#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rqv n ILE 2 N 0.00 5.55 -1.66 0.44 5.41 -1.26 -4.97 119.36 122.87 1rqv n ILE 2 Ca 0.00 -5.48 -0.29 0.00 1.00 0.00 0.00 62.75 57.98 1rqv n ILE 2 Cb 0.00 -1.55 0.10 0.00 -0.71 0.00 0.00 39.64 37.49 1rqv n ILE 2 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1rqv s THR 3 N -4.12 2.47 0.05 1.39 -4.23 -1.26 -4.99 115.64 104.95 1rqv s THR 3 Ca 0.43 0.15 -0.16 0.00 -1.18 0.00 0.00 61.69 60.94 1rqv s THR 3 Cb 0.24 -2.98 -0.28 0.00 1.34 0.00 0.00 72.50 70.81 1rqv s THR 3 CO -0.18 -0.20 1.10 0.11 -0.54 0.00 0.00 174.62 174.91 1rqv h LYS 4 N -1.19 0.60 -0.80 3.99 1.57 -2.00 -3.27 116.57 115.47 1rqv h LYS 4 Ca -0.48 -0.77 0.10 0.00 -1.87 0.00 0.00 60.65 57.63 1rqv h LYS 4 Cb 1.30 0.25 -0.08 0.00 0.08 0.00 0.00 32.23 33.79 1rqv h LYS 4 CO 0.62 1.34 0.44 -0.44 -0.57 0.00 0.00 179.45 180.85 1rqv h ASP 5 N 0.22 0.60 -0.08 0.86 3.32 -2.00 0.13 116.42 119.47 1rqv h ASP 5 Ca -0.17 0.06 0.01 0.00 0.02 0.00 0.00 57.03 56.95 1rqv h ASP 5 Cb 1.82 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 41.31 1rqv h ASP 5 CO 0.22 0.33 0.06 0.06 -1.72 0.00 0.00 179.24 178.19 1rqv h GLN 6 N 0.72 0.05 0.00 3.56 -0.00 -1.94 0.36 115.11 117.86 1rqv h GLN 6 Ca 0.40 -0.00 -0.10 0.00 -0.00 0.00 0.00 58.65 58.94 1rqv h GLN 6 Cb 0.41 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 27.87 1rqv h GLN 6 CO -0.27 0.03 -0.49 0.82 -0.00 0.00 0.00 178.83 178.92 1rqv h ILE 7 N 0.05 1.08 0.16 1.86 2.04 -0.82 -2.66 117.51 119.23 1rqv h ILE 7 Ca 0.04 -1.84 -0.01 0.00 1.00 0.00 0.00 64.86 64.04 1rqv h ILE 7 Cb 0.08 2.08 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1rqv h ILE 7 CO -0.00 0.48 -0.08 0.40 0.00 0.00 0.00 178.15 178.94 1rqv h ILE 8 N 0.00 0.97 0.00 -0.67 1.08 0.28 -2.55 117.51 116.62 1rqv h ILE 8 Ca -0.00 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 63.71 1rqv h ILE 8 Cb 1.04 1.41 0.00 0.00 -3.07 0.00 0.00 36.82 36.20 1rqv h ILE 8 CO 0.06 0.17 0.00 1.05 -0.69 0.00 0.00 178.15 178.74 1rqv h GLU 9 N -0.59 0.00 -0.13 2.37 4.11 -1.43 -2.08 114.58 116.83 1rqv h GLU 9 Ca -0.02 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.24 1rqv h GLU 9 Cb 0.45 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.70 1rqv h GLU 9 CO 0.04 0.00 -0.59 0.00 0.07 0.00 0.00 179.01 178.53 1rqv h ALA 10 N 2.14 0.24 0.00 1.06 0.00 -1.09 -1.05 119.26 120.57 1rqv h ALA 10 Ca 0.00 -0.53 -0.09 0.00 0.00 0.00 0.00 54.91 54.29 1rqv h ALA 10 Cb 0.24 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1rqv h ALA 10 CO 0.00 0.49 -0.43 0.28 0.00 0.00 0.00 179.25 179.58 1rqv h VAL 11 N 0.28 1.15 -0.31 0.00 2.07 -1.07 -1.75 116.25 116.62 1rqv h VAL 11 Ca -0.04 -1.57 0.00 0.00 0.82 0.00 0.00 66.70 65.91 1rqv h VAL 11 Cb 1.23 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 1rqv h VAL 11 CO 0.12 0.42 0.00 0.00 0.02 0.00 0.00 177.57 178.14 1rqv n ALA 12 N -2.38 2.46 -0.06 1.67 0.00 -0.97 -3.55 120.51 117.68 1rqv n ALA 12 Ca -0.01 -0.63 -0.06 0.00 0.00 0.00 0.00 53.44 52.74 1rqv n ALA 12 Cb 0.49 -1.01 -0.09 0.00 0.00 0.00 0.00 19.45 18.85 1rqv n ALA 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rqv n ALA 13 N 0.54 1.71 -2.00 0.00 0.00 -0.41 -5.02 120.51 115.33 1rqv n ALA 13 Ca 0.14 -0.79 -0.18 0.00 0.00 0.00 0.00 53.44 52.61 1rqv n ALA 13 Cb 0.33 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.80 1rqv n ALA 13 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1rqv s MET 14 N -2.29 2.73 0.56 0.00 -1.94 -0.88 -5.08 119.30 112.39 1rqv s MET 14 Ca -0.06 -1.14 -0.15 0.00 -1.71 0.00 0.00 55.69 52.63 1rqv s MET 14 Cb 0.04 -2.68 -0.06 0.00 2.01 0.00 0.00 34.83 34.13 1rqv s MET 14 CO 0.49 -0.42 1.01 -1.54 -0.01 0.00 0.00 175.02 174.55 1rqv s SER 15 N -4.39 6.40 0.25 3.03 1.04 -1.26 -4.91 113.70 113.87 1rqv s SER 15 Ca 0.56 1.54 -0.04 0.00 0.48 0.00 0.00 55.95 58.49 1rqv s SER 15 Cb -0.10 -2.50 0.45 0.00 0.10 0.00 0.00 66.02 63.97 1rqv s SER 15 CO 0.35 -0.74 1.75 0.58 0.98 0.00 0.00 173.24 176.16 1rqv h VAL 16 N 0.44 0.73 -0.57 5.02 2.07 -1.89 0.98 116.25 123.02 1rqv h VAL 16 Ca -0.46 -0.19 0.10 0.00 0.82 0.00 0.00 66.70 66.98 1rqv