#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m1e s SER 10 N 0.00 -0.14 0.19 4.39 1.04 -1.26 -5.00 113.70 112.92 1m1e s SER 10 Ca 0.00 -0.43 -0.12 0.00 0.48 0.00 0.00 55.95 55.88 1m1e s SER 10 Cb 0.00 0.46 0.16 0.00 0.10 0.00 0.00 66.02 66.74 1m1e s SER 10 CO 0.00 -0.86 1.79 -0.65 0.98 0.00 0.00 173.24 174.49 1m1e h PRO 11 N 2.00 0.51 -0.32 4.02 0.11 -2.05 -0.90 132.00 135.36 1m1e h PRO 11 Ca -0.25 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.89 1m1e h PRO 11 Cb 1.23 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 32.16 1m1e h PRO 11 CO 0.27 0.33 -0.08 1.49 -0.21 0.00 0.00 178.00 179.81 1m1e h GLU 12 N 0.52 -0.00 -0.35 1.05 4.81 -2.00 -0.78 114.58 117.83 1m1e h GLU 12 Ca 0.24 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.39 1m1e h GLU 12 Cb 0.16 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1m1e h GLU 12 CO -0.17 -0.00 -0.12 0.93 -0.73 0.00 0.00 179.01 178.92 1m1e h GLU 13 N -0.00 0.61 -0.56 1.92 5.08 -1.84 -2.45 114.58 117.35 1m1e h GLU 13 Ca 0.15 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1m1e h GLU 13 Cb 0.24 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1m1e h GLU 13 CO -0.33 0.72 0.29 0.52 -1.00 0.00 0.00 179.01 179.20 1m1e h MET 14 N 0.56 0.79 -0.21 2.33 2.86 -0.47 -1.61 114.93 119.17 1m1e h MET 14 Ca 0.10 -0.10 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 1m1e h MET 14 Cb 0.54 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 1m1e h MET 14 CO 0.03 0.63 -0.06 -0.92 1.06 0.00 0.00 176.91 177.65 1m1e h TYR 15 N 0.75 -0.12 -0.04 -0.22 3.20 -0.83 -1.21 116.97 118.49 1m1e h TYR 15 Ca 0.19 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.10 1m1e h TYR 15 Cb 0.08 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 1m1e h TYR 15 CO -0.01 -0.10 -0.04 0.82 -1.64 0.00 0.00 178.16 177.20 1m1e h ILE 16 N -0.01 0.89 -0.71 1.81 2.04 -1.13 -0.35 117.51 120.05 1m1e h ILE 16 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1m1e h ILE 16 Cb 0.16 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 1m1e h ILE 16 CO -0.22 0.00 0.46 1.56 0.00 0.00 0.00 178.15 179.95 1m1e h GLN 17 N -0.05 0.94 -0.27 2.37 4.20 -1.07 -0.71 115.11 120.52 1m1e h GLN 17 Ca 0.03 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 1m1e h GLN 17 Cb 0.09 -0.21 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 1m1e h GLN 17 CO -0.07 0.63 -0.35 1.96 -0.67 0.00 0.00 178.83 180.33 1m1e h GLN 18 N 0.97 0.70 -0.63 1.46 4.20 -0.90 -2.07 115.11 118.83 1m1e h GLN 18 Ca 0.26 -0.40 -0.07 0.00 0.06 0.00 0.00 58.65 58.49 1m1e h GLN 18 Cb -0.09 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.69 1m1e h GLN 18 CO -0.05 1.02 0.12 -0.22 -0.67 0.00 0.00 178.83 179.03 1m1e h LYS 19 N 0.44 1.04 -0.43 1.46 3.64 -0.70 -0.63 116.57 121.38 1m1e h LYS 19 Ca 0.03 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.13 1m1e h LYS 19 Cb 0.93 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.61 1m1e h LYS 19 CO 0.08 0.96 0.21 0.28 -2.27 0.00 0.00 179.45 