#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2h56 s ARG 2 N 0.00 0.02 -0.02 -0.41 3.52 -0.86 -0.42 118.95 120.77 2h56 s ARG 2 Ca 0.00 0.03 0.00 0.00 -0.13 0.00 0.00 55.73 55.64 2h56 s ARG 2 Cb 0.00 0.01 -0.04 0.00 -1.56 0.00 0.00 34.95 33.37 2h56 s ARG 2 CO 0.00 -0.00 0.02 0.71 -0.81 0.00 0.00 175.30 175.21 2h56 s TYR 3 N 1.50 3.14 -0.20 5.12 2.02 -1.26 -0.19 117.35 127.48 2h56 s TYR 3 Ca -0.04 0.13 0.01 0.00 -0.37 0.00 0.00 57.07 56.81 2h56 s TYR 3 Cb -0.01 -1.71 0.04 0.00 -0.40 0.00 0.00 41.96 39.88 2h56 s TYR 3 CO -0.13 0.48 -0.12 -0.06 -1.57 0.00 0.00 175.55 174.16 2h56 s PHE 4 N -1.07 2.58 0.63 2.71 0.08 0.20 -5.00 117.98 118.11 2h56 s PHE 4 Ca 0.19 -1.69 -0.04 0.00 0.12 0.00 0.00 56.93 55.51 2h56 s PHE 4 Cb -0.12 -1.72 0.04 0.00 -0.57 0.00 0.00 43.02 40.66 2h56 s PHE 4 CO 0.09 -0.77 0.91 -1.54 -0.10 0.00 0.00 175.22 173.81 2h56 s SER 5 N 1.34 5.15 0.26 1.36 1.04 -1.26 -2.07 113.70 119.51 2h56 s SER 5 Ca -0.01 0.37 0.23 0.00 0.48 0.00 0.00 55.95 57.01 2h56 s SER 5 Cb -0.16 -1.18 0.99 0.00 0.10 0.00 0.00 66.02 65.76 2h56 s SER 5 CO -0.08 -1.32 1.68 0.35 0.98 0.00 0.00 173.24 174.85 2h56 n THR 6 N -2.65 0.88 -0.80 2.02 -2.24 -1.26 -1.96 114.28 108.27 2h56 n THR 6 Ca 0.07 0.32 0.08 0.00 -2.27 0.00 0.00 64.05 62.24 2h56 n THR 6 Cb 0.60 -1.25 0.24 0.00 -2.10 0.00 0.00 70.33 67.81 2h56 n THR 6 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2h56 n ASP 7 N -2.20 3.72 -4.74 3.42 5.75 -1.26 -4.69 116.55 116.54 2h56 n ASP 7 Ca 0.02 -2.78 -0.38 0.00 -0.01 0.00 0.00 54.79 51.64 2h56 n ASP 7 Cb 0.19 -0.48 0.05 0.00 -1.03 0.00 0.00 41.12 39.86 2h56 n ASP 7 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2h56 s SER 8 N -1.69 4.97 0.49 -1.12 0.01 -0.83 -4.87 113.70 110.66 2h56 s SER 8 Ca 0.38 2.67 0.21 0.00 1.31 0.00 0.00 55.95 60.52 2h56 s SER 8 Cb 0.29 -2.62 1.23 0.00 0.21 0.00 0.00 66.02 65.13 2h56 s SER 8 CO 0.11 -1.77 2.04 1.55 0.41 0.00 0.00 173.24 175.58 2h56 h PRO 9 N 1.00 0.00 -0.38 12.44 0.13 -1.95 -0.44 132.00 142.80 2h56 h PRO 9 Ca -0.51 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.54 2h56 h PRO 9 Cb 1.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 2h56 h PRO 9 CO 0.55 0.15 -0.09 0.93 -0.23 0.00 0.00 178.00 179.31 2h56 h GLU 10 N 0.00 0.73 -0.34 0.86 3.07 -1.94 -1.52 114.58 115.44 2h56 h GLU 10 Ca -0.00 -0.28 -0.14 0.00 -0.50 0.00 0.00 59.36 58.44 2h56 h GLU 10 Cb 0.31 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.17 2h56 h GLU 10 CO 0.02 0.88 -0.36 0.28 -1.40 0.00 0.00 179.01 178.43 2h56 h VAL 11 N 0.53 1.28 -0.59 3.13 2.07 -1.67 -1.46 116.25 119.55 2h56 h VAL 11 Ca 0.10 -1.52 -0.04 0.00 0.82 0.00 0.00 66.70 66.05 2h56 h VAL 11 Cb 0.61 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2h56 h VAL 11 CO 0.04 0.50 0.19 0.11 0.02 0.00 0.00 177.57 178.43 2h56 h LYS 12 N 0.66 0.89 -0.14 1.57 1.79 -1.01 -1.75 116.57 118.58 2h56 h LYS 12 Ca 0.06 -0.16 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 2h56 h LYS 12 Cb 0.91 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 2h56 h LYS 12 CO 0.08 0.76 0.00 1.15 -1.08 0.00 0.00 179.45 180.37 2h56 h THR 13 N 0.87 1.25 0.00 -0.16 2.02 -0.87 -2.15 112.91 113.86 2h56 h THR 13 Ca 0.20 -0.80 -0.04 0.00 0.77 0.00 0.00 66.41 66.53 2h56 h THR 13 Cb 0.24 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 2h56 h THR 13 CO -0.01 0.23 -0.20 0.16 0.37 0.00 0.00 175.52 176.07 2h56 h ILE 14 N -0.02 0.62 -0.01 3.11 3.07 -0.90 -2.37 117.51 121.02 2h56 h ILE 14 Ca 0.04 -0.91 0.00 0.00 1.55 0.00 0.00 64.86 65.54 2h56 h ILE 14 Cb 0.35 1.59 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 2h56 h ILE 14 CO 0.01 0.20 -0.58 1.33 -1.05 0.00 0.00 178.15 178.05 2h56 n VAL 15 N -3.54 0.00 -0.32 0.16 0.24 -0.69 -4.51 118.33 109.67 2h56 n VAL 15 Ca -0.01 -0.10 0.12 0.00 -2.04 0.00 0.00 64.34 62.32 2h56 n VAL 15 Cb 0.35 0.76 0.30 0.00 -1.47 0.00 0.00 33.84 33.78 2h56 n VAL 15 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2h56 h ALA 16 N 3.38 1.51 -0.30 2.33 0.00 -0.83 -2.03 119.26 123.32 2h56 h ALA 16 Ca 0.00 0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.80 2h56 h ALA 16 Cb 0.57 0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.21 2h56 h ALA 16 CO 0.00 -0.17 -0.56 1.04 0.00 0.00 0.00 179.25 179.56 2h56 n GLN 17 N -4.89 2.33 -3.28 0.00 6.02 -1.26 -4.86 117.38 111.44 2h56 n GLN 17 Ca 0.22 -3.60 -0.07 0.00 -0.01 0.00 0.00 57.00 53.54 2h56 n GLN 17 Cb 0.58 -1.87 -0.04 0.00 1.02 0.00 0.00 30.24 29.92 2h56 n GLN 17 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2h56 s ASP 18 N -3.29 -0.26 0.43 1.08 -1.08 -0.76 -4.99 116.67 107.80 2h56 s ASP 18 Ca 0.43 -1.04 0.24 0.00 -0.52 0.00 0.00 52.55 51.66 2h56 s ASP 18 Cb 0.39 1.31 0.78 0.00 -1.46 0.00 0.00 42.92 43.94 2h56 s ASP 18 CO -0.03 -0.23 1.76 0.28 0.52 0.00 0.00 175.17 177.48 2h56 h SER 19 N 7.16 0.00 -0.31 -0.34 0.02 -1.89 -2.26 113.55 115.94 2h56 h SER 19 Ca 0.04 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.93 2h56 h SER 19 Cb 1.12 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 2h56 h SER 19 CO 0.16 0.21 -0.01 0.03 -1.14 0.00 0.00 176.83 176.07 2h56 h ARG 20 N 0.00 0.55 -0.66 3.45 3.08 -1.95 -0.38 114.38 118.47 2h56 h ARG 20 Ca -0.00 -0.18 -0.05 0.00 0.07 0.00 0.00 59.98 59.81 2h56 h ARG 20 Cb 0.84 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.82 2h56 h ARG 20 CO 0.03 0.70 0.20 1.25 -1.07 0.00 0.00 179.97 181.08 2h56 h LEU 21 N 0.34 0.95 -0.06 3.04 5.85 -1.88 -1.97 115.31 121.58 2h56 h LEU 21 Ca 0.09 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.64 2h56 h LEU 21 Cb 0.46 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 2h56 h LEU 21 CO 0.02 0.89 0.04 0.15 -0.34 0.00 0.00 178.44 179.19 2h56 h PHE 22 N 0.98 0.08 -0.99 1.25 3.57 -1.20 -0.23 116.94 120.39 2h56 h PHE 22 Ca 0.22 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.83 2h56 h PHE 22 Cb 0.28 -0.03 -0.08 0.00 2.79 0.00 0.00 35.95 38.92 2h56 h PHE 22 CO 0.02 0.11 0.63 1.96 -2.23 0.00 0.00 178.31 178.80 2h56 h GLN 23 N 0.03 0.96 -0.13 1.11 4.20 -0.86 -1.64 115.11 118.78 2h56 h GLN 23 Ca 0.02 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.61 2h56 h GLN 23 Cb 0.05 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 27.61 2h56 h GLN 23 CO -0.00 0.64 -0.19 0.35 -0.67 0.00 0.00 178.83 178.96 2h56 h PHE 24 N 0.99 0.43 -0.58 2.96 3.57 -1.00 -3.20 116.94 120.12 2h56 h PHE 24 Ca 0.48 -0.14 -0.06 0.00 3.53 0.00 0.00 57.97 61.77 2h56 h PHE 24 Cb 0.46 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 2h56 h PHE 24 CO -0.00 0.80 0.12 0.82 -2.23 0.00 0.00 178.31 177.81 2h56 h ILE 25 N -0.06 1.24 -0.27 1.41 2.04 -0.81 0.11 117.51 121.17 2h56 h ILE 25 Ca 0.01 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 64.94 2h56 h ILE 25 Cb 0.75 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 2h56 h ILE 25 CO 0.04 0.33 0.01 -0.33 0.00 0.00 0.00 178.15 178.21 2h56 h GLU 26 N 0.86 0.41 0.10 2.37 3.07 -1.34 -1.07 114.58 118.97 2h56 h GLU 26 Ca 0.18 -0.07 -0.24 0.00 -0.50 0.00 0.00 59.36 58.74 2h56 h GLU 26 Cb 0.35 -0.07 0.02 0.00 -0.84 0.00 0.00 28.75 28.21 2h56 h GLU 26 CO 0.00 0.42 -0.98 0.82 -1.40 0.00 0.00 179.01 177.88 2h56 h ILE 27 N 0.40 1.38 0.00 3.13 5.03 -1.40 -3.36 117.51 122.68 2h56 h ILE 27 Ca 0.09 -2.38 -0.08 0.00 -0.12 0.00 0.00 64.86 62.37 2h56 h ILE 27 Cb 0.24 2.80 -0.01 0.00 -3.03 0.00 0.00 36.82 36.82 2h56 h