#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qwv h PRO 2 N 0.00 0.00 0.00 1.43 0.13 -2.02 -3.07 132.00 128.47 1qwv h PRO 2 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1qwv h PRO 2 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1qwv h PRO 2 CO 0.00 0.02 -0.02 0.93 -0.23 0.00 0.00 178.00 178.70 1qwv h GLU 3 N 0.00 -0.03 0.00 0.86 3.07 -1.94 -0.39 114.58 116.16 1qwv h GLU 3 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1qwv h GLU 3 Cb 0.18 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.10 1qwv h GLU 3 CO 0.00 -0.02 0.00 1.51 -1.40 0.00 0.00 179.01 179.10 1qwv n ILE 4 N -2.63 0.46 0.19 3.13 0.13 -1.23 -2.77 119.36 116.65 1qwv n ILE 4 Ca -0.00 -0.10 0.09 0.00 -1.10 0.00 0.00 62.75 61.63 1qwv n ILE 4 Cb 0.02 -0.65 0.14 0.00 -0.84 0.00 0.00 39.64 38.31 1qwv n ILE 4 CO 0.00 0.00 0.00 0.24 2.80 0.00 0.00 176.55 179.59 1qwv h MET 5 N 0.00 0.00 -5.47 9.51 2.86 -1.41 -3.42 114.93 117.00 1qwv h MET 5 Ca 0.00 0.00 -0.64 0.00 -2.06 0.00 0.00 59.70 57.00 1qwv h MET 5 Cb 0.59 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.10 1qwv h MET 5 CO 0.00 0.18 0.41 0.21 1.06 0.00 0.00 176.91 178.77 1qwv s LYS 6 N -3.15 3.21 0.29 1.72 2.20 -0.18 -5.02 119.74 118.82 1qwv s LYS 6 Ca 0.06 -0.62 -0.30 0.00 -0.36 0.00 0.00 55.97 54.75 1qwv s LYS 6 Cb 0.06 -4.12 -0.11 0.00 -1.51 0.00 0.00 37.83 32.15 1qwv s LYS 6 CO 0.69 -1.52 1.51 -0.80 -0.36 0.00 0.00 175.35 174.88 1qwv s ASN 7 N 3.07 6.48 0.23 1.43 -0.87 -1.26 -4.88 114.94 119.14 1qwv s ASN 7 Ca 0.23 2.86 -0.07 0.00 -1.57 0.00 0.00 52.86 54.32 1qwv s ASN 7 Cb -0.16 -2.64 0.31 0.00 -0.02 0.00 0.00 41.25 38.74 1qwv s ASN 7 CO 0.14 -0.82 1.82 0.17 -2.57 0.00 0.00 177.10 175.85 1qwv h LEU 8 N 4.53 0.66 -1.83 0.60 -0.00 -1.92 -0.86 115.31 116.49 1qwv h LEU 8 Ca -0.47 0.03 -0.02 0.00 -0.00 0.00 0.00 57.88 57.42 1qwv h LEU 8 Cb 1.22 -0.10 -0.00 0.00 -0.00 0.00 0.00 40.66 41.78 1qwv h LEU 8 CO 0.76 0.41 -0.06 0.28 -0.00 0.00 0.00 178.44 179.83 1qwv h SER 9 N 0.79 0.03 0.60 0.17 0.02 -1.91 0.35 113.55 113.61 1qwv h SER 9 Ca 0.35 -0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 61.12 1qwv h SER 9 Cb 0.23 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 1qwv h SER 9 CO -0.20 0.10 -0.77 -1.13 -1.14 0.00 0.00 176.83 173.69 1qwv h ASN 10 N 0.04 0.16 -0.00 3.07 -1.24 -1.55 -1.95 115.58 114.10 1qwv h ASN 10 Ca 0.01 -0.11 -0.02 0.00 0.71 0.00 0.00 56.30 56.89 1qwv h ASN 10 Cb 0.12 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.13 1qwv h ASN 10 CO 0.01 0.86 -0.06 -1.13 -1.29 0.00 0.00 177.43 175.81 1qwv h ASN 11 N 0.08 0.06 0.00 1.15 -1.24 -0.42 -3.37 115.58 111.84 1qwv h ASN 11 Ca -0.02 -0.78 0.00 0.00 0.71 0.00 0.00 56.30 56.21 1qwv h ASN 11 Cb 1.34 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.38 1qwv h ASN 11 CO 0.11 0.83 0.00 0.49 -1.29 0.00 0.00 177.43 177.57 1qwv n PHE 12 N -4.66 0.00 -3.67 0.67 3.72 0.11 -4.91 117.46 108.72 1qwv n PHE 12 Ca -0.09 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.08 1qwv n PHE 12 Cb 0.41 -0.29 0.05 0.00 -0.94 0.00 0.00 39.48 38.71 1qwv n PHE 12 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1qwv n GLY 13 N -0.93 -0.40 0.28 1.37 0.00 -0.73 -4.95 105.19 99.83 1qwv n GLY 13 Ca 0.00 0.16 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 1qwv n GLY 13 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1qwv h LYS 14 N -2.08 -0.64 -2.04 1.61 3.64 -1.91 -3.44 116.57 111.71 1qwv h LYS 14 Ca -0.59 0.04 -0.26 0.00 -1.27 0.00 0.00 60.65 58.57 1qwv h LYS 14 Cb 1.36 0.15 -0.32 0.00 -0.41 0.00 0.00 32.23 33.01 1qwv h LYS 14 CO 0.57 -0.43 -0.58 0.00 -2.27 0.00 0.00 179.45 176.74 1qwv s ALA 15 N -4.32 -0.73 0.20 5.00 0.00 -1.26 -4.99 121.76 115.65 1qwv s ALA 15 Ca -0.10 0.09 0.22 0.00 0.00 0.00 0.00 51.96 52.17 1qwv s ALA 15 Cb 0.01 -1.80 0.88 0.00 0.00 0.00 0.00 23.12 22.21 1qwv s ALA 15 CO 0.29 -1.59 1.82 0.52 0.00 0.00 0.00 175.76 176.80 1qwv h MET 16 N 8.23 0.00 -0.11 0.00 2.86 -2.01 -3.03 114.93 120.87 1qwv h MET 16 Ca -0.14 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1qwv h MET 16 Cb 1.