178.71 1m1e h VAL 20 N 0.95 1.17 -0.31 2.00 2.07 -1.12 -0.55 116.25 120.46 1m1e h VAL 20 Ca 0.19 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1m1e h VAL 20 Cb 0.41 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1m1e h VAL 20 CO 0.01 0.18 0.17 -0.09 0.02 0.00 0.00 177.57 177.86 1m1e h ARG 21 N 0.55 0.44 -0.31 1.57 2.43 -1.11 -1.28 114.38 116.66 1m1e h ARG 21 Ca 0.15 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1m1e h ARG 21 Cb 0.10 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 1m1e h ARG 21 CO -0.02 0.38 0.16 0.28 -1.51 0.00 0.00 179.97 179.26 1m1e h VAL 22 N 0.38 1.14 -0.60 0.20 2.07 -0.93 -1.69 116.25 116.82 1m1e h VAL 22 Ca 0.11 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1m1e h VAL 22 Cb 0.07 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1m1e h VAL 22 CO -0.02 0.14 0.36 -0.07 0.02 0.00 0.00 177.57 178.00 1m1e h LEU 23 N 0.38 0.72 -0.71 2.57 3.38 -0.96 0.16 115.31 120.86 1m1e h LEU 23 Ca 0.11 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1m1e h LEU 23 Cb 0.08 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1m1e h LEU 23 CO -0.02 0.57 0.32 -0.07 0.09 0.00 0.00 178.44 179.33 1m1e h LEU 24 N 0.81 0.95 -0.54 1.67 3.38 -1.11 -1.43 115.31 119.04 1m1e h LEU 24 Ca 0.21 -0.15 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 1m1e h LEU 24 Cb -0.02 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1m1e h LEU 24 CO -0.04 0.84 -0.21 -0.03 0.09 0.00 0.00 178.44 179.09 1m1e h MET 25 N 1.00 0.96 -0.71 1.13 4.05 -0.92 -1.85 114.93 118.59 1m1e h MET 25 Ca 0.24 -0.40 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 1m1e h MET 25 Cb 0.16 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 30.89 1m1e h MET 25 CO -0.03 1.07 0.40 1.25 0.23 0.00 0.00 176.91 179.84 1m1e h LEU 26 N 0.84 0.88 -0.68 3.39 5.85 -0.34 0.21 115.31 125.45 1m1e h LEU 26 Ca 0.11 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 1m1e h LEU 26 Cb 0.77 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1m1e h LEU 26 CO 0.06 0.71 -0.11 -0.09 -0.34 0.00 0.00 178.44 178.68 1m1e h ARG 27 N 0.98 0.91 -0.07 1.25 2.43 -1.16 -2.29 114.38 116.43 1m1e h ARG 27 Ca 0.25 -0.32 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 1m1e h ARG 27 Cb 0.02 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1m1e h ARG 27 CO -0.04 0.97 -0.22 -0.22 -1.51 0.00 0.00 179.97 178.94 1m1e h LYS 28 N 0.82 0.12 0.00 0.20 3.64 -0.71 -1.38 116.57 119.26 1m1e h LYS 28 Ca 0.13 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1m1e h LYS 28 Cb 0.63 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1m1e h LYS 28 CO 0.04 0.35 0.00 -1.33 -2.27 0.00 0.00 179.45 176.24 1m1e n MET 29 N -4.22 0.98 -0.23 1.90 2.81 0.00 -4.90 117.12 113.47 1m1e n MET 29 Ca -0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 1m1e n MET 29 Cb 0.31 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 1m1e n MET 29 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1m1e n GLY 30 N 0.97 0.76 3.87 