ILE 27 CO 0.00 0.70 -0.38 0.00 -0.68 0.00 0.00 178.15 177.80 2h56 h ALA 28 N 0.24 0.88 0.00 1.87 0.00 -0.45 -3.49 119.26 118.31 2h56 h ALA 28 Ca -0.15 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2h56 h ALA 28 Cb 1.70 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.43 2h56 h ALA 28 CO 0.19 0.48 0.00 0.41 0.00 0.00 0.00 179.25 180.33 2h56 n GLY 29 N 0.58 -0.70 3.84 0.00 0.00 -0.44 -4.90 105.19 103.56 2h56 n GLY 29 Ca 0.01 -1.18 -0.32 0.00 0.00 0.00 0.00 46.02 44.53 2h56 n GLY 29 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2h56 s GLU 30 N 0.00 3.95 0.36 1.61 -1.05 -1.26 -4.61 118.70 117.71 2h56 s GLU 30 Ca 0.00 1.00 0.08 0.00 -0.15 0.00 0.00 54.97 55.90 2h56 s GLU 30 Cb 0.00 -2.14 -0.06 0.00 -0.44 0.00 0.00 34.13 31.50 2h56 s GLU 30 CO 0.00 -0.27 0.03 0.14 0.95 0.00 0.00 175.26 176.11 2h56 s VAL 31 N -2.54 2.42 0.11 1.83 -7.23 -0.88 -4.99 120.40 109.13 2h56 s VAL 31 Ca 0.60 -1.96 0.03 0.00 -1.81 0.00 0.00 61.98 58.84 2h56 s VAL 31 Cb -0.10 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.95 2h56 s VAL 31 CO 0.29 -0.13 -0.09 0.00 -0.31 0.00 0.00 175.10 174.85 2h56 s GLN 32 N -3.73 0.92 -0.29 4.82 -2.07 -1.26 -0.63 119.66 117.41 2h56 s GLN 32 Ca 0.36 -1.32 -0.03 0.00 -1.82 0.00 0.00 55.36 52.55 2h56 s GLN 32 Cb 0.03 -0.45 0.10 0.00 -1.09 0.00 0.00 33.01 31.59 2h56 s GLN 32 CO 0.19 0.05 0.11 -1.17 -1.32 0.00 0.00 175.29 173.15 2h56 s LEU 33 N -2.90 1.25 0.25 2.60 2.96 0.73 -5.00 118.68 118.57 2h56 s LEU 33 Ca 0.11 -1.40 -0.30 0.00 -0.22 0.00 0.00 54.13 52.32 2h56 s LEU 33 Cb 0.02 -0.56 -0.09 0.00 0.50 0.00 0.00 46.19 46.05 2h56 s LEU 33 CO -0.01 -0.42 1.33 -2.16 -1.32 0.00 0.00 176.35 173.76 2h56 s PRO 34 N 1.90 4.37 -0.20 0.98 0.04 -1.26 -2.04 135.00 138.78 2h56 s PRO 34 Ca 0.09 2.14 0.01 0.00 0.04 0.00 0.00 61.00 63.28 2h56 s PRO 34 Cb -0.17 -3.14 0.04 0.00 0.04 0.00 0.00 34.50 31.27 2h56 s PRO 34 CO -0.31 -0.25 -0.15 0.99 0.04 0.00 0.00 177.00 177.33 2h56 s THR 35 N -0.30 1.95 -0.02 1.26 2.01 0.44 -4.44 115.64 116.53 2h56 s THR 35 Ca 0.55 -1.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 2h56 s THR 35 Cb -0.38 -1.91 -0.05 0.00 0.01 0.00 0.00 72.50 70.17 2h56 s THR 35 CO 0.43 0.28 1.39 -0.54 -0.69 0.00 0.00 174.62 175.49 2h56 s LYS 36 N 1.28 4.28 0.12 4.92 -0.14 -1.18 -1.54 119.74 127.49 2h56 s LYS 36 Ca -0.00 1.93 -0.30 0.00 -1.36 0.00 0.00 55.97 56.24 2h56 s LYS 36 Cb -0.16 -3.61 -0.08 0.00 -1.68 0.00 0.00 37.83 32.31 2h56 s LYS 36 CO -0.09 -0.59 1.59 -1.00 -0.76 0.00 0.00 175.35 174.49 2h56 h PRO 37 N 7.93 -0.54 -4.70 -1.68 0.13 -1.92 -3.42 132.00 127.81 2h56 h PRO 37 Ca -0.37 0.04 -0.71 0.00 -0.87 0.00 0.00 66.00 64.09 2h56 h PRO 37 Cb 1.17 0.12 -0.20 0.00 0.13 0.00 0.00 31.00 32.22 2h56 h PRO 37 CO 0.91 -0.36 -0.13 1.21 -0.23 0.00 0.00 178.00 179.40 2h56 s ASN 38 N -4.81 6.19 0.16 1.44 3.84 -1.26 -4.98 114.94 115.53 2h56 s ASN 38 Ca -0.16 -1.04 -0.16 0.00 0.21 0.00 0.00 52.86 51.71 2h56 s ASN 38 Cb 0.08 -2.24 0.10 0.00 -0.55 0.00 0.00 41.25 38.65 2h56 s ASN 38 CO 0.64 -0.76 1.71 -0.65 -2.79 0.00 0.00 177.10 175.25 2h56 h PRO 39 N 8.87 0.14 -0.61 0.43 0.11 -1.89 -0.99 132.00 138.06 2h56 h PRO 39 Ca -0.28 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.82 2h56 h PRO 39 Cb 1.10 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 2h56 h PRO 39 CO 0.91 0.09 0.37 0.35 -0.21 0.00 0.00 178.00 179.52 2h56 h PHE 40 N 0.15 0.79 -0.60 0.65 3.57 -1.94 -1.57 116.94 118.00 2h56 h PHE 40 Ca 0.19 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.73 2h56 h PHE 40 Cb 0.25 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 2h56 h PHE 40 CO -0.24 0.53 0.35 0.37 -2.23 0.00 0.00 178.31 177.10 2h56 h GLN 41 N 0.82 0.65 -0.81 1.11 -0.00 -1.63 -2.35 115.11 112.90 2h56 h GLN 41 Ca 0.22 -0.04 0.04 0.00 -0.00 0.00 0.00 58.65 58.87 2h56 h GLN 41 Cb -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 27.48 27.25 2h56 h GLN 41 CO -0.04 0.43 0.51 0.77 0.00 0.00 0.00 178.83 180.50 2h56 h SER 42 N 0.67 0.84 -0.51 -0.69 0.02 -0.71 -0.83 113.55 112.35 2h56 h SER 42 Ca 0.25 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.15 2h56 h SER 42 Cb 0.09 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 2h56 h SER 42 CO -0.13 0.57 0.10 -0.07 -1.14 0.00 0.00 176.83 176.16 2h56 h LEU 43 N 0.99 0.79 0.07 5.07 3.38 -0.80 0.18 115.31 125.00 2h56 h LEU 43 Ca 0.33 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2h56 h LEU 43 Cb 0.04 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2h56 h LEU 43 CO -0.12 0.84 -0.04 0.58 0.09 0.00 0.00 178.44 179.79 2h56 h VAL 44 N 0.71 1.05 -0.93 1.22 2.07 -1.15 -0.39 116.25 118.83 2h56 h VAL 44 Ca 0.16 -0.44 0.13 0.00 0.82 0.00 0.00 66.70 67.37 2h56 h VAL 44 Cb 0.38 1.34 -0.09 0.00 -1.52 0.00 0.00 31.29 31.40 2h56 h VAL 44 CO 0.01 0.11 0.55 -1.28 0.02 0.00 0.00 177.57 176.97 2h56 h SER 45 N -0.30 0.75 -0.78 0.57 0.87 -1.10 -0.63 113.55 112.93 2h56 h SER 45 Ca -0.01 0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 2h56 h SER 45 Cb 0.26 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.11 2h56 h SER 45 CO 0.02 0.37 0.37 0.28 -0.53 0.00 0.00 176.83 177.33 2h56 h SER 46 N 0.82 1.03 -0.65 6.23 0.02 -0.09 -1.84 113.55 119.08 2h56 h SER 46 Ca 0.48 -0.14 -0.06 0.00 -0.84 0.00 0.00 61.79 61.23 2h56 h SER 46 Cb 0.57 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 2h56 h SER 46 CO -0.31 0.88 0.16 0.40 -1.14 0.00 0.00 176.83 176.83 2h56 h ILE 47 N 1.11 1.26 -0.15 3.27 2.04 -0.29 -3.00 117.51 121.75 2h56 h ILE 47 Ca 0.27 -0.93 -0.04 0.00 1.00 0.00 0.00 64.86 65.15 2h56 h ILE 47 Cb 0.13 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 2h56 h ILE 47 CO -0.03 0.35 -0.10 0.58 0.00 0.00 0.00 178.15 178.95 2h56 h VAL 48 N 0.96 1.16 -0.06 1.67 2.07 -0.73 -2.75 116.25 118.58 2h56 h VAL 48 Ca 0.20 -0.69 -0.12 0.00 0.82 0.00 0.00 66.70 66.91 2h56 h VAL 48 Cb 0.36 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.27 2h56 h VAL 48 CO 0.00 0.22 -0.53 -0.33 0.02 0.00 0.00 177.57 176.95 2h56 h GLU 49 N 0.22 0.16 -6.12 1.57 5.08 -1.20 -3.45 114.58 110.83 2h56 h GLU 49 Ca 0.05 -0.09 -0.75 0.00 -1.00 0.00 0.00 59.36 57.56 2h56 h GLU 49 Cb 0.32 0.01 0.04 0.00 0.50 0.00 0.00 28.75 29.62 2h56 h GLU 49 CO 0.02 0.65 0.37 1.04 -1.00 0.00 0.00 179.01 180.08 2h56 n GLN 50 N -3.92 0.57 -1.02 2.33 6.02 -1.04 -1.36 117.38 118.96 2h56 n GLN 50 Ca -0.02 0.21 -0.01 0.00 -0.01 0.00 0.00 57.00 57.17 2h56 n GLN 50 Cb 0.56 -1.78 -0.00 0.00 1.02 0.00 0.00 30.24 30.03 2h56 n GLN 50 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 2h56 n GLN 51 N 2.56 -0.91 -4.29 -1.09 6.02 -1.26 -4.99 117.38 113.41 2h56 n GLN 51 Ca 0.21 0.27 -0.22 0.00 -0.01 0.00 0.00 57.00 57.25 2h56 n GLN 51 Cb 0.11 -3.98 -0.12 0.00 1.02 0.00 0.00 30.24 27.28 2h56 n GLN 51 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2h56 s LEU 52 N -0.14 2.37 0.83 1.08 1.43 -0.47 -5.11 118.68 118.67 2h56 s LEU 52 Ca 0.00 -0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 52.22 2h56 s LEU 52 Cb 0.00 -0.80 0.09 0.00 0.03 0.00 0.00 46.19 45.52 2h56 s LEU 52 CO 0.00 -0.01 1.15 -0.94 0.23 0.00 0.00 176.35 176.77 2h56 s SER 53 N -2.28 3.68 0.36 2.29 1.04 -1.26 -4.76 113.70 112.77 2h56 s SER 53 Ca 0.10 2.14 0.10 0.00 0.48 0.00 0.00 55.95 58.76 2h56 s SER 53 Cb -0.08 -2.56 0.84 0.00 0.10 0.00 0.00 66.02 64.32 2h56 s SER 53 CO 0.05 -2.60 1.88 0.16 0.98 0.00 0.00 