#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f5d h PRO 4 N 0.00 -0.02 -0.53 -2.82 0.11 -1.99 0.37 132.00 127.12 2f5d h PRO 4 Ca 0.00 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.04 2f5d h PRO 4 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 2f5d h PRO 4 CO 0.00 -0.01 0.06 1.03 -0.21 0.00 0.00 178.00 178.87 2f5d h SER 5 N -0.02 0.86 -0.63 -2.05 0.87 -2.01 -1.04 113.55 109.53 2f5d h SER 5 Ca 0.09 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.37 2f5d h SER 5 Cb 0.16 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.86 2f5d h SER 5 CO -0.20 0.92 0.36 -0.03 -0.53 0.00 0.00 176.83 177.35 2f5d h MET 6 N 0.77 0.88 -0.30 2.24 -1.53 -1.94 -1.29 114.93 113.77 2f5d h MET 6 Ca 0.16 -0.09 -0.11 0.00 -3.44 0.00 0.00 59.70 56.22 2f5d h MET 6 Cb 0.44 -0.18 -0.01 0.00 -0.55 0.00 0.00 31.60 31.30 2f5d h MET 6 CO 0.02 0.64 -0.28 0.93 0.14 0.00 0.00 176.91 178.36 2f5d h GLU 7 N 0.89 0.61 -0.79 0.39 5.08 -0.43 -1.72 114.58 118.62 2f5d h GLU 7 Ca 0.23 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2f5d h GLU 7 Cb 0.01 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 2f5d h GLU 7 CO -0.04 0.83 0.39 -0.44 -1.00 0.00 0.00 179.01 178.74 2f5d h ASP 8 N 0.53 1.03 0.14 1.42 3.45 -0.13 -0.67 116.42 122.20 2f5d h ASP 8 Ca 0.07 -0.13 -0.01 0.00 0.43 0.00 0.00 57.03 57.39 2f5d h ASP 8 Cb 0.75 -0.27 0.00 0.00 -0.56 0.00 0.00 39.33 39.26 2f5d h ASP 8 CO 0.06 0.87 -0.07 1.88 -1.57 0.00 0.00 179.24 180.42 2f5d h TYR 9 N 1.12 -0.18 -0.91 4.55 -1.99 -0.96 -1.22 116.97 117.38 2f5d h TYR 9 Ca 0.27 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 61.01 2f5d h TYR 9 Cb 0.11 0.06 -0.05 0.00 2.00 0.00 0.00 36.73 38.85 2f5d h TYR 9 CO 0.01 0.07 0.60 0.82 -0.00 0.00 0.00 178.16 179.66 2f5d h ILE 10 N -0.41 1.21 0.12 -2.88 2.04 -1.21 0.13 117.51 116.52 2f5d h ILE 10 Ca -0.02 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 2f5d h ILE 10 Cb 0.33 -0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.31 2f5d h ILE 10 CO 0.03 0.22 -0.06 -0.08 0.00 0.00 0.00 178.15 178.26 2f5d h GLU 11 N 1.21 -0.16 -0.59 2.37 4.81 -1.01 -1.95 114.58 119.26 2f5d h GLU 11 Ca 0.34 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.54 2f5d h GLU 11 Cb -0.11 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 2f5d h GLU 11 CO -0.08 -0.04 0.22 1.96 -0.73 0.00 0.00 179.01 180.34 2f5d h GLN 12 N -0.24 0.90 -0.49 1.92 1.08 -0.74 -2.28 115.11 115.26 2f5d h GLN 12 Ca -0.02 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.01 2f5d h GLN 12 Cb 0.19 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 2f5d h GLN 12 CO 0.03 0.78 0.31 0.82 -0.95 0.00 0.00 178.83 179.82 2f5d h ILE 13 N 0.83 1.13 -0.92 2.54 2.04 -0.72 -1.45 117.51 120.97 2f5d h ILE 13 Ca 0.20 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 2f5d h ILE 13 Cb 0.23 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 2f5d h ILE 13 CO -0.01 0.13 0.57 0.22 0.00 0.00 0.00 178.15 179.06 2f5d h TYR 14 N 0.66 1.19 -0.39 1.37 3.20 -1.20 -1.81 116.97 119.99 2f5d h TYR 14 Ca 0.18 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.94 2f5d h TYR 14 Cb -0.05 -0.39 -0.01 0.00 1.54 0.00 0.00 36.73 37.81 2f5d h TYR 14 CO -0.04 0.78 -0.22 0.52 -1.64 0.00 0.00 178.16 177.56 2f5d h MET 15 N 1.26 0.77 -0.51 1.82 2.86 -1.04 -2.32 114.93 117.78 2f5d h MET 15 Ca 0.33 -0.31 -0.10 0.00 -2.06 0.00 0.00 59.70 57.56 2f5d h MET 15 Cb -0.08 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 2f5d h MET 15 CO -0.06 0.93 -0.07 -0.07 1.06 0.00 0.00 176.91 178.69 2f5d h LEU 16 N 0.67 0.94 -0.83 1.22 3.38 -0.91 0.51 115.31 120.30 2f5d h LEU 16 Ca 0.09 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 2f5d h LEU 16 Cb 0.73 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 2f5d h LEU 16 CO 0.06 1.06 0.23 0.40 0.09 0.00 0.00 178.44 180.28 2f5d h ILE 17 N 0.81 1.25 0.00 1.22 2.04 -1.25 0.57 117.51 122.15 2f5d h ILE 17 Ca 0.13 -0.87 -0.12 0.00 1.00 0.00 0.00 64.86 65.00 2f5d h ILE 17 Cb 0.62 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 2f5d h ILE 17 CO 0.04 0.34 -0.58 -0.33 0.00 0.00 0.00 178.15 177.63 2f5d h GLU 18 N 1.06 0.00 0.00 2.37 4.39 -1.24 0.70 114.58 121.86 2f5d h GLU 18 Ca 0.23 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.88 2f5d h GLU 18 Cb 0.28 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 2f5d h GLU 18 CO -0.01 0.58 -0.38 1.49 -1.16 0.00 0.00 179.01 179.53 2f5d h GLU 19 N 0.00 0.00 0.00 2.33 4.81 -0.32 -3.41 114.58 117.99 2f5d h GLU 19 Ca -0.01 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 2f5d h GLU 19 Cb 1.11 