3.03 0.00 -0.52 -5.07 105.19 108.23 1m1e n GLY 30 Ca 0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.92 1m1e n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m1e s SER 31 N -2.46 6.62 0.46 1.61 0.01 -0.90 -5.02 113.70 114.01 1m1e s SER 31 Ca 0.00 0.78 -0.20 0.00 1.31 0.00 0.00 55.95 57.85 1m1e s SER 31 Cb 0.00 -2.17 -0.10 0.00 0.21 0.00 0.00 66.02 63.96 1m1e s SER 31 CO 0.00 0.10 0.97 0.20 0.41 0.00 0.00 173.24 174.92 1m1e s ASN 32 N -2.00 6.77 0.16 2.44 0.01 -1.26 -4.03 114.94 117.03 1m1e s ASN 32 Ca 0.37 1.69 0.03 0.00 -0.71 0.00 0.00 52.86 54.24 1m1e s ASN 32 Cb -0.13 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 38.96 1m1e s ASN 32 CO 0.20 -0.48 0.25 -0.76 -1.51 0.00 0.00 177.10 174.80 1m1e s LEU 33 N -3.46 4.19 0.87 0.60 1.43 -1.26 -4.98 118.68 116.07 1m1e s LEU 33 Ca 0.62 0.08 -0.13 0.00 -1.03 0.00 0.00 54.13 53.67 1m1e s LEU 33 Cb -0.10 -2.77 0.12 0.00 0.03 0.00 0.00 46.19 43.47 1m1e s LEU 33 CO 0.19 0.05 1.21 0.42 0.23 0.00 0.00 176.35 178.44 1m1e s THR 34 N -1.77 1.99 0.17 5.49 -4.23 -1.26 -4.87 115.64 111.17 1m1e s THR 34 Ca 0.34 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.73 1m1e s THR 34 Cb -0.11 -2.95 0.07 0.00 1.34 0.00 0.00 72.50 70.86 1m1e s THR 34 CO 0.27 0.00 1.69 0.00 -0.54 0.00 0.00 174.62 176.04 1m1e h ALA 35 N -1.30 0.79 -0.07 3.99 0.00 -1.99 -1.84 119.26 118.84 1m1e h ALA 35 Ca -0.46 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.15 1m1e h ALA 35 Cb 1.31 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1m1e h ALA 35 CO 0.58 0.48 -0.29 0.66 0.00 0.00 0.00 179.25 180.68 1m1e h SER 36 N 0.86 0.12 -0.26 0.00 4.64 -1.99 -1.93 113.55 115.00 1m1e h SER 36 Ca 0.19 -0.04 -0.15 0.00 -0.47 0.00 0.00 61.79 61.32 1m1e h SER 36 Cb 0.33 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1m1e h SER 36 CO -0.00 0.42 -0.43 -0.33 -0.87 0.00 0.00 176.83 175.62 1m1e h GLU 37 N 0.11 0.74 -0.80 4.77 5.08 -1.84 0.40 114.58 123.05 1m1e h GLU 37 Ca 0.02 -0.46 0.03 0.00 -1.00 0.00 0.00 59.36 57.94 1m1e h GLU 37 Cb 0.58 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 1m1e h GLU 37 CO 0.04 1.08 0.52 0.93 -1.00 0.00 0.00 179.01 180.58 1m1e h GLU 38 N 0.48 0.99 -0.27 2.33 4.39 -1.11 0.14 114.58 121.52 1m1e h GLU 38 Ca 0.02 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 1m1e h GLU 38 Cb 1.03 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.45 1m1e h GLU 38 CO 0.10 0.65 0.13 1.49 -1.16 0.00 0.00 179.01 180.22 1m1e h GLU 39 N 1.02 0.39 -0.48 2.33 4.57 -1.21 -2.43 114.58 118.78 1m1e h GLU 39 Ca 0.31 -0.06 0.07 0.00 -1.18 0.00 0.00 59.36 58.51 1m1e h GLU 39 Cb -0.02 -0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 28.44 1m1e h GLU 39 CO -0.10 0.38 0.14 0.35 -1.18 0.00 0.00 179.01 178.60 1m1e h PHE 40 N 0.30 0.24 0.00 0.92 3.57 -0.06 0.39 116.94 122.30 1m1e h PHE 40 Ca 0.09 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 1m1e h PHE 40 Cb 0.12 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.83 1m1e h PHE 40 