU 48 Cb 1.58 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 30.30 3hse h GLU 48 CO -0.64 0.30 -0.90 -0.91 -0.00 0.00 0.00 179.01 176.86 3hse h ASN 49 N 0.00 0.00 0.00 3.06 -0.26 -1.25 -3.40 115.58 113.73 3hse h ASN 49 Ca -0.01 0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.65 3hse h ASN 49 Cb 1.24 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.49 3hse h ASN 49 CO 0.04 0.80 -1.08 0.47 -1.06 0.00 0.00 177.43 176.60 3hse n ASP 50 N -3.26 1.70 -1.80 5.81 8.00 -1.04 -5.12 116.55 120.84 3hse n ASP 50 Ca -0.01 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.77 3hse n ASP 50 Cb 0.87 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 3hse n ASP 50 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3hse n GLU 51 N -4.18 -3.90 -1.87 -1.24 -0.58 0.30 -4.86 120.64 104.31 3hse n GLU 51 Ca -0.18 2.93 0.00 0.00 -0.42 0.00 0.00 57.16 59.49 3hse n GLU 51 Cb 0.49 -3.30 0.00 0.00 -0.57 0.00 0.00 31.44 28.05 3hse n GLU 51 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3hse n LYS 52 N 1.35 0.00 -4.70 3.49 5.02 -1.26 -5.06 118.16 116.99 3hse n LYS 52 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.96 3hse n LYS 52 Cb 0.00 -2.04 -0.13 0.00 -0.02 0.00 0.00 35.03 32.84 3hse n LYS 52 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3hse s LEU 53 N -1.15 2.95 0.65 -0.35 1.43 -1.26 -5.10 118.68 115.85 3hse s LEU 53 Ca 0.00 -0.16 -0.17 0.00 -1.03 0.00 0.00 54.13 52.77 3hse s LEU 53 Cb 0.00 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 3hse s LEU 53 CO 0.00 0.28 0.75 -0.46 0.23 0.00 0.00 176.35 177.15 3hse n ASN 54 N 2.79 -0.20 0.00 2.29 6.94 -1.26 -4.69 115.26 121.13 3hse n ASN 54 Ca -0.18 0.71 0.00 0.00 -0.02 0.00 0.00 54.58 55.09 3hse n ASN 54 Cb 0.53 -1.30 0.00 0.00 -2.36 0.00 0.00 39.78 36.65 3hse n ASN 54 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 3hse n ILE 55 N -2.05 0.46 -0.05 1.53 5.41 -1.26 -1.57 119.36 121.82 3hse n ILE 55 Ca 0.12 0.12 -0.02 0.00 1.00 0.00 0.00 62.75 63.97 3hse n ILE 55 Cb 0.49 -1.12 -0.01 0.00 -0.71 0.00 0.00 39.64 38.29 3hse n ILE 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 3hse h LYS 56 N 0.00 0.00 0.00 0.38 3.64 -1.96 0.19 116.57 118.82 3hse h LYS 56 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 3hse h LYS 56 Cb 0.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3hse h LYS 56 CO 0.00 0.00 -0.05 -0.22 -2.27 0.00 0.00 179.45 176.91 3hse h LYS 57 N -0.76 0.00 0.00 1.90 3.64 -1.71 -0.64 116.57 118.99 3hse h LYS 57 Ca 0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 3hse h LYS 57 Cb 0.24 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3hse h LYS 57 CO 0.00 0.05 -0.46 1.25 -2.27 0.00 0.00 179.45 178.02 3hse h LEU 58 N 0.00 0.00 -1.93 5.20 5.85 -1.44 -2.73 115.31 120.26 3hse h LEU 58 Ca -0.00 -0.10 0.27 0.00 0.84 0.00 0.00 57.88 58.88 3hse h LEU 58 Cb 0.14 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 3hse h LEU 58 CO 0.01 0.79 0.67 1.23 -0.34 0.00 0.00 178.44 180.80 3hse h GLY 59 N -1.00 0.14 0.52 3.75 0.00 -0.52 0.14 103.07 106.10 3hse h GLY 59 Ca -0.04 -0.03 -0.16 0.00 0.00 0.00 0.00 47.33 47.10 3hse h GLY 59 CO -0.03 -0.01 -0.72 0.83 0.00 0.00 0.00 176.54 176.61 3hse h GLU 60 N 0.05 0.23 0.00 4.80 5.08 -1.27 0.27 114.58 123.75 3hse h GLU 60 Ca 0.45 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3hse h GLU 60 Cb 1.72 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 31.12 3hse h GLU 60 CO -0.03 1.19 -0.00 -0.09 -1.00 0.00 0.00 179.01 179.07 3hse h ARG 61 N -0.51 0.00 -0.30 2.33 2.43 -0.65 -1.30 114.38 116.38 3hse h ARG 61 Ca -0.14 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3hse h ARG 61 Cb 1.52 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.07 3hse h ARG 61 CO 0.10 0.00 0.00 1.33 -1.51 0.00 0.00 179.97 179.90 3hse n VAL 62 N -3.11 0.72 -3.69 0.20 0.24 0.29 -5.00 118.33 107.97 3hse n VAL 62 Ca -0.02 -0.86 -0.28 0.00 -2.04 0.00 0.00 64.34 61.14 3hse n VAL 62 Cb 0.15 0.72 0.03 0.00 -1.47 0.00 0.00 33.84 33.27 3hse n VAL 62 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3hse n PHE 63 N 0.70 -1.91 -4.38 6.34 3.72 -0.49 -5.00 117.46 116.44 3hse n PHE 63 Ca 0.12 0.58 -0.20 0.00 -0.05 0.00 0.00 57.45 57.90 3hse n PHE 63 Cb 0.42 -3.67 -0.15 0.00 -0.94 0.00 0.00 39.48 35.14 3hse n PHE 63 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3hse s LEU 64 N -6.50 1.87 0.37 4.37 1.43 0.92 -5.03 118.68 116.11 3hse s LEU 64 Ca 0.33 -0.18 -0.25 0.00 -1.03 0.00 0.00 54.13 53.01 3hse s LEU 64 Cb -0.11 -0.52 -0.09 0.00 0.03 0.00 0.00 46.19 45.50 3hse s LEU 64 CO 0.85 0.08 1.04 1.51 0.23 0.00 0.00 176.35 180.07 3hse s ASP 65 N 0.04 6.91 0.66 2.29 -4.77 -1.26 -4.54 116.67 115.99 3hse s ASP 65 Ca -0.01 2.05 0.12 0.00 -3.30 0.00 0.00 52.55 51.41 3hse s ASP 65 Cb -0.07 -2.59 0.60 0.00 -1.09 0.00 0.00 42.92 39.78 3hse s ASP 65 CO 0.00 -0.38 1.33 -1.28 0.70 0.00 0.00 175.17 175.54 3hse h SER 66 N 2.79 0.00 -0.09 2.11 0.87 -1.93 -0.11 113.55 117.19 3hse h SER 66 Ca -0.48 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 59.98 3hse h SER 66 Cb 1.21 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 3hse h SER 66 CO 0.63 0.00 -0.36 1.23 -0.53 0.00 0.00 176.83 177.81 3hse h GLY 67 N 0.00 0.45 1.50 5.77 0.00 -2.02 -3.09 103.07 105.67 3hse h GLY 67 Ca 0.04 -0.61 -0.27 0.00 0.00 0.00 0.00 47.33 46.49 3hse h GLY 67 CO -0.00 0.54 -1.35 -0.91 0.00 0.00 0.00 176.54 174.82 3hse h THR 68 N -0.04 1.33 -0.46 4.70 1.35 -1.39 -3.37 112.91 115.03 3hse h THR 68 Ca -0.02 -3.03 -0.11 0.00 -0.55 0.00 0.00 66.41 62.71 3hse h THR 68 Cb 0.99 2.75 -0.01 0.00 -1.73 0.00 0.00 68.15 70.15 3hse h THR 68 CO 0.08 0.82 -0.14 0.25 -0.25 0.00 0.00 175.52 176.28 3hse h LEU 69 N 0.03 0.91 0.11 3.87 6.46 -1.60 -3.00 115.31 122.10 3hse h LEU 69 Ca -0.16 -0.37 0.02 0.00 -0.12 0.00 0.00 57.88 57.25 3hse h LEU 69 Cb 1.93 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 41.57 3hse h LEU 69 CO 0.14 1.08 -0.30 0.74 -0.62 0.00 0.00 178.44 179.48 3hse h THR 70 N 0.74 0.36 -0.71 1.05 2.02 -1.70 0.25 112.91 114.93 3hse h THR 70 Ca 0.11 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.32 3hse h THR 70 Cb 0.69 0.36 