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 1qwv h MET 16 CO 0.30 0.28 0.05 0.22 1.06 0.00 0.00 176.91 178.82 1qwv h ASP 17 N 0.00 0.13 0.80 1.22 3.58 -2.00 -2.21 116.42 117.94 1qwv h ASP 17 Ca -0.00 -0.01 -0.16 0.00 0.42 0.00 0.00 57.03 57.28 1qwv h ASP 17 Cb 0.75 -0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.74 1qwv h ASP 17 CO 0.04 0.12 -1.30 1.56 -2.88 0.00 0.00 179.24 176.77 1qwv h GLN 18 N 0.15 0.00 -0.05 0.28 4.20 -1.96 -2.32 115.11 115.41 1qwv h GLN 18 Ca 0.04 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.56 1qwv h GLN 18 Cb 0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1qwv h GLN 18 CO -0.01 0.31 -0.78 0.00 -0.67 0.00 0.00 178.83 177.68 1qwv h LYS 20 N 0.23 0.34 0.00 0.00 1.63 -1.37 -2.37 116.57 115.04 1qwv h LYS 20 Ca -0.04 -0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 59.66 1qwv h LYS 20 Cb 1.37 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.95 1qwv h LYS 20 CO 0.13 0.34 -0.20 0.22 -3.45 0.00 0.00 179.45 176.49 1qwv h ASP 21 N 0.25 0.17 0.18 4.20 3.58 -1.40 -1.45 116.42 121.96 1qwv h ASP 21 Ca 0.08 -0.80 -0.09 0.00 0.42 0.00 0.00 57.03 56.64 1qwv h ASP 21 Cb 0.11 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.09 1qwv h ASP 21 CO -0.01 0.94 -0.34 -0.33 -2.88 0.00 0.00 179.24 176.62 1qwv h GLU 22 N -0.59 0.24 0.00 0.28 4.39 -1.04 -2.40 114.58 115.46 1qwv h GLU 22 Ca -0.03 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.58 1qwv h GLU 22 Cb 0.98 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.62 1qwv h GLU 22 CO 0.04 0.55 -0.78 -0.07 -1.16 0.00 0.00 179.01 177.60 1qwv h LEU 23 N 0.21 0.00 0.56 1.33 -0.00 -1.54 -3.47 115.31 112.39 1qwv h LEU 23 Ca 0.03 -0.11 -0.40 0.00 -0.00 0.00 0.00 57.88 57.40 1qwv h LEU 23 Cb 0.71 0.00 0.08 0.00 -0.00 0.00 0.00 40.66 41.44 1qwv h LEU 23 CO 0.05 0.06 -0.61 -1.20 -0.00 0.00 0.00 178.44 176.74 1qwv n SER 24 N -2.41 -6.10 -4.68 -0.43 7.64 -0.81 -4.87 113.62 101.97 1qwv n SER 24 Ca 0.02 -0.33 -0.46 0.00 1.01 0.00 0.00 58.87 59.11 1qwv n SER 24 Cb 0.49 -4.87 -0.04 0.00 -1.01 0.00 0.00 64.21 58.78 1qwv n SER 24 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1qwv n LEU 25 N -4.15 3.70 -4.76 -3.43 7.94 -0.61 -4.97 117.00 110.72 1qwv n LEU 25 Ca -0.08 0.97 -0.33 0.00 -1.11 0.00 0.00 56.01 55.45 1qwv n LEU 25 Cb 0.61 -1.44 0.06 0.00 0.53 0.00 0.00 43.42 43.17 1qwv n LEU 25 CO 0.50 0.03 0.74 -2.84 -1.11 0.00 0.00 177.39 174.71 1qwv s PRO 26 N 3.67 2.59 0.53 1.96 0.02 -1.26 -4.87 135.00 137.65 1qwv s PRO 26 Ca 0.89 1.42 0.32 0.00 0.02 0.00 0.00 61.00 63.64 1qwv s PRO 26 Cb -0.59 -1.92 1.26 0.00 0.02 0.00 0.00 34.50 33.26 1qwv s PRO 26 CO 0.46 -1.42 1.95 0.38 -0.33 0.00 0.00 177.00 178.04 1qwv h ASP 27 N -0.21 0.00 -0.38 2.53 3.04 -1.99 -1.20 116.42 118.21 1qwv h ASP 27 Ca -0.46 0.00 -0.09 0.00 -3.24 0.00 0.00 57.03 53.23 1qwv h ASP 27 Cb 1.25 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.52 1qwv h ASP 27 CO 0.53 0.03 -0.09 0.28 -2.04 0.00 0.00 179.24 177.94 1qwv h SER 28 N 0.00 0.80 0.05 4.15 0.02 -1.99 -2.03 113.55 114.55 1qwv h SER 28 Ca -0.00 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1qwv h SER 28 Cb 0.57 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1qwv h SER 28 CO 0.00 0.92 -0.02 0.58 -1.14 0.00 0.00 176.83 177.17 1qwv h VAL 29 N 0.74 1.32 -0.73 2.27 2.07 -1.61 -2.44 116.25 117.87 1qwv h VAL 29 Ca 0.13 -1.46 0.07 0.00 0.82 0.00 0.00 66.70 66.25 1qwv h VAL 29 Cb 0.58 2.25 -0.05 0.00 -1.52 0.00 0.00 31.29 32.56 1qwv h VAL 29 CO 0.04 0.36 0.48 -0.37 0.02 0.00 0.00 177.57 178.09 1qwv h VAL 30 N -0.74 1.01 0.13 2.57 -1.51 -1.47 0.29 116.25 116.53 1qwv h VAL 30 Ca -0.01 -0.26 -0.01 0.00 -1.23 0.00 0.00 66.70 65.20 1qwv h VAL 30 Cb 0.63 0.20 0.00 0.00 -2.13 0.00 0.00 31.29 29.99 1qwv h VAL 30 CO 0.01 0.14 -0.06 0.00 -1.23 0.00 0.00 177.57 176.43 1qwv h ALA 31 N 1.61 -0.17 0.00 5.19 0.00 -1.36 -2.61 119.26 121.92 1qwv h ALA 31 Ca 0.32 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1qwv h ALA 31 Cb 0.28 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1qwv h ALA 31 CO -0.11 -0.45 -0.35 0.22 0.00 0.00 0.00 179.25 178.56 1qwv h ASP 32 N -0.45 0.00 0.06 0.00 3.58 -1.18 -2.86 116.42 115.58 1qwv h ASP 32 Ca -0.02 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.45 1qwv h ASP 32 Cb 0.36 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.39 1qwv h ASP 32 CO 0.03 0.35 -0.17 0.25 -2.88 0.00 0.00 179.24 176.81 1qwv h LEU 33 N 0.00 -0.48 -0.00 2.28 5.85 -0.83 -1.97 115.31 120.15 1qwv h LEU 33 Ca -0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1qwv h LEU 33 Cb 0.92 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1qwv h LEU 33 CO 0.04 -0.24 0.00 -1.22 -0.34 0.00 0.00 178.44 176.68 1qwv n TYR 34 N -5.30 0.00 -1.96 1.25 4.01 -1.00 -4.89 117.16 109.27 1qwv n TYR 34 Ca -0.06 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.26 1qwv n TYR 34 Cb 0.22 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.22 1qwv n TYR 34 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1qwv s ASN 35 N -1.27 6.63 0.03 7.72 2.47 -0.74 -4.90 114.94 124.88 1qwv s ASN 35 Ca 0.00 2.47 -0.03 0.00 0.42 0.00 0.00 52.86 55.73 1qwv s ASN 35 Cb 0.00 -2.57 -0.27 0.00 -1.45 0.00 0.00 41.25 36.96 1qwv s ASN 35 CO 0.00 -0.85 0.96 0.15 -3.72 0.00 0.00 177.10 173.64 1qwv h PHE 36 N 7.93 0.43 -3.43 0.43 3.57 -1.90 -3.46 116.94 120.51 1qwv h PHE 36 Ca -0.42 -0.32 -0.52 0.00 3.53 0.00 0.00 57.97 60.24 1qwv h PHE 36 Cb 1.20 -0.02 0.02 0.00 2.79 0.00 0.00 35.95 39.94 1qwv h PHE 36 CO 0.75 1.32 0.57 -1.58 -2.23 0.00 0.00 178.31 177.13 1qwv s TRP 37 N -2.63 3.42 -1.31 0.41 0.51 -1.26 -4.89 118.94 113.18 1qwv s TRP 37 Ca -0.07 1.39 -0.14 0.00 -2.12 0.00 0.00 56.10 55.16 1qwv s TRP 37 Cb 0.07 -3.44 -0.03 0.00 -0.81 0.00 0.00 33.47 29.26 1qwv s TRP 37 CO 0.86 -1.27 2.28 0.36 -0.51 0.00 0.00 176.95 178.68 1qwv n LYS 38 N 2.73 2.67 -0.27 4.98 2.85 -1.26 -4.76 118.16 125.11 1qwv n LYS 38 Ca 0.05 -2.31 -0.05 0.00 -1.05 0.00 0.00 58.31 54.95 1qwv n LYS 38 Cb 0.45 -3.08 0.01 0.00 -0.65 0.00 0.00 35.03 31.75 1qwv n LYS 38 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 1qwv h ASP 39 N 6.24 -1.34 -4.82 -5.58 5.19 -1.95 -3.47 116.42 110.69 1qwv h ASP 39 Ca 0.59 0.26 0.00 0.00 -0.62 0.00 0.00 57.03 57.26 1qwv h ASP 39 Cb 0.56 0.66 0.00 0.00 0.18 0.00 0.00 39.33 40.73 1qwv h ASP 39 CO 1.86 -0.30 -0.01 -0.67 -3.12 0.00 0.00 179.24 176.99 1qwv n ASP 40 N -5.44 -6.47 -4.39 6.45 2.03 -1.26 -5.07 116.55 102.41 1qwv n ASP 40 Ca 0.06 -0.04 -0.29 0.00 0.52 0.00 0.00 54.79 55.04 1qwv n ASP 40 Cb 0.37 -4.32 -0.08 0.00 -0.72 0.00 0.00 41.12 36.37 1qwv n ASP 40 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1qwv s TYR 41 N -2.97 1.81 -0.06 -0.67 -0.85 -1.26 -5.12 117.35 108.23 1qwv s TYR 41 Ca 0.01 -1.16 -0.26 0.00 -0.52 0.00 0.00 57.07 55.14 1qwv s TYR 41 Cb -0.00 -1.36 -0.03 0.00 0.38 0.00 0.00 41.96 40.95 1qwv s TYR 41 CO 0.58 -0.08 0.83 0.08 -1.52 0.00 0.00 175.55 175.44 1qwv s VAL 42 N -3.05 4.95 -0.81 -3.49 1.01 -1.26 -4.96 120.40 112.78 1qwv s VAL 42 Ca 0.15 1.71 -0.25 0.00 0.00 0.00 0.00 61.98 63.59 1qwv s VAL 42 Cb 0.02 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.18 1qwv s VAL 42 CO 0.09 0.18 2.01 -0.32 0.00 0.00 0.00 175.10 177.06 1qwv s MET 43 N 1.12 2.42 -0.09 2.72 1.75 -1.26 -4.73 119.30 121.23 1qwv s MET 43 Ca 0.43 0.07 0.09 0.00 -1.25 0.00 0.00 55.69 55.03 1qwv s MET 43 Cb -0.19 -4.87 -0.24 0.00 2.84 0.00 0.00 34.83 32.38 1qwv s MET 43 CO 0.21 -3.39 0.47 0.25 -0.65 0.00 0.00 175.02 171.90 1qwv n THR 44 N 7.88 1.61 -2.26 10.11 -2.24 -1.26 -4.88 114.28 123.24 1qwv n THR 44 Ca 0.37 -0.76 -0.42 0.00 -2.27 0.00 0.00 64.05 60.97 1qwv n THR 44 Cb 0.48 -1.12 -0.03 0.00 -2.10 0.00 0.00 70.33 67.56 1qwv n THR 44 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qwv s ASP 45 N -6.23 6.91 0.47 3.42 2.15 -1.26 -4.90 116.67 117.23 1qwv s ASP 45 Ca -0.11 2.21 0.27 0.00 0.43 0.00 0.00 52.55 55.35 1qwv s ASP 45 Cb 0.07 -2.58 0.78 0.00 -0.30 0.00 0.00 42.92 40.90 1qwv s ASP 45 CO 0.80 -0.59 1.77 0.03 -0.17 0.00 0.00 175.17 177.01 1qwv h ARG 46 N 6.83 0.00 0.00 4.34 -0.00 -1.96 -2.66 114.38 120.93 1qwv h ARG 46 Ca -0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.06 1qwv h ARG 46 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.18 1qwv h ARG 46 CO 0.85 0.07 0.00 -0.07 0.00 0.00 0.00 179.97 180.81 1qwv h LEU 47 N 0.00 0.00 0.00 3.04 -0.00 -1.97 -2.71 115.31 113.67 1qwv h LEU 47 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1qwv h LEU 47 Cb 0.81 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.47 1qwv h LEU 47 CO 0.01 0.00 -0.04 0.00 -0.00 0.00 0.00 178.44 178.41 1qwv h ALA 48 N 2.39 0.00 -0.95 1.53 0.00 -1.87 -2.01 119.26 118.35 1qwv h ALA 48 Ca 0.00 -0.04 0.23 0.00 0.00 0.00 0.00 54.91 55.09 1qwv h ALA 48 Cb 0.72 0.04 -0.18 0.00 0.00 0.00 0.00 17.79 18.37 1qwv h ALA 48 CO 0.00 0.04 -0.09 0.78 0.00 0.00 0.00 179.25 179.98 1qwv h GLY 49 N -0.75 0.97 0.98 0.00 0.00 -1.66 -1.24 103.07 101.37 1qwv h GLY 49 Ca 0.00 0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.46 1qwv h GLY 49 CO 0.00 -0.42 -0.06 0.00 0.00 0.00 0.00 176.54 176.05 1qwv h ALA 51 N 0.87 1.00 -0.99 0.00 0.00 -0.51 -2.22 119.26 117.41 1qwv h ALA 51 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.14 1qwv h ALA 51 Cb 0.58 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 1qwv h ALA 51 CO 0.03 0.00 0.62 0.82 0.00 0.00 0.00 179.25 180.72 1qwv h ILE 52 N 0.00 0.92 -2.86 0.00 1.08 -1.07 -3.15 117.51 112.43 1qwv h ILE 52 Ca 0.00 -0.34 -0.63 0.00 -0.39 0.00 0.00 64.86 63.51 1qwv h ILE 52 Cb 0.28 -0.15 -0.41 0.00 -3.07 0.00 0.00 36.82 33.48 1qwv h ILE 52 CO 0.00 0.18 -0.50 0.59 -0.69 0.00 0.00 178.15 177.73 1qwv n ASN 53 N -4.63 3.44 0.00 1.72 4.13 -0.83 -4.59 115.26 114.49 1qwv n ASN 53 Ca 0.18 -3.28 0.00 0.00 1.68 0.00 0.00 54.58 53.17 1qwv n ASN 53 Cb 0.35 -0.78 0.00 0.00 -1.54 0.00 0.00 39.78 37.81 1qwv n ASN 53 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1qwv n LEU 55 N -2.66 0.50 -0.07 0.00 4.32 -1.26 -0.77 