#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aa7 n SER 2 N 0.00 -1.47 -0.25 7.83 2.88 -1.26 -4.75 113.62 116.59 1aa7 n SER 2 Ca 0.00 1.30 -0.07 0.00 -1.33 0.00 0.00 58.87 58.77 1aa7 n SER 2 Cb 0.00 -4.73 0.05 0.00 -0.75 0.00 0.00 64.21 58.78 1aa7 n SER 2 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1aa7 h LEU 3 N 4.27 1.04 -1.89 2.46 5.85 -2.04 -2.95 115.31 122.04 1aa7 h LEU 3 Ca -0.49 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.02 1aa7 h LEU 3 Cb 1.10 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 1aa7 h LEU 3 CO 0.01 0.98 0.08 -0.07 -0.34 0.00 0.00 178.44 179.10 1aa7 h LEU 4 N 1.05 0.13 -0.68 2.25 3.38 -1.99 0.11 115.31 119.55 1aa7 h LEU 4 Ca 0.23 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.06 1aa7 h LEU 4 Cb 0.32 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1aa7 h LEU 4 CO -0.01 0.10 -0.64 0.71 0.09 0.00 0.00 178.44 178.69 1aa7 h THR 5 N 0.16 1.43 -0.16 0.22 1.35 -1.81 -1.09 112.91 113.00 1aa7 h THR 5 Ca 0.04 -2.22 -0.03 0.00 -0.55 0.00 0.00 66.41 63.65 1aa7 h THR 5 Cb -0.01 2.21 -0.00 0.00 -1.73 0.00 0.00 68.15 68.61 1aa7 h THR 5 CO -0.01 0.63 -0.04 -0.33 -0.25 0.00 0.00 175.52 175.52 1aa7 h GLU 6 N 0.00 0.30 -0.57 4.72 5.08 -0.81 -2.26 114.58 121.05 1aa7 h GLU 6 Ca -0.01 -0.11 0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1aa7 h GLU 6 Cb 1.16 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 30.32 1aa7 h GLU 6 CO 0.08 0.58 0.17 0.28 -1.00 0.00 0.00 179.01 179.12 1aa7 h VAL 7 N 0.01 0.74 -0.90 3.13 2.07 -1.07 -2.18 116.25 118.05 1aa7 h VAL 7 Ca 0.04 -0.11 0.06 0.00 0.82 0.00 0.00 66.70 67.50 1aa7 h VAL 7 Cb 0.46 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 1aa7 h VAL 7 CO 0.02 0.06 0.57 -0.08 0.02 0.00 0.00 177.57 178.15 1aa7 h GLU 8 N 0.33 1.01 -0.68 1.57 4.81 -0.91 -0.34 114.58 120.37 1aa7 h GLU 8 Ca 0.29 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.38 1aa7 h GLU 8 Cb 0.37 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 1aa7 h GLU 8 CO -0.32 0.67 0.13 1.79 -0.73 0.00 0.00 179.01 180.54 1aa7 h THR 9 N 1.04 1.26 -0.56 0.32 1.35 -0.81 0.41 112.91 115.92 1aa7 h THR 9 Ca 0.38 -1.03 -0.08 0.00 -0.55 0.00 0.00 66.41 65.14 1aa7 h THR 9 Cb 0.14 0.60 -0.02 0.00 -1.73 0.00 0.00 68.15 67.15 1aa7 h THR 9 CO -0.16 0.39 0.04 1.88 -0.25 0.00 0.00 175.52 177.42 1aa7 h TYR 10 N 1.05 1.03 -0.51 4.73 0.05 -1.11 -1.07 116.97 121.14 1aa7 h TYR 10 Ca 0.21 -0.16 -0.11 0.00 0.05 0.00 0.00 58.73 58.72 1aa7 h TYR 10 Cb 0.43 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.87 1aa7 h TYR 10 CO 0.03 0.92 -0.09 0.28 -1.05 0.00 0.00 178.16 178.25 1aa7 h VAL 11 N 0.85 1.27 0.00 -2.88 2.07 -0.83 -3.03 116.25 113.69 1aa7 h VAL 11 Ca 0.16 -1.23 -0.11 0.00 0.82 0.00 0.00 66.70 66.34 1aa7 h VAL 11 Cb 0.48 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1aa7 h VAL 11 CO 0.02 0.43 -0.51 -0.07 0.02 0.00 0.00 177.57 177.47 1aa7 h LEU 12 N 0.83 0.00 -2.40 2.57 3.38 -0.75 -3.21 115.31 115.74 1aa7 h LEU 12 Ca 0.13 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1aa7 h LEU 12 Cb 0.65 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 1aa7 h LEU 12 CO 0.04 0.51 0.18 0.77 0.09 0.00 0.00 178.44 180.03 1aa7 h SER 13 N 0.00 0.00 0.11 -0.43 4.64 -1.06 -1.34 113.55 115.46 1aa7 h SER 13 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1aa7 h SER 13 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1aa7 h SER 13 CO 0.07 0.00 -0.56 2.30 -0.87 0.00 0.00 176.83 177.76 1aa7 n ILE 14 N -3.32 0.00 -3.35 0.95 -5.35 -1.21 -4.83 119.36 102.26 1aa7 n ILE 14 Ca -0.01 -0.13 -0.38 0.00 -0.27 0.00 0.00 62.75 61.96 1aa7 n ILE 14 Cb 0.26 0.87 -0.06 0.00 -1.74 0.00 0.00 39.64 38.98 1aa7 n ILE 14 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1aa7 s ILE 15 N -2.68 4.96 0.33 7.28 1.01 -0.51 -5.03 121.20 126.56 1aa7 s ILE 15 Ca 0.16 1.04 -0.29 0.00 0.00 0.00 0.00 60.65 61.57 1aa7 s ILE 15 Cb 0.18 -3.83 -0.10 0.00 0.01 0.00 0.00 42.46 38.72 1aa7 s ILE 15 CO 0.65 0.49 1.37 -2.16 0.00 0.00 0.00 174.94 175.29 1aa7 s PRO 16 N -0.57 4.29 0.28 2.79 0.04 -1.26 -4.93 135.00 135.64 1aa7 s PRO 16 Ca 0.27 2.31 -0.30 0.00 0.04 0.00 0.00 61.00 63.32 1aa7 s PRO 16 Cb -0.17 -3.05 -0.12 0.00 0.04 0.00 0.00 34.50 31.20 1aa7 s PRO 16 CO 0.15 -0.30 1.58 0.43 0.04 0.00 0.00 177.00 178.90 1aa7 n SER 17 N 0.94 3.75 0.00 6.66 7.64 -1.26 -4.34 113.62 127.00 1aa7 n SER 17 Ca 0.01 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1aa7 n SER 17 Cb 0.41 -1.57 0.00 0.00 -1.01 0.00 0.00 64.21 62.03 1aa7 n SER 17 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aa7 n GLY 18 N 2.23 -1.82 0.27 0.23 0.00 -1.26 -4.93 105.19 99.91 1aa7 n GLY 18 Ca 0.09 -1.24 -0.00 0.00 0.00 0.00 0.00 46.02 44.86 1aa7 n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1aa7 h PRO 19 N 0.00 0.51 -0.39 1.61 0.13 -1.99 -2.46 132.00 129.40 1aa7 h PRO 19 Ca 0.00 -0.12 -0.03 0.00 -0.87 0.00 0.00 66.00 64.99 1aa7 h PRO 19 Cb 0.00 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.04 1aa7 h PRO 19 CO 0.00 0.56 0.13 1.25 -0.23 0.00 0.00 178.00 179.71 1aa7 h LEU 20 N 0.48 0.56 -2.70 1.56 6.46 -1.93 0.13 115.31 119.88 1aa7 h LEU 20 Ca 0.10 -0.20 -0.00 0.00 -0.12 0.00 0.00 57.88 57.66 1aa7 h LEU 20 Cb 0.36 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.15 1aa7 h LEU 20 CO 0.01 0.61 -0.01 0.50 -0.62 0.00 0.00 178.44 178.94 1aa7 h LYS 21 N 0.48 0.00 0.07 1.25 3.64 -1.64 