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 3hse h THR 70 CO 0.05 0.00 0.47 -0.65 0.37 0.00 0.00 175.52 175.76 3hse h PRO 71 N -0.51 0.84 -0.07 6.66 0.11 -1.73 -0.50 132.00 136.80 3hse h PRO 71 Ca 0.03 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 65.93 3hse h PRO 71 Cb 0.54 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 3hse h PRO 71 CO -0.18 0.56 -0.67 1.25 -0.21 0.00 0.00 178.00 178.75 3hse h LEU 72 N 0.87 0.34 -0.13 2.35 6.46 -1.28 -0.89 115.31 123.03 3hse h LEU 72 Ca 0.28 -0.21 -0.02 0.00 -0.12 0.00 0.00 57.88 57.81 3hse h LEU 72 Cb 0.04 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.87 3hse h LEU 72 CO -0.08 0.91 0.02 -0.07 -0.62 0.00 0.00 178.44 178.60 3hse h LEU 73 N 0.21 0.21 -0.31 2.25 3.38 0.29 0.30 115.31 121.64 3hse h LEU 73 Ca -0.02 -0.26 0.06 0.00 0.09 0.00 0.00 57.88 57.75 3hse h LEU 73 Cb 1.21 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.84 3hse h LEU 73 CO 0.11 0.42 -0.05 0.11 0.09 0.00 0.00 178.44 179.12 3hse h LYS 74 N -0.00 0.03 0.39 1.13 1.57 -1.00 -0.85 116.57 117.83 3hse h LYS 74 Ca 0.04 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3hse h LYS 74 Cb 0.30 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 3hse h LYS 74 CO 0.00 0.02 -0.38 -0.22 -0.57 0.00 0.00 179.45 178.30 3hse h LYS 75 N 0.03 -0.76 -0.01 3.15 3.64 -0.97 0.14 116.57 121.80 3hse h LYS 75 Ca 0.15 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3hse h LYS 75 Cb 0.22 0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3hse h LYS 75 CO -0.29 -0.51 0.26 -0.07 -2.27 0.00 0.00 179.45 176.58 3hse h LEU 76 N -0.79 0.00 0.21 5.20 3.38 -0.58 -0.02 115.31 122.72 3hse h LEU 76 Ca -0.03 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.65 3hse h LEU 76 Cb 0.70 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.48 3hse h LEU 76 CO -0.06 0.00 -1.31 -0.33 0.09 0.00 0.00 178.44 176.83 3hse h GLU 77 N 0.00 0.45 -0.74 1.13 5.08 0.44 -1.83 114.58 119.10 3hse h GLU 77 Ca 0.00 -0.76 -0.03 0.00 -1.00 0.00 0.00 59.36 57.56 3hse h GLU 77 Cb 0.53 0.28 -0.03 0.00 0.50 0.00 0.00 28.75 30.03 3hse h GLU 77 CO -0.00 1.37 0.33 -0.22 -1.00 0.00 0.00 179.01 179.49 3hse h LYS 78 N -0.03 1.09 0.00 2.33 3.64 0.13 0.42 116.57 124.16 3hse h LYS 78 Ca -0.23 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 3hse h LYS 78 Cb 1.99 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.63 3hse h LYS 78 CO 0.22 0.87 0.28 0.87 -2.27 0.00 0.00 179.45 179.42 3hse h LYS 79 N 1.06 0.00 -4.90 1.90 1.79 -1.23 -3.45 116.57 111.74 3hse h LYS 79 Ca 0.25 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.44 3hse h LYS 79 Cb 0.16 0.00 0.13 0.00 -1.58 0.00 0.00 32.23 30.94 3hse h LYS 79 CO -0.03 0.00 -0.59 -3.47 -1.08 0.00 0.00 179.45 174.29 3hse n ASP 80 N -2.73 -3.39 -0.02 0.86 4.64 0.15 -4.91 116.55 111.14 3hse n ASP 80 Ca -0.02 -0.47 0.00 0.00 -1.38 0.00 0.00 54.79 52.92 3hse n ASP 80 Cb 0.32 -4.17 -0.07 0.00 -1.04 0.00 0.00 41.12 36.16 3hse n ASP 80 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 3hse n TYR 81 N -3.90 0.00 -3.85 -0.67 4.01 -0.71 -4.38 