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 2f5d h GLU 19 CO 0.08 0.62 -1.98 1.63 -0.73 0.00 0.00 179.01 178.63 2f5d n LYS 20 N -4.61 0.65 0.00 1.92 5.02 0.20 -4.99 118.16 116.36 2f5d n LYS 20 Ca -0.13 -0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.00 2f5d n LYS 20 Cb 0.39 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.91 2f5d n LYS 20 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2f5d n GLY 21 N 1.41 0.36 3.80 0.72 0.00 0.24 -5.02 105.19 106.71 2f5d n GLY 21 Ca -0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.90 2f5d n GLY 21 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2f5d s TYR 22 N -2.00 -0.11 -0.14 1.61 -0.85 -1.25 -4.88 117.35 109.73 2f5d s TYR 22 Ca 0.00 -0.29 -0.02 0.00 -0.52 0.00 0.00 57.07 56.24 2f5d s TYR 22 Cb 0.00 0.69 0.05 0.00 0.38 0.00 0.00 41.96 43.07 2f5d s TYR 22 CO 0.00 -1.03 0.03 0.00 -1.52 0.00 0.00 175.55 173.03 2f5d s ALA 23 N -3.29 0.82 0.18 9.51 0.00 -1.26 -3.76 121.76 123.96 2f5d s ALA 23 Ca 0.13 -0.42 -0.08 0.00 0.00 0.00 0.00 51.96 51.59 2f5d s ALA 23 Cb -0.03 -0.98 -0.07 0.00 0.00 0.00 0.00 23.12 22.04 2f5d s ALA 23 CO 0.05 -0.88 0.48 1.03 0.00 0.00 0.00 175.76 176.44 2f5d s ARG 24 N 1.93 3.75 0.27 0.00 0.52 -1.26 -4.27 118.95 119.89 2f5d s ARG 24 Ca 0.02 0.16 -0.01 0.00 -0.52 0.00 0.00 55.73 55.37 2f5d s ARG 24 Cb -0.15 -2.76 0.46 0.00 0.52 0.00 0.00 34.95 33.02 2f5d s ARG 24 CO -0.07 0.40 1.85 0.28 0.02 0.00 0.00 175.30 177.78 2f5d h VAL 25 N 2.15 0.99 -0.76 3.52 2.07 -1.99 -1.35 116.25 120.88 2f5d h VAL 25 Ca -0.47 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.68 2f5d h VAL 25 Cb 1.17 -0.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.78 2f5d h VAL 25 CO 0.70 0.19 0.38 0.77 0.02 0.00 0.00 177.57 179.63 2f5d h SER 26 N 1.03 0.97 -0.38 0.57 4.64 -1.97 -0.77 113.55 117.65 2f5d h SER 26 Ca 0.45 -0.12 -0.11 0.00 -0.47 0.00 0.00 61.79 61.54 2f5d h SER 26 Cb 0.33 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.16 2f5d h SER 26 CO -0.22 0.82 -0.17 0.44 -0.87 0.00 0.00 176.83 176.82 2f5d h ASP 27 N 1.06 0.86 -0.32 4.97 3.32 -1.70 -2.23 116.42 122.37 2f5d h ASP 27 Ca 0.26 -0.29 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 2f5d h ASP 27 Cb 0.08 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2f5d h ASP 27 CO -0.04 1.02 0.07 0.40 -1.72 0.00 0.00 179.24 178.98 2f5d h ILE 28 N 0.75 1.22 -0.29 0.35 2.04 -0.95 -1.47 117.51 119.16 2f5d h ILE 28 Ca 0.11 -0.76 0.05 0.00 1.00 0.00 0.00 64.86 65.26 2f5d h ILE 28 Cb 0.70 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.84 2f5d h ILE 28 CO 0.05 0.25 0.02 0.00 0.00 0.00 0.00 178.15 178.48 2f5d h ALA 29 N 0.91 0.28 -0.05 1.87 0.00 -1.01 -1.61 119.26 119.63 2f5d h ALA 29 Ca 0.10 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 2f5d h ALA 29 Cb 0.31 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2f5d h ALA 29 CO 0.00 -0.39 -0.43 0.93 0.00 0.00 0.00 179.25 179.36 2f5d h GLU 30 N 0.11 0.12 -0.28 0.00 5.08 -1.33 -0.66 114.58 117.62 2f5d h GLU 30 Ca 0.14 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.31 2f5d h GLU 30 Cb 0.17 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2f5d h GLU 30 CO -0.22 0.53 -0.39 0.00 -1.00 0.00 0.00 179.01 177.93 2f5d h ALA 31 N 1.46 0.80 -0.58 3.43 0.00 -0.72 -3.05 119.26 120.60 2f5d h ALA 31 Ca 0.01 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2f5d h ALA 31 Cb 0.80 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2f5d h ALA 31 CO 0.06 0.65 0.00 1.28 0.00 0.00 0.00 179.25 181.24 2f5d n LEU 32 N -4.04 3.77 -3.87 0.00 4.77 -0.66 -4.97 117.00 112.01 2f5d n LEU 32 Ca -0.02 -1.77 -0.29 0.00 -0.03 0.00 0.00 56.01 53.90 2f5d n LEU 32 Cb 0.52 -0.39 0.01 0.00 -2.33 0.00 0.00 43.42 41.23 2f5d n LEU 32 CO 0.46 0.88 -0.17 0.00 -1.33 0.00 0.00 177.39 177.23 2f5d n ALA 33 N 1.61 -2.26 -2.30 -1.18 0.00 -0.49 -4.97 120.51 110.93 2f5d n ALA 33 Ca 0.22 -0.29 -0.17 0.00 0.00 0.00 0.00 53.44 53.21 2f5d n ALA 33 Cb 0.62 -2.54 -0.09 0.00 0.00 0.00 0.00 19.45 17.44 2f5d n ALA 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2f5d s VAL 34 N -3.75 0.25 0.16 0.00 -7.23 -0.38 -5.04 120.40 104.41 2f5d s VAL 34 Ca 0.22 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.26 2f5d s VAL 34 Cb -0.08 -2.53 -0.07 0.00 0.56 0.00 0.00 36.38 34.26 2f5d s VAL 34 CO 0.89 0.00 0.53 -1.00 -0.31 0.00 0.00 175.10 175.21 2f5d s HIS 35 N -3.74 3.56 0.59 2.82 3.76 -1.26 -4.45 115.29 116.57 2f5d s HIS 35 Ca 0.37 0.98 0.29 0.00 -0.15 0.00 0.00 55.06 56.56 2f5d s HIS 35 Cb 0.06 -2.32 1.42 0.00 1.11 0.00 0.00 32.58 32.85 2f5d s