173.24 173.71 2h56 h ILE 54 N -1.25 0.84 0.18 -1.02 -2.65 -1.98 -0.17 117.51 111.45 2h56 h ILE 54 Ca -0.44 -0.23 -0.01 0.00 1.03 0.00 0.00 64.86 65.21 2h56 h ILE 54 Cb 1.26 0.12 0.00 0.00 -2.05 0.00 0.00 36.82 36.15 2h56 h ILE 54 CO 0.46 0.12 -0.09 0.50 0.03 0.00 0.00 178.15 179.18 2h56 h LYS 55 N 0.66 -0.24 0.05 0.16 3.64 -1.99 -1.94 116.57 116.92 2h56 h LYS 55 Ca 0.43 0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.86 2h56 h LYS 55 Cb 0.72 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.55 2h56 h LYS 55 CO -0.19 0.04 -0.26 0.00 -2.27 0.00 0.00 179.45 176.77 2h56 h ALA 56 N 0.25 -0.40 -0.53 5.00 0.00 -1.84 -2.43 119.26 119.31 2h56 h ALA 56 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2h56 h ALA 56 Cb 0.39 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 2h56 h ALA 56 CO 0.04 -0.78 0.21 0.00 0.00 0.00 0.00 179.25 178.72 2h56 h ALA 57 N 0.35 1.37 -0.50 0.00 0.00 -1.11 -2.47 119.26 116.90 2h56 h ALA 57 Ca 0.05 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 2h56 h ALA 57 Cb 0.49 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2h56 h ALA 57 CO -0.19 0.48 -0.17 1.03 0.00 0.00 0.00 179.25 180.40 2h56 h SER 58 N 0.76 0.99 -0.33 0.00 0.87 -1.18 -0.18 113.55 114.48 2h56 h SER 58 Ca 0.18 -0.35 0.02 0.00 -1.23 0.00 0.00 61.79 60.42 2h56 h SER 58 Cb 0.15 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 61.82 2h56 h SER 58 CO -0.02 1.13 0.17 0.00 -0.53 0.00 0.00 176.83 177.58 2h56 h ALA 59 N 0.94 0.40 -0.21 6.23 0.00 -0.99 -0.56 119.26 125.07 2h56 h ALA 59 Ca 0.12 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 2h56 h ALA 59 Cb 0.73 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2h56 h ALA 59 CO 0.06 -0.21 -0.20 0.82 0.00 0.00 0.00 179.25 179.72 2h56 h ILE 60 N 0.35 1.32 -0.66 0.00 2.04 -1.19 -2.76 117.51 116.60 2h56 h ILE 60 Ca 0.14 -1.36 -0.05 0.00 1.00 0.00 0.00 64.86 64.59 2h56 h ILE 60 Cb 0.04 1.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 2h56 h ILE 60 CO -0.09 0.42 0.20 0.22 0.00 0.00 0.00 178.15 178.90 2h56 h TYR 61 N 0.20 1.04 -0.95 1.37 3.20 -0.99 -1.79 116.97 119.05 2h56 h TYR 61 Ca 0.04 -0.09 0.13 0.00 3.14 0.00 0.00 58.73 61.94 2h56 h TYR 61 Cb 0.75 -0.31 -0.08 0.00 1.54 0.00 0.00 36.73 38.63 2h56 h TYR 61 CO 0.08 0.83 0.61 0.78 -1.64 0.00 0.00 178.16 178.82 2h56 h GLY 62 N 1.06 1.46 1.96 1.82 0.00 -0.91 -1.09 103.07 107.37 2h56 h GLY 62 Ca 0.22 -0.38 -0.18 0.00 0.00 0.00 0.00 47.33 46.99 2h56 h GLY 62 CO -0.01 0.14 -0.84 3.21 0.00 0.00 0.00 176.54 179.05 2h56 h ARG 63 N 0.88 0.03 -0.58 4.80 3.08 -1.08 -2.81 114.38 118.70 2h56 h ARG 63 Ca 0.47 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.43 2h56 h ARG 63 Cb 0.56 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.60 2h56 h ARG 63 CO -0.24 0.85 0.14 0.28 -1.07 0.00 0.00 179.97 179.93 2h56 h VAL 64 N 0.02 1.25 -0.95 2.04 2.07 -0.51 -2.31 116.25 117.85 2h56 h VAL 64 Ca -0.01 -0.90 0.06 0.00 0.82 0.00 0.00 66.70 66.66 2h56 h VAL 64 Cb 1.47 0.73 -0.06 0.00 -1.52 0.00 0.00 31.29 31.91 2h56 h VAL 64 CO 0.11 0.33 0.61 -0.33 0.02 0.00 0.00 177.57 178.32 2h56 h GLU 65 N 0.83 1.07 -0.46 1.57 5.08 -1.08 -1.52 114.58 120.07 2h56 h GLU 65 Ca 0.18 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2h56 h GLU 65 Cb 0.35 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2h56 h GLU 65 CO 0.00 0.71 0.04 1.96 -1.00 0.00 0.00 179.01 180.73 2h56 h GLN 66 N 1.10 0.79 -0.45 2.33 4.20 -1.23 0.12 115.11 121.97 2h56 h GLN 66 Ca 0.40 -0.23 0.08 0.00 0.06 0.00 0.00 58.65 58.96 2h56 h GLN 66 Cb 0.16 -0.08 -0.06 0.00 0.30 0.00 0.00 27.48 27.79 2h56 h GLN 66 CO -0.15 0.82 0.07 -0.07 -0.67 0.00 0.00 178.83 178.82 2h56 h LEU 67 N 0.65 -0.05 0.00 1.46 3.38 -0.76 -1.51 115.31 118.47 2h56 h LEU 67 Ca 0.14 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2h56 h LEU 67 Cb 0.43 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2h56 h LEU 67 CO 0.01 0.01 0.00 1.33 0.09 0.00 0.00 178.44 179.88 2h56 n VAL 68 N -5.13 0.01 -1.30 1.22 0.24 -0.73 -4.94 118.33 107.70 2h56 n VAL 68 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2h56 n VAL 68 Cb 0.22 -0.51 0.00 0.00 -1.47 0.00 0.00 33.84 32.08 2h56 n VAL 68 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2h56 n GLY 69 N 1.31 0.66 0.00 7.63 0.00 0.26 -4.91 105.19 110.13 2h56 n GLY 69 Ca 0.13 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2h56 n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2h56 n GLY 70 N -1.59 0.64 3.66 -0.02 0.00 -0.35 -5.00 105.19 102.53 2h56 n GLY 70 Ca 0.00 -1.59 -0.46 0.00 0.00 0.00 0.00 46.02 43.98 2h56 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h56 n ALA 71 N -0.86 0.85 -2.60 4.61 0.00 -1.26 -4.65 120.51 116.59 2h56 n ALA 71 Ca 0.00 0.43 -0.43 0.00 0.00 0.00 0.00 53.44 53.44 2h56 n ALA 71 Cb 0.00 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 17.17 2h56 n ALA 71 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2h56 s LEU 72 N 0.32 3.77 -0.02 0.00 2.96 -1.26 -4.83 118.68 119.63 2h56 s LEU 72 Ca 0.71 0.51 0.02 0.00 -0.22 0.00 0.00 54.13 55.15 2h56 s LEU 72 Cb -0.69 -3.46 -0.03 0.00 0.50 0.00 0.00 46.19 42.51 2h56 s LEU 72 CO 0.48 -1.13 0.01 -0.62 -1.32 0.00 0.00 176.35 173.77 2h56 n GLU 73 N 7.49 3.29 -3.94 1.98 1.02 -1.26 -4.64 120.64 124.58 2h56 n GLU 73 Ca 0.11 -0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.12 2h56 n GLU 73 Cb 0.49 -1.05 -0.13 0.00 -0.02 0.00 0.00 31.44 30.72 2h56 n GLU 73 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2h56 s LYS 74 N -2.06 0.13 0.44 3.49 2.20 -1.26 -4.67 119.74 118.01 2h56 s LYS 74 Ca -0.01 -0.16 0.11 0.00 -0.36 0.00 0.00 55.97 55.55 2h56 s LYS 74 Cb 0.01 -0.05 0.97 0.00 -1.51 0.00 0.00 37.83 37.25 2h56 s LYS 74 CO 0.08 0.01 2.05 -1.35 -0.36 0.00 0.00 175.35 175.78 2h56 h PRO 75 N 5.81 0.27 -0.47 4.03 0.11 -1.98 -2.24 132.00 137.53 2h56 h PRO 75 Ca -0.26 -0.03 0.14 0.00 0.11 0.00 0.00 66.00 65.95 2h56 h PRO 75 Cb 1.21 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2h56 h PRO 75 CO 0.49 0.25 0.35 0.93 -0.21 0.00 0.00 178.00 179.80 2h56 h GLU 76 N 0.27 0.00 0.00 1.05 3.07 -1.97 -0.85 114.58 116.16 2h56 h GLU 76 Ca 0.07 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 2h56 h GLU 76 Cb 0.09 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.00 2h56 h GLU 76 CO -0.01 0.00 -0.05 1.96 -1.40 0.00 0.00 179.01 179.52 2h56 h GLN 77 N 0.00 0.00 0.00 2.33 4.20 -1.83 -2.26 115.11 117.54 2h56 h GLN 77 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 2h56 h GLN 77 Cb 0.