h VAL 16 Cb 1.19 0.14 -0.08 0.00 -1.52 0.00 0.00 31.29 31.02 1rqv h VAL 16 CO 0.61 0.10 0.15 0.24 0.02 0.00 0.00 177.57 178.69 1rqv h MET 17 N 0.54 0.28 -0.01 1.57 2.86 -1.93 0.45 114.93 118.70 1rqv h MET 17 Ca 0.41 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 58.00 1rqv h MET 17 Cb 0.56 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.16 1rqv h MET 17 CO -0.35 0.19 -0.14 0.22 1.06 0.00 0.00 176.91 177.88 1rqv h ASP 18 N 0.29 0.01 0.39 1.22 1.82 -1.21 0.10 116.42 119.03 1rqv h ASP 18 Ca 0.29 -0.00 -0.25 0.00 -0.39 0.00 0.00 57.03 56.68 1rqv h ASP 18 Cb 0.41 -0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.42 1rqv h ASP 18 CO -0.35 0.15 -1.06 0.58 -1.61 0.00 0.00 179.24 176.95 1rqv h VAL 19 N 0.01 1.41 -0.17 2.25 2.07 0.25 -2.40 116.25 119.67 1rqv h VAL 19 Ca 0.00 -2.61 -0.00 0.00 0.82 0.00 0.00 66.70 64.91 1rqv h VAL 19 Cb 0.26 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.61 1rqv h VAL 19 CO 0.02 0.77 0.09 0.58 0.02 0.00 0.00 177.57 179.05 1rqv h VAL 20 N 0.20 1.11 -0.38 2.57 2.07 0.89 -1.18 116.25 121.54 1rqv h VAL 20 Ca -0.11 -0.32 0.06 0.00 0.82 0.00 0.00 66.70 67.15 1rqv h VAL 20 Cb 1.72 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 32.46 1rqv h VAL 20 CO 0.18 0.11 0.06 -0.33 0.02 0.00 0.00 177.57 177.61 1rqv h GLU 21 N 0.16 0.17 0.12 1.57 5.08 -1.03 0.17 114.58 120.82 1rqv h GLU 21 Ca 0.06 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1rqv h GLU 21 Cb 0.09 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1rqv h GLU 21 CO -0.01 0.11 -0.15 1.25 -1.00 0.00 0.00 179.01 179.21 1rqv h LEU 22 N 0.18 -0.43 -0.81 1.33 7.12 -1.13 0.36 115.31 121.92 1rqv h LEU 22 Ca 0.18 0.04 0.20 0.00 0.13 0.00 0.00 57.88 58.43 1rqv h LEU 22 Cb 0.22 0.15 -0.14 0.00 -0.53 0.00 0.00 40.66 40.36 1rqv h LEU 22 CO -0.25 -0.19 0.08 0.40 -0.13 0.00 0.00 178.44 178.35 1rqv h ILE 23 N -0.28 0.31 -0.96 4.05 1.08 -1.09 0.93 117.51 121.55 1rqv h ILE 23 Ca -0.01 -0.05 0.07 0.00 -0.39 0.00 0.00 64.86 64.48 1rqv h ILE 23 Cb 0.25 0.17 -0.07 0.00 -3.07 0.00 0.00 36.82 34.10 1rqv h ILE 23 CO -0.04 0.02 0.62 0.28 -0.69 0.00 0.00 178.15 178.35 1rqv h SER 24 N 0.13 0.96 0.66 1.72 0.02 -0.05 0.22 113.55 117.21 1rqv h SER 24 Ca 0.47 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.40 1rqv h SER 24 Cb 0.87 -0.19 0.01 0.00 0.14 0.00 0.00 62.40 63.23 1rqv h SER 24 CO -0.68 0.60 -0.32 0.00 -1.14 0.00 0.00 176.83 175.29 1rqv h ALA 25 N 1.49 -1.14 -1.01 3.77 0.00 0.50 -2.95 119.26 119.92 1rqv h ALA 25 Ca 0.42 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 55.37 1rqv h ALA 25 Cb 0.23 0.34 -0.11 0.00 0.00 0.00 0.00 17.79 18.25 1rqv h ALA 25 CO -0.17 -1.08 0.61 0.52 0.00 0.00 0.00 179.25 179.13 1rqv h MET 26 N -0.95 0.59 -0.87 0.00 2.07 -0.78 0.12 114.93 115.11 1rqv h MET 26 Ca -0.09 -0.04 0.22 0.00 -2.07 0.00 0.00 59.70 57.72 1rqv h MET 26 Cb 0.68 -0.13 -0.13 0.00 -1.87 0.00 0.00 31.60 30.15 1rqv h MET 26 CO 0.15 0.39 0.33 0.93 1.07 0.00 0.00 176.91 179.78 1rqv h GLU 27 N 0.61 0.32 0.04 1.72 5.08 -0.40 0.39 114.58 122.34 1rqv h GLU 27 Ca 0.61 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.86 1rqv h GLU 27 Cb 1.15 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.34 1rqv h GLU 27 CO -0.40 0.21 -0.36 1.49 -1.00 0.00 0.00 179.01 178.95 1rqv h GLU 28 N 0.33 0.17 0.27 2.33 4.81 -0.71 0.24 114.58 122.02 1rqv h GLU 28 Ca 0.54 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.52 1rqv h GLU 28 Cb 1.05 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 1rqv h GLU 28 CO -0.56 1.05 -0.23 -0.22 -0.73 0.00 0.00 179.01 178.31 1rqv h LYS 29 N -0.58 -0.47 0.00 1.92 1.63 -0.45 -2.31 116.57 116.31 1rqv h LYS 29 Ca -0.06 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1rqv h LYS 29 Cb 1.21 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.94 1rqv h LYS 29 CO 0.07 -0.32 0.00 1.19 -3.45 0.00 0.00 179.45 176.94 1rqv n PHE 30 N -3.75 0.00 0.00 1.91 3.72 0.13 -4.97 117.46 114.50 1rqv n PHE 30 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1rqv n PHE 30 Cb 0.22 -0.29 0.00 0.00 -0.94 0.00 0.00 39.48 38.47 1rqv n PHE 30 