117.00 117.06 1qwv n LEU 55 Ca 0.00 0.58 0.15 0.00 -0.02 0.00 0.00 56.01 56.72 1qwv n LEU 55 Cb 0.37 -0.25 0.76 0.00 -1.62 0.00 0.00 43.42 42.67 1qwv n LEU 55 CO 0.00 -0.25 0.99 0.00 -1.22 0.00 0.00 177.39 176.91 1qwv n ALA 56 N -1.26 2.64 0.07 -1.18 0.00 -1.26 -2.25 120.51 117.28 1qwv n ALA 56 Ca 0.00 -0.22 -0.17 0.00 0.00 0.00 0.00 53.44 53.05 1qwv n ALA 56 Cb 0.00 -1.43 -0.14 0.00 0.00 0.00 0.00 19.45 17.88 1qwv n ALA 56 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1qwv h THR 57 N 0.34 1.19 0.00 0.00 2.02 -1.84 -3.06 112.91 111.56 1qwv h THR 57 Ca 0.00 -2.81 0.00 0.00 0.77 0.00 0.00 66.41 64.37 1qwv h THR 57 Cb 0.23 2.79 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 1qwv h THR 57 CO 0.00 0.83 0.00 0.11 0.37 0.00 0.00 175.52 176.83 1qwv h LYS 58 N 0.07 0.00 0.28 6.66 1.57 -0.63 -3.30 116.57 121.22 1qwv h LYS 58 Ca -0.23 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.53 1qwv h LYS 58 Cb 2.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.33 1qwv h LYS 58 CO 0.17 0.00 -0.13 1.25 -0.57 0.00 0.00 179.45 180.17 1qwv h LEU 59 N 0.00 -0.31 -6.29 2.94 5.85 -1.47 -3.48 115.31 112.55 1qwv h LEU 59 Ca 0.00 0.01 0.23 0.00 0.84 0.00 0.00 57.88 58.96 1qwv h LEU 59 Cb 0.68 0.08 -0.27 0.00 0.37 0.00 0.00 40.66 41.52 1qwv h LEU 59 CO 0.00 -0.18 0.47 -0.62 -0.34 0.00 0.00 178.44 177.77 1qwv s ASP 60 N -3.01 -0.21 -0.11 1.25 2.15 -1.16 -5.08 116.67 110.50 1qwv s ASP 60 Ca -0.05 0.30 0.00 0.00 0.43 0.00 0.00 52.55 53.23 1qwv s ASP 60 Cb 0.01 1.23 0.01 0.00 -0.30 0.00 0.00 42.92 43.86 1qwv s ASP 60 CO 0.16 -0.04 0.69 0.55 -0.17 0.00 0.00 175.17 176.36 1qwv n VAL 61 N 4.50 0.00 -3.81 1.11 3.14 -1.26 -4.81 118.33 117.20 1qwv n VAL 61 Ca -0.08 -0.19 -0.36 0.00 -2.96 0.00 0.00 64.34 60.74 1qwv n VAL 61 Cb 0.55 0.51 -0.12 0.00 -1.06 0.00 0.00 33.84 33.72 1qwv n VAL 61 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 1qwv s VAL 62 N 0.00 4.35 0.03 1.55 -7.23 -1.26 -4.11 120.40 113.74 1qwv s VAL 62 Ca 0.00 -0.16 -0.27 0.00 -1.81 0.00 0.00 61.98 59.74 1qwv s VAL 62 Cb 0.01 -3.02 -0.17 0.00 0.56 0.00 0.00 36.38 33.76 1qwv s VAL 62 CO -0.00 0.36 1.36 -0.78 -0.31 0.00 0.00 175.10 175.72 1qwv h ASP 63 N 8.01 -0.47 0.00 4.85 3.58 -1.86 -3.47 116.42 127.07 1qwv h ASP 63 Ca -0.38 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 56.98 1qwv h ASP 63 Cb 1.18 0.12 0.00 0.00 1.72 0.00 0.00 39.33 42.35 1qwv h ASP 63 CO 0.59 -0.17 0.00 -0.81 -2.88 0.00 0.00 179.24 175.98 1qwv n PRO 64 N -5.24 2.76 0.00 0.28 -0.05 -1.26 -4.92 135.00 126.57 1qwv n PRO 64 Ca -0.11 0.00 0.08 0.00 -0.05 0.00 0.00 63.50 63.43 1qwv n PRO 64 Cb 0.28 0.00 0.43 0.00 -0.05 0.00 0.00 33.50 34.16 1qwv n PRO 64 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 1qwv n ASP 65 N 0.00 0.00 0.00 3.54 2.03 -1.26 -4.80 116.55 116.06 1qwv n ASP 65 Ca 0.00 0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.33 1qwv n ASP 65 Cb 0.00 -0.28 0.00 0.00 -0.72 0.00 0.00 41.12 40.12 1qwv n ASP 65 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qwv n GLY 66 N 0.16 3.28 3.84 0.27 0.00 -1.26 -5.12 105.19 106.36 1qwv n GLY 66 Ca 0.08 -0.51 -0.33 0.00 0.00 0.00 0.00 46.02 45.26 1qwv n GLY 66 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qwv s ASN 67 N 0.00 6.84 -0.73 1.61 4.22 -1.26 -4.42 114.94 121.20 1qwv s ASN 67 Ca 0.00 1.40 -0.02 0.00 -2.14 0.00 0.00 52.86 52.10 1qwv s ASN 67 Cb 0.00 -2.42 0.00 0.00 1.28 0.00 0.00 41.25 40.11 1qwv s ASN 67 CO 0.00 -0.22 0.62 -0.11 -2.04 0.00 0.00 177.10 175.34 1qwv n LEU 68 N -0.33 -3.05 -4.58 3.54 -0.00 -1.26 -4.52 117.00 106.81 1qwv n LEU 68 Ca 0.04 -0.34 -0.36 0.00 -0.00 0.00 0.00 56.01 55.35 1qwv n LEU 68 Cb 0.53 -2.00 -0.03 0.00 -0.00 0.00 0.00 43.42 41.92 1qwv n LEU 68 CO 0.41 0.28 1.71 -1.38 -0.00 0.00 0.00 177.39 178.40 1qwv s HIS 69 N -3.20 2.36 -0.08 1.96 -3.43 -1.26 -4.59 115.29 107.04 1qwv s HIS 69 Ca 0.12 -0.57 -0.04 0.00 -0.80 0.00 0.00 55.06 53.78 1qwv s HIS 69 Cb -0.05 -4.40 -0.01 0.00 -1.43 0.00 0.00 32.58 26.69 1qwv s HIS 69 CO 0.42 -1.56 -0.07 1.25 -2.00 0.00 0.00 174.74 172.78 1qwv h HIS 70 N 8.85 0.00 0.98 0.38 6.17 -1.90 -3.33 115.15 126.29 1qwv h HIS 70 Ca 0.31 0.00 -0.05 0.00 0.71 0.00 0.00 60.37 61.35 1qwv h HIS 70 Cb 0.92 0.00 0.01 0.00 2.52 0.00 0.00 27.41 30.86 1qwv h HIS 70 CO 1.31 0.00 -0.47 0.78 0.71 0.00 0.00 177.93 180.27 1qwv h GLY 71 N -0.67 -1.37 1.14 5.26 0.00 -1.97 -2.56 103.07 102.90 1qwv h GLY 71 Ca 0.00 0.51 0.12 0.00 0.00 0.00 0.00 47.33 47.96 1qwv h GLY 71 CO 0.00 -0.50 0.32 3.43 0.00 0.00 0.00 176.54 179.79 1qwv h ASN 72 N -1.33 0.00 0.07 0.19 2.35 -1.86 0.16 115.58 115.16 1qwv h ASN 72 Ca -0.13 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.42 1qwv h ASN 72 Cb 1.