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.70 2h56 h GLN 77 CO -0.00 0.05 -0.82 -0.07 -0.67 0.00 0.00 178.83 177.32 2h56 h LEU 78 N 0.00 0.00 -0.60 1.46 3.38 -1.33 -3.30 115.31 114.92 2h56 h LEU 78 Ca -0.00 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 57.89 2h56 h LEU 78 Cb 0.12 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 2h56 h LEU 78 CO 0.01 0.08 0.27 0.22 0.09 0.00 0.00 178.44 179.10 2h56 h TYR 79 N 0.00 0.48 0.00 1.13 3.20 -1.45 -2.03 116.97 118.29 2h56 h TYR 79 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2h56 h TYR 79 Cb 0.84 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.99 2h56 h TYR 79 CO 0.00 0.18 0.00 0.54 -1.64 0.00 0.00 178.16 177.24 2h56 n ARG 80 N -4.92 0.12 -3.93 1.82 3.00 -1.24 -4.68 116.66 106.82 2h56 n ARG 80 Ca 0.08 0.17 -0.35 0.00 -0.01 0.00 0.00 57.85 57.74 2h56 n ARG 80 Cb 0.22 -1.50 -0.12 0.00 0.00 0.00 0.00 32.46 31.06 2h56 n ARG 80 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2h56 s VAL 81 N -2.78 4.29 0.72 1.55 1.01 -0.77 -5.10 120.40 119.32 2h56 s VAL 81 Ca 0.12 -0.19 -0.11 0.00 0.00 0.00 0.00 61.98 61.80 2h56 s VAL 81 Cb 0.11 -2.96 0.02 0.00 0.00 0.00 0.00 36.38 33.55 2h56 s VAL 81 CO 0.28 0.40 1.07 -0.94 0.00 0.00 0.00 175.10 175.90 2h56 s SER 82 N 1.13 5.14 0.19 3.32 1.04 -1.26 -4.92 113.70 118.33 2h56 s SER 82 Ca 0.04 1.57 -0.12 0.00 0.48 0.00 0.00 55.95 57.92 2h56 s SER 82 Cb -0.14 -2.41 0.15 0.00 0.10 0.00 0.00 66.02 63.72 2h56 s SER 82 CO 0.03 -1.59 1.81 0.44 0.98 0.00 0.00 173.24 174.91 2h56 h ASP 83 N -0.82 0.53 -0.99 7.02 5.19 -1.97 -2.27 116.42 123.11 2h56 h ASP 83 Ca -0.44 0.01 0.02 0.00 -0.62 0.00 0.00 57.03 56.00 2h56 h ASP 83 Cb 1.22 -0.10 -0.05 0.00 0.18 0.00 0.00 39.33 40.58 2h56 h ASP 83 CO 0.57 0.36 0.65 -0.33 -3.12 0.00 0.00 179.24 177.37 2h56 h GLU 84 N 0.66 1.25 0.03 3.56 3.07 -1.99 -0.15 114.58 121.00 2h56 h GLU 84 Ca 0.24 -0.08 -0.00 0.00 -0.50 0.00 0.00 59.36 59.03 2h56 h GLU 84 Cb 0.08 -0.28 0.00 0.00 -0.84 0.00 0.00 28.75 27.71 2h56 h GLU 84 CO -0.13 0.83 -0.01 0.00 -1.40 0.00 0.00 179.01 178.30 2h56 h ALA 85 N 1.41 -0.03 -1.01 3.43 0.00 -1.83 0.76 119.26 121.99 2h56 h ALA 85 Ca 0.38 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.32 2h56 h ALA 85 Cb -0.07 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 2h56 h ALA 85 CO -0.10 -0.49 0.65 -0.07 0.00 0.00 0.00 179.25 179.24 2h56 h LEU 86 N -0.09 1.04 -0.66 0.00 3.38 -1.01 -1.21 115.31 116.75 2h56 h LEU 86 Ca -0.00 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2h56 h LEU 86 Cb 0.08 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2h56 h LEU 86 CO 0.01 0.67 0.01 0.03 0.09 0.00 0.00 178.44 179.25 2h56 h ARG 87 N 1.18 1.05 0.00 1.13 3.08 -0.39 -1.57 114.38 118.87 2h56 h ARG 87 Ca 0.43 -0.32 -0.03 0.00 0.07 0.00 0.00 59.98 60.13 2h56 h ARG 87 Cb 0.16 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2h56 h ARG 87 CO -0.17 1.02 -0.15 1.96 -1.07 0.00 0.00 179.97 181.56 2h56 h GLN 88 N 0.96 0.00 0.00 0.04 4.20 -0.17 -0.66 115.11 119.48 2h56 h GLN 88 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2h56 h GLN 88 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 2h56 h GLN 88 CO 0.03 0.15 0.00 0.00 -0.67 0.00 0.00 178.83 178.34 2h56 n ALA 89 N -2.46 1.93 0.00 3.87 0.00 -0.52 -4.90 120.51 118.43 2h56 n ALA 89 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2h56 n ALA 89 Cb 0.22 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2h56 n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2h56 n GLY 90 N 0.59 0.85 3.71 0.00 0.00 -0.25 -4.74 105.19 105.34 2h56 n GLY 90 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2h56 n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2h56 s VAL 91 N -2.00 4.70 0.83 1.61 1.01 -0.64 -5.00 120.40 120.91 2h56 s VAL 91 Ca 0.00 1.94 -0.11 0.00 0.00 0.00 0.00 61.98 63.81 2h56 s VAL 91 Cb 0.00 -4.24 0.09 0.00 0.00 0.00 0.00 36.38 32.22 2h56 s VAL 91 CO 0.00 0.13 1.10 -0.94 0.00 0.00 0.00 175.10 175.39 2h56 s SER 92 N 1.04 4.01 0.24 3.32 1.04 -1.26 -4.11 113.70 117.98 2h56 s SER 92 Ca 0.53 1.77 -0.07 0.00 0.48 0.00 0.00 55.95 58.66 2h56 s SER 92 Cb -0.22 -2.43 0.22 0.00 0.10 0.00 0.00 66.02 63.69 2h56 s SER 92 CO 0.27 -2.34 1.87 0.50 0.98 0.00 0.00 173.24 174.52 2h56 h LYS 93 N -1.34 1.27 -0.35 4.02 3.64 -1.98 -1.88 116.57 119.95 2h56 h LYS 93 Ca -0.45 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 58.77 2h56 h LYS 93 Cb 1.25 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 2h56 h LYS 93 CO 0.51 0.91 0.11 0.00 -2.27 0.00 0.00 179.45 178.71 2h56 h ARG 94 N 1.29 0.55 -0.22 1.90 3.08 -2.00 -2.56 114.38 116.41 2h56 h ARG 94 Ca 0.33 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 60.24 2h56 h ARG 94 Cb -0.02 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 2h56 h ARG 94 CO -0.06 0.57 0.06 0.87 -1.07 0.00 0.00 179.97 180.35 2h56 h LYS 95 N 0.42 0.31 -0.50 0.04 1.57 -1.87 -1.61 116.57 114.92 2h56 h LYS 95 Ca 0.11 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 2h56 h LYS 95 Cb 0.25 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 2h56 h LYS 95 CO -0.00 0.28 0.18 0.82 -0.57 0.00 0.00 179.45 180.15 2h56 h ILE 96 N 0.31 1.22 -0.67 1.86 2.04 -1.10 -0.29 117.51 120.88 2h56 h ILE 96 Ca 0.08 -0.72 0.02 0.00 1.00 0.00 0.00 64.86 65.23 2h56 h ILE 96 Cb 0.11 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 2h56 h ILE 96 CO -0.00 0.27 0.43 -0.08 0.00 0.00 0.00 178.15 178.76 2h56 h GLU 97 N 0.68 0.83 -0.43 2.37 4.81 -0.97 -0.72 114.58 121.15 2h56 h GLU 97 Ca 0.16 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 2h56 h GLU 97 Cb 0.24 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 2h56 h GLU 97 CO -0.01 0.55 0.15 1.88 -0.73 0.00 0.00 179.01 180.86 2h56 h TYR 98 N 0.86 0.68 -0.33 0.92 0.05 -0.89 -0.76 116.97 117.49 2h56 h TYR 98 Ca 0.26 -0.06 -0.01 0.00 0.05 0.00 0.00 58.73 58.97 2h56 h TYR 98 Cb -0.04 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.49 2h56 h TYR 98 CO -0.04 0.60 0.18 0.82 -1.05 0.00 0.00 178.16 178.68 2h56 h ILE 99 N 0.55 1.13 -0.93 -2.88 2.04 -0.80 -0.57 117.51 116.05 2h56 h ILE 99 Ca 0.14 -0.34 0.09 0.00 1.00 0.00 0.00 64.86 65.75 2h56 h ILE 99 Cb 0.23 0.76 -0.07 0.00 -0.74 0.00 0.00 36.82 36.99 2h56 h ILE 99 CO -0.01 0.13 0.58 0.03 0.00 0.00 0.00 178.15 178.88 2h56 h ARG 100 N 0.41 0.96 -0.21 2.37 2.47 -0.99 -0.62 114.38 118.77 2h56 h ARG 100 Ca 0.12 -0.06 -0.11 0.00 -1.26 0.00 0.00 59.98 58.67 2h56 h ARG 100 Cb 0.05 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.14 2h56 h ARG 100 CO -0.02 0.64 -0.32 1.25 0.56 0.00 0.00 179.97 182.07 2h56 h HIS 101 N 0.99 0.49 -0.44 3.04 2.76 -0.35 -0.35 115.15 121.30 2h56 h HIS 101 Ca 0.43 -0.12 -0.03 0.00 -2.20 0.00 0.00 60.37 58.46 2h56 h HIS 101 Cb 0.31 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.14 2h56 h HIS 101 CO -0.02 0.70 0.17 0.28 -1.30 0.00 0.00 177.93 177.76 2h56 h VAL 102 N 0.37 1.20 0.02 5.26 2.07 -0.10 -1.69 116.25 123.38 2h56 h VAL 102 Ca 0.05 -0.64 0.01 0.00 0.82 0.00 0.00 66.70 66.94 2h56 h VAL 102 Cb 0.75 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 2h56 h VAL 102 CO 0.06 0.23 -0.09 0.00 0.02 0.00 0.00 177.57 177.79 2h56 h GLU 104 N -0.16 0.17 -0.19 0.00 4.81 -0.95 -0.65 114.58 117.61 2h56 h GLU 104 Ca 0.03 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.10 2h56 h GLU 104 Cb 0.20 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2h56 h GLU 104 CO -0.08 0.11 -0.50 0.45 -0.73 0.00 0.00 179.01 178.26 2h56 h HIS 105 N 0.18 0.65 -0.16 0.92 3.86 -0.78 -1.67 115.15 118.14 2h56 h HIS 105 Ca 0.31 -0.22 -0.06 0.00 -1.16 0.00 0.00 60.37 59.25 2h56 h HIS 105 Cb 0.49 -0.13 -0.00 0.00 1.06 0.00 0.00 27.41 28.83 2h56 h HIS 105 CO -0.30 0.92 -0.14 0.28 0.86 0.00 0.00 177.93 179.55 2h56 h VAL 106 N 0.41 1.34 0.00 2.45 2.07 -0.62 -1.75 116.25 120.16 2h56 h VAL 106 Ca 0.02 -1.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.26 2h56 h VAL 106 Cb 1.03 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 32.61 2h56 h VAL 106 CO 0.09 0.38 -0.02 -0.33 0.02 0.00 0.00 177.57 177.71 2h56 h GLU 107 N 0.02 0.00 0.00 1.57 5.08 -1.08 -2.73 114.58 117.44 2h56 h GLU 107 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2h56 h GLU 107 Cb 0.