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rqv n GLY 31 N 0.76 0.26 0.26 1.37 0.00 -0.47 -4.24 105.19 103.13 1rqv n GLY 31 Ca 0.11 -1.47 0.16 0.00 0.00 0.00 0.00 46.02 44.83 1rqv n GLY 31 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1rqv h VAL 32 N 0.00 0.00 -0.01 1.61 -1.51 -0.84 0.65 116.25 116.16 1rqv h VAL 32 Ca 0.00 -0.52 -0.11 0.00 -1.23 0.00 0.00 66.70 64.85 1rqv h VAL 32 Cb 0.00 1.49 0.01 0.00 -2.13 0.00 0.00 31.29 30.66 1rqv h VAL 32 CO 0.00 0.00 -0.42 0.28 -1.23 0.00 0.00 177.57 176.20 1rqv h SER 33 N 0.00 0.39 0.88 4.19 0.02 -1.86 -0.11 113.55 117.06 1rqv h SER 33 Ca 0.00 -0.75 -0.23 0.00 -0.84 0.00 0.00 61.79 59.97 1rqv h SER 33 Cb 0.53 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1rqv h SER 33 CO 0.00 1.08 -1.16 0.00 -1.14 0.00 0.00 176.83 175.62 1rqv h ALA 34 N 0.31 0.44 0.00 3.77 0.00 -1.68 -3.23 119.26 118.87 1rqv h ALA 34 Ca -0.05 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 53.83 1rqv h ALA 34 Cb 1.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1rqv h ALA 34 CO 0.08 1.32 -0.83 0.00 0.00 0.00 0.00 179.25 179.82 1rqv n ALA 35 N -2.40 3.04 -0.32 0.00 0.00 0.20 -4.14 120.51 116.89 1rqv n ALA 35 Ca -0.04 -0.30 0.15 0.00 0.00 0.00 0.00 53.44 53.24 1rqv n ALA 35 Cb 0.97 -1.09 0.30 0.00 0.00 0.00 0.00 19.45 19.63 1rqv n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rqv h ALA 36 N 2.45 1.23 -0.64 0.00 0.00 -1.02 1.12 119.26 122.40 1rqv h ALA 36 Ca 0.00 0.30 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 1rqv h ALA 36 Cb 0.77 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1rqv h ALA 36 CO 0.00 -0.56 0.28 0.00 0.00 0.00 0.00 179.25 178.97 1rqv h ALA 37 N 1.92 0.82 -0.25 0.00 0.00 -1.79 -1.08 119.26 118.88 1rqv h ALA 37 Ca 0.59 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 55.19 1rqv h ALA 37 Cb 1.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1rqv h ALA 37 CO -0.83 0.41 -0.49 0.28 0.00 0.00 0.00 179.25 178.62 1rqv h VAL 38 N 0.88 1.30 -0.06 0.00 2.07 0.72 -0.85 116.25 120.32 1rqv h VAL 38 Ca 0.22 -1.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.04 1rqv h VAL 38 Cb 0.16 1.63 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1rqv h VAL 38 CO -0.02 0.54 0.02 0.00 0.02 0.00 0.00 177.57 178.12 1rqv h ALA 39 N 0.93 0.08 0.00 1.67 0.00 0.59 0.46 119.26 122.99 1rqv h ALA 39 Ca 0.03 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1rqv h ALA 39 Cb 1.04 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1rqv h ALA 39 CO 0.10 -0.30 -0.56 -0.39 0.00 0.00 0.00 179.25 178.11 1rqv h VAL 40 N -0.11 1.29 0.00 0.00 -1.51 -1.21 0.63 116.25 115.34 1rqv h VAL 40 Ca 0.02 -1.98 -0.17 0.00 -1.23 0.00 0.00 66.70 63.35 1rqv h VAL 40 Cb 0.24 2.10 -0.02 0.00 -2.13 0.00 0.00 31.29 31.47 1rqv h VAL 40 CO 0.00 0.55 -0.79 0.00 -1.23 0.00 0.00 177.57 176.09 1rqv h ALA 41 N 1.44 0.57 0.00 5.19 0.00 -0.84 -3.23 119.26 122.39 1rqv h ALA 41 Ca -0.01 -0.72 -0.01 0.00 0.00 0.00 0.00 54.91 54.17 1rqv h ALA 41 Cb 1.05 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1rqv h ALA 41 CO 0.07 0.99 -1.69 0.00 0.00 0.00 0.00 179.25 178.63 1rqv n ALA 42 N -2.34 2.67 -0.21 0.00 0.00 0.16 -4.26 120.51 116.53 1rqv n ALA 42 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1rqv n ALA 42 Cb 0.81 -0.85 0.08 0.00 0.00 0.00 0.00 19.45 19.49 1rqv n ALA 42 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rqv h GLY 43 N 3.99 0.55 1.41 0.00 0.00 0.25 -0.55 103.07 108.73 1rqv h GLY 43 Ca -0.02 0.16 -0.23 0.00 0.00 0.00 0.00 47.33 47.24 1rqv h GLY 43 CO 0.00 -0.23 -0.91 -0.56 0.00 0.00 0.00 176.54 174.84 1rqv h PRO 44 N 0.04 0.55 -0.98 4.80 0.13 -1.76 -2.97 132.00 131.82 1rqv h PRO 44 Ca 0.32 -0.54 0.11 0.00 -0.87 0.00 0.00 66.00 65.02 1rqv h PRO 44 Cb 0.51 0.14 -0.08 0.00 0.13 0.00 0.00 31.00 31.70 1rqv h PRO 44 CO -0.61 1.17 0.62 0.28 -0.23 0.00 0.00 178.00 179.23 1rqv h VAL 45 N 0.33 0.95 -0.10 1.56 2.07 -1.37 0.18 116.25 119.88 1rqv h VAL 45 Ca -0.08 -0.34 -0.10 0.00 0.82 0.00 0.00 66.70 67.00 1rqv h VAL 45 Cb 1.54 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1rqv h VAL 45 CO 0.17 0.18 -0.34 -0.33 0.02 