CO -0.02 0.06 -0.07 -0.07 -2.23 0.00 0.00 178.31 175.98 1m1e h LEU 41 N 0.29 0.00 0.02 0.59 3.38 -0.74 -1.20 115.31 117.64 1m1e h LEU 41 Ca 0.23 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1m1e h LEU 41 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1m1e h LEU 41 CO -0.27 0.07 -0.13 0.03 0.09 0.00 0.00 178.44 178.23 1m1e h ARG 42 N 0.00 0.05 -1.01 1.13 3.08 -0.55 -2.48 114.38 114.60 1m1e h ARG 42 Ca -0.00 -0.08 0.16 0.00 0.07 0.00 0.00 59.98 60.13 1m1e h ARG 42 Cb 0.18 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.16 1m1e h ARG 42 CO 0.01 0.99 0.62 1.15 -1.07 0.00 0.00 179.97 181.67 1m1e h THR 43 N -0.84 0.79 -1.14 2.04 2.02 -0.57 -2.15 112.91 113.05 1m1e h THR 43 Ca -0.02 -0.29 -0.62 0.00 0.77 0.00 0.00 66.41 66.25 1m1e h THR 43 Cb 1.05 -0.14 -0.37 0.00 -1.74 0.00 0.00 68.15 66.95 1m1e h THR 43 CO 0.02 0.16 -0.13 -1.22 0.37 0.00 0.00 175.52 174.72 1m1e n TYR 44 N -4.71 3.05 0.10 3.16 4.02 -0.49 -4.72 117.16 117.56 1m1e n TYR 44 Ca 0.22 -2.63 0.09 0.00 -0.01 0.00 0.00 57.90 55.57 1m1e n TYR 44 Cb 0.49 -0.68 0.57 0.00 -0.02 0.00 0.00 39.34 39.70 1m1e n TYR 44 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1m1e h ALA 45 N 2.33 1.99 0.05 -0.72 0.00 -0.90 -0.90 119.26 121.11 1m1e h ALA 45 Ca 0.44 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.35 1m1e h ALA 45 Cb 1.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1m1e h ALA 45 CO 1.08 -0.04 -0.07 0.78 0.00 0.00 0.00 179.25 181.00 1m1e h GLY 46 N 0.22 -0.13 1.27 0.00 0.00 -1.85 0.29 103.07 102.86 1m1e h GLY 46 Ca 0.12 0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.49 1m1e h GLY 46 CO -0.02 -0.08 0.25 -2.08 0.00 0.00 0.00 176.54 174.61 1m1e h VAL 47 N -0.15 1.23 0.53 4.60 2.07 -1.68 0.56 116.25 123.40 1m1e h VAL 47 Ca 0.01 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 1m1e h VAL 47 Cb 0.16 0.47 0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1m1e h VAL 47 CO -0.03 0.28 -0.25 0.58 0.02 0.00 0.00 177.57 178.17 1m1e h VAL 48 N 0.92 0.48 -0.40 2.57 2.07 -0.50 -0.41 116.25 120.98 1m1e h VAL 48 Ca 0.22 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.69 1m1e h VAL 48 Cb 0.19 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1m1e h VAL 48 CO -0.02 0.00 0.16 0.78 0.02 0.00 0.00 177.57 178.52 1m1e h ASN 49 N -0.73 0.51 -0.92 0.57 2.35 -0.30 0.49 115.58 117.56 1m1e h ASN 49 Ca -0.07 -0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.62 1m1e h ASN 49 Cb 0.55 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.75 1m1e h ASN 49 CO 0.12 0.47 0.54 -1.28 -1.65 0.00 0.00 177.43 175.63 1m1e h SER 50 N 0.57 1.11 0.77 5.81 0.87 -0.48 -2.68 113.55 119.51 1m1e h SER 50 Ca 0.14 -0.07 -0.25 0.00 -1.23 0.00 0.00 61.79 60.38 1m1e h SER 50 Cb 0.12 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.76 1m1e h SER 50 CO -0.01 0.86 -1.30 1.56 -0.53 0.00 0.00 176.83 177.41 1m1e h GLN 51 N 1.27 0.02 0.00 2.24 4.20 -0.11 -3.24 115.11 119.49 1m1e h GLN 51 Ca 0.33 