HIS 35 CO 0.17 0.41 1.83 -1.00 -0.85 0.00 0.00 174.74 175.29 2f5d h PRO 36 N 3.36 0.00 -0.28 8.40 0.13 -1.92 0.13 132.00 141.82 2f5d h PRO 36 Ca -0.48 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.48 2f5d h PRO 36 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2f5d h PRO 36 CO 0.67 0.00 -0.47 0.66 -0.23 0.00 0.00 178.00 178.63 2f5d h SER 37 N 0.00 0.89 -0.43 1.44 4.64 -1.99 -2.30 113.55 115.81 2f5d h SER 37 Ca 0.26 -0.52 -0.02 0.00 -0.47 0.00 0.00 61.79 61.04 2f5d h SER 37 Cb 1.43 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 2f5d h SER 37 CO -0.00 1.25 0.20 0.28 -0.87 0.00 0.00 176.83 177.68 2f5d h SER 38 N 0.57 0.56 0.19 4.97 0.02 -1.14 -2.58 113.55 116.14 2f5d h SER 38 Ca 0.02 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2f5d h SER 38 Cb 1.07 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 2f5d h SER 38 CO 0.11 0.53 -0.19 0.58 -1.14 0.00 0.00 176.83 176.72 2f5d h VAL 39 N 0.55 0.58 -0.97 2.27 2.07 -1.40 -2.25 116.25 117.08 2f5d h VAL 39 Ca 0.15 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.81 2f5d h VAL 39 Cb 0.12 0.58 -0.09 0.00 -1.52 0.00 0.00 31.29 30.38 2f5d h VAL 39 CO -0.02 0.00 0.59 0.74 0.02 0.00 0.00 177.57 178.90 2f5d h THR 40 N -0.42 0.82 -0.67 2.57 2.02 -1.34 0.10 112.91 116.00 2f5d h THR 40 Ca 0.00 -0.29 -0.05 0.00 0.77 0.00 0.00 66.41 66.84 2f5d h THR 40 Cb 0.39 -0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 66.66 2f5d h THR 40 CO -0.05 0.16 0.21 0.11 0.37 0.00 0.00 175.52 176.32 2f5d h LYS 41 N 0.85 1.03 -0.16 6.66 1.57 -1.08 -2.46 116.57 122.98 2f5d h LYS 41 Ca 0.52 -0.21 -0.17 0.00 -1.87 0.00 0.00 60.65 58.92 2f5d h LYS 41 Cb 0.65 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 32.81 2f5d h LYS 41 CO -0.32 0.88 -0.56 1.98 -0.57 0.00 0.00 179.45 180.86 2f5d h MET 42 N 0.99 0.66 -0.68 3.15 4.05 -0.52 -3.13 114.93 119.45 2f5d h MET 42 Ca 0.22 -0.50 0.09 0.00 -0.28 0.00 0.00 59.70 59.23 2f5d h MET 42 Cb 0.28 0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.13 2f5d h MET 42 CO -0.01 1.12 0.45 0.28 0.23 0.00 0.00 176.91 178.98 2f5d h VAL 43 N 0.34 0.93 -0.44 -5.77 2.07 -0.70 -0.11 116.25 112.58 2f5d h VAL 43 Ca -0.02 -0.20 -0.08 0.00 0.82 0.00 0.00 66.70 67.22 2f5d h VAL 43 Cb 1.18 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 2f5d h VAL 43 CO 0.12 0.10 -0.05 1.56 0.02 0.00 0.00 177.57 179.32 2f5d h GLN 44 N 0.57 0.81 -0.54 1.57 4.20 -1.41 0.53 115.11 120.83 2f5d h GLN 44 Ca 0.31 -0.28 -0.09 0.00 0.06 0.00 0.00 58.65 58.64 2f5d h GLN 44 Cb 0.46 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 2f5d h GLN 44 CO -0.10 0.90 -0.03 -0.22 -0.67 0.00 0.00 178.83 178.70 2f5d h LYS 45 N 0.64 0.98 -0.50 1.46 3.64 -1.20 -1.14 116.57 120.45 2f5d h LYS 45 Ca 0.12 -0.33 -0.08 0.00 -1.27 0.00 0.00 60.65 59.09 2f5d h LYS 45 Cb 0.56 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 2f5d h LYS 45 CO 0.03 1.00 -0.02 -0.07 -2.27 0.00 0.00 179.45 178.11 2f5d h LEU 46 N 0.85 0.83 -0.18 5.20 3.38 -0.93 -0.23 115.31 124.23 2f5d h LEU 46 Ca 0.15 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2f5d h LEU 46 Cb 0.58 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2f5d h LEU 46 CO 0.03 0.91 0.09 -0.78 0.09 0.00 0.00 178.44 178.78 2f5d h ASP 47 N 0.79 0.24 -0.01 -0.43 1.82 -0.62 -0.87 116.42 117.33 2f5d h ASP 47 Ca 0.15 -0.12 -0.06 0.00 -0.39 0.00 0.00 57.03 56.61 2f5d h ASP 47 Cb 0.51 -0.06 -0.01 0.00 0.68 0.00 0.00 39.33 40.44 2f5d h ASP 47 CO 0.03 0.29 -0.14 0.11 -1.61 0.00 0.00 179.24 177.92 2f5d h LYS 48 N 0.17 0.31 -0.07 0.28 6.56 -0.92 -1.85 116.57 121.04 2f5d h LYS 48 Ca 0.06 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2f5d h LYS 48 Cb 0.12 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.74 2f5d h LYS 48 CO -0.01 0.45 0.00 -0.25 -2.06 0.00 0.00 179.45 177.59 2f5d n ASP 49 N -4.24 0.59 -1.50 0.86 8.00 -0.12 -4.91 116.55 115.23 2f5d n ASP 49 Ca -0.00 -1.60 -0.12 0.00 0.71 0.00 0.00 54.79 53.77 2f5d n ASP 49 Cb 0.29 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 2f5d n ASP 49 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2f5d n GLU 50 N -0.36 -1.42 0.02 -1.24 1.02 -0.70 -4.93 120.64 113.03 2f5d n GLU 50 Ca 0.13 0.57 0.01 0.00 -0.02 0.00 0.00 57.16 57.86 2f5d n GLU 50 Cb 0.15 -4.72 -0.09 0.00 -0.02 0.00 0.00 31.44 26.75 2f5d n GLU 50 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2f5d n TYR 51 N -4.00 0.74 -3.77 -0.32 4.02 -0.38 -4.43 117.16 109.01 2f5d n TYR 51 Ca -0.13 0.24 -0.09 0.00 -0.01 0.00 0.00 57.90 57.91 2f5d n TYR 51 Cb 0.60 -0.99 -0.04 0.00 -0.02 0.00 0.00 