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2h56 h GLU 107 CO 0.04 0.02 -0.23 0.66 -1.00 0.00 0.00 179.01 178.49 2h56 h SER 108 N 0.00 0.00 0.00 1.42 4.64 -1.42 -3.48 113.55 114.71 2h56 h SER 108 Ca -0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2h56 h SER 108 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2h56 h SER 108 CO 0.00 0.03 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 2h56 n GLY 109 N 1.28 0.75 0.15 -0.77 0.00 -1.03 -4.92 105.19 100.66 2h56 n GLY 109 Ca 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 2h56 n GLY 109 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2h56 h ARG 110 N 4.02 0.15 -3.78 1.61 3.08 -1.70 -3.32 114.38 114.44 2h56 h ARG 110 Ca 0.00 -0.01 -0.74 0.00 0.07 0.00 0.00 59.98 59.30 2h56 h ARG 110 Cb 0.00 -0.03 -0.31 0.00 0.08 0.00 0.00 29.97 29.71 2h56 h ARG 110 CO 0.00 0.10 -0.17 -1.17 -1.07 0.00 0.00 179.97 177.66 2h56 s LEU 111 N -10.40 5.94 -0.39 3.04 2.96 -0.70 -5.03 118.68 114.10 2h56 s LEU 111 Ca -0.13 -2.66 -0.13 0.00 -0.22 0.00 0.00 54.13 50.99 2h56 s LEU 111 Cb 0.12 -2.03 0.02 0.00 0.50 0.00 0.00 46.19 44.81 2h56 s LEU 111 CO 0.71 -0.50 0.26 -0.62 -1.32 0.00 0.00 176.35 174.87 2h56 s ASP 112 N 1.59 5.96 0.46 3.68 2.15 -1.25 -4.54 116.67 124.72 2h56 s ASP 112 Ca 0.16 -0.87 0.22 0.00 0.43 0.00 0.00 52.55 52.49 2h56 s ASP 112 Cb -0.17 -2.11 1.12 0.00 -0.30 0.00 0.00 42.92 41.46 2h56 s ASP 112 CO -0.05 -0.40 1.94 -0.26 -0.17 0.00 0.00 175.17 176.23 2h56 h PHE 113 N 8.54 0.00 -0.10 -5.34 0.04 -1.96 -2.38 116.94 115.74 2h56 h PHE 113 Ca -0.27 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.45 2h56 h PHE 113 Cb 1.12 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.27 2h56 h PHE 113 CO 0.57 0.22 -0.15 1.15 -0.60 0.00 0.00 178.31 179.50 2h56 h THR 114 N 0.00 1.38 -0.99 -1.55 2.02 -1.94 -2.45 112.91 109.39 2h56 h THR 114 Ca -0.00 -1.39 0.08 0.00 0.77 0.00 0.00 66.41 65.87 2h56 h THR 114 Cb 0.53 2.07 -0.07 0.00 -1.74 0.00 0.00 68.15 68.93 2h56 h THR 114 CO 0.03 0.40 0.63 -0.33 0.37 0.00 0.00 175.52 176.61 2h56 h GLU 115 N -0.16 1.09 -0.70 6.66 3.07 -1.96 -2.77 114.58 119.81 2h56 h GLU 115 Ca 0.01 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 2h56 h GLU 115 Cb 0.71 -0.24 -0.03 0.00 -0.84 0.00 0.00 28.75 28.34 2h56 h GLU 115 CO 0.03 0.72 0.33 -0.07 -1.40 0.00 0.00 179.01 178.62 2h56 h LEU 116 N 1.12 0.90 -8.32 1.33 3.38 -1.34 -3.23 115.31 109.15 2h56 h LEU 116 Ca 0.44 -0.10 -0.26 0.00 0.09 0.00 0.00 57.88 58.05 2h56 h LEU 116 Cb 0.23 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2h56 h LEU 116 CO -0.19 0.77 0.70 -1.61 0.09 0.00 0.00 178.44 178.20 2h56 s GLU 117 N -5.56 2.28 0.00 1.13 2.02 -0.93 -1.25 118.70 116.39 2h56 s GLU 117 Ca -0.11 0.17 0.00 0.00 0.02 0.00 0.00 54.97 55.05 2h56 s GLU 117 Cb 0.16 -4.86 0.00 0.00 0.10 0.00 0.00 34.13 29.54 2h56 s GLU 117 CO 0.80 -3.56 0.00 0.41 0.02 0.00 0.00 175.26 172.94 2h56 n GLY 118 N 6.61 3.78 3.80 -1.39 0.00 -1.25 -4.94 105.19 111.82 2h56 n GLY 118 Ca 0.39 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 2h56 n GLY 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2h56 s ALA 119 N 0.00 2.85 0.61 4.61 0.00 -0.38 -5.01 121.76 124.43 2h56 s ALA 119 Ca 0.00 0.48 -0.19 0.00 0.00 0.00 0.00 51.96 52.25 2h56 s ALA 119 Cb 0.00 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 2h56 s ALA 119 CO 0.00 -0.48 1.28 -1.83 0.00 0.00 0.00 175.76 174.73 2h56 s GLU 120 N -3.62 2.80 0.25 0.00 4.04 -1.26 -4.81 118.70 116.09 2h56 s GLU 120 Ca 0.65 2.02 -0.04 0.00 0.04 0.00 0.00 54.97 57.64 2h56 s GLU 120 Cb -0.15 -1.95 0.47 0.00 0.02 0.00 0.00 34.13 32.52 2h56 s GLU 120 CO 0.27 -1.39 1.70 0.00 -1.84 0.00 0.00 175.26 173.99 2h56 h ALA 121 N 0.84 1.00 -0.97 -0.84 0.00 -1.95 -0.33 119.26 117.02 2h56 h ALA 121 Ca -0.51 0.15 0.30 0.00 0.00 0.00 0.00 54.91 54.85 2h56 h ALA 121 Cb 1.32 0.19 -0.15 0.00 0.00 0.00 0.00 17.79 19.15 2h56 h ALA 121 CO 0.55 -0.31 0.46 0.00 0.00 0.00 0.00 179.25 179.95 2h56 h THR 122 N 0.32 0.30 0.06 0.00 1.03 -1.96 -0.70 112.91 111.95 2h56 h THR 122 Ca 0.42 -0.10 -0.15 0.00 -0.01 0.00 0.00 66.41 66.58 2h56 h THR 122 Cb 0.70 -0.01 0.01 0.00 -1.07 0.00 0.00 68.15 67.78 2h56 h THR 122 CO -0.48 0.05 -0.61 0.74 -0.01 0.00 0.00 175.52 175.21 2h56 h THR 123 N 0.29 1.50 -0.26 0.00 2.02 -1.41 -2.97 112.91 112.08 2h56 h THR 123 Ca 0.68 -2.27 0.06 0.00 0.77 0.00 0.00 66.41 65.65 2h56 h THR 123 Cb 1.51 2.92 -0.07 0.00 -1.74 0.00 0.00 68.15 70.77 2h56 h THR 123 CO -0.63 0.64 -0.21 0.58 0.37 0.00 0.00 175.52 176.28 2h56 h VAL 124 N -0.32 0.45 -0.94 3.16 2.07 -1.28 -0.25 116.25 119.15 2h56 h VAL 124 Ca -0.09 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.53 2h56 h VAL 124 Cb 1.40 0.45 -0.08 0.00 -1.52 0.00 0.00 31.29 31.54 2h56 h VAL 124 CO 0.12 0.00 0.58 0.40 0.02 0.00 0.00 177.57 178.68 2h56 h ILE 125 N -0.20 0.95 0.24 4.57 5.03 -1.22 0.75 117.51 127.63 2h56 h ILE 125 Ca 0.14 -0.33 -0.01 0.00 -0.12 0.00 0.00 64.86 64.55 2h56 h ILE 125 Cb 0.42 -0.09 -0.00 0.00 -3.03 0.00 0.00 36.82 34.12 2h56 h ILE 125 CO -0.38 0.17 -0.13 -0.33 -0.68 0.00 0.00 178.15 176.81 2h56 h GLU 126 N 0.95 -0.33 -0.64 2.37 5.08 -1.18 -0.55 114.58 120.27 2h56 h GLU 126 Ca 0.45 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 2h56 h GLU 126 Cb 0.38 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 2h56 h GLU 126 CO -0.24 -0.22 0.42 0.87 -1.00 0.00 0.00 179.01 178.84 2h56 h LYS 127 N -0.35 0.85 -0.36 2.33 1.79 -0.12 -2.59 116.57 118.13 2h56 h LYS 127 Ca -0.03 -0.06 -0.10 0.00 -2.18 0.00 0.00 60.65 58.29 2h56 h LYS 127 Cb 0.28 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 2h56 h LYS 127 CO 0.04 0.57 -0.15 -0.07 -1.08 0.00 0.00 179.45 178.76 2h56 h LEU 128 N 0.87 0.75 -0.37 2.94 3.38 -0.80 -3.28 115.31 118.80 2h56 h LEU 128 Ca 0.24 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2h56 h LEU 128 Cb -0.09 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.45 2h56 h LEU 128 CO -0.05 0.98 0.00 0.71 0.09 0.00 0.00 178.44 180.17 2h56 h THR 129 N 0.52 0.00 -0.41 0.22 1.35 -0.93 -2.32 112.91 111.33 2h56 h THR 129 Ca 0.08 -0.59 0.12 0.00 -0.55 0.00 0.00 66.41 65.47 2h56 h THR 129 Cb 0.69 1.54 -0.02 0.00 -1.73 0.00 0.00 68.15 68.63 2h56 h THR 129 CO 0.05 0.00 0.52 0.00 -0.25 0.00 0.00 175.52 175.84 2h56 h ALA 130 N 2.24 2.10 -2.41 6.62 0.00 -1.53 -3.41 119.26 122.87 2h56 h ALA 130 Ca 0.00 -0.01 -0.57 0.00 0.00 0.00 0.00 54.91 54.33 2h56 h ALA 130 Cb 0.71 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 2h56 h ALA 130 CO 0.00 -0.73 0.38 0.42 0.00 0.00 0.00 179.25 179.32 2h56 s ILE 131 N -4.52 4.88 0.28 0.00 1.01 -0.87 -5.01 121.20 116.97 2h56 s ILE 131 Ca -0.04 1.74 -0.28 0.00 0.00 0.00 0.00 60.65 62.07 2h56 s ILE 131 Cb 0.14 -4.18 -0.14 0.00 0.01 0.00 0.00 42.46 38.29 2h56 s ILE 131 CO 0.49 0.07 1.05 0.29 0.00 0.00 0.00 174.94 176.85 2h56 n LYS 132 N 4.82 1.42 0.00 2.79 5.02 -1.26 -1.67 118.16 129.27 2h56 n LYS 132 Ca 0.05 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.83 2h56 n LYS 132 Cb 0.49 -1.90 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 2h56 n LYS 132 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2h56 n GLY 133 N 1.27 2.86 3.51 0.72 0.00 -1.26 -4.61 105.19 107.68 2h56 n GLY 133 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 2h56 n GLY 133 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2h56 s ILE 