0.00 0.00 177.57 177.27 1rqv h GLU 46 N 0.99 0.41 -0.56 1.57 5.08 -1.14 -3.23 114.58 117.69 1rqv h GLU 46 Ca 0.47 -0.30 -0.08 0.00 -1.00 0.00 0.00 59.36 58.45 1rqv h GLU 46 Cb 0.43 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1rqv h GLU 46 CO -0.23 0.93 0.05 0.00 -1.00 0.00 0.00 179.01 178.76 1rqv h ALA 47 N 0.48 1.02 -0.76 3.43 0.00 -1.20 -2.47 119.26 119.76 1rqv h ALA 47 Ca -0.01 -0.27 0.12 0.00 0.00 0.00 0.00 54.91 54.74 1rqv h ALA 47 Cb 0.97 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.49 1rqv h ALA 47 CO 0.07 0.61 0.50 0.00 0.00 0.00 0.00 179.25 180.44 1rqv h ALA 48 N 1.18 1.90 0.00 0.00 0.00 -0.69 0.18 119.26 121.82 1rqv h ALA 48 Ca 0.17 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1rqv h ALA 48 Cb 0.45 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1rqv h ALA 48 CO 0.02 -0.07 -0.15 0.93 0.00 0.00 0.00 179.25 179.98 1rqv h GLU 49 N 0.60 0.00 -0.01 0.00 5.08 -1.47 -0.08 114.58 118.70 1rqv h GLU 49 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1rqv h GLU 49 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1rqv h GLU 49 CO -0.13 0.15 -0.28 0.39 -1.00 0.00 0.00 179.01 178.13 1rqv n GLU 50 N -3.40 0.68 -3.67 2.33 1.02 0.60 -4.94 120.64 113.26 1rqv n GLU 50 Ca -0.01 -0.39 -0.23 0.00 -0.02 0.00 0.00 57.16 56.52 1rqv n GLU 50 Cb 0.33 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.31 1rqv n GLU 50 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1rqv n LYS 51 N -0.82 -5.93 -2.30 3.49 4.01 -0.04 -4.91 118.16 111.66 1rqv n LYS 51 Ca 0.11 0.70 -0.15 0.00 -0.51 0.00 0.00 58.31 58.46 1rqv n LYS 51 Cb 0.34 -5.52 0.03 0.00 -0.51 0.00 0.00 35.03 29.38 1rqv n LYS 51 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1rqv n THR 52 N -4.44 2.07 -3.90 -0.18 -2.24 -1.18 -4.91 114.28 99.49 1rqv n THR 52 Ca -0.18 -3.74 -0.28 0.00 -2.27 0.00 0.00 64.05 57.58 1rqv n THR 52 Cb 0.63 -0.25 -0.12 0.00 -2.10 0.00 0.00 70.33 68.49 1rqv n THR 52 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1rqv s GLU 53 N -3.66 2.45 -0.05 -0.78 2.02 -1.26 -3.64 118.70 113.77 1rqv s GLU 53 Ca 0.42 -3.30 -0.02 0.00 0.02 0.00 0.00 54.97 52.09 1rqv s GLU 53 Cb 0.38 -3.43 -0.04 0.00 0.10 0.00 0.00 34.13 31.14 1rqv s GLU 53 CO 0.01 -1.27 0.08 -0.06 0.02 0.00 0.00 175.26 174.03 1rqv s PHE 54 N -1.37 3.33 -0.16 1.61 0.40 -0.70 -4.68 117.98 116.41 1rqv s PHE 54 Ca 0.24 0.28 -0.03 0.00 -0.60 0.00 0.00 56.93 56.82 1rqv s PHE 54 Cb -0.06 -1.80 -0.02 0.00 0.51 0.00 0.00 43.02 41.64 1rqv s PHE 54 CO -0.15 0.58 -0.05 -0.51 0.70 0.00 0.00 175.22 175.79 1rqv s ASP 55 N -1.35 4.64 -0.34 1.36 1.11 -0.51 -2.22 116.67 119.36 1rqv s ASP 55 Ca 0.19 -0.19 -0.08 0.00 0.18 0.00 0.00 52.55 52.65 1rqv s ASP 55 Cb -0.12 -1.76 0.03 0.00 1.07 0.00 0.00 42.92 42.14 1rqv s ASP 55 CO 0.09 0.14 0.13 -0.69 1.18 0.00 0.00 175.17 176.01 1rqv s VAL 56 N 0.55 4.03 0.06 -1.27 1.01 -0.89 -2.42 120.40 121.47 1rqv s VAL 56 Ca -0.03 -0.96 0.03 0.00 0.00 0.00 0.00 61.98 61.02 1rqv s VAL 56 Cb -0.14 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 1rqv s VAL 56 CO 0.03 -0.13 0.01 -0.63 0.00 0.00 0.00 175.10 174.38 1rqv s ILE 57 N 1.46 4.15 -0.27 2.22 1.01 -0.17 0.47 121.20 130.08 1rqv s ILE 57 Ca 0.00 -0.82 -0.08 0.00 0.00 0.00 0.00 60.65 59.76 1rqv s ILE 57 Cb -0.19 -2.94 -0.02 0.00 0.01 0.00 0.00 42.46 39.32 1rqv s ILE 57 CO 0.04 0.21 0.10 -0.22 0.00 0.00 0.00 174.94 175.06 1rqv s LEU 58 N -2.06 3.64 -0.16 2.97 0.20 0.65 -0.44 118.68 123.47 1rqv s LEU 58 Ca 0.24 -0.29 -0.13 0.00 0.69 0.00 0.00 54.13 54.65 1rqv s LEU 58 Cb -0.12 -1.95 -0.06 0.00 -0.43 0.00 0.00 46.19 43.63 1rqv s LEU 58 CO 0.16 -0.08 -0.18 0.29 -0.29 0.00 0.00 176.35 176.25 1rqv n LYS 59 N 4.94 0.49 -4.10 1.98 5.02 -0.97 -1.82 118.16 123.70 1rqv n LYS 59 Ca -0.15 0.45 -0.20 0.00 -2.02 0.00 0.00 58.31 56.38 1rqv n LYS 59 Cb 0.51 -1.63 -0.16 0.00 -0.02 0.00 0.00 35.03 33.73 1rqv n LYS 59 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rqv s ALA 60 N -2.72 0.65 0.28 7.82 0.00 -1.04 -4.62 121.76 122.13 1rqv s ALA 60 Ca -0.21 -0.05 0.24 0.00 0.00 0.00 0.00 51.96 51.94 1rqv s ALA 60 Cb 0.04 -0.45 1.11 0.00 0.00 0.00 0.00 23.12 23.82 1rqv s ALA 60 CO 0.32 -0.07 1.92 0.00 0.00 0.00 0.00 175.76 177.94 1rqv h ALA 61 N 7.31 1.16 -0.07 0.00 0.00 -1.89 0.17 119.26 125.93 1rqv h ALA 61 Ca -0.36 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1rqv h ALA 61 Cb 1.