0.16 116.57 120.53 1aa7 h LYS 21 Ca 0.13 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.39 1aa7 h LYS 21 Cb 0.24 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1aa7 h LYS 21 CO -0.01 0.01 -0.48 0.00 -2.27 0.00 0.00 179.45 176.70 1aa7 h ALA 22 N 1.99 -0.03 -0.66 5.00 0.00 -0.76 -2.71 119.26 122.10 1aa7 h ALA 22 Ca -0.00 -0.60 0.01 0.00 0.00 0.00 0.00 54.91 54.32 1aa7 h ALA 22 Cb 0.08 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1aa7 h ALA 22 CO 0.00 0.22 0.44 0.93 0.00 0.00 0.00 179.25 180.84 1aa7 h GLU 23 N -0.55 0.87 -0.05 0.00 3.07 0.69 -1.74 114.58 116.87 1aa7 h GLU 23 Ca -0.08 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.73 1aa7 h GLU 23 Cb 1.34 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 29.05 1aa7 h GLU 23 CO 0.09 0.57 0.03 0.82 -1.40 0.00 0.00 179.01 179.12 1aa7 h ILE 24 N 0.89 1.10 -0.92 3.13 2.04 -0.87 -2.36 117.51 120.52 1aa7 h ILE 24 Ca 0.24 -0.29 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1aa7 h ILE 24 Cb -0.10 1.20 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 1aa7 h ILE 24 CO -0.05 0.08 0.61 0.00 0.00 0.00 0.00 178.15 178.79 1aa7 h ALA 25 N 0.91 1.18 -0.48 1.87 0.00 -1.34 -0.60 119.26 120.80 1aa7 h ALA 25 Ca 0.02 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1aa7 h ALA 25 Cb 0.11 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1aa7 h ALA 25 CO -0.00 0.55 0.29 0.37 0.00 0.00 0.00 179.25 180.46 1aa7 h GLN 26 N 1.24 0.64 -0.22 0.00 5.75 -1.26 -1.87 115.11 119.40 1aa7 h GLN 26 Ca 0.34 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.78 1aa7 h GLN 26 Cb -0.12 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.28 1aa7 h GLN 26 CO -0.08 0.46 0.10 0.00 -2.65 0.00 0.00 178.83 176.66 1aa7 h ARG 27 N 0.64 0.31 0.35 1.69 3.08 -0.80 -1.60 114.38 118.05 1aa7 h ARG 27 Ca 0.17 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 1aa7 h ARG 27 Cb -0.02 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1aa7 h ARG 27 CO -0.03 0.33 -0.33 -0.07 -1.07 0.00 0.00 179.97 178.79 1aa7 h LEU 28 N 0.22 -0.89 -0.83 3.04 3.38 -1.02 -1.42 115.31 117.78 1aa7 h LEU 28 Ca 0.07 0.08 0.18 0.00 0.09 0.00 0.00 57.88 58.30 1aa7 h LEU 28 Cb 0.12 0.30 -0.11 0.00 0.09 0.00 0.00 40.66 41.06 1aa7 h LEU 28 CO -0.01 -0.47 0.34 -0.33 0.09 0.00 0.00 178.44 178.06 1aa7 h GLU 29 N -0.70 0.42 -0.34 1.13 5.08 -1.27 0.27 114.58 119.16 1aa7 h GLU 29 Ca -0.02 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 1aa7 h GLU 29 Cb 0.63 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1aa7 h GLU 29 CO -0.05 0.28 -0.04 -0.44 -1.00 0.00 0.00 179.01 177.76 1aa7 h ASP 30 N 0.43 0.62 0.08 1.42 3.32 -0.88 -0.08 116.42 121.34 1aa7 h ASP 30 Ca 0.49 -0.33 -0.14 0.00 0.02 0.00 0.00 57.03 57.06 1aa7 h ASP 30 Cb 0.83 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1aa7 h ASP 30 CO -0.47 0.81 -0.49 -0.37 -1.72 0.00 0.00 179.24 177.00 1aa7 h VAL 31 N 0.42 1.32 -0.46 -1.35 -1.51 -0.17 -1.14 116.25 113.37 1aa7 h VAL 31 Ca 0.09 -1.70 -0.04 0.00 -1.23 0.00 0.00 66.70 63.82 1aa7 h VAL 31 Cb 0.51 1.72 -0.02 0.00 -2.13 0.00 0.00 31.29 31.36 1aa7 h VAL 31 CO 0.02 0.52 0.13 -0.26 -1.23 0.00 0.00 177.57 176.76 1aa7 h PHE 32 N 0.37 0.68 0.00 5.19 0.04 -0.33 -0.18 116.94 122.72 1aa7 h PHE 32 Ca 0.02 -0.05 0.00 0.00 2.80 0.00 0.00 57.97 60.74 1aa7 h PHE 32 Cb 0.99 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 38.93 1aa7 h PHE 32 CO 0.03 0.58 0.00 0.00 -0.60 0.00 0.00 178.31 178.32 1aa7 n ALA 33 N -2.47 2.40 0.00 2.45 0.00 -0.06 -4.92 120.51 117.91 1aa7 n ALA 33 Ca 0.03 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1aa7 n ALA 33 Cb 0.19 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1aa7 n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aa7 n GLY 34 N 1.09 0.47 3.57 0.00 0.00 -0.08 -5.03 105.19 105.21 1aa7 n GLY 34 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 1aa7 n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aa7 s LYS 35 N -0.92 2.87 -0.04 1.61 -0.14 -0.46 -4.90 119.74 117.75 1aa7 s LYS 35 Ca 0.00 0.93 -0.30 0.00 -1.36 0.00 0.00 55.97 55.24 1aa7 s LYS 35 Cb 0.00 -4.32 -0.08 0.00 -1.68 0.00 0.00 37.83 31.75 1aa7 s LYS 35 CO 0.00 -2.43 2.05 -1.71 -0.76 0.00 0.00 175.35 172.49 1aa7 n ASN 36 N 11.96 3.87 -4.76 2.83 5.15 -1.26 -4.35 115.26 128.71 1aa7 n ASN 36 Ca 0.22 0.70 -0.25 0.00 -0.60 0.00 0.00 54.58 54.65 1aa7 n ASN 36 Cb 0.50 -1.53 -0.06 0.00 -0.53 0.00 0.00 39.78 38.17 1aa7 n ASN 36 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1aa7 s THR 37 N 5.57 4.20 -0.68 -0.44 2.01 -1.26 -5.03 115.64 120.00 1aa7 s THR 37 Ca 0.93 -1.29 -0.27 0.00 0.31 0.00 0.00 61.69 61.37 1aa7 s THR 37 Cb -0.42 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 68.93 1aa7 s THR 37 CO 0.41 -0.17 1.59 -0.62 -0.69 0.00 0.00 174.62 175.13 1aa7 s ASP 38 N -3.23 5.70 0.44 3.53 -1.08 -1.26 -4.82 116.67 115.95 1aa7 s ASP 38 Ca 0.30 -0.07 0.16 0.00 -0.52 0.00 0.00 52.55 52.42 1aa7 s ASP 38 Cb -0.09 -2.54 1.08 0.00 -1.46 0.00 0.00 42.92 39.91 1aa7 s ASP 38 CO 0.22 -2.12 1.95 0.25 0.52 0.00 0.00 175.17 175.99 1aa7 h LEU 39 N 14.82 0.34 -0.80 -1.34 5.85 -1.90 -0.02 115.31 132.26 1aa7 h LEU 39 Ca -0.26 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 1aa7 h LEU 39 Cb 1.11 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.05 1aa7 h LEU 39 CO 1.25 0.19 0.28 -0.08 -0.34 0.00 0.00 178.44 179.74 1aa7 h GLU 40 N 0.37 1.18 -0.22 1.25 4.81 -1.90 0.22 114.58 120.29 1aa7 h GLU 40 Ca 0.32 -0.23 -0.12 0.00 -0.13 0.00 0.00 59.36 59.20 1aa7 h GLU 40 Cb 0.75 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.94 1aa7 h GLU 40 CO -0.09 0.97 -0.34 0.28 -0.73 0.00 0.00 179.01 179.10 1aa7 h VAL 41 N 1.14 1.32 -0.08 0.32 2.07 -1.46 -2.66 116.25 116.90 1aa7 h VAL 41 Ca 0.26 -1.55 0.00 0.00 0.82 0.00 0.00 66.70 66.23 1aa7 h VAL 41 Cb 0.26 1.79 -0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1aa7 h VAL 41 CO -0.02 0.48 0.05 0.25 0.02 0.00 0.00 177.57 178.36 1aa7 h LEU 42 N 0.30 0.09 -0.96 2.57 6.46 -0.80 -2.27 115.31 120.71 1aa7 h LEU 42 Ca 0.02 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.75 1aa7 h LEU 42 Cb 0.93 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 40.79 1aa7 h LEU 42 CO 0.08 0.07 0.45 0.24 -0.62 0.00 0.00 178.44 178.66 1aa7 h MET 43 N 0.10 1.19 -0.66 1.25 2.86 -0.61 -1.25 114.93 117.82 1aa7 h MET 43 Ca 0.03 -0.15 -0.09 0.00 -2.06 0.00 0.00 59.70 57.44 1aa7 h MET 43 Cb -0.01 -0.23 -0.02 0.00 0.06 0.00 0.00 31.60 31.40 1aa7 h MET 43 CO -0.01 0.88 0.07 1.49 1.06 0.00 0.00 176.91 180.40 1aa7 h GLU 44 N 1.19 1.11 0.18 1.72 4.57 -1.35 0.20 114.58 122.20 1aa7 h GLU 44 Ca 0.30 -0.32 -0.01 0.00 -1.18 0.00 0.00 59.36 58.15 1aa7 h GLU 44 Cb 0.05 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 1aa7 h GLU 44 CO -0.04 1.04 -0.09 2.35 -1.18 0.00 0.00 179.01 181.08 1aa7 h TRP 45 N 1.03 -0.23 0.11 0.92 7.01 -1.00 -0.08 115.95 123.71 1aa7 h TRP 45 Ca 0.19 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.20 1aa7 h TRP 45 Cb 0.49 0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.60 1aa7 h TRP 45 CO 0.04 -0.07 -0.19 -0.07 -2.79 0.00 0.00 178.44 175.36 1aa7 h LEU 46 N -0.34 -0.52 -0.67 0.65 3.38 -1.11 -1.96 115.31 114.75 1aa7 h LEU 46 Ca -0.03 0.06 0.15 0.00 0.09 0.00 0.00 57.88 58.15 1aa7 h LEU 46 Cb 0.26 0.20 -0.11 0.00 0.09 0.00 0.00 40.66 41.09 1aa7 h LEU 46 CO 0.04 -0.27 0.01 0.50 0.09 0.00 0.00 178.44 178.81 1aa7 h LYS 47 N -0.36 0.11 -0.13 1.13 3.64 -0.78 -1.58 116.57 118.61 1aa7 h LYS 47 Ca 0.02 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1aa7 h LYS 47 Cb 0.38 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1aa7 h LYS 47 CO -0.10 0.08 0.00 0.25 -2.27 0.00 0.00 179.45 177.40 1aa7 n THR 48 N -5.30 0.16 -2.45 1.00 -2.24 -0.06 -4.92 114.28 100.49 1aa7 n THR 48 Ca 0.11 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 1aa7 n THR 48 Cb 0.40 0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 1aa7 n THR 48 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1aa7 s ARG 49 N -1.84 4.40 1.00 -0.78 1.81 -0.60 -5.03 118.95 117.92 1aa7 s ARG 49 Ca 0.22 1.72 -0.16 0.00 -1.72 0.00 0.00 55.73 55.79 1aa7 s ARG 49 Cb 0.11 -3.44 0.20 0.00 -0.45 0.00 0.00 34.95 31.37 1aa7 s ARG 49 CO 0.17 -0.33 1.25 -1.25 -0.68 0.00 0.00 175.30 174.46 1aa7 s PRO 50 N 1.55 0.39 0.00 3.54 0.04 -1.26 -4.16 135.00 135.10 1aa7 s PRO 50 Ca 0.57 -0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.39 1aa7 s PRO 50 Cb -0.27 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1aa7 s PRO 50 CO 0.26 -2.61 0.00 0.44 0.04 0.00 0.00 177.00 175.13 1aa7 n ILE 51 N -3.95 0.00 -1.99 0.56 -5.35 -1.26 -4.93 119.36 102.44 1aa7 n ILE 51 Ca 0.13 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 62.20 1aa7 n ILE 51 Cb 0.60 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.47 1aa7 n ILE 51 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1aa7 s LEU 52 N 0.00 4.38 0.59 7.28 1.43 -1.26 -4.99 118.68 126.12 1aa7 s LEU 52 Ca 0.00 2.70 -0.16 0.00 -1.03 0.00 0.00 54.13 55.64 1aa7 s LEU 52 Cb 0.00 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.56 1aa7 s LEU 52 CO 0.00 -0.72 1.06 -0.94 0.23 0.00 0.00 176.35 175.99 1aa7 s SER 53 N 0.34 5.76 0.52 2.29 1.04 -1.26 -4.85 113.70 117.54 1aa7 s SER 53 Ca 0.59 1.85 0.17 0.00 0.48 0.00 0.00 55.95 59.04 1aa7 s SER 53 Cb -0.42 -2.54 1.30 0.00 0.10 0.00 0.00 66.02 64.45 1aa7 s SER 53 CO 0.44 -1.18 2.15 -0.65 0.98 0.00 0.00 173.24 174.98 1aa7 h PRO 54 N 0.51 0.00 0.00 4.02 0.11 -1.98 -0.35 132.00 134.30 1aa7 h PRO 54 Ca -0.47 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.64 1aa7 h PRO 54 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1aa7 h PRO 54 CO 0.57 0.00 -0.00 1.25 -0.21 0.00 0.00 178.00 179.61 1aa7 h LEU 55 N 0.00 -0.00 -0.68 2.35 6.46 -1.91 -1.65 115.31 119.88 1aa7 h LEU 55 Ca 0.01 -0.41 0.06 0.00 -0.12 0.00 0.00 57.88 57.43 1aa7 h LEU 55 Cb 0.04 0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 39.92 1aa7 h LEU 55 CO -0.00 0.41 0.37 0.74 -0.62 0.00 0.00 178.44 179.34 1aa7 h THR 56 N -0.41 0.95 -0.07 1.05 2.02 -1.70 -1.13 112.91 113.63 1aa7 h THR 56 Ca -0.00 -0.23 -0.05 0.00 0.77 0.00 0.00 66.41 66.89 1aa7 h THR 56 Cb 0.41 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 1aa7 h THR 56 CO 0.00 0.12 -0.21 0.11 0.37 0.00 0.00 175.52 175.91 1aa7 h LYS 57 N 0.68 0.11 -0.25 6.66 1.57 -1.02 -1.28 116.57 123.05 1aa7 h LYS 57 Ca 0.31 -0.03 -0.17 0.00 -1.87 0.00 0.00 60.65 58.89 1aa7 h LYS 57 Cb 0.21 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1aa7 h LYS 57 CO -0.19 0.33 -0.52 0.78 -0.57 0.00 0.00 179.45 179.28 1aa7 h GLY 58 N 0.78 0.86 0.93 3.86 0.00 -0.24 0.38 103.07 109.64 1aa7 h GLY 58 Ca 0.02 -1.03 -0.03 0.00 0.00 0.00 0.00 47.33 46.29 1aa7 h GLY 58 CO 0.03 0.92 0.12 -2.22 0.00 0.00 0.00 176.54 175.39 1aa7 h ILE 59 N 0.53 1.21 -0.37 2.60 