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.38 1qwv h ASN 72 CO 0.22 0.00 -0.74 0.00 -1.65 0.00 0.00 177.43 175.26 1qwv h ALA 73 N 1.75 0.48 0.08 -0.83 0.00 -1.61 0.11 119.26 119.24 1qwv h ALA 73 Ca 0.19 -0.60 -0.25 0.00 0.00 0.00 0.00 54.91 54.26 1qwv h ALA 73 Cb 0.82 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 1qwv h ALA 73 CO -0.00 0.72 -1.13 0.87 0.00 0.00 0.00 179.25 179.71 1qwv h LYS 74 N 0.40 0.21 -0.75 0.00 1.79 -0.81 -2.58 116.57 114.83 1qwv h LYS 74 Ca -0.04 -0.33 -0.06 0.00 -2.18 0.00 0.00 60.65 58.04 1qwv h LYS 74 Cb 1.33 0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 32.07 1qwv h LYS 74 CO 0.14 1.14 0.23 0.22 -1.08 0.00 0.00 179.45 180.10 1qwv h ASP 75 N 0.07 1.10 -0.06 0.86 3.58 -0.71 -1.61 116.42 119.65 1qwv h ASP 75 Ca -0.09 -0.21 -0.04 0.00 0.42 0.00 0.00 57.03 57.10 1qwv h ASP 75 Cb 1.85 -0.29 -0.01 0.00 1.72 0.00 0.00 39.33 42.60 1qwv h ASP 75 CO 0.18 1.02 -0.07 0.15 -2.88 0.00 0.00 179.24 177.64 1qwv h PHE 76 N 1.12 0.31 -0.12 0.28 3.57 -0.71 -1.24 116.94 120.15 1qwv h PHE 76 Ca 0.24 -0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.60 1qwv h PHE 76 Cb 0.31 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1qwv h PHE 76 CO 0.03 0.37 -0.45 0.00 -2.23 0.00 0.00 178.31 176.02 1qwv h ALA 77 N 1.65 1.02 0.00 2.41 0.00 -1.00 -1.80 119.26 121.54 1qwv h ALA 77 Ca 0.06 -0.45 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1qwv h ALA 77 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1qwv h ALA 77 CO 0.01 0.63 -0.38 0.52 0.00 0.00 0.00 179.25 180.03 1qwv h MET 78 N 0.23 0.00 0.00 0.00 2.86 -0.32 -2.21 114.93 115.49 1qwv h MET 78 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1qwv h MET 78 Cb 0.89 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.55 1qwv h MET 78 CO 0.07 0.38 -0.49 0.87 1.06 0.00 0.00 176.91 178.80 1qwv h LYS 79 N 0.00 0.00 -2.23 1.72 1.57 -0.97 -3.42 116.57 113.24 1qwv h LYS 79 Ca -0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.38 1qwv h LYS 79 Cb 0.76 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 32.73 1qwv h LYS 79 CO 0.05 0.00 -0.70 -1.01 -0.57 0.00 0.00 179.45 177.22 1qwv s HIS 80 N -3.17 -0.17 0.00 -1.35 3.76 -0.71 -4.97 115.29 108.68 1qwv s HIS 80 Ca 0.07 -0.63 0.00 0.00 -0.15 0.00 0.00 55.06 54.34 1qwv s HIS 80 Cb 0.12 -0.56 0.00 0.00 1.11 0.00 0.00 32.58 33.25 1qwv s HIS 80 CO 0.70 -0.91 0.00 0.41 -0.85 0.00 0.00 174.74 174.09 1qwv n GLY 81 N 4.84 2.72 3.76 -2.22 0.00 -1.23 -4.56 105.19 108.49 1qwv n GLY 81 Ca 0.03 -0.81 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 1qwv n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qwv s ALA 82 N 0.00 3.52 0.76 4.61 0.00 -0.87 -4.51 121.76 125.27 1qwv s ALA 82 Ca 0.00 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.17 1qwv s ALA 82 Cb 0.00 -1.69 0.13 0.00 0.00 0.00 0.00 23.12 21.56 1qwv s ALA 82 CO 0.00 0.58 1.06 0.16 0.00 0.00 0.00 175.76 177.56 1qwv s ASP 83 N -0.88 4.20 0.32 0.00 1.47 -1.26 -4.08 116.67 116.45 1qwv s ASP 83 Ca 0.13 -0.05 0.05 0.00 1.18 0.00 0.00 52.55 53.86 1qwv s ASP 83 Cb -0.12 -0.33 0.70 0.00 -0.34 0.00 0.00 42.92 42.84 1qwv s ASP 83 CO 0.03 -1.97 1.86 -0.33 0.68 0.00 0.00 175.17 175.43 1qwv h GLU 84 N -0.76 0.80 0.00 2.11 4.39 -1.98 0.26 114.58 119.40 1qwv h GLU 84 Ca -0.40 -0.05 -0.07 0.00 0.34 0.00 0.00 59.36 59.18 1qwv h GLU 84 Cb 1.27 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 1qwv h GLU 84 CO 0.44 0.53 -0.35 0.00 -1.16 0.00 0.00 179.01 178.47 1qwv h THR 85 N 0.83 0.76 0.19 1.13 1.03 -1.98 -1.82 112.91 113.06 1qwv h THR 85 Ca 0.46 -1.53 -0.35 0.00 -0.01 0.00 0.00 66.41 64.98 1qwv h THR 85 Cb 0.60 1.98 0.01 0.00 -1.07 0.00 0.00 68.15 69.67 1qwv h THR 85 CO -0.23 0.34 -1.70 0.24 -0.01 0.00 0.00 175.52 174.16 1qwv h MET 86 N 0.00 0.41 -0.62 0.00 2.86 -0.94 -1.81 114.93 114.82 1qwv h MET 86 Ca -0.00 -0.69 -0.08 0.00 -2.06 0.00 0.00 59.70 56.86 1qwv h MET 86 Cb 0.95 0.26 -0.02 0.00 0.06 0.00 0.00 31.60 32.85 1qwv h MET 86 CO 0.05 1.32 0.06 0.00 1.06 0.00 0.00 176.91 179.40 1qwv h ALA 87 N 0.15 0.94 0.00 6.32 0.00 -1.01 -0.69 119.26 124.97 1qwv h ALA 87 Ca -0.33 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.21 1qwv h ALA 87 Cb 2.11 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.65 1qwv h ALA 87 CO 0.19 0.65 -0.45 1.96 0.00 0.00 0.00 179.25 181.61 1qwv h GLN 88 N 0.97 0.00 0.00 0.00 7.50 -1.35 0.38 115.11 122.60 1qwv h GLN 88 Ca 0.19 0.00 -0.08 0.00 0.50 0.00 0.00 58.65 59.26 1qwv h GLN 88 Cb 0.47 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.99 1qwv h GLN 88 CO 0.02 0.45 -0.62 -0.56 -1.50 0.00 0.00 178.83 176.61 1qwv h GLN 89 N 0.00 0.00 0.04 1.46 3.07 -1.22 -3.30 115.11 115.17 1qwv h GLN 