117.16 107.66 3hse n TYR 81 Ca -0.14 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.49 3hse n TYR 81 Cb 0.60 -0.32 -0.09 0.00 -0.31 0.00 0.00 39.34 39.22 3hse n TYR 81 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3hse s VAL 82 N -2.42 0.09 0.00 -0.72 1.01 -1.12 0.09 120.40 117.33 3hse s VAL 82 Ca -0.04 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.17 3hse s VAL 82 Cb 0.04 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.76 3hse s VAL 82 CO 0.37 -0.43 0.00 0.52 0.00 0.00 0.00 175.10 175.56 3hse n VAL 83 N 1.10 0.00 -3.69 2.92 0.31 -1.26 -3.24 118.33 114.47 3hse n VAL 83 Ca -0.21 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.07 3hse n VAL 83 Cb 0.57 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.48 3hse n VAL 83 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3hse s THR 99 N -1.00 0.00 0.29 2.52 -4.23 0.11 -5.06 115.64 108.27 3hse s THR 99 Ca 0.00 -0.51 0.06 0.00 -1.18 0.00 0.00 61.69 60.06 3hse s THR 99 Cb 0.00 -1.72 0.03 0.00 1.34 0.00 0.00 72.50 72.15 3hse s THR 99 CO 0.00 0.00 1.68 -0.33 -0.54 0.00 0.00 174.62 175.43 3hse h GLU 100 N 2.00 0.27 -0.06 3.99 4.39 -1.89 -1.41 114.58 121.87 3hse h GLU 100 Ca -0.24 -0.13 -0.19 0.00 0.34 0.00 0.00 59.36 59.15 3hse h GLU 100 Cb 1.24 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 3hse h GLU 100 CO 0.27 0.65 -0.75 -0.56 -1.16 0.00 0.00 179.01 177.45 3hse h GLN 101 N 0.23 0.37 0.32 2.33 3.07 -1.94 -2.98 115.11 116.51 3hse h GLN 101 Ca 0.02 -0.32 0.00 0.00 0.09 0.00 0.00 58.65 58.44 3hse h GLN 101 Cb 0.83 0.07 -0.03 0.00 0.08 0.00 0.00 27.48 28.44 3hse h GLN 101 CO 0.07 0.96 -0.36 0.78 0.09 0.00 0.00 178.83 180.37 3hse h GLY 102 N 1.35 -0.82 1.87 0.06 0.00 -1.60 -0.04 103.07 103.88 3hse h GLY 102 Ca -0.03 0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.71 3hse h GLY 102 CO 0.13 -0.29 0.05 0.28 0.00 0.00 0.00 176.54 176.70 3hse n LYS 103 N -5.46 0.11 -0.03 4.80 5.02 -0.59 -1.63 118.16 120.38 3hse n LYS 103 Ca -0.09 0.60 -0.17 0.00 -2.02 0.00 0.00 58.31 56.63 3hse n LYS 103 Cb 0.36 -1.90 -0.07 0.00 -0.02 0.00 0.00 35.03 33.40 3hse n LYS 103 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hse h ALA 104 N 1.87 0.28 -0.38 7.82 0.00 -0.84 -3.26 119.26 124.75 3hse h ALA 104 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3hse h ALA 104 Cb 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3hse h ALA 104 CO 0.00 0.60 0.00 0.44 0.00 0.00 0.00 179.25 180.29 3hse n ILE 105 N -4.02 0.74 -0.14 0.00 -5.35 -0.65 -4.23 119.36 105.71 3hse n ILE 105 Ca -0.08 -0.58 0.06 0.00 -0.27 0.00 0.00 62.75 61.88 3hse n ILE 105 Cb 0.70 0.12 0.37 0.00 -1.74 0.00 0.00 39.64 39.10 3hse n ILE 105 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 3hse h LYS 106 N 2.29 0.68 0.28 6.28 3.64 -1.60 -0.22 116.57 127.92 3hse h LYS 106 Ca 0.00 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 3hse h LYS 106 Cb 0.70 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 3hse h LYS 106 CO 0.06 0.45 -0.13 1.03 -2.27 0.00 0.00 179.45 178.59 3hse h SER 107 N 0.70 -0.31 0.12 4.20 