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.00 1m1e h GLN 51 Cb -0.03 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1m1e h GLN 51 CO -0.06 0.83 0.05 -0.07 -0.67 0.00 0.00 178.83 178.91 1m1e h LEU 52 N 0.01 0.00 -4.17 1.46 -0.00 0.28 -0.26 115.31 112.62 1m1e h LEU 52 Ca -0.13 0.00 -0.63 0.00 -0.00 0.00 0.00 57.88 57.12 1m1e h LEU 52 Cb 1.88 0.00 -0.36 0.00 -0.00 0.00 0.00 40.66 42.18 1m1e h LEU 52 CO 0.12 0.00 0.01 -1.20 -0.00 0.00 0.00 178.44 177.36 1m1e n SER 53 N -2.35 6.14 0.00 -0.43 7.64 -1.11 -5.06 113.62 118.45 1m1e n SER 53 Ca -0.02 -3.77 0.00 0.00 1.01 0.00 0.00 58.87 56.09 1m1e n SER 53 Cb 0.08 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1m1e n SER 53 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1m1e n GLN 54 N -0.70 0.00 -3.07 1.43 6.02 -0.11 -5.05 117.38 115.90 1m1e n GLN 54 Ca 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.49 1m1e n GLN 54 Cb 0.70 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.96 1m1e n GLN 54 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 1m1e n ILE 60 N -0.35 0.00 0.00 5.09 -0.00 -1.26 -5.11 119.36 117.72 1m1e n ILE 60 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1m1e n ILE 60 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1m1e n ILE 60 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 1m1e n ASP 61 N 0.00 0.00 -1.10 4.38 -0.08 -1.26 -4.72 116.55 113.77 1m1e n ASP 61 Ca 0.00 0.00 -0.06 0.00 -1.51 0.00 0.00 54.79 53.22 1m1e n ASP 61 Cb 0.00 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.47 1m1e n ASP 61 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1m1e n GLN 62 N 0.00 -1.56 0.00 -0.67 1.13 -1.26 -5.04 117.38 109.99 1m1e n GLN 62 Ca 0.00 0.26 0.00 0.00 -1.94 0.00 0.00 57.00 55.32 1m1e n GLN 62 Cb 0.00 -3.73 0.00 0.00 0.11 0.00 0.00 30.24 26.62 1m1e n GLN 62 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1m1e n GLY 63 N -0.96 0.49 2.34 1.08 0.00 -1.26 -4.81 105.19 102.06 1m1e n GLY 63 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 1m1e n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m1e n ALA 64 N -3.00 1.75 -1.67 4.61 0.00 -1.26 -4.90 120.51 116.04 1m1e n ALA 64 Ca 0.00 -0.20 -0.46 0.00 0.00 0.00 0.00 53.44 52.78 1m1e n ALA 64 Cb 0.00 -2.18 -0.04 0.00 0.00 0.00 0.00 19.45 17.22 1m1e n ALA 64 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1m1e n GLU 65 N 2.74 2.21 -2.92 0.00 -0.58 -1.26 -4.95 120.64 115.88 1m1e n GLU 65 Ca 0.05 0.80 -0.37 0.00 -0.42 0.00 0.00 57.16 57.21 1m1e n GLU 65 Cb 0.11 -2.58 -0.06 0.00 -0.57 0.00 0.00 31.44 28.35 1m1e n GLU 65 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1m1e s ASP 66 N 1.01 7.27 -0.15 1.62 1.01 -1.26 -5.07 116.67 121.09 1m1e s ASP 66 Ca 0.79 1.67 0.01 0.00 0.71 0.00 0.00 52.55 55.72 1m1e s ASP 66 Cb -0.66 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 40.76 1m1e s ASP 66 CO 0.38 0.03 -0.17 -0.69 0.21 0.00 0.00 175.17 174.92 1m1e s VAL 67 N -1.48 2.50 0.60 -1.27 1.01 -1.26 -5.12 120.40 115.38 1m1e s VAL 67 