39.34 38.89 2f5d n TYR 51 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 176.86 175.37 2f5d s LEU 52 N -5.53 0.04 -0.18 7.72 0.05 -1.24 -1.66 118.68 117.87 2f5d s LEU 52 Ca -0.04 -0.53 -0.00 0.00 0.05 0.00 0.00 54.13 53.60 2f5d s LEU 52 Cb 0.09 2.19 0.01 0.00 -2.05 0.00 0.00 46.19 46.43 2f5d s LEU 52 CO 0.82 -1.10 -0.15 -0.63 -0.55 0.00 0.00 176.35 174.75 2f5d s ILE 53 N -3.89 2.57 -5.00 1.48 1.09 0.13 -4.18 121.20 113.41 2f5d s ILE 53 Ca 0.11 -0.78 0.00 0.00 -1.10 0.00 0.00 60.65 58.88 2f5d s ILE 53 Cb -0.02 -2.11 0.00 0.00 -1.06 0.00 0.00 42.46 39.28 2f5d s ILE 53 CO -0.01 0.50 0.00 0.00 -0.10 0.00 0.00 174.94 175.34 2f5d n TYR 54 N 4.45 0.00 0.00 3.97 4.19 -1.26 -2.34 117.16 126.17 2f5d n TYR 54 Ca -0.20 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.01 2f5d n TYR 54 Cb 0.51 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.34 2f5d n TYR 54 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2f5d n GLY 59 N -0.07 -1.28 3.72 2.98 0.00 -1.26 -4.71 105.19 104.58 2f5d n GLY 59 Ca 0.00 -0.42 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 2f5d n GLY 59 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2f5d s LEU 60 N 0.00 4.35 -0.04 0.99 0.05 -1.26 -5.06 118.68 117.70 2f5d s LEU 60 Ca 0.00 1.26 0.05 0.00 0.05 0.00 0.00 54.13 55.49 2f5d s LEU 60 Cb 0.00 -3.13 -0.02 0.00 -2.05 0.00 0.00 46.19 40.99 2f5d s LEU 60 CO 0.00 -0.09 -0.20 -0.69 -0.55 0.00 0.00 176.35 174.82 2f5d s VAL 61 N 0.63 2.54 0.23 1.48 1.01 -0.99 -4.57 120.40 120.74 2f5d s VAL 61 Ca 0.38 -0.91 -0.24 0.00 0.00 0.00 0.00 61.98 61.21 2f5d s VAL 61 Cb -0.18 -1.95 -0.09 0.00 0.00 0.00 0.00 36.38 34.16 2f5d s VAL 61 CO 0.19 0.58 0.82 -0.76 0.00 0.00 0.00 175.10 175.93 2f5d s LEU 62 N -0.54 4.46 0.88 3.92 1.43 -1.26 0.22 118.68 127.79 2f5d s LEU 62 Ca 0.07 1.66 -0.12 0.00 -1.03 0.00 0.00 54.13 54.71 2f5d s LEU 62 Cb -0.11 -3.59 0.16 0.00 0.03 0.00 0.00 46.19 42.67 2f5d s LEU 62 CO 0.01 0.08 1.23 0.42 0.23 0.00 0.00 176.35 178.32 2f5d s THR 63 N -1.38 2.04 0.40 5.49 -4.23 -0.67 -4.77 115.64 112.53 2f5d s THR 63 Ca 0.42 -0.11 0.07 0.00 -1.18 0.00 0.00 61.69 60.89 2f5d s THR 63 Cb -0.20 -2.94 0.27 0.00 1.34 0.00 0.00 72.50 70.97 2f5d s THR 63 CO 0.25 0.00 2.05 0.77 -0.54 0.00 0.00 174.62 177.14 2f5d h SER 64 N -1.31 0.50 -0.39 3.99 4.64 -1.89 -0.77 113.55 118.32 2f5d h SER 64 Ca -0.44 -0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 60.81 2f5d h SER 64 Cb 1.26 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2f5d h SER 64 CO 0.45 0.36 0.02 0.50 -0.87 0.00 0.00 176.83 177.28 2f5d h LYS 65 N 0.59 0.69 -0.37 4.77 3.64 -1.88 -2.05 116.57 121.96 2f5d h LYS 65 Ca 0.17 -0.21 -0.10 0.00 -1.27 0.00 0.00 60.65 59.25 2f5d h LYS 65 Cb -0.02 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 2f5d h LYS 65 CO -0.04 0.77 -0.18 0.78 -2.27 0.00 0.00 179.45 178.50 2f5d h GLY 66 N 0.52 0.75 1.17 5.01 0.00 -1.35 -2.34 103.07 106.82 2f5d h GLY 66 Ca 0.11 -0.60 -0.14 0.00 0.00 0.00 0.00 47.33 46.71 2f5d h GLY 66 CO 0.02 0.55 -0.26 0.50 0.00 0.00 0.00 176.54 177.34 2f5d h LYS 67 N 0.62 0.93 -0.06 4.80 1.57 -1.07 -0.51 116.57 122.84 2f5d h LYS 67 Ca 0.10 -0.42 -0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2f5d h LYS 67 Cb 0.65 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.94 2f5d h LYS 67 CO 0.05 1.08 0.02 0.87 -0.57 0.00 0.00 179.45 180.90 2f5d h LYS 68 N 0.80 0.09 -0.51 3.15 1.57 -1.26 -0.70 116.57 119.70 2f5d h LYS 68 Ca 0.09 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2f5d h LYS 68 Cb 0.83 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.11 2f5d h LYS 68 CO 0.07 0.21 0.10 0.82 -0.57 0.00 0.00 179.45 180.09 2f5d h ILE 69 N -0.06 1.25 -0.23 1.86 1.08 -1.42 -2.37 117.51 117.62 2f5d h ILE 69 Ca 0.02 -0.90 0.02 0.00 -0.39 0.00 0.00 64.86 63.61 2f5d h ILE 69 Cb 0.16 0.85 -0.02 0.00 -3.07 0.00 0.00 36.82 34.73 2f5d h ILE 69 CO -0.00 0.33 0.09 1.23 -0.69 0.00 0.00 178.15 179.11 2f5d h GLY 70 N 0.72 0.30 0.88 5.37 0.00 -0.98 -0.31 103.07 109.05 2f5d h GLY 70 Ca 0.16 -0.06 0.03 0.00 0.00 0.00 0.00 47.33 47.46 2f5d h GLY 70 CO 0.01 0.05 0.57 1.70 0.00 0.00 0.00 176.54 178.86 2f5d h LYS 71 N 0.21 1.07 -0.55 4.80 3.64 -1.04 -1.68 116.57 123.02 2f5d h LYS 71 Ca 0.10 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2f5d h LYS 71 Cb 0.05 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 2f5d h LYS 71 CO -0.09 0.71 0.20 0.00 -2.27 0.00 0.00 179.45 178.00 2f5d h ARG 72 N 1.11 0.84 -0.54 1.90 2.47 -0.90 -1.72 114.38 117.54 2f5d h ARG 72 Ca 0.35 -0.17 -0.10 0.00 -1.26 0.00 0.00 59.98 58.80 2f5d