2.04 -1.01 0.38 117.51 122.89 1aa7 h ILE 59 Ca 0.01 -0.69 -0.13 0.00 1.00 0.00 0.00 64.86 65.04 1aa7 h ILE 59 Cb 1.13 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1aa7 h ILE 59 CO 0.11 0.24 -0.29 -0.07 0.00 0.00 0.00 178.15 178.15 1aa7 h LEU 60 N 0.47 0.81 -0.33 1.44 3.38 -1.26 -0.48 115.31 119.34 1aa7 h LEU 60 Ca 0.12 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.79 1aa7 h LEU 60 Cb 0.25 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1aa7 h LEU 60 CO -0.00 1.05 0.16 1.23 0.09 0.00 0.00 178.44 180.96 1aa7 h GLY 61 N 0.94 0.44 0.94 0.83 0.00 -0.60 -0.53 103.07 105.09 1aa7 h GLY 61 Ca 0.08 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 1aa7 h GLY 61 CO 0.07 0.08 -0.01 -2.75 0.00 0.00 0.00 176.54 173.93 1aa7 h PHE 62 N 0.33 -0.03 -0.14 5.60 3.04 -0.69 -2.48 116.94 122.58 1aa7 h PHE 62 Ca 0.14 -0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.13 1aa7 h PHE 62 Cb 0.06 0.01 -0.04 0.00 2.56 0.00 0.00 35.95 38.53 1aa7 h PHE 62 CO -0.10 0.04 -0.13 0.28 -2.02 0.00 0.00 178.31 176.38 1aa7 h VAL 63 N -0.09 0.64 -0.74 1.41 2.07 -0.82 -1.94 116.25 116.79 1aa7 h VAL 63 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1aa7 h VAL 63 Cb 0.08 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 1aa7 h VAL 63 CO 0.00 0.00 0.47 -0.26 0.02 0.00 0.00 177.57 177.80 1aa7 h PHE 64 N -0.15 0.88 -0.01 1.57 0.04 -1.06 -0.17 116.94 118.03 1aa7 h PHE 64 Ca 0.09 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.79 1aa7 h PHE 64 Cb 0.29 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 38.13 1aa7 h PHE 64 CO -0.25 0.52 -0.44 1.79 -0.60 0.00 0.00 178.31 179.32 1aa7 h THR 65 N 0.93 1.32 -0.07 -1.55 1.35 -1.23 0.24 112.91 113.89 1aa7 h THR 65 Ca 0.29 -1.52 -0.20 0.00 -0.55 0.00 0.00 66.41 64.43 1aa7 h THR 65 Cb -0.01 1.80 -0.00 0.00 -1.73 0.00 0.00 68.15 68.21 1aa7 h THR 65 CO -0.10 0.44 -0.78 0.25 -0.25 0.00 0.00 175.52 175.08 1aa7 h LEU 66 N 0.03 0.56 0.00 3.87 5.85 -0.62 -3.35 115.31 121.64 1aa7 h LEU 66 Ca -0.00 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.34 1aa7 h LEU 66 Cb 0.79 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.65 1aa7 h LEU 66 CO 0.06 1.14 -1.73 0.35 -0.34 0.00 0.00 178.44 177.92 1aa7 n THR 67 N -3.83 0.02 -1.88 1.05 -2.24 -0.14 -4.96 114.28 102.29 1aa7 n THR 67 Ca -0.05 -0.38 -0.40 0.00 -2.27 0.00 0.00 64.05 60.94 1aa7 n THR 67 Cb 0.74 0.22 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 1aa7 n THR 67 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1aa7 s VAL 68 N -3.39 2.23 0.11 2.28 0.11 0.05 -4.78 120.40 117.02 1aa7 s VAL 68 Ca -0.04 0.21 -0.25 0.00 -2.93 0.00 0.00 61.98 58.98 1aa7 s VAL 68 Cb 0.14 -3.13 -0.08 0.00 -1.53 0.00 0.00 36.38 31.79 1aa7 s VAL 68 CO 0.90 0.04 1.67 -0.65 -3.33 0.00 0.00 175.10 173.73 1aa7 h PRO 69 N 2.77 -0.28 -5.18 1.54 0.11 -1.88 -3.42 132.00 125.65 1aa7 h PRO 69 Ca -0.50 0.02 -0.57 0.00 0.11 0.00 0.00 66.00 65.05 1aa7 h PRO 69 Cb 1.25 0.06 -0.32 0.00 0.11 0.00 0.00 31.00 32.10 1aa7 h PRO 69 CO 0.63 -0.19 -0.84 -1.12 -0.21 0.00 0.00 178.00 176.27 1aa7 s SER 70 N -4.96 2.23 0.11 -2.05 0.01 -1.26 -5.00 113.70 102.77 1aa7 s SER 70 Ca -0.15 -0.37 0.26 0.00 1.31 0.00 0.00 55.95 57.00 1aa7 s SER 70 Cb 0.08 -0.75 0.75 0.00 0.21 0.00 0.00 66.02 66.31 1aa7 s SER 70 CO 0.66 0.13 1.65 -0.62 0.41 0.00 0.00 173.24 175.47 1aa7 n GLU 71 N 3.31 0.17 -3.46 12.44 1.02 -1.26 -4.63 120.64 128.23 1aa7 n GLU 71 Ca -0.19 0.10 -0.25 0.00 -0.02 0.00 0.00 57.16 56.80 1aa7 n GLU 71 Cb 0.53 -1.66 0.03 0.00 -0.02 0.00 0.00 31.44 30.32 1aa7 n GLU 71 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1aa7 n ARG 72 N -1.94 -5.36 -2.87 3.49 1.74 -1.26 -2.02 116.66 108.44 1aa7 n ARG 72 Ca 0.05 0.71 -0.21 0.00 -0.77 0.00 0.00 57.85 57.63 1aa7 n ARG 72 Cb 0.40 -5.59 0.02 0.00 -1.02 0.00 0.00 32.46 26.26 1aa7 n ARG 72 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1aa7 n GLY 73 N -1.59 -0.51 3.75 -0.13 0.00 -1.26 -4.97 105.19 100.47 1aa7 n GLY 73 Ca -0.02 0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1aa7 n GLY 73 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aa7 s LEU 74 N -6.42 4.64 0.70 0.99 1.43 -0.85 -5.03 118.68 114.13 1aa7 s LEU 74 Ca 0.22 1.93 -0.14 0.00 -1.03 0.00 0.00 54.13 55.11 1aa7 s LEU 74 Cb -0.10 -3.59 0.02 0.00 0.03 0.00 0.00 46.19 42.55 1aa7 s LEU 74 CO 0.27 0.16 1.11 -1.10 0.23 0.00 0.00 176.35 177.02 1aa7 s GLN 75 N -1.15 2.56 0.66 1.70 -1.52 -1.26 -4.98 119.66 115.66 1aa7 s GLN 75 Ca 0.41 1.37 -0.17 0.00 -1.95 0.00 0.00 55.36 55.01 1aa7 s GLN 75 Cb -0.26 -1.92 -0.00 0.00 -0.22 0.00 0.00 33.01 30.61 1aa7 s GLN 75 CO 0.32 -1.44 1.21 1.03 -0.25 0.00 0.00 175.29 176.16 1aa7 s ARG 76 N -4.30 2.59 -0.06 2.91 1.81 -1.26 -4.98 118.95 115.65 1aa7 s ARG 76 Ca 0.66 1.81 -0.17 0.00 -1.72 0.00 0.00 55.73 56.30 1aa7 s ARG 76 Cb -0.20 -1.88 -0.05 0.00 -0.45 0.00 0.00 34.95 32.37 1aa7 s ARG 76 CO 0.46 -1.50 0.47 1.03 -0.68 0.00 0.00 175.30 175.08 1aa7 s ARG 77 N -3.61 4.22 0.26 3.54 1.81 -1.26 -4.99 118.95 118.92 1aa7 s ARG 77 Ca 0.76 0.48 -0.04 0.00 -1.72 0.00 0.00 55.73 55.21 1aa7 s ARG 77 Cb -0.30 -3.36 0.34 0.00 -0.45 0.00 0.00 34.95 31.18 1aa7 s ARG 77 CO 0.39 0.35 1.91 -0.09 -0.68 0.00 0.00 175.30 177.19 1aa7 h ARG 78 N 5.94 1.23 -0.06 3.54 2.43 -1.99 -0.86 114.38 124.61 1aa7 h ARG 78 Ca -0.45 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.64 1aa7 h ARG 78 Cb 1.19 