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1rqv h ALA 61 CO 0.45 0.26 0.00 0.41 0.00 0.00 0.00 179.25 180.37 1rqv n GLY 62 N -0.26 -0.91 1.98 0.00 0.00 -1.26 -3.77 105.19 100.97 1rqv n GLY 62 Ca -0.01 -1.20 -0.21 0.00 0.00 0.00 0.00 46.02 44.61 1rqv n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rqv n ALA 63 N 3.26 5.33 -2.80 4.61 0.00 -1.25 -4.13 120.51 125.53 1rqv n ALA 63 Ca 0.00 -2.08 -0.10 0.00 0.00 0.00 0.00 53.44 51.26 1rqv n ALA 63 Cb 0.00 -1.45 0.07 0.00 0.00 0.00 0.00 19.45 18.07 1rqv n ALA 63 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1rqv n ASN 64 N -0.02 -1.29 0.26 0.00 2.85 -1.25 -4.95 115.26 110.87 1rqv n ASN 64 Ca 0.38 -3.16 0.11 0.00 -0.11 0.00 0.00 54.58 51.80 1rqv n ASN 64 Cb 0.66 1.00 0.72 0.00 1.24 0.00 0.00 39.78 43.40 1rqv n ASN 64 CO 0.00 0.00 0.00 0.50 -2.11 0.00 0.00 177.26 175.65 1rqv h LYS 65 N 2.74 0.00 0.63 1.20 3.64 -1.76 -1.60 116.57 121.42 1rqv h LYS 65 Ca -0.11 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1rqv h LYS 65 Cb 1.14 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.96 1rqv h LYS 65 CO 0.18 0.08 -0.30 0.28 -2.27 0.00 0.00 179.45 177.42 1rqv h VAL 66 N 0.00 0.00 -0.97 2.00 2.07 -1.94 0.50 116.25 117.90 1rqv h VAL 66 Ca -0.00 -0.18 0.08 0.00 0.82 0.00 0.00 66.70 67.43 1rqv h VAL 66 Cb 0.18 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.88 1rqv h VAL 66 CO 0.01 0.00 0.62 0.00 0.02 0.00 0.00 177.57 178.22 1rqv h ALA 67 N -1.43 1.39 0.60 1.67 0.00 -1.93 -2.00 119.26 117.55 1rqv h ALA 67 Ca -0.09 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1rqv h ALA 67 Cb 0.65 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1rqv h ALA 67 CO 0.14 0.34 -0.43 0.28 0.00 0.00 0.00 179.25 179.58 1rqv h VAL 68 N 1.08 0.13 -1.04 0.00 2.07 -1.21 0.46 116.25 117.74 1rqv h VAL 68 Ca 0.44 0.00 0.26 0.00 0.82 0.00 0.00 66.70 68.23 1rqv h VAL 68 Cb 0.27 0.13 -0.11 0.00 -1.52 0.00 0.00 31.29 30.07 1rqv h VAL 68 CO -0.20 0.00 0.65 0.40 0.02 0.00 0.00 177.57 178.43 1rqv h ILE 69 N -0.99 0.51 0.14 4.57 2.04 -0.34 0.36 117.51 123.81 1rqv h ILE 69 Ca -0.07 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 1rqv h ILE 69 Cb 0.83 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 1rqv h ILE 69 CO 0.03 0.08 -0.07 0.11 0.00 0.00 0.00 178.15 178.30 1rqv h LYS 70 N 0.46 -0.19 -0.83 2.37 1.57 -0.61 -1.31 116.57 118.03 1rqv h LYS 70 Ca 0.62 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.50 1rqv h LYS 70 Cb 1.43 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 33.72 1rqv h LYS 70 CO -0.38 0.07 0.49 0.00 -0.57 0.00 0.00 179.45 179.06 1rqv h ALA 71 N 0.39 1.17 -2.30 3.86 0.00 0.17 0.48 119.26 123.02 1rqv h ALA 71 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rqv h ALA 71 Cb 0.34 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1rqv h ALA 71 CO 0.03 0.15 0.00 0.28 0.00 0.00 0.00 179.25 179.71 1rqv n VAL 72 N -4.71 0.00 -0.16 0.00 0.31 0.90 -0.06 118.33 114.60 1rqv n VAL 72 Ca 0.13 1.12 0.29 0.00 -0.01 0.00 0.00 64.34 65.87 1rqv n VAL 72 Cb 0.25 -2.09 0.72 0.00 -0.91 0.00 0.00 33.84 31.80 1rqv n VAL 72 CO 0.00 0.00 0.00 0.08 -1.32 0.00 0.00 176.83 175.59 1rqv h ARG 73 N 0.00 0.00 -0.10 5.55 -0.00 -1.22 0.83 114.38 119.43 1rqv h ARG 73 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 59.98 59.82 1rqv h ARG 73 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.96 1rqv h ARG 73 CO 0.00 0.00 -0.61 0.78 -0.00 0.00 0.00 179.97 180.14 1rqv h GLY 74 N 0.00 0.40 1.41 0.08 0.00 0.16 0.91 103.07 106.04 1rqv h GLY 74 Ca 0.42 -0.49 -0.06 0.00 0.00 0.00 0.00 47.33 47.19 1rqv h GLY 74 CO -0.00 0.44 -0.78 0.00 0.00 0.00 0.00 176.54 176.19 1rqv h ALA 75 N 1.08 0.68 -1.60 3.60 0.00 0.42 -3.43 119.26 120.01 1rqv h ALA 75 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1rqv h ALA 75 Cb 1.14 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1rqv