h ARG 72 Cb -0.00 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.17 2f5d h ARG 72 CO -0.12 0.75 -0.07 -0.07 0.56 0.00 0.00 179.97 181.02 2f5d h LEU 73 N 0.76 0.97 -0.57 3.04 3.38 -0.60 -0.57 115.31 121.73 2f5d h LEU 73 Ca 0.18 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.72 2f5d h LEU 73 Cb 0.24 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2f5d h LEU 73 CO -0.01 1.07 -0.25 0.58 0.09 0.00 0.00 178.44 179.92 2f5d h VAL 74 N 0.89 1.27 -0.35 1.22 2.07 -1.24 -1.25 116.25 118.86 2f5d h VAL 74 Ca 0.15 -1.40 -0.00 0.00 0.82 0.00 0.00 66.70 66.27 2f5d h VAL 74 Cb 0.62 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 2f5d h VAL 74 CO 0.04 0.47 0.21 0.22 0.02 0.00 0.00 177.57 178.53 2f5d h TYR 75 N 0.76 0.46 -0.61 1.57 3.20 -1.09 -0.62 116.97 120.64 2f5d h TYR 75 Ca 0.10 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.98 2f5d h TYR 75 Cb 0.80 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 2f5d h TYR 75 CO 0.05 0.34 0.38 -0.09 -1.64 0.00 0.00 178.16 177.20 2f5d h ARG 76 N 0.45 0.74 -0.05 1.82 2.43 -0.87 -0.15 114.38 118.74 2f5d h ARG 76 Ca 0.12 -0.04 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 2f5d h ARG 76 Cb 0.02 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2f5d h ARG 76 CO -0.02 0.49 0.02 1.25 -1.51 0.00 0.00 179.97 180.20 2f5d h HIS 77 N 0.76 0.07 -0.77 2.20 2.76 -0.95 -2.16 115.15 117.06 2f5d h HIS 77 Ca 0.24 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.41 2f5d h HIS 77 Cb -0.01 -0.02 -0.04 0.00 1.55 0.00 0.00 27.41 28.89 2f5d h HIS 77 CO -0.05 0.19 0.51 1.49 -1.30 0.00 0.00 177.93 178.77 2f5d h GLU 78 N -0.06 1.02 -0.36 5.26 4.81 -0.88 -1.88 114.58 122.49 2f5d h GLU 78 Ca 0.02 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2f5d h GLU 78 Cb 0.14 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 2f5d h GLU 78 CO -0.00 0.68 0.18 1.25 -0.73 0.00 0.00 179.01 180.38 2f5d h LEU 79 N 1.05 0.47 -1.00 1.64 5.85 -0.93 -1.92 115.31 120.47 2f5d h LEU 79 Ca 0.28 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 2f5d h LEU 79 Cb -0.11 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 2f5d h LEU 79 CO -0.06 0.46 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.36 2f5d h LEU 80 N 0.44 0.62 -0.46 2.25 3.38 -1.13 0.08 115.31 120.49 2f5d h LEU 80 Ca 0.12 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2f5d h LEU 80 Cb 0.11 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2f5d h LEU 80 CO -0.02 0.74 0.08 -0.33 0.09 0.00 0.00 178.44 179.01 2f5d h GLU 81 N 0.60 0.76 -0.84 1.13 5.08 -1.17 -1.90 114.58 118.24 2f5d h GLU 81 Ca 0.11 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2f5d h GLU 81 Cb 0.48 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.60 2f5d h GLU 81 CO 0.03 0.77 0.49 0.37 -1.00 0.00 0.00 179.01 179.67 2f5d h GLN 82 N 0.63 1.15 0.29 2.33 4.15 -0.85 -1.05 115.11 121.75 2f5d h GLN 82 Ca 0.14 -0.11 -0.01 0.00 0.77 0.00 0.00 58.65 59.44 2f5d h GLN 82 Cb 0.37 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.83 2f5d h GLN 82 CO 0.01 0.82 -0.14 0.35 -1.93 0.00 0.00 178.83 177.94 2f5d h PHE 83 N 1.16 -0.36 -0.39 3.99 3.57 -0.77 -0.63 116.94 123.50 2f5d h PHE 83 Ca 0.30 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.76 2f5d h PHE 83 Cb -0.03 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2f5d h PHE 83 CO -0.00 -0.17 0.09 -0.07 -2.23 0.00 0.00 178.31 175.93 2f5d h LEU 84 N -0.47 0.53 -0.31 0.59 3.38 -1.23 -2.28 115.31 115.52 2f5d h LEU 84 Ca -0.04 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 2f5d h LEU 84 Cb 0.35 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2f5d h LEU 84 CO 0.07 0.54 -0.02 -0.09 0.09 0.00 0.00 178.44 179.03 2f5d h ARG 85 N 0.57 0.56 -0.63 1.13 2.43 -1.03 -1.49 114.38 115.92 2f5d h ARG 85 Ca 0.13 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2f5d h ARG 85 Cb 0.23 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 2f5d h ARG 85 CO -0.00 0.71 0.30 0.82 -1.51 0.00 0.00 179.97 180.30 2f5d h ILE 86 N 0.35 1.20 -0.09 1.20 2.04 -0.70 -2.15 117.51 119.36 2f5d h ILE 86 Ca 0.08 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2f5d h ILE 86 Cb 0.48 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2f5d h ILE 86 CO 0.02 0.24 0.00 2.30 0.00 0.00 0.00 178.15 180.71 2f5d n ILE 87 N -4.35 0.12 -0.46 -0.67 -5.35 -0.89 -4.91 119.36 102.85 2f5d n ILE 87 Ca 0.06 -0.15 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 2f5d n ILE 87 Cb 0.13 0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.05 2f5d n ILE 87 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2f5d