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 30.46 1aa7 h ARG 78 CO 0.71 0.81 -0.02 0.27 -1.51 0.00 0.00 179.97 180.22 1aa7 h PHE 79 N 1.26 0.08 0.11 2.20 -0.00 -1.99 0.09 116.94 118.70 1aa7 h PHE 79 Ca 0.39 -0.00 -0.18 0.00 -0.00 0.00 0.00 57.97 58.18 1aa7 h PHE 79 Cb -0.01 -0.03 0.01 0.00 -0.00 0.00 0.00 35.95 35.92 1aa7 h PHE 79 CO -0.00 0.12 -0.87 0.28 -0.00 0.00 0.00 178.31 177.84 1aa7 h VAL 80 N 0.09 1.42 -0.92 0.88 2.07 -1.71 -1.97 116.25 116.11 1aa7 h VAL 80 Ca 0.02 -2.47 0.05 0.00 0.82 0.00 0.00 66.70 65.12 1aa7 h VAL 80 Cb 0.10 3.08 -0.06 0.00 -1.52 0.00 0.00 31.29 32.90 1aa7 h VAL 80 CO 0.00 0.68 0.59 1.56 0.02 0.00 0.00 177.57 180.43 1aa7 h GLN 81 N -0.46 1.08 -0.20 1.57 4.20 -0.89 0.51 115.11 120.91 1aa7 h GLN 81 Ca -0.17 -0.06 -0.16 0.00 0.06 0.00 0.00 58.65 58.32 1aa7 h GLN 81 Cb 1.58 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 29.11 1aa7 h GLN 81 CO 0.10 0.71 -0.52 -0.91 -0.67 0.00 0.00 178.83 177.54 1aa7 h ASN 82 N 1.11 0.63 0.32 1.46 2.35 -1.06 -3.01 115.58 117.40 1aa7 h ASN 82 Ca 0.38 -0.33 -0.13 0.00 -0.55 0.00 0.00 56.30 55.68 1aa7 h ASN 82 Cb 0.09 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 1aa7 h ASN 82 CO -0.15 1.04 -0.54 0.00 -1.65 0.00 0.00 177.43 176.13 1aa7 h ALA 83 N 0.98 0.94 -0.77 -0.83 0.00 -0.49 -3.26 119.26 115.83 1aa7 h ALA 83 Ca 0.02 -0.50 -0.39 0.00 0.00 0.00 0.00 54.91 54.04 1aa7 h ALA 83 Cb 1.06 -0.09 -0.23 0.00 0.00 0.00 0.00 17.79 18.53 1aa7 h ALA 83 CO 0.10 0.68 0.39 1.28 0.00 0.00 0.00 179.25 181.70 1aa7 n LEU 84 N -3.92 5.84 -1.29 0.00 4.77 0.08 -4.62 117.00 117.86 1aa7 n LEU 84 Ca -0.02 -3.63 0.10 0.00 -0.03 0.00 0.00 56.01 52.42 1aa7 n LEU 84 Cb 0.57 -0.77 0.30 0.00 -2.33 0.00 0.00 43.42 41.19 1aa7 n LEU 84 CO 0.43 1.10 0.75 -0.46 -1.33 0.00 0.00 177.39 177.89 1aa7 n ASN 85 N -1.07 3.77 -2.21 -1.43 0.23 -1.14 -3.43 115.26 109.98 1aa7 n ASN 85 Ca 0.50 -2.16 -0.17 0.00 -0.53 0.00 0.00 54.58 52.22 1aa7 n ASN 85 Cb 1.45 -0.48 -0.02 0.00 -2.08 0.00 0.00 39.78 38.65 1aa7 n ASN 85 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1aa7 n GLY 86 N 1.34 -0.03 2.48 4.83 0.00 -1.26 -0.57 105.19 111.97 1aa7 n GLY 86 Ca 0.22 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.06 1aa7 n GLY 86 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1aa7 n ASN 87 N -1.70 -5.22 -1.84 1.61 3.02 -1.26 -2.00 115.26 107.87 1aa7 n ASN 87 Ca -0.19 0.33 -0.19 0.00 -0.03 0.00 0.00 54.58 54.49 1aa7 n ASN 87 Cb 0.63 -4.31 -0.06 0.00 -0.61 0.00 0.00 39.78 35.43 1aa7 n ASN 87 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1aa7 n GLY 88 N -0.81 1.06 3.69 7.41 0.00 0.26 -4.94 105.19 111.86 1aa7 n GLY 88 Ca -0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1aa7 n GLY 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1aa7 s ASP 89 N -2.44 7.08 0.42 1.61 2.15 -0.85 -4.97 116.67 119.69 1aa7 s ASP 89 Ca 0.00 1.32 0.09 0.00 0.43 0.00 0.00 52.55 54.39 1aa7 s ASP 89 Cb 0.00 -2.48 0.92 0.00 -0.30 0.00 0.00 42.92 41.05 1aa7 s ASP 89 CO 0.00 -0.33 2.05 -0.65 -0.17 0.00 0.00 175.17 176.07 1aa7 h PRO 90 N 7.09 0.47 -0.16 4.34 0.11 -1.92 -1.03 132.00 140.92 1aa7 h PRO 90 Ca -0.34 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.55 1aa7 h PRO 90 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1aa7 h PRO 90 CO 0.81 0.31 -0.69 -0.91 -0.21 0.00 0.00 178.00 177.31 1aa7 h ASN 91 N 0.49 0.76 -0.12 -2.05 2.35 -1.96 0.11 115.58 115.15 1aa7 h ASN 91 Ca 0.16 -0.47 -0.01 0.00 -0.55 0.00 0.00 56.30 55.43 1aa7 h ASN 91 Cb 0.04 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 1aa7 h ASN 91 CO -0.04 1.24 0.05 0.78 -1.65 0.00 0.00 177.43 177.81 1aa7 h ASN 92 N 0.46 0.16 -0.70 5.81 2.35 -1.74 -1.47 115.58 120.46 1aa7 h ASN 92 Ca -0.03 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1aa7 h ASN 92 Cb 1.29 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 39.58 1aa7 h ASN 92 CO 0.14 0.28 0.40 0.24 -1.65 0.00 0.00 177.43 176.84 1aa7 h MET 93 N 0.03 0.98 -0.24 0.81 2.86 -1.14 0.65 114.93 118.88 1aa7 h MET 93 Ca 0.04 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1aa7 h MET 93 Cb 0.17 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1aa7 h MET 93 CO -0.00 0.72 0.11 0.22 1.06 0.00 0.00 176.91 179.01 1aa7 h ASP 94 N 0.99 0.32 0.07 1.22 3.58 -0.49 -1.24 116.42 120.87 1aa7 h ASP 94 Ca 0.25 -0.14 -0.12 0.00 0.42 0.00 0.00 57.03 57.44 1aa7 h ASP 94 Cb 0.01 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 1aa7 h ASP 94 CO -0.04 0.37 -0.41 0.11 -2.88 0.00 0.00 179.24 176.39 1aa7 h LYS 95 N 0.24 0.44 -0.45 0.28 6.56 -0.66 -2.19 116.57 120.79 1aa7 h LYS 95 Ca 0.08 -0.22 -0.06 0.00 -1.06 0.00 0.00 60.65 59.39 1aa7 h LYS 95 Cb 0.14 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.78 1aa7 h LYS 95 CO -0.01 0.78 0.02 0.00 -2.06 0.00 0.00 179.45 178.18 1aa7 h ALA 96 N 1.20 1.19 -0.22 3.86 0.00 -0.66 0.26 119.26 124.88 1aa7 h ALA 96 Ca 0.03 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.54 1aa7 h ALA 96 Cb 0.88 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1aa7 h ALA 96 CO 0.07 0.53 -0.54 0.28 0.00 0.00 0.00 179.25 179.60 1aa7 h VAL 97 N 0.69 1.31 -0.29 0.00 2.07 -1.02 -0.95 116.25 118.06 1aa7 h VAL 97 Ca 0.14 -1.76 -0.04 0.00 0.82 0.00 0.00 66.70 65.86 1aa7 h VAL 97 Cb 0.39 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 1aa7 h VAL 97 CO 0.01 0.56 0.02 0.11 0.02 0.00 0.00 177.57 178.28 1aa7 h LYS 98 N 0.51 0.51 -0.20 