134 N -1.44 4.85 0.57 -0.61 -1.09 -0.67 -5.02 121.20 117.78 2h56 s ILE 134 Ca 0.00 -0.00 0.03 0.00 -2.23 0.00 0.00 60.65 58.45 2h56 s ILE 134 Cb 0.00 -4.21 0.06 0.00 -1.58 0.00 0.00 42.46 36.73 2h56 s ILE 134 CO 0.00 -0.61 0.80 -0.83 -1.23 0.00 0.00 174.94 173.06 2h56 s GLY 135 N 2.07 1.82 0.16 6.18 0.00 -1.26 -4.37 107.32 111.92 2h56 s GLY 135 Ca 0.21 -1.61 -0.29 0.00 0.00 0.00 0.00 44.72 43.03 2h56 s GLY 135 CO 0.18 -1.24 1.55 -1.61 0.00 0.00 0.00 173.10 171.97 2h56 h GLN 136 N 0.04 -0.16 -0.59 2.90 5.75 -1.94 0.33 115.11 121.44 2h56 h GLN 136 Ca -0.38 0.01 0.07 0.00 -0.15 0.00 0.00 58.65 58.20 2h56 h GLN 136 Cb 1.29 0.04 -0.06 0.00 1.07 0.00 0.00 27.48 29.81 2h56 h GLN 136 CO 0.46 -0.11 0.28 2.35 -2.65 0.00 0.00 178.83 179.16 2h56 h TRP 137 N -0.16 0.50 -0.32 3.99 7.01 -1.99 0.13 115.95 125.11 2h56 h TRP 137 Ca 0.16 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.18 2h56 h TRP 137 Cb 0.52 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.43 2h56 h TRP 137 CO -0.86 0.20 0.20 1.15 -2.79 0.00 0.00 178.44 176.34 2h56 h THR 138 N 0.51 1.11 -0.87 2.65 2.02 -1.59 -1.87 112.91 114.86 2h56 h THR 138 Ca 0.28 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 2h56 h THR 138 Cb 0.25 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 67.31 2h56 h THR 138 CO -0.23 0.11 0.50 0.00 0.37 0.00 0.00 175.52 176.27 2h56 h ALA 139 N 1.08 1.11 0.00 6.16 0.00 0.41 -1.08 119.26 126.96 2h56 h ALA 139 Ca 0.12 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2h56 h ALA 139 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.44 2h56 h ALA 139 CO -0.02 0.60 0.00 0.39 0.00 0.00 0.00 179.25 180.22 2h56 n GLU 140 N -4.38 0.30 -3.14 0.00 1.02 0.39 -4.97 120.64 109.85 2h56 n GLU 140 Ca 0.09 0.00 -0.15 0.00 -0.02 0.00 0.00 57.16 57.08 2h56 n GLU 140 Cb 0.08 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 2h56 n GLU 140 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2h56 n PHE 142 N 0.51 -1.19 0.00 -0.32 7.35 -0.41 -5.02 117.46 118.39 2h56 n PHE 142 Ca 0.00 0.49 0.00 0.00 -0.76 0.00 0.00 57.45 57.18 2h56 n PHE 142 Cb 0.10 -1.48 0.00 0.00 0.35 0.00 0.00 39.48 38.45 2h56 n PHE 142 CO 0.00 0.00 0.00 1.19 -0.76 0.00 0.00 176.76 177.19 2h56 n PHE 145 N -1.52 0.00 0.00 -5.13 3.72 -1.26 -2.13 117.46 111.14 2h56 n PHE 145 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 2h56 n PHE 145 Cb 0.39 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 2h56 n PHE 145 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2h56 n SER 146 N 0.63 0.54 -0.25 4.37 2.88 -1.26 -3.08 113.62 117.45 2h56 n SER 146 Ca 0.00 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.69 2h56 n SER 146 Cb 0.00 0.00 0.71 0.00 -0.75 0.00 0.00 64.21 64.17 2h56 n SER 146 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2h56 n LEU 147 N -2.23 0.79 -2.75 2.46 4.32 -0.91 -4.19 117.00 114.49 2h56 n LEU 147 Ca 0.00 -0.25 -0.18 0.00 -0.02 0.00 0.00 56.01 55.56 2h56 n LEU 147 Cb 0.14 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 41.93 2h56 n LEU 147 CO 0.00 0.13 -0.12 0.61 -1.22 0.00 0.00 177.39 176.79 2h56 n GLY 148 N 1.11 -0.50 3.70 -0.72 0.00 -1.26 -4.94 105.19 102.58 2h56 n GLY 148 Ca 0.21 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 2h56 n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2h56 s ARG 149 N -5.38 4.49 0.00 1.61 1.81 -1.26 -4.96 118.95 115.25 2h56 s ARG 149 Ca 0.15 1.30 0.27 0.00 -1.72 0.00 0.00 55.73 55.73 2h56 s ARG 149 Cb -0.07 -3.49 0.76 0.00 -0.45 0.00 0.00 34.95 31.70 2h56 s ARG 149 CO 0.18 -0.12 1.58 1.28 -0.68 0.00 0.00 175.30 177.55 2h56 n LEU 150 N 4.25 1.97 -2.51 2.53 4.77 -1.26 -4.45 117.00 122.30 2h56 n LEU 150 Ca 0.05 -0.65 -0.31 0.00 -0.03 0.00 0.00 56.01 55.07 2h56 n LEU 150 Cb 0.50 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.61 2h56 n LEU 150 CO 0.51 0.33 0.70 -0.90 -1.33 0.00 0.00 177.39 176.70 2h56 n ASP 151 N 0.53 5.86 -4.16 -1.43 5.75 -1.25 -0.34 116.55 121.50 2h56 n ASP 151 Ca 0.17 -3.77 -0.28 0.00 -0.01 0.00 0.00 54.79 50.91 2h56 n ASP 151 Cb 0.43 -0.66 -0.16 0.00 -1.03 0.00 0.00 41.12 39.70 2h56 n ASP 151 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2h56 s VAL 152 N -5.18 1.61 -0.29 2.12 1.01 -1.26 -4.85 120.40 113.56 2h56 s VAL 152 Ca 0.51 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 2h56 s VAL 152 Cb 0.42 -1.38 0.09 0.00 0.00 0.00 0.00 36.38 35.52 2h56 s VAL 152 CO -0.20 0.46 0.09 -0.22 0.00 0.00 0.00 175.10 175.23 2h56 s LEU 153 N 0.07 2.05 -0.88 3.92 2.96 -1.26 -2.19 118.68 123.34 2h56 s LEU 153 Ca -0.06 -1.50 -0.24 0.00 -0.22 0.00 0.00 54.13 52.11 2h56 s LEU 153 Cb -0.13 -0.82 0.05 0.00 0.50 0.00 0.00 46.19 45.79 2h56 s LEU 153 CO 0.03 -0.40 1.32 -0.55 -1.32 0.00 0.00 176.35 175.44 2h56 s SER 154 N 1.66 6.36 0.56 3.68 0.15 -1.26 -4.82 113.70 120.04 2h56 s SER 154 Ca 0.08 -1.10 0.25 0.00 0.70 0.00 0.00 55.95 55.88 2h56 s SER 154 Cb -0.17 -2.54 1.57 0.00 -1.71 0.00 0.00 66.02 63.17 2h56 s SER 154 CO -0.23 -1.59 2.14 0.58 1.20 0.00 0.00 173.24 175.34 2h56 h VAL 155 N 6.37 0.65 -0.01 4.45 2.07 -1.98 -1.92 116.25 125.89 2h56 h VAL 155 Ca -0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.50 2h56 h VAL 155 Cb 1.03 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.71 2h56 h VAL 155 CO 1.33 0.00 -0.10 0.61 0.02 0.00 0.00 177.57 179.42 2h56 n GLY 156 N -1.45 -0.61 3.62 2.17 0.00 -1.26 -4.78 105.19 102.87 2h56 n GLY 156 Ca 0.00 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 2h56 n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2h56 s ASP 157 N -2.30 6.43 0.60 1.61 2.15 -0.73 -4.87 116.67 119.56 2h56 s ASP 157 Ca 0.32 1.20 0.30 0.00 0.43 0.00 0.00 52.55 54.80 2h56 s ASP 157 Cb 0.20 -2.54 1.67 0.00 -0.30 0.00 0.00 42.92 41.95 2h56 s ASP 157 CO 0.44 -1.28 2.07 0.58 -0.17 0.00 0.00 175.17 176.80 2h56 h VAL 158 N 6.23 0.40 0.25 1.11 2.07 -1.90 0.43 116.25 124.84 2h56 h VAL 158 Ca -0.29 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2h56 h VAL 158 Cb 1.12 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2h56 h VAL 158 CO 1.04 0.00 -0.12 1.23 0.02 0.00 0.00 177.57 179.74 2h56 h GLY 159 N 0.00 -0.35 0.56 2.17 0.00 -1.97 -1.42 103.07 102.05 2h56 h GLY 159 Ca 0.09 0.13 0.12 0.00 0.00 0.00 0.00 47.33 47.67 2h56 h GLY 159 CO -0.00 -0.13 0.60 1.41 0.00 0.00 0.00 176.54 178.42 2h56 h LEU 160 N -0.95 0.82 -0.38 3.11 3.38 -1.75 -1.38 115.31 118.17 2h56 h LEU 160 Ca -0.03 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2h56 h LEU 160 Cb 0.48 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2h56 h LEU 160 CO 0.06 0.45 0.16 1.56 0.09 0.00 0.00 178.44 180.76 2h56 h GLN 161 N 0.89 0.55 -0.90 1.13 4.20 -0.92 -0.16 115.11 119.90 2h56 h GLN 161 Ca 0.46 -0.09 0.05 0.00 0.06 0.00 0.00 58.65 59.13 2h56 h GLN 161 Cb 0.52 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 28.15 2h56 h GLN 161 CO -0.22 0.52 0.57 -0.09 -0.67 0.00 0.00 178.83 178.94 2h56 h ARG 162 N 0.46 1.03 -0.36 1.46 2.43 -0.47 -1.80 114.38 117.13 2h56 h ARG 162 Ca 0.13 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.09 2h56 h ARG 162 Cb 0.16 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 2h56 h ARG 162 CO -0.01 0.68 -0.34 0.78 -1.51 0.00 0.00 179.97 179.57 2h56 h GLY 163 N 1.06 0.91 0.92 2.80 0.00 -0.83 -2.60 103.07 105.34 2h56 h GLY 163 Ca 0.38 -0.88 -0.00 0.00 0.00 0.00 0.00 47.33 46.83 2h56 h GLY 163 CO -0.16 0.80 0.03 0.00 0.00 0.00 0.00 176.54 177.21 2h56 h ALA 164 N 0.91 0.07 -1.00 3.60 0.00 -0.67 0.62 119.26 122.80 2h56 h ALA 164 Ca 0.07 -0.05 0.11 0.00 0.00 0.00 0.00 54.91 55.04 2h56 h ALA 164 Cb 0.90 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 2h56 h ALA 164 CO 0.08 -0.39 0.63 0.87 0.00 0.00 0.00 179.25 180.45 2h56 h LYS 165 N 0.00 0.99 -0.12 0.00 1.57 -1.32 0.13 116.57 117.81 2h56 h LYS 165 Ca 0.02 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 2h56 h LYS 165 Cb 0.08 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 2h56 h LYS 165 CO -0.00 0.65 -0.10 2.35 -0.57 0.00 0.00 179.45 181.78 2h56 h TRP 166 N 1.01 0.34 0.00 -1.35 7.01 -1.01 0.77 115.95 122.72 2h56 h TRP 166 Ca 0.49 -0.10 -0.08 0.00 2.11 0.00 0.00 58.89 61.31 2h56 h TRP 166 Cb 0.45 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.42 2h56 h TRP 166 CO -0.00 0.67 -0.54 1.25 -2.79 0.00 0.00 178.44 177.03 2h56 h LEU 167 N -0.09 0.00 0.00 0.65 5.85 -0.60 -2.72 115.31 118.40 2h56 h LEU 167 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2h56 h LEU 167 Cb 0.