h ALA 75 CO 0.10 0.35 0.00 0.25 0.00 0.00 0.00 179.25 179.95 1rqv n THR 76 N -2.93 0.00 0.00 0.00 -2.24 0.27 -5.06 114.28 104.31 1rqv n THR 76 Ca -0.01 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1rqv n THR 76 Cb 0.65 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 1rqv n THR 76 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rqv n GLY 77 N 3.44 1.64 3.78 3.38 0.00 0.32 -5.01 105.19 112.73 1rqv n GLY 77 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1rqv n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rqv s LEU 78 N 0.00 3.46 0.49 0.99 1.43 -1.26 -4.96 118.68 118.83 1rqv s LEU 78 Ca 0.00 1.98 -0.22 0.00 -1.03 0.00 0.00 54.13 54.86 1rqv s LEU 78 Cb 0.00 -4.55 -0.09 0.00 0.03 0.00 0.00 46.19 41.58 1rqv s LEU 78 CO 0.00 -1.47 1.00 0.61 0.23 0.00 0.00 176.35 176.72 1rqv n GLY 79 N -0.52 -0.23 0.33 -3.19 0.00 -1.26 -4.56 105.19 95.75 1rqv n GLY 79 Ca 0.10 0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.25 1rqv n GLY 79 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1rqv h LEU 80 N 1.20 -0.64 0.52 0.99 5.85 -1.99 0.25 115.31 121.49 1rqv h LEU 80 Ca -0.46 0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1rqv h LEU 80 Cb 1.34 0.51 0.00 0.00 0.37 0.00 0.00 40.66 42.89 1rqv h LEU 80 CO 0.55 -0.31 -0.29 0.50 -0.34 0.00 0.00 178.44 178.55 1rqv h LYS 81 N 0.02 -0.72 -0.94 1.25 3.64 -1.99 0.39 116.57 118.22 1rqv h LYS 81 Ca 0.50 0.05 0.23 0.00 -1.27 0.00 0.00 60.65 60.16 1rqv h LYS 81 Cb 0.90 0.16 -0.17 0.00 -0.41 0.00 0.00 32.23 32.71 1rqv h LYS 81 CO -0.91 -0.48 -0.05 0.93 -2.27 0.00 0.00 179.45 176.68 1rqv h GLU 82 N -0.75 0.02 -0.41 1.90 4.39 -1.34 0.87 114.58 119.27 1rqv h GLU 82 Ca -0.07 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.62 1rqv h GLU 82 Cb 0.59 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.21 1rqv h GLU 82 CO 0.10 0.02 0.24 0.00 -1.16 0.00 0.00 179.01 178.20 1rqv h ALA 83 N 1.93 0.52 0.25 3.43 0.00 -0.35 0.16 119.26 125.21 1rqv h ALA 83 Ca 0.53 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.38 1rqv h ALA 83 Cb 1.00 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1rqv h ALA 83 CO -0.90 0.02 -0.31 -0.22 0.00 0.00 0.00 179.25 177.85 1rqv h LYS 84 N 0.53 -0.59 -0.36 0.00 3.64 0.29 0.09 116.57 120.17 1rqv h LYS 84 Ca 0.14 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.62 1rqv h LYS 84 Cb 0.02 0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.93 1rqv h LYS 84 CO -0.03 -0.39 0.07 -0.44 -2.27 0.00 0.00 179.45 176.39 1rqv h ASP 85 N -0.61 0.01 -0.17 4.20 3.32 -0.61 0.14 116.42 122.70 1rqv h ASP 85 Ca -0.00 0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.15 1rqv h ASP 85 Cb 0.58 0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.14 1rqv h ASP 85 CO -0.09 0.04 -0.47 0.25 -1.72 0.00 0.00 179.24 177.25 1rqv h LEU 86 N 0.19 -1.48 -0.94 1.55 6.46 -0.15 0.67 115.31 121.63 1rqv h LEU 86 Ca 0.17 0.19 0.04 0.00 -0.12 0.00 0.00 57.88 58.16 1rqv h LEU 86 Cb 0.20 0.60 -0.06 0.00 -0.73 0.00 0.00 40.66 40.67 1rqv h LEU 86 CO -0.22 -0.44 0.61 0.58 -0.62 0.00 0.00 178.44 178.34 1rqv h VAL 87 N -0.50 1.15 0.00 1.05 2.07 -0.47 0.58 116.25 120.13 1rqv h VAL 87 Ca 0.07 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1rqv h VAL 87 Cb 0.64 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1rqv h VAL 87 CO -0.44 0.21 0.00 -0.62 0.02 0.00 0.00 177.57 176.75 1rqv n GLU 88 N -4.50 0.18 -0.92 1.57 1.02 0.45 -2.36 120.64 116.08 1rqv n GLU 88 Ca 0.12 0.34 -0.03 0.00 -0.02 0.00 0.00 57.16 57.57 1rqv n GLU 88 Cb 0.10 -1.80 0.29 0.00 -0.02 0.00 0.00 31.44 30.02 1rqv n GLU 88 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1rqv n SER 89 N -2.12 4.50 -4.60 1.62 3.41 0.22 -5.00 113.62 111.65 1rqv n SER 89 Ca 0.03 -3.24 -0.40 0.00 -0.26 0.00 0.00 58.87 55.00 1rqv n SER 89 Cb 0.27 -0.71 0.03 0.00 -0.26 0.00 0.00 64.21 63.54 1rqv n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rqv n ALA 90 N -0.29 0.07 -1.70 7.33 0.00 -1.00 -4.30 120.51 120.64 1rqv n ALA 90 Ca 0.37 0.12 -0.33 0.00 0.00 0.00 0.00 53.44 53.61 1rqv n ALA 90 Cb 1.28 