1.57 1.57 -0.71 -2.27 116.57 117.54 1aa7 h LYS 98 Ca 0.01 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1aa7 h LYS 98 Cb 1.10 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1aa7 h LYS 98 CO 0.11 0.64 0.13 1.25 -0.57 0.00 0.00 179.45 181.01 1aa7 h LEU 99 N 0.30 0.22 -0.75 2.94 5.85 -0.44 -2.49 115.31 120.94 1aa7 h LEU 99 Ca 0.08 -0.00 0.16 0.00 0.84 0.00 0.00 57.88 58.96 1aa7 h LEU 99 Cb 0.40 -0.05 -0.11 0.00 0.37 0.00 0.00 40.66 41.27 1aa7 h LEU 99 CO 0.01 0.16 0.23 0.22 -0.34 0.00 0.00 178.44 178.72 1aa7 h TYR 100 N 0.26 0.37 -0.51 1.25 3.20 -1.03 0.92 116.97 121.43 1aa7 h TYR 100 Ca 0.07 0.04 0.04 0.00 3.14 0.00 0.00 58.73 62.03 1aa7 h TYR 100 Cb -0.03 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 1aa7 h TYR 100 CO -0.07 -0.04 0.26 -0.09 -1.64 0.00 0.00 178.16 176.59 1aa7 h ARG 101 N 0.33 0.50 -0.49 1.82 2.43 -0.96 -0.87 114.38 117.14 1aa7 h ARG 101 Ca 0.42 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.45 1aa7 h ARG 101 Cb 0.71 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 1aa7 h ARG 101 CO -0.48 0.33 -0.13 0.87 -1.51 0.00 0.00 179.97 179.05 1aa7 h LYS 102 N 0.51 0.94 -0.03 0.20 1.57 -0.87 -2.94 116.57 115.95 1aa7 h LYS 102 Ca 0.23 -0.35 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 1aa7 h LYS 102 Cb 0.13 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1aa7 h LYS 102 CO -0.15 1.01 -0.24 -0.07 -0.57 0.00 0.00 179.45 179.42 1aa7 h LEU 103 N 0.83 0.05 -2.29 2.94 3.38 -0.14 -1.34 115.31 118.74 1aa7 h LEU 103 Ca 0.13 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1aa7 h LEU 103 Cb 0.67 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1aa7 h LEU 103 CO 0.05 0.30 -0.05 0.11 0.09 0.00 0.00 178.44 178.94 1aa7 h LYS 104 N 0.05 0.00 -0.00 1.13 1.57 -0.99 -1.65 116.57 116.67 1aa7 h LYS 104 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1aa7 h LYS 104 Cb 0.46 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1aa7 h LYS 104 CO 0.03 0.05 -0.43 0.54 -0.57 0.00 0.00 179.45 179.07 1aa7 n ARG 105 N -3.65 0.34 -3.09 3.15 1.74 -0.51 -4.92 116.66 109.72 1aa7 n ARG 105 Ca -0.02 -0.20 -0.30 0.00 -0.77 0.00 0.00 57.85 56.56 1aa7 n ARG 105 Cb 0.15 -1.50 -0.04 0.00 -1.02 0.00 0.00 32.46 30.06 1aa7 n ARG 105 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1aa7 s GLU 106 N -2.80 3.74 0.00 5.56 0.41 -0.62 -4.99 118.70 119.99 1aa7 s GLU 106 Ca 0.16 0.30 0.00 0.00 -0.41 0.00 0.00 54.97 55.02 1aa7 s GLU 106 Cb 0.18 -2.50 0.00 0.00 -1.78 0.00 0.00 34.13 30.03 1aa7 s GLU 106 CO 0.64 0.09 0.07 1.51 -0.49 0.00 0.00 175.26 177.07 1aa7 n ILE 107 N -1.02 0.00 -4.43 -1.63 0.13 -1.26 -4.85 119.36 106.30 1aa7 n ILE 107 Ca 0.01 -0.17 -0.22 0.00 -1.10 0.00 0.00 62.75 61.27 1aa7 n ILE 107 Cb 0.54 1.27 -0.10 0.00 -0.84 0.00 0.00 39.64 40.50 1aa7 n ILE 107 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 1aa7 s THR 108 N -0.20 2.22 0.11 9.51 -4.23 -1.26 -4.80 115.64 116.99 1aa7 s THR 108 Ca 0.00 -2.33 -0.18 0.00 -1.18 0.00 0.00 61.69 58.00 1aa7 s THR 108 Cb 0.00 -2.21 -0.06 0.00 1.34 0.00 0.00 72.50 71.58 1aa7 s THR 108 CO 0.00 -0.46 1.63 0.15 -0.54 0.00 0.00 174.62 175.40 1aa7 h PHE 109 N 2.39 0.45 -0.19 3.99 3.57 -1.94 -2.36 116.94 122.84 1aa7 h PHE 109 Ca -0.39 -0.04 -0.16 0.00 3.53 0.00 0.00 57.97 60.90 1aa7 h PHE 109 Cb 1.25 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.85 1aa7 h PHE 109 CO 0.78 0.47 -0.55 0.45 -2.23 0.00 0.00 178.31 177.22 1aa7 h HIS 110 N 0.30 0.73 -0.67 0.41 3.86 -1.97 0.39 115.15 118.20 1aa7 h HIS 110 Ca 0.09 -0.26 -0.08 0.00 -1.16 0.00 0.00 60.37 58.96 1aa7 h HIS 110 Cb 0.23 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.54 1aa7 h HIS 110 CO 0.00 1.00 0.10 0.78 0.86 0.00 0.00 177.93 180.67 1aa7 h GLY 111 N 1.04 1.20 0.76 2.45 0.00 -1.98 0.68 103.07 107.23 1aa7 h GLY 111 Ca 0.01 -0.81 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 1aa7 h GLY 111 CO 0.11 0.75 -0.01 0.00 0.00 0.00 0.00 176.54 177.39 1aa7 h ALA 112 N 1.04 0.18 -0.79 3.60 0.00 -1.34 -2.15 119.26 119.80 1aa7 h ALA 112 Ca 0.20 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1aa7 h ALA 112 Cb 0.46 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 1aa7 h ALA 112 CO 0.02 -0.10 0.34 -0.22 0.00 0.00 0.00 179.25 179.28 1aa7 h LYS 113 N -0.04 1.17 -0.07 0.00 3.64 -0.72 -1.34 116.57 119.21 1aa7 h LYS 113 Ca 0.04 -0.20 -0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1aa7 h LYS 113 Cb 0.40 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1aa7 h LYS 113 CO 0.01 0.93 0.04 0.93 -2.27 0.00 0.00 179.45 179.09 1aa7 h GLU 114 N 1.15 0.10 -0.15 1.90 5.08 -0.77 -1.95 114.58 119.94 1aa7 h GLU 114 Ca 0.27 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.52 1aa7 h GLU 114 Cb 0.18 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1aa7 h GLU 114 CO -0.03 0.17 -0.31 -0.84 -1.00 0.00 0.00 179.01 177.00 1aa7 h ILE 115 N 0.01 1.27 -0.59 3.13 3.07 -1.24 -3.09 117.51 120.08 1aa7 h ILE 115 Ca 0.02 -1.30 -0.07 0.00 1.55 0.00 0.00 64.86 65.07 1aa7 h ILE 115 Cb 0.10 1.50 -0.02 0.00 -0.27 0.00 0.00 36.82 38.12 1aa7 h ILE 115 CO -0.00 0.40 0.11 0.28 -1.05 0.00 0.00 178.15 177.88 1aa7 h SER 116 N 0.26 0.92 0.01 2.16 0.02 -1.05 -2.80 113.55 113.07 1aa7 h SER 116 Ca 0.04 -0.25 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1aa7 h SER 116 Cb 0.68 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1aa7 h SER 116 CO 0.05 0.93 0.00 0.18 -1.14 0.00 0.00 176.83 176.86 1aa7 n LEU 117 N -4.33 0.53 -0.19 5.07 4.77 -0.75 -0.84 117.00 121.25 1aa7 n LEU 117 Ca 0.03 0.75 0.13 0.00 -0.03 0.00 0.00 56.01 56.89 1aa7 n LEU 117 Cb 0.26 -0.81 0.68 0.00 -2.33 0.00 0.00 43.42 41.22 1aa7 n LEU 117 CO 0.41 -0.93 0.95 -1.54 -1.33 0.00 0.00 177.39 174.96 1aa7 n SER 118 N -2.21 0.60 -4.64 -1.43 3.41 -1.05 -4.84 113.62 103.45 1aa7 n SER 118 Ca -0.01 -1.31 -0.28 0.00 -0.26 0.00 0.00 58.87 57.01 1aa7 n SER 118 Cb 0.03 -0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 63.89 1aa7 n SER 118 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1aa7 s TYR 119 N -1.97 2.83 0.76 7.33 1.51 -0.02 -5.12 117.35 122.67 1aa7 s TYR 119 Ca 0.39 -0.13 -0.11 0.00 -1.01 0.00 0.00 57.07 56.21 1aa7 s TYR 119 Cb 0.19 -1.40 0.05 0.00 -0.11 0.00 0.00 41.96 40.69 1aa7 s TYR 119 CO 0.31 0.49 1.10 -1.54 -1.11 0.00 0.00 175.55 174.80 1aa7 s SER 120 N -2.69 4.51 0.30 2.29 1.04 -1.26 -4.82 113.70 113.08 1aa7 s SER 120 Ca 0.26 1.86 -0.00 0.00 0.48 0.00 0.00 55.95 58.55 1aa7 s SER 120 Cb -0.10 -2.53 0.51 0.00 0.10 0.00 0.00 66.02 64.00 1aa7 s SER 120 CO 0.17 -2.03 1.93 0.00 0.98 0.00 0.00 173.24 174.29 1aa7 h ALA 121 N -1.01 1.48 -0.66 5.32 0.00 -1.96 -0.60 119.26 121.83 1aa7 h ALA 121 Ca -0.44 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.41 1aa7 h ALA 121 Cb 1.23 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1aa7 h ALA 121 CO 0.51 0.42 0.32 0.78 0.00 0.00 0.00 179.25 181.28 1aa7 h GLY 122 N 1.05 1.01 1.31 0.00 0.00 -1.96 0.01 103.07 104.50 1aa7 h GLY 122 Ca 0.36 -0.49 -0.14 0.00 0.00 0.00 0.00 47.33 47.05 1aa7 h GLY 122 CO -0.11 0.47 -0.38 0.00 0.00 0.00 0.00 176.54 176.52 1aa7 h ALA 123 N 1.15 0.73 -0.37 3.60 0.00 -1.70 -1.59 119.26 121.08 1aa7 h ALA 123 Ca 0.23 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1aa7 h ALA 123 Cb 0.11 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1aa7 h ALA 123 CO -0.03 0.66 -0.05 -0.07 0.00 0.00 0.00 179.25 179.76 1aa7 h LEU 124 N 0.62 0.68 -0.78 0.00 3.38 -0.76 -0.55 115.31 117.91 1aa7 h LEU 124 Ca 0.06 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.60 1aa7 h LEU 124 Cb 0.92 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1aa7 h LEU 124 CO 0.08 0.86 0.04 0.00 0.09 0.00 0.00 178.44 179.52 1aa7 h ALA 125 N 0.84 0.98 -0.52 1.53 0.00 -0.94 -1.23 119.26 119.92 1aa7 h ALA 125 Ca 0.10 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 1aa7 h ALA 125 Cb 0.54 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1aa7 h ALA 125 CO 0.03 0.63 -0.12 1.03 0.00 0.00 0.00 179.25 180.82 1aa7 h SER 126 N 0.90 0.99 -0.47 0.00 0.87 -1.18 -1.39 113.55 113.28 1aa7 h SER 126 Ca 0.17 -0.33 -0.01 0.00 -1.23 0.00 0.00 61.79 60.40 1aa7 h SER 126 Cb 0.47 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 1aa7 h SER 126 CO 0.02 1.11 0.26 0.00 -0.53 0.00 0.00 176.83 177.69 1aa7 h MET 128 N 0.62 1.17 -0.57 0.00 2.86 -1.00 -0.71 114.93 117.29 1aa7 h MET 128 Ca 0.17 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.68 1aa7 h MET 128 Cb 0.04 -0.26 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 1aa7 h MET 128 CO -0.03 0.77 0.15 0.78 1.06 0.00 0.00 176.91 179.65 1aa7 h GLY 129 N 1.21 0.95 1.01 8.32 0.00 -0.68 0.20 103.07 114.07 1aa7 h GLY 129 Ca 0.34 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1aa7 h GLY 129 CO -0.08 0.51 0.46 -2.00 0.00 0.00 0.00 176.54 175.43 1aa7 h LEU 130 N 0.85 0.99 -0.04 3.11 6.46 0.29 0.15 115.31 127.12 1aa7 h LEU 130 Ca 0.19 -0.08 -0.13 0.00 -0.12 0.00 0.00 57.88 57.73 1aa7 h LEU 130 Cb 0.29 -0.25 0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1aa7 h LEU 130 CO -0.00 0.79 -0.48 0.40 -0.62 0.00 0.00 178.44 178.52 1aa7 h ILE 131 N 1.11 1.43 -0.51 4.05 1.08 -1.00 0.57 117.51 124.24 1aa7 h ILE 131 Ca 0.29 -1.94 0.09 0.00 -0.39 0.00 0.00 64.86 62.91 1aa7 h ILE 131 Cb 0.00 2.48 -0.08 0.00 -3.07 0.00 0.00 36.82 36.15 1aa7 h ILE 131 CO -0.05 0.56 0.06 0.22 -0.69 0.00 0.00 178.15 178.25 1aa7 h TYR 132 N -0.12 0.07 0.00 1.37 3.20 -0.25 0.13 116.97 121.38 1aa7 h TYR 132 Ca -0.05 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1aa7 h TYR 132 Cb 1.17 0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.48 1aa7 h TYR 132 CO 0.14 -0.06 0.00 0.09 -1.64 0.00 0.00 178.16 176.69 1aa7 n ASN 133 N -5.17 0.00 -2.04 -2.11 3.02 0.48 -4.89 115.26 104.55 1aa7 n ASN 133 Ca 0.06 -1.19 -0.19 0.00 -0.03 0.00 0.00 54.58 53.23 1aa7 n ASN 133 Cb 0.26 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.42 1aa7 n ASN 133 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1aa7 n ARG 134 N -0.85 -1.47 0.00 3.52 1.74 0.47 -4.86 116.66 115.21 1aa7 n ARG 134 Ca 0.16 0.94 0.14 0.00 -0.77 0.00 0.00 57.85 58.32 1aa7 n ARG 134 Cb 0.07 -5.45 0.57 0.00 -1.02 0.00 0.00 32.46 26.62 1aa7 n ARG 134 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1aa7 n MET 135 N -2.75 0.12 -3.76 5.56 2.81 0.18 -4.85 117.12 114.42 1aa7 n MET 135 Ca -0.22 -0.02 -0.09 0.00 -1.81 0.00 0.00 57.70 55.55 1aa7 n MET 135 Cb 0.66 -1.50 -0.04 0.00 -0.71 0.00 0.00 33.22 31.63 1aa7 n MET 135 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1aa7 s GLY 136 N -2.90 -0.05 -0.02 3.03 0.00 -1.14 -4.99 107.32 101.25 1aa7 s GLY 136 Ca 0.17 -0.26 -0.02 0.00 0.00 0.00 0.00 44.72 44.60 1aa7 s GLY 136 CO 0.55 -0.28 0.06 0.00 0.00 0.00 0.00 173.10 173.43 1aa7 s ALA 137 N -3.88 -0.15 0.18 3.20 0.00 -1.26 -4.53 121.76 115.32 1aa7 s