n GLY 88 N 0.85 0.73 3.77 3.28 0.00 -0.81 -5.06 105.19 107.94 2f5d n GLY 88 Ca 0.11 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 2f5d n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2f5d s VAL 89 N -2.00 3.05 0.02 1.61 1.01 -0.57 -4.92 120.40 118.60 2f5d s VAL 89 Ca 0.00 1.04 -0.35 0.00 0.00 0.00 0.00 61.98 62.66 2f5d s VAL 89 Cb 0.00 -3.65 -0.14 0.00 0.00 0.00 0.00 36.38 32.59 2f5d s VAL 89 CO 0.00 0.23 1.66 0.47 0.00 0.00 0.00 175.10 177.46 2f5d n ASP 90 N 0.86 2.89 -0.35 3.32 10.43 -1.26 -4.73 116.55 127.71 2f5d n ASP 90 Ca 0.00 1.05 0.24 0.00 2.57 0.00 0.00 54.79 58.66 2f5d n ASP 90 Cb 0.43 -1.34 0.51 0.00 1.84 0.00 0.00 41.12 42.56 2f5d n ASP 90 CO 0.00 0.00 0.00 -0.08 -1.07 0.00 0.00 177.20 176.05 2f5d h GLU 91 N 6.91 0.35 0.00 -1.24 4.57 -1.97 0.18 114.58 123.38 2f5d h GLU 91 Ca -0.47 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 2f5d h GLU 91 Cb 1.28 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2f5d h GLU 91 CO 0.90 0.23 0.00 0.93 -1.18 0.00 0.00 179.01 179.89 2f5d h GLU 92 N 0.36 0.00 0.00 1.92 3.07 -2.03 -2.98 114.58 114.92 2f5d h GLU 92 Ca 0.66 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.52 2f5d h GLU 92 Cb 1.67 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.58 2f5d h GLU 92 CO -0.39 0.00 -1.40 1.63 -1.40 0.00 0.00 179.01 177.45 2f5d n LYS 93 N -2.73 0.35 0.12 2.33 4.76 0.04 -4.63 118.16 118.41 2f5d n LYS 93 Ca 0.01 -0.08 -0.13 0.00 -2.87 0.00 0.00 58.31 55.24 2f5d n LYS 93 Cb 0.24 -1.54 -0.07 0.00 -1.84 0.00 0.00 35.03 31.81 2f5d n LYS 93 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2f5d h ILE 94 N 0.00 0.77 -0.09 -0.18 2.04 -1.46 -2.77 117.51 115.81 2f5d h ILE 94 Ca 0.00 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.90 2f5d h ILE 94 Cb 0.77 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.58 2f5d h ILE 94 CO 0.00 0.00 -0.15 0.22 0.00 0.00 0.00 178.15 178.22 2f5d h TYR 95 N -0.27 -0.38 -0.32 1.37 3.20 -1.82 -0.56 116.97 118.19 2f5d h TYR 95 Ca -0.01 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 2f5d h TYR 95 Cb 0.23 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 2f5d h TYR 95 CO -0.09 -0.22 0.01 -0.91 -1.64 0.00 0.00 178.16 175.31 2f5d h ASN 96 N -0.20 0.45 -0.17 -2.11 2.35 -1.85 -0.30 115.58 113.75 2f5d h ASN 96 Ca 0.08 -0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 2f5d h ASN 96 Cb 0.32 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 2f5d h ASN 96 CO -0.21 0.51 -0.19 0.44 -1.65 0.00 0.00 177.43 176.33 2f5d h ASP 97 N 0.47 0.46 -0.65 5.81 5.19 -1.17 -2.66 116.42 123.86 2f5d h ASP 97 Ca 0.10 -0.49 -0.01 0.00 -0.62 0.00 0.00 57.03 56.02 2f5d h ASP 97 Cb 0.29 -0.13 -0.03 0.00 0.18 0.00 0.00 39.33 39.64 2f5d h ASP 97 CO 0.01 0.85 0.38 0.58 -3.12 0.00 0.00 179.24 177.94 2f5d h VAL 98 N 0.07 1.19 -0.27 -1.35 2.07 -0.83 -1.37 116.25 115.76 2f5d h VAL 98 Ca 0.02 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2f5d h VAL 98 Cb 0.73 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 2f5d h VAL 98 CO 0.05 0.21 0.17 -0.33 0.02 0.00 0.00 177.57 177.68 2f5d h GLU 99 N 0.88 0.35 0.22 1.57 4.39 -1.05 -1.22 114.58 119.73 2f5d h GLU 99 Ca 0.23 -0.02 -0.34 0.00 0.34 0.00 0.00 59.36 59.57 2f5d h GLU 99 Cb 0.00 -0.08 0.03 0.00 -0.10 0.00 0.00 28.75 28.60 2f5d h GLU 99 CO -0.04 0.24 -1.54 0.78 -1.16 0.00 0.00 179.01 177.29 2f5d h GLY 100 N 0.38 0.54 1.27 -3.84 0.00 -1.03 -3.39 103.07 97.01 2f5d h GLY 100 Ca 0.10 -1.38 -0.16 0.00 0.00 0.00 0.00 47.33 45.88 2f5d h GLY 100 CO -0.02 1.21 -1.20 0.16 0.00 0.00 0.00 176.54 176.69 2f5d h ILE 101 N 0.13 0.67 -1.08 2.60 3.07 -1.15 -3.39 117.51 118.36 2f5d h ILE 101 Ca -0.27 -2.17 0.31 0.00 1.55 0.00 0.00 64.86 64.28 2f5d h ILE 101 Cb 2.13 2.19 -0.05 0.00 -0.27 0.00 0.00 36.82 40.82 2f5d h ILE 101 CO 0.24 0.38 0.76 1.05 -1.05 0.00 0.00 178.15 179.54 2f5d h GLU 102 N 0.00 0.08 0.00 0.16 4.11 -1.41 -0.12 114.58 117.40 2f5d h GLU 102 Ca -0.13 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.30 2f5d h GLU 102 Cb 1.58 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.81 2f5d h GLU 102 CO 0.06 0.05 -0.39 0.72 0.07 0.00 0.00 179.01 179.52 2f5d n HIS 103 N -4.29 0.37 -0.42 2.06 8.25 -1.26 -4.05 115.22 115.88 2f5d n HIS 103 Ca 0.24 0.11 0.07 0.00 -0.26 0.00 0.00 57.72 57.88 2f5d n HIS 103 Cb 1.10 -0.56 0.22 0.00 1.12 0.00 0.00 29.99 31.86 2f5d n HIS 103 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2f5d n HIS 104 N -1.87 0.74 -4.37 4.41 8.25 -0.06 -4.92 115.22 117.40 2f5d n HIS 104 Ca 0.05 -0.59 -0.34 0.00 -0.26 0.00 0.00 