89 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.61 1qwv h GLN 89 Cb 1.17 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.73 1qwv h GLN 89 CO 0.06 0.29 -0.61 1.25 0.09 0.00 0.00 178.83 179.91 1qwv h LEU 90 N 0.00 0.13 -1.39 0.06 6.46 -0.50 -3.34 115.31 116.74 1qwv h LEU 90 Ca -0.03 -0.87 0.07 0.00 -0.12 0.00 0.00 57.88 56.93 1qwv h LEU 90 Cb 1.29 -0.04 -0.05 0.00 -0.73 0.00 0.00 40.66 41.13 1qwv h LEU 90 CO 0.04 1.26 0.48 -0.37 -0.62 0.00 0.00 178.44 179.23 1qwv h VAL 91 N -0.79 1.01 -0.56 1.05 -1.51 -0.43 -1.89 116.25 113.12 1qwv h VAL 91 Ca -0.14 -0.25 -0.08 0.00 -1.23 0.00 0.00 66.70 65.00 1qwv h VAL 91 Cb 1.28 0.21 -0.02 0.00 -2.13 0.00 0.00 31.29 30.63 1qwv h VAL 91 CO -0.01 0.13 0.04 -0.78 -1.23 0.00 0.00 177.57 175.72 1qwv h ASP 92 N 0.73 0.93 -0.63 4.19 3.58 -1.71 -1.32 116.42 122.19 1qwv h ASP 92 Ca 0.32 -0.29 -0.02 0.00 0.42 0.00 0.00 57.03 57.46 1qwv h ASP 92 Cb 0.29 -0.25 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 1qwv h ASP 92 CO -0.11 0.99 0.30 0.40 -2.88 0.00 0.00 179.24 177.94 1qwv h ILE 93 N 0.85 1.22 -0.31 2.25 5.03 -1.48 -1.83 117.51 123.23 1qwv h ILE 93 Ca 0.16 -0.63 0.04 0.00 -0.12 0.00 0.00 64.86 64.32 1qwv h ILE 93 Cb 0.49 0.46 -0.04 0.00 -3.03 0.00 0.00 36.82 34.70 1qwv h ILE 93 CO 0.02 0.26 0.09 0.40 -0.68 0.00 0.00 178.15 178.24 1qwv h ILE 94 N 0.87 0.89 -0.26 -0.67 2.04 -0.77 0.31 117.51 119.91 1qwv h ILE 94 Ca 0.22 -0.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.91 1qwv h ILE 94 Cb 0.13 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1qwv h ILE 94 CO -0.03 0.04 -0.23 0.45 0.00 0.00 0.00 178.15 178.39 1qwv h HIS 95 N 0.22 0.55 0.03 1.37 3.86 -1.04 0.53 115.15 120.67 1qwv h HIS 95 Ca 0.14 -0.11 -0.08 0.00 -1.16 0.00 0.00 60.37 59.16 1qwv h HIS 95 Cb 0.13 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.46 1qwv h HIS 95 CO -0.15 0.69 -0.42 0.78 0.86 0.00 0.00 177.93 179.68 1qwv h GLY 96 N 1.00 0.07 1.88 2.45 0.00 -0.68 -2.33 103.07 105.47 1qwv h GLY 96 Ca 0.07 -0.17 -0.17 0.00 0.00 0.00 0.00 47.33 47.06 1qwv h GLY 96 CO 0.05 0.15 -0.77 0.00 0.00 0.00 0.00 176.54 175.97 1qwv h GLU 98 N 0.07 0.83 -0.13 0.00 5.08 -1.00 0.60 114.58 120.03 1qwv h GLU 98 Ca -0.02 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.15 1qwv h GLU 98 Cb 1.35 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.42 1qwv h GLU 98 CO 0.11 0.55 -0.46 -0.22 -1.00 0.00 0.00 179.01 177.99 1qwv h LYS 99 N 0.85 0.54 -0.64 2.33 1.63 -0.80 -3.30 116.57 117.18 1qwv h LYS 99 Ca 0.35 -0.41 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 1qwv h LYS 99 Cb 0.26 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.96 1qwv h LYS 99 CO -0.12 1.03 0.00 0.43 -3.45 0.00 0.00 179.45 177.34 1qwv n SER 100 N -4.25 4.47 -4.85 4.20 7.64 0.76 -4.94 113.62 116.66 1qwv n SER 100 Ca -0.07 -2.46 -0.32 0.00 1.01 0.00 0.00 58.87 57.03 1qwv n SER 100 Cb 0.57 -0.57 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1qwv n SER 100 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1qwv s ALA 101 N -1.92 3.11 0.85 -0.43 0.00 0.19 -4.98 121.76 118.58 1qwv s ALA 101 Ca 0.47 0.12 -0.11 0.00 0.00 0.00 0.00 51.96 52.44 1qwv s ALA 101 Cb 0.31 -3.05 0.10 0.00 0.00 0.00 0.00 23.12 20.48 1qwv s ALA 101 CO 0.21 -0.19 1.09 -2.14 0.00 0.00 0.00 175.76 174.74 1qwv s PRO 102 N -4.01 1.60 0.00 0.00 0.02 -1.26 -4.87 135.00 126.48 1qwv s PRO 102 Ca 0.58 0.97 -0.00 0.00 0.02 0.00 0.00 61.00 62.56 1qwv s PRO 102 Cb -0.10 -1.84 -0.01 0.00 0.02 0.00 0.00 34.50 32.57 1qwv s PRO 102 CO 0.31 -2.05 1.02 -2.30 -0.33 0.00 0.00 177.00 173.65 1qwv n PRO 103 N -3.77 0.51 -2.67 5.54 -0.02 -1.26 -4.75 135.00 128.57 1qwv n PRO 103 Ca 0.08 -0.03 -0.42 0.00 -2.02 0.00 0.00 63.50 61.11 1qwv n PRO 103 Cb 0.54 -1.30 -0.03 0.00 -0.02 0.00 0.00 33.50 32.69 1qwv n PRO 103 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1qwv s ASN 104 N 2.04 6.40 -0.88 2.55 -0.87 -1.26 -4.95 114.94 117.97 1qwv s ASN 104 Ca 0.02 -1.28 -0.24 0.00 -1.57 0.00 0.00 52.86 49.79 1qwv s ASN 104 Cb 0.01 -2.51 0.05 0.00 -0.02 0.00 0.00 41.25 38.78 1qwv s ASN 104 CO 0.00 -1.48 1.32 -0.62 -2.57 0.00 0.00 177.10 173.74 1qwv s ASP 105 N 4.24 6.36 -0.23 -1.22 2.15 -1.26 -4.76 116.67 121.95 1qwv s ASP 105 Ca 0.37 -1.10 -0.02 0.00 0.43 0.00 0.00 52.55 52.23 1qwv s ASP 105 Cb -0.05 -2.54 0.07 0.00 -0.30 0.00 0.00 42.92 40.10 1qwv s ASP 105 CO -0.01 -1.58 0.04 -0.62 -0.17 0.00 0.00 175.17 172.83 1qwv s ASP 106 N 4.30 3.30 0.08 -0.34 -1.08 -1.26 -5.05 116.67 116.61 1qwv s ASP 106 Ca 0.39 -1.07 -0.12 0.00 -0.52 0.00 0.00 52.55 51.23 1qwv s ASP 106 Cb -0.05 -0.72 -0.00 0.00 -1.46 0.00 0.00 42.92 40.69 1qwv s ASP 106 CO 0.01 -0.33 0.68 1.17 0.52 0.00 0.00 175.17 177.22 