ALA 137 Ca 0.10 0.11 -0.01 0.00 0.00 0.00 0.00 51.96 52.17 1aa7 s ALA 137 Cb -0.01 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 1aa7 s ALA 137 CO -0.02 -0.05 0.10 0.14 0.00 0.00 0.00 175.76 175.93 1aa7 s VAL 138 N -0.14 0.10 0.71 0.00 -7.23 -1.26 -4.85 120.40 107.73 1aa7 s VAL 138 Ca -0.02 -1.97 -0.13 0.00 -1.81 0.00 0.00 61.98 58.05 1aa7 s VAL 138 Cb -0.01 -2.36 0.02 0.00 0.56 0.00 0.00 36.38 34.59 1aa7 s VAL 138 CO 0.00 -0.16 1.10 0.42 -0.31 0.00 0.00 175.10 176.15 1aa7 s THR 139 N -4.08 3.31 0.16 5.32 -4.23 -1.26 -4.81 115.64 110.04 1aa7 s THR 139 Ca 0.34 0.52 -0.18 0.00 -1.18 0.00 0.00 61.69 61.19 1aa7 s THR 139 Cb 0.07 -3.03 0.06 0.00 1.34 0.00 0.00 72.50 70.95 1aa7 s THR 139 CO 0.09 -0.46 1.67 0.74 -0.54 0.00 0.00 174.62 176.12 1aa7 h THR 140 N -0.50 0.62 -0.07 3.99 2.02 -1.99 -0.71 112.91 116.27 1aa7 h THR 140 Ca -0.45 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.66 1aa7 h THR 140 Cb 1.24 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.26 1aa7 h THR 140 CO 0.53 0.00 -0.26 -0.33 0.37 0.00 0.00 175.52 175.83 1aa7 h GLU 141 N -0.02 0.12 -0.16 6.66 3.07 -1.92 0.18 114.58 122.51 1aa7 h GLU 141 Ca 0.17 -0.04 -0.18 0.00 -0.50 0.00 0.00 59.36 58.81 1aa7 h GLU 141 Cb 0.28 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1aa7 h GLU 141 CO -0.37 0.38 -0.63 0.28 -1.40 0.00 0.00 179.01 177.27 1aa7 h VAL 142 N 0.11 1.33 -0.39 3.13 2.07 -1.64 -2.09 116.25 118.77 1aa7 h VAL 142 Ca 0.02 -1.91 -0.09 0.00 0.82 0.00 0.00 66.70 65.53 1aa7 h VAL 142 Cb 0.53 1.89 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1aa7 h VAL 142 CO 0.04 0.59 -0.13 0.00 0.02 0.00 0.00 177.57 178.09 1aa7 h ALA 143 N 0.89 1.03 -0.55 1.67 0.00 -0.18 -1.47 119.26 120.65 1aa7 h ALA 143 Ca -0.01 -0.32 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1aa7 h ALA 143 Cb 1.20 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 1aa7 h ALA 143 CO 0.12 0.58 0.19 0.74 0.00 0.00 0.00 179.25 180.88 1aa7 h PHE 144 N 0.64 0.87 -0.61 0.00 0.04 -0.86 -1.56 116.94 115.47 1aa7 h PHE 144 Ca 0.11 -0.08 -0.03 0.00 2.80 0.00 0.00 57.97 60.77 1aa7 h PHE 144 Cb 0.59 -0.26 -0.03 0.00 2.20 0.00 0.00 35.95 38.46 1aa7 h PHE 144 CO 0.03 0.73 0.28 0.78 -0.60 0.00 0.00 178.31 179.52 1aa7 h GLY 145 N 0.76 0.93 0.74 -1.45 0.00 -0.83 0.65 103.07 103.87 1aa7 h GLY 145 Ca 0.18 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1aa7 h GLY 145 CO -0.01 0.43 -0.10 -2.00 0.00 0.00 0.00 176.54 174.86 1aa7 h LEU 146 N 0.86 -0.24 -1.57 3.11 5.85 -0.96 -0.87 115.31 121.49 1aa7 h LEU 146 Ca 0.21 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 1aa7 h LEU 146 Cb 0.12 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1aa7 h LEU 146 CO -0.03 0.06 -0.18 1.62 -0.34 0.00 0.00 178.44 179.57 1aa7 h VAL 147 N -0.56 1.15 -0.11 1.05 3.04 -1.11 -1.81 116.25 117.90 1aa7 h VAL 147 Ca -0.03 -0.69 -0.18 0.00 -1.01 0.00 0.00 66.70 64.79 1aa7 h VAL 147 Cb 0.41 1.33 -0.00 0.00 -2.01 0.00 0.00 31.29 31.01 1aa7 h VAL 147 CO 0.05 0.20 -0.69 0.00 -1.01 0.00 0.00 177.57 176.12 1aa7 h ALA 149 N 0.91 0.68 -0.18 0.00 0.00 -0.75 -0.27 119.26 119.65 1aa7 h ALA 149 Ca -0.02 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1aa7 h ALA 149 Cb 1.26 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1aa7 h ALA 149 CO 0.12 0.40 0.09 1.15 0.00 0.00 0.00 179.25 181.01 1aa7 h THR 150 N 0.72 1.00 -0.91 0.00 2.02 -1.20 0.48 112.91 115.02 1aa7 h THR 150 Ca 0.16 -0.07 0.01 0.00 0.77 0.00 0.00 66.41 67.28 1aa7 h THR 150 Cb 0.38 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.54 1aa7 h THR 150 CO 0.01 0.04 0.60 0.00 0.37 0.00 0.00 175.52 176.53 1aa7 h GLU 152 N 1.24 0.57 -0.30 0.00 4.81 -0.61 0.98 114.58 121.28 1aa7 h GLU 152 Ca 0.33 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1aa7 h GLU 152 Cb -0.13 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 1aa7 h GLU 152 CO -0.07 0.56 0.15 1.96 -0.73 0.00 0.00 179.01 180.88 1aa7 h GLN 153 N 0.47 0.42 -0.38 1.92 1.08 -0.50 -1.58 115.11 116.54 1aa7 h GLN 153 Ca 0.13 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.23 1aa7 h GLN 153 Cb 0.20 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 1aa7 h GLN 153 CO -0.01 0.38 0.07 0.82 -0.95 0.00 0.00 178.83 179.14 1aa7 h ILE 154 N 0.35 1.24 -0.50 2.54 2.04 -1.04 -2.55 117.51 119.59 1aa7 h ILE 154 Ca 0.10 -0.84 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 1aa7 h ILE 154 Cb 0.10 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 1aa7 h ILE 154 CO -0.01 0.28 0.30 0.00 0.00 0.00 0.00 178.15 178.72 1aa7 h ALA 155 N 0.92 0.64 0.00 1.87 0.00 -0.73 -2.23 119.26 119.73 1aa7 h ALA 155 Ca 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1aa7 h ALA 155 Cb 0.35 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1aa7 h ALA 155 CO 0.01 0.13 -0.03 -0.44 0.00 0.00 0.00 179.25 178.92 1aa7 h ASP 156 N 0.67 0.00 1.03 0.00 3.32 -1.10 -0.66 116.42 119.67 1aa7 h ASP 156 Ca 0.18 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 1aa7 h ASP 156 Cb -0.01 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1aa7 h ASP 156 CO -0.03 0.03 -0.17 0.77 -1.72 0.00 0.00 179.24 178.12 1aa7 h SER 157 N 0.00 0.00 -0.02 6.45 4.64 -0.98 -3.51 113.55 120.13 1aa7 h SER 157 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1aa7 h SER 157 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1aa7 h SER 157 CO 0.00 0.17 0.00 0.00 -0.87 0.00 0.00 176.83 176.13