0.87 -1.85 -1.69 113.55 115.59 3hse h SER 107 Ca 0.27 -0.21 -0.04 0.00 -1.23 0.00 0.00 61.79 60.58 3hse h SER 107 Cb 0.19 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 3hse h SER 107 CO -0.08 0.16 -0.15 1.55 -0.53 0.00 0.00 176.83 177.77 3hse h PRO 108 N -0.91 0.07 -0.13 2.24 0.13 -1.80 -0.34 132.00 131.27 3hse h PRO 108 Ca -0.04 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.03 3hse h PRO 108 Cb 0.51 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.62 3hse h PRO 108 CO 0.06 0.23 -0.11 -0.07 -0.23 0.00 0.00 178.00 177.88 3hse h LEU 109 N 0.07 0.32 -0.70 1.56 3.38 -1.09 -2.82 115.31 116.03 3hse h LEU 109 Ca 0.01 -0.47 0.06 0.00 0.09 0.00 0.00 57.88 57.57 3hse h LEU 109 Cb 0.31 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 3hse h LEU 109 CO 0.02 0.72 0.40 0.00 0.09 0.00 0.00 178.44 179.68 3hse h ALA 110 N 0.61 0.93 -0.85 1.53 0.00 -1.01 -0.81 119.26 119.66 3hse h ALA 110 Ca 0.02 0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.15 3hse h ALA 110 Cb 0.63 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 3hse h ALA 110 CO 0.03 0.10 0.58 1.49 0.00 0.00 0.00 179.25 181.45 3hse h GLU 111 N 0.75 0.23 -0.11 0.00 4.22 -0.90 -0.18 114.58 118.58 3hse h GLU 111 Ca 0.31 -0.01 -0.00 0.00 0.08 0.00 0.00 59.36 59.73 3hse h GLU 111 Cb 0.16 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3hse h GLU 111 CO -0.17 0.15 0.06 0.82 -2.18 0.00 0.00 179.01 177.69 3hse h ILE 112 N 0.23 1.03 0.00 2.32 2.04 -0.89 -0.85 117.51 121.39 3hse h ILE 112 Ca 0.43 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 66.15 3hse h ILE 112 Cb 1.31 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 3hse h ILE 112 CO -0.10 0.04 -0.26 0.28 0.00 0.00 0.00 178.15 178.11 3hse h SER 113 N 0.15 0.00 0.09 1.72 0.02 -1.12 -1.99 113.55 112.42 3hse h SER 113 Ca 0.04 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.79 3hse h SER 113 Cb 0.00 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.56 3hse h SER 113 CO -0.01 0.26 -0.84 0.58 -1.14 0.00 0.00 176.83 175.68 3hse h VAL 114 N 0.00 1.43 0.06 2.27 2.07 -1.24 -2.99 116.25 117.85 3hse h VAL 114 Ca -0.00 -2.35 -0.00 0.00 0.82 0.00 0.00 66.70 65.16 3hse h VAL 114 Cb 0.74 2.87 0.00 0.00 -1.52 0.00 0.00 31.29 33.38 3hse h VAL 114 CO 0.03 0.68 -0.03 0.11 0.02 0.00 0.00 177.57 178.39 3hse h LYS 115 N -0.13 -0.08 -0.68 1.57 1.79 -1.40 -2.19 116.57 115.45 3hse h LYS 115 Ca -0.13 0.01 0.12 0.00 -2.18 0.00 0.00 60.65 58.46 3hse h LYS 115 Cb 1.59 0.02 -0.08 0.00 -1.58 0.00 0.00 32.23 32.17 3hse h LYS 115 CO 0.16 0.07 0.25 0.28 -1.08 0.00 0.00 179.45 179.13 3hse h VAL 116 N -0.22 0.70 0.00 0.50 2.07 -1.46 -0.38 116.25 117.47 3hse h VAL 116 Ca -0.01 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.37 3hse h VAL 116 Cb 0.19 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3hse h VAL 116 CO 0.01 0.08 -0.17 -0.26 0.02 0.00 0.00 177.57 177.24 3hse h PHE 117 N 0.41 0.00 -0.12 1.57 0.04 -1.48 -3.08 116.94 114.29 3hse h PHE 117 Ca 0.36 0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.94 3hse h PHE 117 Cb 0.50 