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1rqv n ALA 90 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1rqv s PRO 91 N -2.28 3.43 -0.05 0.00 0.04 -1.26 -5.08 135.00 129.80 1rqv s PRO 91 Ca 0.68 1.19 -0.02 0.00 0.04 0.00 0.00 61.00 62.88 1rqv s PRO 91 Cb -0.49 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.02 1rqv s PRO 91 CO 0.53 -0.72 0.10 0.00 0.04 0.00 0.00 177.00 176.96 1rqv s ALA 92 N -2.44 -0.18 -0.04 8.56 0.00 -0.76 -4.96 121.76 121.94 1rqv s ALA 92 Ca 0.63 0.47 -0.30 0.00 0.00 0.00 0.00 51.96 52.76 1rqv s ALA 92 Cb -0.15 -0.31 -0.05 0.00 0.00 0.00 0.00 23.12 22.61 1rqv s ALA 92 CO 0.35 -0.11 1.38 0.00 0.00 0.00 0.00 175.76 177.38 1rqv s ALA 93 N 0.79 3.59 -0.15 0.00 0.00 -1.26 -0.25 121.76 124.47 1rqv s ALA 93 Ca -0.06 0.79 -0.22 0.00 0.00 0.00 0.00 51.96 52.47 1rqv s ALA 93 Cb -0.08 -3.61 -0.24 0.00 0.00 0.00 0.00 23.12 19.19 1rqv s ALA 93 CO -0.03 -1.00 0.49 -0.07 0.00 0.00 0.00 175.76 175.15 1rqv h LEU 94 N 8.80 0.14 -8.07 0.00 3.38 -0.32 -3.47 115.31 115.76 1rqv h LEU 94 Ca -0.36 -0.77 -0.14 0.00 0.09 0.00 0.00 57.88 56.71 1rqv h LEU 94 Cb 1.16 -0.04 -0.18 0.00 0.09 0.00 0.00 40.66 41.69 1rqv h LEU 94 CO 0.92 1.40 -0.65 -0.54 0.09 0.00 0.00 178.44 179.66 1rqv s LYS 95 N -2.36 0.51 -0.04 1.13 1.02 -0.99 -4.88 119.74 114.12 1rqv s LYS 95 Ca -0.23 -0.91 -0.01 0.00 0.02 0.00 0.00 55.97 54.85 1rqv s LYS 95 Cb 0.03 0.18 0.03 0.00 -0.52 0.00 0.00 37.83 37.55 1rqv s LYS 95 CO 0.68 -0.10 0.02 -1.21 -0.92 0.00 0.00 175.35 173.82 1rqv s GLU 96 N -2.81 0.28 -0.87 1.68 2.02 -1.26 -2.09 118.70 115.64 1rqv s GLU 96 Ca -0.03 0.18 -0.01 0.00 0.02 0.00 0.00 54.97 55.12 1rqv s GLU 96 Cb -0.00 -0.63 -0.01 0.00 0.10 0.00 0.00 34.13 33.59 1rqv s GLU 96 CO -0.06 -0.24 0.74 0.41 0.02 0.00 0.00 175.26 176.13 1rqv n GLY 97 N 4.78 -0.26 3.61 -1.39 0.00 -1.11 -4.98 105.19 105.84 1rqv n GLY 97 Ca -0.14 0.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.68 1rqv n GLY 97 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rqv s VAL 98 N -3.27 3.27 0.50 1.61 -7.23 -0.94 -4.74 120.40 109.59 1rqv s VAL 98 Ca 0.07 -1.97 -0.23 0.00 -1.81 0.00 0.00 61.98 58.04 1rqv s VAL 98 Cb -0.01 -2.73 -0.07 0.00 0.56 0.00 0.00 36.38 34.13 1rqv s VAL 98 CO 0.55 -0.35 1.33 -1.54 -0.31 0.00 0.00 175.10 174.78 1rqv n SER 99 N -0.76 2.68 -0.18 4.85 3.41 -1.24 -1.72 113.62 120.66 1rqv n SER 99 Ca -0.07 1.03 -0.02 0.00 -0.26 0.00 0.00 58.87 59.55 1rqv n SER 99 Cb 0.59 -1.55 0.08 0.00 -0.26 0.00 0.00 64.21 63.07 1rqv n SER 99 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1rqv h LYS 100 N 1.72 0.42 -0.69 4.33 3.11 -1.91 0.28 116.57 123.82 1rqv h LYS 100 Ca -0.50 -0.03 0.11 0.00 -2.81 0.00 0.00 60.65 57.43 1rqv h LYS 100 Cb 1.30 -0.09 -0.08 0.00 -1.00 0.00 0.00 32.23 32.35 1rqv h LYS 100 CO 0.58 0.28 0.28 -0.44 -2.81 0.00 0.00 179.45 177.33 1rqv h ASP 101 N 0.43 0.28 -0.36 4.20 3.32 -1.99 0.24 116.42 122.55 1rqv h ASP 101 Ca 0.27 0.09 -0.07 0.00 0.02 0.00 0.00 57.03 57.34 1rqv h ASP 101 Cb 0.28 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1rqv h ASP 101 CO -0.25 0.14 -0.04 0.44 -1.72 0.00 0.00 179.24 177.81 1rqv h ASP 102 N 0.45 0.65 -0.28 6.45 3.32 -1.56 -0.59 116.42 124.86 1rqv h ASP 102 Ca 0.36 -0.34 0.03 0.00 0.02 0.00 0.00 57.03 57.10 1rqv h ASP 102 Cb 0.48 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1rqv h ASP 102 CO -0.34 0.83 0.09 0.00 -1.72 0.00 0.00 179.24 178.10 1rqv h ALA 103 N 0.84 0.32 0.00 3.45 0.00 0.58 -1.37 119.26 123.08 1rqv h ALA 103 Ca 0.10 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1rqv h ALA 103 Cb 0.52 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1rqv h ALA 103 CO 0.03 -0.32 -0.25 1.49 0.00 0.00 0.00 179.25 180.20 1rqv h GLU 104 N 0.21 0.00 0.07 0.00 4.81 -0.46 -1.45 114.58 117.76 1rqv h GLU 104 Ca 0.13 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1rqv h GLU 104 Cb 0.10 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.48 1rqv h GLU 104 CO -0.14 0.25 -0.03 0.00 -0.73 0.00 0.00 179.01 178.36 1rqv h ALA 105 N 1.75 -0.09 -0.39 2.92 0.00 0.01 0.30 119.26 123.77 1rqv h ALA 105 Ca -0.00 