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2h56 h LEU 167 CO 0.03 0.38 -0.48 -1.22 -0.34 0.00 0.00 178.44 176.81 2h56 n TYR 168 N -3.13 0.00 -1.23 1.25 4.01 0.43 -4.84 117.16 113.65 2h56 n TYR 168 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 2h56 n TYR 168 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.73 2h56 n TYR 168 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2h56 n GLY 169 N 1.27 1.23 2.60 2.72 0.00 0.15 -4.99 105.19 108.16 2h56 n GLY 169 Ca 0.00 -1.88 -0.28 0.00 0.00 0.00 0.00 46.02 43.85 2h56 n GLY 169 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2h56 n ASN 170 N 0.00 4.98 -0.19 1.61 5.15 -1.23 -4.73 115.26 120.86 2h56 n ASN 170 Ca 0.00 -3.72 -0.02 0.00 -0.60 0.00 0.00 54.58 50.23 2h56 n ASN 170 Cb 0.00 -0.55 -0.01 0.00 -0.53 0.00 0.00 39.78 38.69 2h56 n ASN 170 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2h56 n GLY 171 N -0.44 0.58 2.34 8.20 0.00 -0.51 -4.62 105.19 110.73 2h56 n GLY 171 Ca 0.39 -0.56 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 2h56 n GLY 171 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2h56 n GLU 172 N -2.65 0.42 0.00 1.61 1.02 -1.25 -4.85 120.64 114.93 2h56 n GLU 172 Ca -0.02 -2.42 0.00 0.00 -0.02 0.00 0.00 57.16 54.69 2h56 n GLU 172 Cb 0.11 1.77 0.00 0.00 -0.02 0.00 0.00 31.44 33.30 2h56 n GLU 172 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2h56 n GLY 173 N -0.29 -2.64 3.37 0.62 0.00 -1.26 -4.26 105.19 100.72 2h56 n GLY 173 Ca 0.02 -1.84 -0.45 0.00 0.00 0.00 0.00 46.02 43.75 2h56 n GLY 173 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2h56 s ASP 174 N -2.51 6.18 0.22 1.61 -1.08 -1.26 -4.96 116.67 114.87 2h56 s ASP 174 Ca 0.00 -1.45 -0.08 0.00 -0.52 0.00 0.00 52.55 50.50 2h56 s ASP 174 Cb 0.00 -2.23 0.35 0.00 -1.46 0.00 0.00 42.92 39.58 2h56 s ASP 174 CO 0.00 -0.83 1.72 1.23 0.52 0.00 0.00 175.17 177.82 2h56 h GLY 175 N 9.12 0.93 0.70 2.66 0.00 -1.89 0.17 103.07 114.75 2h56 h GLY 175 Ca -0.29 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 2h56 h GLY 175 CO 0.98 -0.08 -0.42 1.70 0.00 0.00 0.00 176.54 178.72 2h56 h LYS 176 N 0.37 -0.90 -0.76 4.80 3.64 -1.87 0.08 116.57 121.93 2h56 h LYS 176 Ca 0.35 0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.82 2h56 h LYS 176 Cb 0.50 0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.48 2h56 h LYS 176 CO -0.38 -0.60 0.50 0.87 -2.27 0.00 0.00 179.45 177.58 2h56 h LYS 177 N -0.93 0.92 -0.31 1.90 1.57 -1.81 -0.91 116.57 117.00 2h56 h LYS 177 Ca -0.06 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2h56 h LYS 177 Cb 0.79 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.88 2h56 h LYS 177 CO 0.01 0.61 0.03 -0.07 -0.57 0.00 0.00 179.45 179.45 2h56 h LEU 178 N 0.95 0.51 -0.49 2.94 3.38 -0.31 -1.73 115.31 120.56 2h56 h LEU 178 Ca 0.30 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2h56 h LEU 178 Cb 0.02 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 2h56 h LEU 178 CO -0.08 0.66 0.26 0.25 0.09 0.00 0.00 178.44 179.62 2h56 h LEU 179 N 0.33 0.62 -0.73 1.67 5.85 -0.46 0.35 115.31 122.95 2h56 h LEU 179 Ca 0.09 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2h56 h LEU 179 Cb 0.38 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 2h56 h LEU 179 CO 0.01 0.54 0.44 0.40 -0.34 0.00 0.00 178.44 179.49 2h56 h ILE 180 N 0.65 1.20 0.22 4.05 2.04 -1.07 -0.84 117.51 123.76 2h56 h ILE 180 Ca 0.17 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 2h56 h ILE 180 Cb 0.06 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.33 2h56 h ILE 180 CO -0.03 0.21 -0.11 0.22 0.00 0.00 0.00 178.15 178.45 2h56 h TYR 181 N 0.99 -0.27 0.00 1.37 5.03 -0.97 -3.29 116.97 119.82 2h56 h TYR 181 Ca 0.26 -0.01 -0.10 0.00 2.58 0.00 0.00 58.73 61.47 2h56 h TYR 181 Cb -0.04 0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.31 2h56 h TYR 181 CO -0.01 0.11 -0.46 0.45 -1.32 0.00 0.00 178.16 176.92 2h56 h HIS 182 N -0.89 0.00 -0.44 -3.82 3.86 -1.01 -3.07 115.15 109.78 2h56 h HIS 182 Ca -0.03 0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.31 2h56 h HIS 182 Cb 0.50 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 2h56 h HIS 182 CO 0.06 0.46 0.32 0.78 0.86 0.00 0.00 177.93 180.41 2h56 h GLY 183 N 1.86 0.03 1.43 2.45 0.00 -1.22 -1.68 103.07 105.93 2h56 h GLY 183 Ca -0.00 -0.01 0.08 0.00 0.00 0.00 0.00 47.33 47.39 2h56 h GLY 183 CO 0.06 0.00 0.21 0.50 0.00 0.00 0.00 176.54 177.31 2h56 h LYS 184 N 0.02 0.00 0.00 4.80 1.57 -1.62 -2.14 116.57 119.20 2h56 h LYS 184 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2h56 h LYS 184 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 2h56 h LYS 184 CO -0.01 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.87 2h56 n ALA 185 N -2.51 1.67 0.67 3.86 0.00 -0.63 -3.90 120.51 119.67 2h56 n ALA 185 Ca 0.03 0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.62 2h56 n ALA 185 Cb 0.36 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 2h56 n ALA 185 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2h56 n TRP 186 N -2.19 0.00 -1.64 0.00 8.01 -0.80 -4.73 117.44 116.08 2h56 n TRP 186 Ca 0.02 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.81 2h56 n TRP 186 Cb 0.23 0.00 0.02 0.00 -2.01 0.00 0.00 31.31 29.55 2h56 n TRP 186 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2h56 n ALA 187 N -0.63 0.57 -1.16 6.99 0.00 -1.25 -0.63 120.51 124.40 2h56 n ALA 187 Ca 0.05 0.20 -0.28 0.00 0.00 0.00 0.00 53.44 53.41 2h56 n ALA 187 Cb 0.28 -2.15 0.11 0.00 0.00 0.00 0.00 19.45 17.69 2h56 n ALA 187 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2h56 n PRO 188 N -0.11 2.37 -2.03 0.00 -0.04 -1.26 -4.90 135.00 129.03 2h56 n PRO 188 Ca 0.09 -2.88 -0.18 0.00 -0.04 0.00 0.00 63.50 60.49 2h56 n PRO 188 Cb 0.41 -2.13 0.04 0.00 -0.04 0.00 0.00 33.50 31.78 2h56 n PRO 188 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2h56 n TYR 189 N -0.82 2.28 -0.31 0.54 4.01 0.19 -3.86 117.16 119.19 2h56 n TYR 189 Ca 0.56 -2.13 0.11 0.00 -0.16 0.00 0.00 57.90 56.29 2h56 n TYR 189 Cb 1.03 -0.31 0.34 0.00 -0.31 0.00 0.00 39.34 40.08 2h56 n TYR 189 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 2h56 h GLU 190 N 2.14 0.75 -0.86 -0.72 3.07 -1.34 -0.35 114.58 117.27 2h56 h GLU 190 Ca 0.26 -0.05 0.06 0.00 -0.50 0.00 0.00 59.36 59.13 2h56 