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.65 3hse h PHE 117 CO -0.18 0.00 -0.70 -0.91 -0.60 0.00 0.00 178.31 175.93 3hse h ASN 118 N 0.00 0.62 0.00 2.17 4.21 -0.80 -2.35 115.58 119.43 3hse h ASN 118 Ca 0.00 -0.39 0.00 0.00 1.21 0.00 0.00 56.30 57.12 3hse h ASN 118 Cb 0.96 -0.18 0.00 0.00 -1.12 0.00 0.00 38.32 37.98 3hse h ASN 118 CO 0.00 1.13 0.02 1.21 -1.29 0.00 0.00 177.43 178.50 3hse n GLU 119 N -3.89 0.00 -0.04 0.81 2.13 -0.21 0.38 120.64 119.82 3hse n GLU 119 Ca -0.05 0.42 0.02 0.00 0.66 0.00 0.00 57.16 58.21 3hse n GLU 119 Cb 0.69 -1.52 0.04 0.00 0.27 0.00 0.00 31.44 30.92 3hse n GLU 119 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 3hse n PHE 120 N -1.42 0.10 -3.69 4.31 3.72 -0.90 -5.02 117.46 114.56 3hse n PHE 120 Ca 0.00 -0.54 -0.31 0.00 -0.05 0.00 0.00 57.45 56.55 3hse n PHE 120 Cb 0.02 -0.06 0.04 0.00 -0.94 0.00 0.00 39.48 38.54 3hse n PHE 120 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3hse n ASN 121 N -0.37 -5.05 -4.35 4.37 3.02 0.16 -4.96 115.26 108.07 3hse n ASN 121 Ca 0.04 -1.01 -0.38 0.00 -0.03 0.00 0.00 54.58 53.19 3hse n ASN 121 Cb 0.32 -3.38 -0.12 0.00 -0.61 0.00 0.00 39.78 35.99 3hse n ASN 121 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hse s ILE 122 N -3.49 4.17 1.04 2.41 1.01 -1.08 -5.05 121.20 120.22 3hse s ILE 122 Ca 0.45 -0.81 -0.14 0.00 0.00 0.00 0.00 60.65 60.15 3hse s ILE 122 Cb -0.16 -3.25 0.21 0.00 0.01 0.00 0.00 42.46 39.27 3hse s ILE 122 CO 0.86 -0.07 1.10 -0.94 0.00 0.00 0.00 174.94 175.89 3hse s SER 123 N 1.51 2.25 0.00 3.58 1.04 -1.26 -4.79 113.70 116.03 3hse s SER 123 Ca 0.02 1.01 0.22 0.00 0.48 0.00 0.00 55.95 57.68 3hse s SER 123 Cb -0.18 -1.57 1.01 0.00 0.10 0.00 0.00 66.02 65.38 3hse s SER 123 CO 0.04 -3.34 1.70 -0.62 0.98 0.00 0.00 173.24 172.00 3hse n GLU 124 N -4.29 0.15 -0.01 4.02 1.02 -1.26 -1.65 120.64 118.62 3hse n GLU 124 Ca 0.07 0.11 -0.20 0.00 -0.02 0.00 0.00 57.16 57.12 3hse n GLU 124 Cb 0.58 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.36 3hse n GLU 124 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 3hse h ARG 125 N 0.00 0.19 -0.44 3.49 2.43 -2.00 -2.86 114.38 115.19 3hse h ARG 125 Ca 0.00 -0.32 -0.11 0.00 -0.81 0.00 0.00 59.98 58.74 3hse h ARG 125 Cb 0.30 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 3hse h ARG 125 CO 0.00 1.15 -0.16 1.49 -1.51 0.00 0.00 179.97 180.95 3hse h GLU 126 N -0.54 0.88 -0.27 0.20 4.57 -1.83 -2.49 114.58 115.09 3hse h GLU 126 Ca -0.20 -0.36 0.04 0.00 -1.18 0.00 0.00 59.36 57.65 3hse h GLU 126 Cb 1.53 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 30.05 3hse h GLU 126 CO 0.05 1.01 0.06 0.00 -1.18 0.00 0.00 179.01 178.94 3hse h ALA 127 N 0.85 0.29 -0.14 2.92 0.00 -1.44 -0.71 119.26 121.03 3hse h ALA 127 Ca 0.10 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.10 3hse h ALA 127 Cb 0.71 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 3hse h ALA 127 CO 0.05 -0.35 -0.09 0.77 0.00 0.00 0.00 179.25 179.63 3hse h SER 128 N 0.16 -0.29 -0.97 0.00 0.02 -1.41 0.33 113.55 111.39 3hse h SER 128 Ca 0.13 