57.72 56.58 2f5d n HIS 104 Cb 0.39 -0.11 -0.11 0.00 1.12 0.00 0.00 29.99 31.28 2f5d n HIS 104 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2f5d s LEU 105 N -1.47 3.38 0.87 2.41 1.43 -1.21 -5.11 118.68 118.98 2f5d s LEU 105 Ca 0.33 -0.03 -0.11 0.00 -1.03 0.00 0.00 54.13 53.28 2f5d s LEU 105 Cb 0.20 -1.80 0.11 0.00 0.03 0.00 0.00 46.19 44.73 2f5d s LEU 105 CO 0.17 0.24 1.09 -0.94 0.23 0.00 0.00 176.35 177.14 2f5d s SER 106 N -0.03 3.76 0.42 2.29 1.04 -1.26 -4.84 113.70 115.07 2f5d s SER 106 Ca 0.02 1.47 0.17 0.00 0.48 0.00 0.00 55.95 58.09 2f5d s SER 106 Cb -0.13 -2.16 0.91 0.00 0.10 0.00 0.00 66.02 64.74 2f5d s SER 106 CO 0.02 -2.46 1.89 -0.50 0.98 0.00 0.00 173.24 173.18 2f5d h TRP 107 N -1.42 0.00 -0.43 5.02 4.06 -1.99 -2.01 115.95 119.18 2f5d h TRP 107 Ca -0.49 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.45 2f5d h TRP 107 Cb 1.28 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.42 2f5d h TRP 107 CO 0.44 0.29 0.21 -0.97 -3.56 0.00 0.00 178.44 174.85 2f5d h ASN 108 N 0.00 0.56 -0.46 -3.49 -1.24 -1.99 -0.09 115.58 108.86 2f5d h ASN 108 Ca -0.00 -0.13 -0.02 0.00 0.71 0.00 0.00 56.30 56.86 2f5d h ASN 108 Cb 0.57 -0.14 -0.02 0.00 0.73 0.00 0.00 38.32 39.46 2f5d h ASN 108 CO 0.04 0.53 0.20 0.28 -1.29 0.00 0.00 177.43 177.18 2f5d h SER 109 N 0.55 0.63 -0.60 1.15 0.02 -1.80 -1.73 113.55 111.77 2f5d h SER 109 Ca 0.15 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2f5d h SER 109 Cb 0.12 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 2f5d h SER 109 CO -0.02 0.61 0.38 0.40 -1.14 0.00 0.00 176.83 177.06 2f5d h ILE 110 N 0.60 1.17 -0.66 3.27 1.08 -1.09 -0.57 117.51 121.31 2f5d h ILE 110 Ca 0.16 -0.36 -0.04 0.00 -0.39 0.00 0.00 64.86 64.23 2f5d h ILE 110 Cb 0.17 0.32 -0.03 0.00 -3.07 0.00 0.00 36.82 34.21 2f5d h ILE 110 CO -0.01 0.17 0.27 0.44 -0.69 0.00 0.00 178.15 178.32 2f5d h ASP 111 N 0.82 0.91 -0.05 1.72 3.32 -0.84 -0.02 116.42 122.28 2f5d h ASP 111 Ca 0.22 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 57.00 2f5d h ASP 111 Cb -0.05 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 2f5d h ASP 111 CO -0.04 0.83 -0.27 0.03 -1.72 0.00 0.00 179.24 178.08 2f5d h ARG 112 N 0.93 0.48 -0.14 3.56 2.47 -1.01 -1.72 114.38 118.96 2f5d h ARG 112 Ca 0.22 -0.19 -0.11 0.00 -1.26 0.00 0.00 59.98 58.65 2f5d h ARG 112 Cb 0.21 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.49 2f5d h ARG 112 CO -0.02 0.71 -0.38 0.82 0.56 0.00 0.00 179.97 181.66 2f5d h ILE 113 N 0.42 1.30 -0.66 2.04 2.04 -0.73 -1.54 117.51 120.39 2f5d h ILE 113 Ca 0.06 -1.47 -0.04 0.00 1.00 0.00 0.00 64.86 64.42 2f5d h ILE 113 Cb 0.69 1.61 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 2f5d h ILE 113 CO 0.05 0.44 0.27 1.23 0.00 0.00 0.00 178.15 180.15 2f5d h GLY 114 N 1.16 1.06 1.75 5.37 0.00 -0.23 -0.68 103.07 111.50 2f5d h GLY 114 Ca 0.03 -0.57 -0.09 0.00 0.00 0.00 0.00 47.33 46.70 2f5d h GLY 114 CO 0.06 0.54 -0.32 -0.55 0.00 0.00 0.00 176.54 176.26 2f5d h ASP 115 N 0.93 0.29 -0.38 0.19 3.32 -1.00 -2.10 116.42 117.67 2f5d h ASP 115 Ca 0.22 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.10 2f5d h ASP 115 Cb 0.19 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2f5d h ASP 115 CO -0.02 0.61 -0.04 0.25 -1.72 0.00 0.00 179.24 178.31 2f5d h LEU 116 N 0.25 0.70 -0.62 1.55 5.85 -0.73 -0.47 115.31 121.84 2f5d h LEU 116 Ca 0.03 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 2f5d h LEU 116 Cb 0.70 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2f5d h LEU 116 CO 0.05 0.87 0.31 0.58 -0.34 0.00 0.00 178.44 179.90 2f5d h VAL 117 N 0.51 1.21 -0.74 1.05 2.07 -0.93 -2.43 116.25 116.99 2f5d h VAL 117 Ca 0.10 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 2f5d h VAL 117 Cb 0.54 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2f5d h VAL 117 CO 0.03 0.25 0.46 -0.61 0.02 0.00 0.00 177.57 177.71 2f5d h GLN 118 N 0.85 1.00 -0.13 1.57 5.75 -1.21 -1.37 115.11 121.57 2f5d h GLN 118 Ca 0.21 -0.08 0.05 0.00 -0.15 0.00 0.00 58.65 58.68 2f5d h GLN 118 Cb 0.11 -0.21 -0.06 0.00 1.07 0.00 0.00 27.48 28.38 2f5d h GLN 118 CO -0.03 0.70 -0.29 -0.92 -2.65 0.00 0.00 178.83 175.64 2f5d h TYR 119 N 1.01 -0.79 0.00 3.99 3.20 -0.63 -1.32 116.97 122.43 2f5d h TYR 119 Ca 0.27 0.04 -0.08 0.00 3.14 0.00 0.00 58.73 62.09 2f5d h TYR 119 Cb -0.05 0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 2f5d h TYR 119 CO -0.01 -0.37 -0.38 0.74 -1.64 0.00 0.00 178.16 176.50 2f5d h PHE 120 N -0.36 0.00 0.00 -3.82 -1.00 -1.21 -3.13 116.94 107.41 2f5d h PHE 120 Ca 0.10 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.78 2f5d h PHE 120 Cb 0.51 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.06 2f5d h PHE 120 CO -0.38 0.38 -0.48 0.93 -1.61 0.00 0.00 178.31 177.15 2f5d h GLU 121 N 0.00 0.00 -0.00 1.51 4.39 -0.72 -3.29 114.58 116.47 2f5d h GLU 121 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2f5d h GLU 121 Cb 0.