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 1rqv h ALA 105 Cb 0.71 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1rqv h ALA 105 CO 0.03 -0.42 -0.32 1.25 0.00 0.00 0.00 179.25 179.79 1rqv h LEU 106 N -0.35 0.96 -0.20 0.00 5.85 -1.37 -2.66 115.31 117.54 1rqv h LEU 106 Ca -0.01 -0.45 0.06 0.00 0.84 0.00 0.00 57.88 58.32 1rqv h LEU 106 Cb 0.31 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 1rqv h LEU 106 CO 0.02 1.20 -0.25 0.50 -0.34 0.00 0.00 178.44 179.57 1rqv h LYS 107 N 0.72 -0.27 -0.30 1.25 3.64 -1.10 0.23 116.57 120.74 1rqv h LYS 107 Ca 0.07 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1rqv h LYS 107 Cb 0.91 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1rqv h LYS 107 CO 0.08 -0.18 0.19 1.57 -2.27 0.00 0.00 179.45 178.84 1rqv h LYS 108 N -0.28 0.39 -0.47 1.90 2.10 -0.91 -0.59 116.57 118.71 1rqv h LYS 108 Ca 0.12 -0.02 -0.05 0.00 -2.00 0.00 0.00 60.65 58.70 1rqv h LYS 108 Cb 0.47 -0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.69 1rqv h LYS 108 CO -0.36 0.26 0.11 0.00 -2.00 0.00 0.00 179.45 177.46 1rqv h ALA 109 N 1.81 0.62 -0.52 0.07 0.00 -0.38 0.51 119.26 121.37 1rqv h ALA 109 Ca 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1rqv h ALA 109 Cb -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1rqv h ALA 109 CO -0.02 0.32 0.26 -0.07 0.00 0.00 0.00 179.25 179.74 1rqv h LEU 110 N 0.64 0.67 -0.58 0.00 -0.00 0.74 -2.35 115.31 114.44 1rqv h LEU 110 Ca 0.15 -0.12 -0.01 0.00 -0.00 0.00 0.00 57.88 57.90 1rqv h LEU 110 Cb 0.34 -0.17 -0.03 0.00 -0.00 0.00 0.00 40.66 40.80 1rqv h LEU 110 CO 0.00 0.60 0.31 -0.33 -0.00 0.00 0.00 178.44 179.02 1rqv h GLU 111 N 0.70 0.82 -0.78 1.13 5.08 -0.85 0.45 114.58 121.12 1rqv h GLU 111 Ca 0.18 -0.10 0.11 0.00 -1.00 0.00 0.00 59.36 58.55 1rqv h GLU 111 Cb 0.10 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.14 1rqv h GLU 111 CO -0.02 0.63 0.51 0.93 -1.00 0.00 0.00 179.01 180.06 1rqv h GLU 112 N 0.79 0.62 0.03 2.33 4.39 -0.57 -0.07 114.58 122.09 1rqv h GLU 112 Ca 0.20 -0.04 -0.24 0.00 0.34 0.00 0.00 59.36 59.62 1rqv h GLU 112 Cb 0.06 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 1rqv h GLU 112 CO -0.03 0.41 -1.22 0.00 -1.16 0.00 0.00 179.01 177.01 1rqv h ALA 113 N 1.62 0.39 -0.00 3.43 0.00 -0.79 -3.49 119.26 120.42 1rqv h ALA 113 Ca 0.37 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1rqv h ALA 113 Cb 0.56 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1rqv h ALA 113 CO -0.14 1.26 0.00 0.41 0.00 0.00 0.00 179.25 180.78 1rqv n GLY 114 N 1.45 0.86 3.30 0.00 0.00 0.14 -4.71 105.19 106.24 1rqv n GLY 114 Ca -0.06 -0.74 -0.17 0.00 0.00 0.00 0.00 46.02 45.06 1rqv n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rqv s ALA 115 N -1.89 1.76 -0.28 4.61 0.00 -0.37 -3.93 121.76 121.66 1rqv s ALA 115 Ca 0.00 -1.60 -0.14 0.00 0.00 0.00 0.00 51.96 50.22 1rqv s ALA 115 Cb 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1rqv s ALA 115 CO 0.00 -0.03 0.33 -2.00 0.00 0.00 0.00 175.76 174.06 1rqv s GLU 116 N -3.71 3.93 0.33 0.00 2.56 0.58 -4.35 118.70 118.04 1rqv s GLU 116 Ca 0.20 -0.12 0.09 0.00 0.00 0.00 0.00 54.97 55.14 1rqv s GLU 116 Cb 0.01 -3.68 -0.05 0.00 2.00 0.00 0.00 34.13 32.41 1rqv s GLU 116 CO 0.04 -0.29 0.07 0.08 -0.56 0.00 0.00 175.26 174.59 1rqv s VAL 117 N 1.99 2.90 -0.05 3.70 1.01 -1.26 -2.30 120.40 126.38 1rqv s VAL 117 Ca 0.12 -1.85 0.01 0.00 0.00 0.00 0.00 61.98 60.27 1rqv s VAL 117 Cb -0.16 -2.88 0.02 0.00 0.00 0.00 0.00 36.38 33.36 1rqv s VAL 117 CO 0.10 -0.21 -0.07 -0.70 0.00 0.00 0.00 175.10 174.22 1rqv s GLU 118 N -3.77 1.17 -0.19 2.72 2.12 0.41 -4.84 118.70 116.32 1rqv s GLU 118 Ca 0.36 -0.22 -0.01 0.00 0.36 0.00 0.00 54.97 55.46 1rqv s GLU 118 Cb -0.02 -1.07 0.01 0.00 0.26 0.00 0.00 34.13 33.30 1rqv s GLU 118 CO 0.21 -0.05 -0.13 0.08 -0.54 0.00 0.00 175.26 174.83 1rqv s VAL 119 N 0.86 2.66 0.00 3.70 1.01 -1.26 -1.00 120.40 126.37 1rqv s VAL 119 Ca -0.12 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1rqv s VAL 119 Cb -0.15 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.07 1rqv s VAL 119 CO 0.01 0.49 0.00 2.29 0.00 0.00 0.00 175.10 177.89