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.21 3hse h SER 128 Cb 0.13 0.15 -0.07 0.00 0.14 0.00 0.00 62.40 62.75 3hse h SER 128 CO -0.16 -0.12 0.62 0.44 -1.14 0.00 0.00 176.83 176.47 3hse h ASP 129 N -0.09 1.00 -0.29 3.07 3.32 -1.07 -0.60 116.42 121.75 3hse h ASP 129 Ca 0.08 0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.97 3hse h ASP 129 Cb 0.21 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.56 3hse h ASP 129 CO -0.19 0.63 -0.50 0.40 -1.72 0.00 0.00 179.24 177.86 3hse h ILE 130 N 1.13 1.28 -0.64 0.35 2.04 -0.48 -2.00 117.51 119.19 3hse h ILE 130 Ca 0.42 -1.68 0.01 0.00 1.00 0.00 0.00 64.86 64.61 3hse h ILE 130 Cb 0.17 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 3hse h ILE 130 CO -0.18 0.55 0.43 0.40 0.00 0.00 0.00 178.15 179.35 3hse h ILE 131 N 0.64 1.15 0.00 -0.67 2.04 0.31 0.23 117.51 121.21 3hse h ILE 131 Ca 0.02 -0.29 -0.25 0.00 1.00 0.00 0.00 64.86 65.34 3hse h ILE 131 Cb 1.10 0.22 0.02 0.00 -0.74 0.00 0.00 36.82 37.43 3hse h ILE 131 CO 0.11 0.16 -0.99 0.78 0.00 0.00 0.00 178.15 178.21 3hse h ASN 132 N 0.85 0.87 -0.28 1.72 -0.26 -1.03 -0.34 115.58 117.11 3hse h ASN 132 Ca 0.24 -0.74 -0.02 0.00 -0.56 0.00 0.00 56.30 55.21 3hse h ASN 132 Cb -0.07 -0.27 -0.01 0.00 -1.06 0.00 0.00 38.32 36.92 3hse h ASN 132 CO -0.06 1.50 0.08 0.78 -1.06 0.00 0.00 177.43 178.67 3hse h ASN 133 N 0.33 0.42 -0.12 5.81 -0.26 -1.03 -1.87 115.58 118.86 3hse h ASN 133 Ca -0.12 -0.22 -0.12 0.00 -0.56 0.00 0.00 56.30 55.28 3hse h ASN 133 Cb 1.65 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 38.79 3hse h ASN 133 CO 0.20 0.53 -0.33 -0.07 -1.06 0.00 0.00 177.43 176.69 3hse h LEU 134 N 0.29 0.63 -0.79 1.61 3.38 -1.02 -1.21 115.31 118.20 3hse h LEU 134 Ca 0.09 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 3hse h LEU 134 Cb 0.26 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3hse h LEU 134 CO -0.00 0.92 0.02 -0.09 0.09 0.00 0.00 178.44 179.37 3hse h ARG 135 N 0.52 0.93 0.16 1.13 2.43 -0.92 -1.61 114.38 117.02 3hse h ARG 135 Ca 0.06 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 58.96 3hse h ARG 135 Cb 0.82 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 3hse h ARG 135 CO 0.07 0.91 -0.08 -0.97 -1.51 0.00 0.00 179.97 178.39 3hse h ASN 136 N 0.86 -0.18 -0.92 -3.80 -0.73 -1.19 -1.85 115.58 107.78 3hse h ASN 136 Ca 0.16 -0.34 0.09 0.00 1.87 0.00 0.00 56.30 58.08 3hse h ASN 136 Cb 0.49 0.05 -0.11 0.00 0.27 0.00 0.00 38.32 39.01 3hse h ASN 136 CO 0.02 0.29 -0.52 0.33 -0.37 0.00 0.00 177.43 177.18 3hse n PHE 137 N -4.97 -0.36 1.08 0.67 7.35 -0.47 0.14 117.46 120.90 3hse n PHE 137 Ca -0.09 1.14 0.10 0.00 -0.76 0.00 0.00 57.45 57.85 3hse n PHE 137 Cb 0.26 -0.60 0.55 0.00 0.35 0.00 0.00 39.48 40.04 3hse n PHE 137 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 3hse n VAL 138 N -5.17 0.27 1.78 -2.13 0.31 -0.61 -5.10 118.33 107.68 3hse n VAL 138 Ca 0.03 0.07 0.15 0.00 -0.01 0.00 0.00 64.34 64.58 3hse n VAL 138 Cb 0.25 -0.72 0.76 0.00 -0.91 0.00 0.00 33.84 33.22 3hse n VAL 138 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97