1qwv n LYS 107 N 4.97 -0.17 0.03 4.34 4.81 -1.26 -0.61 118.16 130.26 1qwv n LYS 107 Ca -0.08 0.67 0.11 0.00 -0.87 0.00 0.00 58.31 58.14 1qwv n LYS 107 Cb 0.45 -0.98 -0.03 0.00 0.02 0.00 0.00 35.03 34.49 1qwv n LYS 107 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1qwv h MET 109 N 0.00 0.00 -0.32 0.00 1.85 -1.21 -3.34 114.93 111.91 1qwv h MET 109 Ca 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 59.70 59.10 1qwv h MET 109 Cb 0.80 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.81 1qwv h MET 109 CO 0.00 0.41 0.19 1.57 -0.40 0.00 0.00 176.91 178.67 1qwv h LYS 110 N 0.00 0.37 0.00 0.39 -0.00 -1.69 0.34 116.57 115.99 1qwv h LYS 110 Ca -0.08 -0.02 0.00 0.00 -0.00 0.00 0.00 60.65 60.55 1qwv h LYS 110 Cb 1.49 -0.08 0.00 0.00 -0.00 0.00 0.00 32.23 33.64 1qwv h LYS 110 CO 0.06 0.25 0.22 2.41 -0.00 0.00 0.00 179.45 182.38 1qwv n THR 111 N -4.91 0.79 -0.03 0.07 -1.04 -1.25 -1.84 114.28 106.06 1qwv n THR 111 Ca -0.00 0.72 -0.21 0.00 -2.04 0.00 0.00 64.05 62.51 1qwv n THR 111 Cb 0.05 -1.72 -0.13 0.00 -1.82 0.00 0.00 70.33 66.72 1qwv n THR 111 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1qwv n ILE 112 N -2.02 1.70 0.10 12.58 -0.00 0.12 -1.94 119.36 129.89 1qwv n ILE 112 Ca -0.01 -0.55 0.03 0.00 -0.00 0.00 0.00 62.75 62.22 1qwv n ILE 112 Cb 0.24 -1.74 0.42 0.00 -0.00 0.00 0.00 39.64 38.56 1qwv n ILE 112 CO 0.00 0.00 0.00 -2.24 -0.00 0.00 0.00 176.55 174.31 1qwv h ASP 113 N -0.12 0.27 0.60 4.38 3.04 -0.97 0.29 116.42 123.92 1qwv h ASP 113 Ca -0.45 -0.04 -0.28 0.00 -3.24 0.00 0.00 57.03 53.03 1qwv h ASP 113 Cb 1.90 -0.07 0.00 0.00 -1.04 0.00 0.00 39.33 40.13 1qwv h ASP 113 CO 0.01 0.34 -1.28 -0.37 -2.04 0.00 0.00 179.24 175.90 1qwv h VAL 114 N 0.29 1.46 -0.11 4.15 -1.51 -1.57 -2.34 116.25 116.62 1qwv h VAL 114 Ca 0.07 -3.03 -0.00 0.00 -1.23 0.00 0.00 66.70 62.50 1qwv h VAL 114 Cb 0.23 2.94 -0.00 0.00 -2.13 0.00 0.00 31.29 32.32 1qwv h VAL 114 CO 0.01 0.88 0.05 0.00 -1.23 0.00 0.00 177.57 177.28 1qwv h ALA 115 N 0.56 0.14 0.00 5.19 0.00 -0.81 -1.93 119.26 122.40 1qwv h ALA 115 Ca -0.15 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1qwv h ALA 115 Cb 1.99 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1qwv h ALA 115 CO 0.20 -0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.16 1qwv h MET 116 N 0.04 0.00 -0.01 0.00 -0.00 -0.52 0.75 114.93 115.18 1qwv h MET 116 Ca 0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 59.70 59.63 1qwv h MET 116 Cb 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.72 1qwv h MET 116 CO -0.00 0.00 -0.47 0.00 -0.00 0.00 0.00 176.91 176.44 1qwv h PHE 118 N 0.03 0.74 0.00 0.00 3.57 -0.11 -0.36 116.94 120.80 1qwv h PHE 118 Ca -0.00 -0.26 -0.09 0.00 3.53 0.00 0.00 57.97 61.15 1qwv h PHE 118 Cb 0.84 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 1qwv h PHE 118 CO 0.00 1.00 -0.45 1.57 -2.23 0.00 0.00 178.31 178.20 1qwv h LYS 119 N 0.28 0.00 -0.37 1.11 2.10 -1.42 0.46 116.57 118.73 1qwv h LYS 119 Ca 0.02 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.72 1qwv h LYS 119 Cb 0.93 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.22 1qwv h LYS 119 CO 0.08 0.45 0.10 -0.22 -2.00 0.00 0.00 179.45 177.86 1qwv h LYS 120 N 0.00 0.23 -0.15 0.07 1.63 -1.12 -1.42 116.57 115.82 1qwv h LYS 120 Ca -0.00 -0.01 0.03 0.00 -0.85 0.00 0.00 60.65 59.81 1qwv h LYS 120 Cb 0.81 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.37 1qwv h LYS 120 CO 0.06 0.15 -0.04 1.49 -3.45 0.00 0.00 179.45 177.66 1qwv h GLU 121 N 0.23 0.00 -0.42 1.90 4.57 -0.22 -1.48 114.58 119.17 1qwv h GLU 121 Ca 0.17 -0.00 0.10 0.00 -1.18 0.00 0.00 59.36 58.45 1qwv h GLU 121 Cb 0.18 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1qwv h GLU 121 CO -0.20 0.00 0.29 0.97 -1.18 0.00 0.00 179.01 178.89 1qwv h ILE 122 N 0.00 0.86 -0.06 2.32 -0.00 -0.72 0.72 117.51 120.64 1qwv h ILE 122 Ca 0.07 -0.05 -0.14 0.00 -0.00 0.00 0.00 64.86 64.74 1qwv h ILE 122 Cb 0.11 0.70 -0.01 0.00 -0.00 0.00 0.00 36.82 37.62 1qwv h ILE 122 CO -0.15 0.03 -0.59 0.45 -0.00 0.00 0.00 178.15 177.89 1qwv h HIS 123 N 0.14 0.23 0.00 2.19 3.86 -0.35 -3.00 115.15 118.22 1qwv h HIS 123 Ca 0.20 -0.09 -0.10 0.00 -1.16 0.00 0.00 60.37 59.22 1qwv h HIS 123 Cb 0.59 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 1qwv h HIS 123 CO -0.00 0.73 -0.48 -0.22 0.86 0.00 0.00 177.93 178.82 1qwv h LYS 124 N 0.14 0.00 -0.20 2.45 3.11 0.08 -2.76 116.57 119.39 1qwv h LYS 124 Ca -0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1qwv h LYS 124 Cb 1.08 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.31 1qwv h LYS 124 CO 0.09 0.48 0.00 1.28 -2.81 0.00 0.00 179.45 178.49 1qwv n LEU 125 N -3.67 0.20 -4.73 5.20 4.77 -0.59 -4.90 117.00 