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 2f5d h GLU 121 CO 0.05 0.48 -0.04 -0.85 -1.16 0.00 0.00 179.01 177.49 2f5d n GLU 122 N -3.29 0.02 -3.26 2.33 0.28 -0.55 -4.65 120.64 111.53 2f5d n GLU 122 Ca 0.01 -0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 56.98 2f5d n GLU 122 Cb 0.68 -1.50 -0.04 0.00 1.43 0.00 0.00 31.44 32.01 2f5d n GLU 122 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2f5d s ASP 123 N -2.98 -0.42 0.40 -1.84 -1.08 -1.24 -5.02 116.67 104.49 2f5d s ASP 123 Ca 0.14 0.20 0.28 0.00 -0.52 0.00 0.00 52.55 52.65 2f5d s ASP 123 Cb 0.19 1.52 1.45 0.00 -1.46 0.00 0.00 42.92 44.62 2f5d s ASP 123 CO 0.54 -0.31 1.85 -2.24 0.52 0.00 0.00 175.17 175.53 2f5d h ASP 124 N 8.10 0.00 0.51 -0.34 3.04 -1.83 -1.40 116.42 124.50 2f5d h ASP 124 Ca -0.14 0.00 -0.08 0.00 -3.24 0.00 0.00 57.03 53.57 2f5d h ASP 124 Cb 1.15 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.43 2f5d h ASP 124 CO 0.25 0.00 -0.38 0.00 -2.04 0.00 0.00 179.24 177.07 2f5d h ALA 125 N 2.03 1.23 -0.27 4.15 0.00 -1.95 -2.62 119.26 121.83 2f5d h ALA 125 Ca 0.00 -0.35 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 2f5d h ALA 125 Cb 0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2f5d h ALA 125 CO 0.00 0.48 -0.33 0.00 0.00 0.00 0.00 179.25 179.40 2f5d h ARG 126 N 0.00 0.59 -0.24 0.00 3.08 -1.58 -1.45 114.38 114.77 2f5d h ARG 126 Ca -0.00 -0.26 -0.14 0.00 0.07 0.00 0.00 59.98 59.64 2f5d h ARG 126 Cb 0.74 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 2f5d h ARG 126 CO 0.05 0.84 -0.44 0.87 -1.07 0.00 0.00 179.97 180.22 2f5d h LYS 127 N 0.50 0.61 -0.49 0.04 1.57 -1.59 -2.09 116.57 115.12 2f5d h LYS 127 Ca 0.06 -0.33 -0.13 0.00 -1.87 0.00 0.00 60.65 58.38 2f5d h LYS 127 Cb 0.81 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 2f5d h LYS 127 CO 0.07 0.93 -0.19 0.87 -0.57 0.00 0.00 179.45 180.56 2f5d h LYS 128 N 0.49 0.97 -0.34 3.15 1.57 -1.25 -1.11 116.57 120.06 2f5d h LYS 128 Ca 0.03 -0.40 -0.08 0.00 -1.87 0.00 0.00 60.65 58.34 2f5d h LYS 128 Cb 0.97 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.22 2f5d h LYS 128 CO 0.09 1.07 -0.11 -0.44 -0.57 0.00 0.00 179.45 179.49 2f5d h ASP 129 N 0.85 0.56 -0.35 0.86 3.32 -1.13 -1.11 116.42 119.42 2f5d h ASP 129 Ca 0.12 -0.15 -0.16 0.00 0.02 0.00 0.00 57.03 56.86 2f5d h ASP 129 Cb 0.76 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 2f5d h ASP 129 CO 0.06 0.71 -0.38 0.25 -1.72 0.00 0.00 179.24 178.16 2f5d h LEU 130 N 0.53 0.96 -1.14 1.55 5.85 -1.14 -2.86 115.31 119.06 2f5d h LEU 130 Ca 0.10 -0.43 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 2f5d h LEU 130 Cb 0.51 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 2f5d h LEU 130 CO 0.03 1.22 0.27 0.50 -0.34 0.00 0.00 178.44 180.11 2f5d h LYS 131 N 0.74 0.87 -0.18 1.25 1.63 -0.81 -2.56 116.57 117.50 2f5d h LYS 131 Ca 0.06 -0.12 0.01 0.00 -0.85 0.00 0.00 60.65 59.75 2f5d h LYS 131 Cb 0.96 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.42 2f5d h LYS 131 CO 0.09 0.69 0.09 0.77 -3.45 0.00 0.00 179.45 177.65 2f5d h SER 132 N 0.86 0.14 -0.55 4.20 0.02 -0.99 -2.06 113.55 115.18 2f5d h SER 132 Ca 0.21 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.16 2f5d h SER 132 Cb 0.13 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 2f5d h SER 132 CO -0.02 0.11 0.33 0.40 -1.14 0.00 0.00 176.83 176.51 2f5d h ILE 133 N 0.20 1.16 0.00 3.27 2.04 -1.33 -0.93 117.51 121.92 2f5d h ILE 133 Ca 0.07 -0.37 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 2f5d h ILE 133 Cb 0.01 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2f5d h ILE 133 CO -0.05 0.17 -0.11 1.56 0.00 0.00 0.00 178.15 179.72 2f5d h GLN 134 N 0.77 0.00 -0.23 2.37 4.20 -0.99 -1.93 115.11 119.30 2f5d h GLN 134 Ca 0.20 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.72 2f5d h GLN 134 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 2f5d h GLN 134 CO -0.04 0.11 -0.61 0.87 -0.67 0.00 0.00 178.83 178.50 2f5d h LYS 135 N 0.00 0.79 0.00 1.46 1.79 -0.69 -3.51 116.57 116.41 2f5d h LYS 135 Ca -0.00 -0.54 0.00 0.00 -2.18 0.00 0.00 60.65 57.93 2f5d h LYS 135 Cb 0.21 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.94 2f5d h LYS 135 CO 0.01 1.17 0.00 1.63 -1.08 0.00 0.00 179.45 181.18