h GLU 190 Cb 1.46 -0.17 -0.05 0.00 -0.84 0.00 0.00 28.75 29.15 2h56 h GLU 190 CO 0.61 0.50 0.56 1.15 -1.40 0.00 0.00 179.01 180.43 2h56 h THR 191 N 0.78 1.07 -0.40 1.13 2.02 -0.19 -1.16 112.91 116.16 2h56 h THR 191 Ca 0.49 -0.34 -0.04 0.00 0.77 0.00 0.00 66.41 67.30 2h56 h THR 191 Cb 0.73 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 2h56 h THR 191 CO -0.26 0.18 0.11 0.58 0.37 0.00 0.00 175.52 176.50 2h56 h VAL 192 N 0.98 1.22 -0.75 3.16 2.07 -1.22 -1.73 116.25 119.99 2h56 h VAL 192 Ca 0.37 -0.75 0.11 0.00 0.82 0.00 0.00 66.70 67.25 2h56 h VAL 192 Cb 0.19 0.96 -0.08 0.00 -1.52 0.00 0.00 31.29 30.83 2h56 h VAL 192 CO -0.13 0.26 0.36 0.00 0.02 0.00 0.00 177.57 178.08 2h56 h ALA 193 N 0.96 1.07 -0.49 1.67 0.00 -1.41 -2.31 119.26 118.75 2h56 h ALA 193 Ca 0.13 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2h56 h ALA 193 Cb 0.29 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2h56 h ALA 193 CO -0.00 -0.09 0.19 0.00 0.00 0.00 0.00 179.25 179.35 2h56 h LEU 195 N 0.70 0.95 -0.51 0.00 3.38 -0.77 -0.46 115.31 118.60 2h56 h LEU 195 Ca 0.17 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.96 2h56 h LEU 195 Cb 0.16 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2h56 h LEU 195 CO -0.01 0.67 -0.62 1.88 0.09 0.00 0.00 178.44 180.44 2h56 h TYR 196 N 1.12 0.56 -0.48 1.13 0.05 -0.82 -1.78 116.97 116.75 2h56 h TYR 196 Ca 0.33 -0.22 0.00 0.00 0.05 0.00 0.00 58.73 58.90 2h56 h TYR 196 Cb -0.05 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 37.57 2h56 h TYR 196 CO -0.02 0.94 0.30 -0.07 -1.05 0.00 0.00 178.16 178.26 2h56 h LEU 197 N 0.32 0.56 -1.08 3.88 3.38 -0.47 0.14 115.31 122.04 2h56 h LEU 197 Ca -0.01 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2h56 h LEU 197 Cb 1.16 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.73 2h56 h LEU 197 CO 0.11 0.43 0.61 -0.50 0.09 0.00 0.00 178.44 179.18 2h56 h TRP 198 N 0.64 1.18 -0.40 1.13 6.55 -0.87 0.17 115.95 124.33 2h56 h TRP 198 Ca 0.17 0.02 -0.03 0.00 0.95 0.00 0.00 58.89 60.01 2h56 h TRP 198 Cb -0.03 -0.40 -0.02 0.00 -0.86 0.00 0.00 29.16 27.85 2h56 h TRP 198 CO -0.03 0.74 0.15 -0.22 -1.05 0.00 0.00 178.44 178.03 2h56 h LYS 199 N 1.26 0.61 -0.84 0.49 3.64 -0.68 -2.00 116.57 119.06 2h56 h LYS 199 Ca 0.34 -0.12 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2h56 h LYS 199 Cb -0.14 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.54 2h56 h LYS 199 CO -0.07 0.59 0.55 0.00 -2.27 0.00 0.00 179.45 178.24 2h56 h ALA 200 N 0.99 1.07 -0.44 5.00 0.00 0.11 -2.82 119.26 123.17 2h56 h ALA 200 Ca 0.13 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2h56 h ALA 200 Cb 0.21 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2h56 h ALA 200 CO -0.01 0.44 0.05 0.00 0.00 0.00 0.00 179.25 179.73 2h56 h ALA 201 N 1.32 1.27 -3.00 0.00 0.00 -0.32 -0.55 119.26 117.98 2h56 h ALA 201 Ca 0.31 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2h56 h ALA 201 Cb -0.10 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2h56 h ALA 201 CO -0.08 0.50 0.00 0.41 0.00 0.00 0.00 179.25 180.08 2h56 n GLY 202 N -0.83 1.22 0.28 0.00 0.00 -0.79 -4.26 105.19 100.82 2h56 n GLY 202 Ca 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 2h56 n GLY 202 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2h56 h THR 203 N 0.00 0.35 -0.40 2.61 2.02 -1.82 -2.42 112.91 113.25 2h56 h THR 203 Ca 0.00 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.10 2h56 h THR 203 Cb 0.00 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 2h56 h THR 203 CO 0.00 0.00 -0.08 -0.26 0.37 0.00 0.00 175.52 175.55 2h56 h PHE 204 N -0.19 0.84 -0.79 3.16 0.04 -1.70 -2.34 116.94 115.97 2h56 h PHE 204 Ca 0.18 -0.17 0.11 0.00 2.80 0.00 0.00 57.97 60.89 2h56 h PHE 204 Cb 0.47 -0.21 -0.08 0.00 2.20 0.00 0.00 35.95 38.33 2h56 h PHE 204 CO -0.46 0.88 0.41 0.00 -0.60 0.00 0.00 178.31 178.53 2h56 h ALA 205 N 0.85 1.13 -0.55 2.45 0.00 -0.92 -0.39 119.26 121.83 2h56 h ALA 205 Ca 0.10 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 2h56 h ALA 205 Cb 0.59 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2h56 h ALA 205 CO 0.04 -0.03 0.06 1.05 0.00 0.00 0.00 179.25 180.36 2h56 h GLU 206 N 0.65 0.89 0.00 0.00 -0.00 -0.93 -3.24 114.58 111.96 2h56 h GLU 206 Ca 0.40 -0.23 0.00 0.00 -0.00 0.00 0.00 59.36 59.53 2h56 h GLU 206 Cb 0.47 -0.11 0.00 0.00 -0.00 0.00 0.00 28.75 29.11 2h56 h GLU 206 CO -0.30 0.85 -1.16 -0.85 -0.00 0.00 0.00 179.01 177.55 2h56 n GLU 207 N -4.22 0.29 -3.93 1.06 0.28 -1.05 -4.96 120.64 108.10 2h56 n GLU 207 Ca 0.03 -0.03 -0.12 0.00 -0.16 0.00 0.00 57.16 56.89 2h56 n GLU 207 Cb 0.28 -1.56 -0.13 0.00 1.43 0.00 0.00 31.44 31.46 2h56 n GLU 207 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2h56 s TYR 208 N -3.20 0.14 0.06 -1.84 2.02 -0.18 -5.06 117.35 109.28 2h56 s TYR 208 Ca 0.03 -0.16 -0.24 0.00 -0.37 0.00 0.00 57.07 56.33 2h56 s TYR 208 Cb 0.15 -0.09 -0.16 0.00 -0.40 0.00 0.00 41.96 41.45 2h56 s TYR 208 CO 0.83 -0.05 1.61 0.07 -1.57 0.00 0.00 175.55 176.44 2h56 h ARG 209 N 5.69 0.00 -3.95 -0.62 0.11 -1.85 -3.40 114.38 110.37 2h56 h ARG 209 Ca -0.27 -0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.67 2h56 h ARG 209 Cb 1.21 -0.00 -0.10 0.00 1.11 0.00 0.00 29.97 32.19 2h56 h ARG 209 CO 0.48 0.13 -0.24 -1.54 0.10 0.00 0.00 179.97 178.91 2h56 s SER 210 N -5.33 0.18 0.41 0.08 1.04 -1.26 -4.18 113.70 104.64 2h56 s SER 210 Ca -0.14 -1.15 0.14 0.00 0.48 0.00 0.00 55.95 55.29 2h56 s SER 210 Cb 0.05 0.56 1.01 0.00 0.10 0.00 0.00 66.02 67.74 2h56 s SER 210 CO 0.66 -1.12 1.91 0.25 0.98 0.00 0.00 173.24 175.93 2h56 h LEU 211 N 2.30 0.44 -0.30 2.42 5.85 -1.80 -2.07 115.31 122.15 2h56 h LEU 211 Ca -0.29 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.51 2h56 h LEU 211 Cb 1.25 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 2h56 h LEU 211 CO 0.40 0.23 -0.03 -0.33 -0.34 0.00 0.00 178.44 178.36 2h56 h GLU 212 N 0.47 0.05 -0.44 1.25 3.07 -1.92 -2.67 114.58 114.37 2h56 h GLU 212 Ca 0.38 -0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.27 2h56 h GLU 212 Cb 0.82 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 28.68 2h56 h GLU 212 CO -0.13 0.03 0.22 0.93 -1.40 0.00 0.00 179.01 178.66 2h56 h GLU 213 N 0.05 0.44 -0.82 2.33 5.08 -1.78 -2.59 114.58 117.29 2h56 h GLU 213 Ca 0.14 -0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.58 2h56 h GLU 213 Cb 0.20 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.30 2h56 h GLU 213 CO -0.27 0.29 0.54 1.25 -1.00 0.00 0.00 179.01 179.82 2h56 h LEU 214 N 0.45 0.67 -3.55 1.33 5.85 -1.43 -2.30 115.31 116.34 2h56 h LEU 214 Ca 0.19 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.84 2h56 h LEU 214 Cb 0.09 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 2h56 h LEU 214 CO -0.13 0.39 -0.18 0.18 -0.34 0.00 0.00 178.44 178.36 2h56 n LEU 215 N -4.52 5.08 -1.29 2.25 4.77 -0.97 -2.95 117.00 119.37 2h56 n LEU 215 Ca 0.14 -2.70 -0.09 0.00 -0.03 0.00 0.00 56.01 53.34 2h56 n LEU 215 Cb 0.35 -1.23 0.12 0.00 -2.33 0.00 0.00 43.42 40.34 2h56 n LEU 215 CO 0.32 1.30 0.29 1.41 -1.33 0.00 0.00 177.39 179.38 2h56 n HIS 216 N 2.03 1.34 0.00 -1.77 8.25 -0.87 -5.04 115.22 119.16 2h56 n HIS 216 Ca 0.21 -1.85 0.00 0.00 -0.26 0.00 0.00 57.72 55.82 2h56 n HIS 216 Cb 0.68 -0.31 0.00 0.00 1.12 0.00 0.00 29.99 31.49 2h56 n HIS 216 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56