113.28 1qwv n LEU 125 Ca -0.01 -0.10 -0.66 0.00 -0.03 0.00 0.00 56.01 55.21 1qwv n LEU 125 Cb 0.55 -0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 1qwv n LEU 125 CO 0.39 0.05 1.13 -3.20 -1.33 0.00 0.00 177.39 174.43 1qwv n ASN 126 N -0.31 1.24 -0.95 -1.43 2.85 -1.04 -4.79 115.26 110.83 1qwv n ASN 126 Ca 0.00 1.18 -0.00 0.00 -0.11 0.00 0.00 54.58 55.65 1qwv n ASN 126 Cb 0.05 -0.91 0.00 0.00 1.24 0.00 0.00 39.78 40.16 1qwv n ASN 126 CO 0.00 0.00 0.00 0.79 -2.11 0.00 0.00 177.26 175.94 1qwv n TRP 127 N 3.95 0.01 -2.04 1.20 8.01 -1.26 -4.89 117.44 122.42 1qwv n TRP 127 Ca 0.30 -0.45 -0.42 0.00 -1.31 0.00 0.00 57.50 55.62 1qwv n TRP 127 Cb -0.03 -0.23 -0.03 0.00 -2.01 0.00 0.00 31.31 29.01 1qwv n TRP 127 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.69 176.82 1qwv s VAL 128 N -0.12 3.33 0.01 -0.99 -7.23 -1.26 -4.94 120.40 109.20 1qwv s VAL 128 Ca 0.00 0.72 -0.25 0.00 -1.81 0.00 0.00 61.98 60.64 1qwv s VAL 128 Cb 0.00 -3.46 -0.15 0.00 0.56 0.00 0.00 36.38 33.33 1qwv s VAL 128 CO 0.00 -0.01 1.14 -0.65 -0.31 0.00 0.00 175.10 175.27 1qwv h PRO 129 N 8.31 -0.60 0.00 4.82 0.11 -2.03 -3.46 132.00 139.15 1qwv h PRO 129 Ca -0.41 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1qwv h PRO 129 Cb 1.19 0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1qwv h PRO 129 CO 0.92 -0.29 0.00 -1.71 -0.21 0.00 0.00 178.00 176.71 1qwv n ASN 130 N -5.23 0.00 -4.91 -2.05 5.15 -1.26 -4.75 115.26 102.21 1qwv n ASN 130 Ca -0.10 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.67 1qwv n ASN 130 Cb 0.30 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.54 1qwv n ASN 130 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 1qwv s MET 131 N 0.00 2.51 0.41 1.20 -1.94 -1.26 -5.14 119.30 115.08 1qwv s MET 131 Ca 0.00 -1.58 0.06 0.00 -1.71 0.00 0.00 55.69 52.46 1qwv s MET 131 Cb 0.00 -2.40 0.06 0.00 2.01 0.00 0.00 34.83 34.49 1qwv s MET 131 CO 0.00 -0.32 0.48 -0.25 -0.01 0.00 0.00 175.02 174.92 1qwv n ASP 132 N -1.67 1.81 -3.38 3.03 8.00 -1.26 -4.79 116.55 118.28 1qwv n ASP 132 Ca 0.04 -2.21 -0.13 0.00 0.71 0.00 0.00 54.79 53.20 1qwv n ASP 132 Cb 0.62 -0.21 0.01 0.00 -0.02 0.00 0.00 41.12 41.52 1qwv n ASP 132 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1qwv n LEU 133 N 0.00 -4.70 -4.55 0.64 4.32 -1.26 -4.85 117.00 106.60 1qwv n LEU 133 Ca 0.07 -0.53 -0.41 0.00 -0.02 0.00 0.00 56.01 55.12 1qwv n LEU 133 Cb 0.44 -2.70 -0.03 0.00 -1.62 0.00 0.00 43.42 39.52 1qwv n LEU 133 CO 0.28 -0.34 1.27 0.54 -1.22 0.00 0.00 177.39 177.91 1qwv s VAL 134 N -3.11 3.84 -0.36 4.08 0.11 -1.26 -4.32 120.40 119.38 1qwv s VAL 134 Ca 0.12 -0.12 -0.10 0.00 -2.93 0.00 0.00 61.98 58.96 1qwv s VAL 134 Cb -0.04 -4.96 0.01 0.00 -1.53 0.00 0.00 36.38 29.87 1qwv s VAL 134 CO 0.81 -1.87 0.36 -0.38 -3.33 0.00 0.00 175.10 170.69 1qwv n ILE 135 N 6.54-10.80 -3.78 7.04 2.08 -1.26 -5.01 119.36 114.16 1qwv n ILE 135 Ca 0.15 1.15 -0.29 0.00 0.56 0.00 0.00 62.75 64.32 1qwv n ILE 135 Cb 0.50 -6.96 -0.13 0.00 -0.75 0.00 0.00 39.64 32.30 1qwv n ILE 135 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1qwv s GLY 136 N -2.15 2.05 -0.29 7.39 0.00 -1.26 -5.04 107.32 108.02 1qwv s GLY 136 Ca 0.15 -2.97 0.01 0.00 0.00 0.00 0.00 44.72 41.90 1qwv s GLY 136 CO 0.72 1.37 0.04 1.85 0.00 0.00 0.00 173.10 177.09 1qwv s GLU 137 N -0.15 1.12 -0.09 2.90 2.12 -1.26 -5.10 118.70 118.25 1qwv s GLU 137 Ca 0.20 -1.19 0.01 0.00 0.36 0.00 0.00 54.97 54.36 1qwv s GLU 137 Cb -0.19 -2.44 0.02 0.00 0.26 0.00 0.00 34.13 31.78 1qwv s GLU 137 CO -0.04 -0.85 -0.12 0.54 -0.54 0.00 0.00 175.26 174.25 1qwv s VAL 138 N 1.41 1.21 -0.04 3.70 0.11 -1.26 -5.05 120.40 120.49 1qwv s VAL 138 Ca 0.05 -0.48 -0.02 0.00 -2.93 0.00 0.00 61.98 58.60 1qwv s VAL 138 Cb -0.18 -1.13 -0.01 0.00 -1.53 0.00 0.00 36.38 33.53 1qwv s VAL 138 CO -0.15 0.38 -0.05 0.25 -3.33 0.00 0.00 175.10 172.21 1qwv h LEU 139 N 7.38 0.00 -0.71 2.54 5.85 -2.05 -3.52 115.31 124.81 1qwv h LEU 139 Ca -0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1qwv h LEU 139 Cb 1.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1qwv h LEU 139 CO 0.46 0.20 -0.55 0.00 -0.34 0.00 0.00 178.44 178.22 1qwv n ALA 140 N -2.61 -2.42 0.07 1.25 0.00 -1.26 -4.89 120.51 110.65 1qwv n ALA 140 Ca -0.02 0.28 -0.05 0.00 0.00 0.00 0.00 53.44 53.64 1qwv n ALA 140 Cb 0.07 -1.05 -0.10 0.00 0.00 0.00 0.00 19.45 18.37 1qwv n ALA 140 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1qwv h GLU 141 N 1.72 0.00 0.00 0.00 4.11 -2.08 -3.57 114.58 114.75 1qwv h GLU 141 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1qwv h GLU 141 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1qwv h GLU 141 CO 0.00 0.89 0.00 1.55 0.07 0.00 0.00 179.01 181.52