Ca 0.45 -0.83 -0.17 0.00 0.00 0.00 0.00 61.98 61.43 1m1e s VAL 67 Cb -0.19 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 1m1e s VAL 67 CO 0.24 0.53 1.10 0.68 0.00 0.00 0.00 175.10 177.64 1m1e s VAL 68 N 0.78 3.41 -0.22 2.92 -7.23 -1.26 -5.04 120.40 113.76 1m1e s VAL 68 Ca -0.06 0.74 -0.05 0.00 -1.81 0.00 0.00 61.98 60.79 1m1e s VAL 68 Cb -0.15 -3.25 -0.02 0.00 0.56 0.00 0.00 36.38 33.51 1m1e s VAL 68 CO 0.00 -0.33 -0.00 -0.04 -0.31 0.00 0.00 175.10 174.41 1m1e s MET 69 N -3.80 3.53 -0.74 4.82 -1.94 -1.26 -5.06 119.30 114.85 1m1e s MET 69 Ca 0.68 -0.55 -0.27 0.00 -1.71 0.00 0.00 55.69 53.84 1m1e s MET 69 Cb -0.20 -3.09 0.03 0.00 2.01 0.00 0.00 34.83 33.58 1m1e s MET 69 CO 0.35 -0.10 1.26 0.00 -0.01 0.00 0.00 175.02 176.52 1m1e s ALA 70 N 1.28 2.77 -0.62 3.03 0.00 -1.26 -4.85 121.76 122.11 1m1e s ALA 70 Ca 0.04 -1.41 0.25 0.00 0.00 0.00 0.00 51.96 50.83 1m1e s ALA 70 Cb -0.15 -4.24 0.46 0.00 0.00 0.00 0.00 23.12 19.19 1m1e s ALA 70 CO 0.00 -3.27 1.46 0.74 0.00 0.00 0.00 175.76 174.70 1m1e h PHE 71 N 10.00 0.00 -3.37 0.00 -1.00 -2.06 -3.47 116.94 117.04 1m1e h PHE 71 Ca -0.27 0.00 -0.54 0.00 2.81 0.00 0.00 57.97 59.97 1m1e h PHE 71 Cb 1.05 0.00 0.09 0.00 3.61 0.00 0.00 35.95 40.70 1m1e h PHE 71 CO 1.12 0.00 0.82 0.43 -1.61 0.00 0.00 178.31 179.08 1m1e n SER 72 N -2.29 3.72 -3.46 2.17 7.64 -1.26 -5.01 113.62 115.12 1m1e n SER 72 Ca 0.04 1.17 -0.23 0.00 1.01 0.00 0.00 58.87 60.86 1m1e n SER 72 Cb 0.45 -1.58 -0.12 0.00 -1.01 0.00 0.00 64.21 61.95 1m1e n SER 72 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1m1e s ARG 73 N -0.90 0.29 0.97 1.43 1.81 -1.26 -5.16 118.95 116.12 1m1e s ARG 73 Ca 0.62 -0.38 -0.12 0.00 -1.72 0.00 0.00 55.73 54.13 1m1e s ARG 73 Cb -0.51 -0.90 0.17 0.00 -0.45 0.00 0.00 34.95 33.27 1m1e s ARG 73 CO 0.53 -1.04 1.08 -1.12 -0.68 0.00 0.00 175.30 174.07 1m1e s SER 74 N 2.16 2.77 0.00 0.23 0.01 -1.26 -5.08 113.70 112.53 1m1e s SER 74 Ca 0.10 1.53 0.00 0.00 1.31 0.00 0.00 55.95 58.88 1m1e s SER 74 Cb -0.15 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 63.89 1m1e s SER 74 CO -0.32 -3.09 0.00 -0.62 0.41 0.00 0.00 173.24 169.62 1m1e n GLU 75 N -4.18 2.36 -4.76 12.44 4.71 -1.26 -5.09 120.64 124.86 1m1e n GLU 75 Ca 0.06 0.00 -0.26 0.00 -0.01 0.00 0.00 57.16 56.95 1m1e n GLU 75 Cb 0.55 0.00 -0.15 0.00 -1.01 0.00 0.00 31.44 30.83 1m1e n GLU 75 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 1m1e s THR 76 N 0.11 1.65 0.00 2.62 -4.23 -1.26 -5.09 115.64 109.45 1m1e s THR 76 Ca 0.00 -1.10 0.00 0.00 -1.18 0.00 0.00 61.69 59.41 1m1e s THR 76 Cb 0.00 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.42 1m1e s THR 76 CO 0.00 0.29 0.00 -1.84 -0.54 0.00 0.00 174.62 172.53 1m1e n GLU 77 N 2.08 0.00 0.00 3.99 -0.00 -1.26 -5.38 120.64 120.08 1m1e n GLU 77 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 56.99 1m1e n GLU 77 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.97 1m1e n GLU 77 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66