#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h39 s GLN 2 N 0.00 4.25 -0.14 2.12 0.74 -1.26 -4.95 119.66 120.42 3h39 s GLN 2 Ca 0.00 0.67 0.04 0.00 0.05 0.00 0.00 55.36 56.13 3h39 s GLN 2 Cb 0.00 -3.56 -0.23 0.00 1.10 0.00 0.00 33.01 30.32 3h39 s GLN 2 CO 0.00 -0.19 0.28 -0.89 -0.55 0.00 0.00 175.29 173.94 3h39 n ILE 3 N 4.54 1.61 -4.61 -2.34 5.41 -1.26 -4.80 119.36 117.91 3h39 n ILE 3 Ca -0.01 -0.71 -0.34 0.00 1.00 0.00 0.00 62.75 62.69 3h39 n ILE 3 Cb 0.50 -1.27 -0.12 0.00 -0.71 0.00 0.00 39.64 38.04 3h39 n ILE 3 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 3h39 s PHE 4 N -2.55 2.93 0.17 1.39 0.40 -1.26 -1.12 117.98 117.94 3h39 s PHE 4 Ca -0.18 -0.14 -0.02 0.00 -0.60 0.00 0.00 56.93 55.99 3h39 s PHE 4 Cb 0.07 -1.78 -0.04 0.00 0.51 0.00 0.00 43.02 41.79 3h39 s PHE 4 CO 0.76 0.17 0.13 1.03 0.70 0.00 0.00 175.22 178.01 3h39 s ARG 5 N -0.40 1.10 -0.58 0.44 0.52 -1.16 -4.99 118.95 113.88 3h39 s ARG 5 Ca 0.06 -1.50 0.02 0.00 -0.52 0.00 0.00 55.73 53.78 3h39 s ARG 5 Cb -0.12 0.28 0.15 0.00 0.52 0.00 0.00 34.95 35.77 3h39 s ARG 5 CO 0.02 -0.35 0.35 0.34 0.02 0.00 0.00 175.30 175.68 3h39 s ASP 6 N -3.09 4.68 -0.08 0.23 3.68 -1.26 -0.93 116.67 119.89 3h39 s ASP 6 Ca 0.31 -3.06 0.06 0.00 2.13 0.00 0.00 52.55 51.99 3h39 s ASP 6 Cb 0.07 -1.71 0.33 0.00 -1.45 0.00 0.00 42.92 40.15 3h39 s ASP 6 CO 0.07 -0.26 1.06 1.33 0.13 0.00 0.00 175.17 177.50 3h39 n VAL 7 N 3.10 1.01 -0.33 1.11 0.24 0.82 -4.38 118.33 119.91 3h39 n VAL 7 Ca 0.08 -0.55 -0.04 0.00 -2.04 0.00 0.00 64.34 61.79 3h39 n VAL 7 Cb 0.34 -0.29 0.10 0.00 -1.47 0.00 0.00 33.84 32.51 3h39 n VAL 7 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3h39 h SER 8 N 1.68 1.12 -0.62 -1.34 4.64 -1.87 -0.64 113.55 116.53 3h39 h SER 8 Ca 0.00 -0.10 -0.05 0.00 -0.47 0.00 0.00 61.79 61.16 3h39 h SER 8 Cb 0.98 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 3h39 h SER 8 CO 0.17 0.90 0.17 0.07 -0.87 0.00 0.00 176.83 177.27 3h39 h LYS 9 N 1.25 0.97 -0.09 4.77 -0.00 -1.92 -2.06 116.57 119.49 3h39 h LYS 9 Ca 0.31 -0.22 -0.03 0.00 -0.00 0.00 0.00 60.65 60.71 3h39 h LYS 9 Cb 0.03 -0.13 -0.01 0.00 -0.00 0.00 0.00 32.23 32.12 3h39 h LYS 9 CO -0.05 0.87 -0.07 1.25 -0.00 0.00 0.00 179.45 181.45 3h39 h LEU 10 N 0.89 0.12 -0.18 7.07 5.85 -1.75 -2.20 115.31 125.11 3h39 h LEU 10 Ca 0.20 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 3h39 h LEU 10 Cb 0.32 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3h39 h LEU 10 CO -0.00 0.21 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.23 3h39 h LEU 11 N 0.13 0.32 -0.90 2.25 3.38 -0.42 -0.74 115.31 119.33 3h39 h LEU 11 Ca 0.03 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.58 3h39 h LEU 11 Cb 0.21 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3h39 h LEU 11 CO 0.01 0.56 -0.47 -0.37 0.09 0.00 0.00 178.44 178.27 3h39 h VAL 12 N 0.07 1.13 0.07 1.22 -1.51 -1.23 -0.95 116.25 115.04 3h39 h VAL 12 Ca 0.05 -1.73 -0.25 0.00 -1.23 0.00 0.00 66.70 63.54 3h39 h VAL 12 Cb 0.41 1.99 -0.00 0.00 -2.13 0.00 0.00 31.29 31.56 3h39 h VAL 12 CO 0.01 0.46 -1.10 -0.08 -1.23 0.00 0.00 177.57 175.63 3h39 h GLU 13 N 0.00 0.24 0.00 5.19 4.81 -1.38 -3.40 114.58 120.05 3h39 h GLU 13 Ca -0.00 -0.36 -0.29 0.00 -0.13 0.00 0.00 59.36 58.58 3h39 h GLU 13 Cb 0.95 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 30.41 3h39 h GLU 13 CO 0.06 1.13 -2.09 0.54 -0.73 0.00 0.00 179.01 177.92 3h39 n ARG 14 N -3.57 0.82 -2.83 1.92 1.74 -0.29 -4.99 116.66 109.46 3h39 n ARG 14 Ca -0.06 0.07 -0.38 0.00 -0.77 0.00 0.00 57.85 56.71 3h39 n ARG 14 Cb 0.95 -1.39 -0.06 0.00 -1.02 0.00 0.00 32.46 30.93 3h39 n ARG 14 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3h39 s VAL 15 N -2.38 4.23 0.34 1.55 1.01 -0.37 -5.02 120.40 119.75 3h39 s VAL 15 Ca -0.20 1.83 -0.29 0.00 0.00 0.00 0.00 61.98 63.32 3h39 s VAL 15 Cb 0.06 -4.09 -0.12 0.00 0.00 0.00 0.00 36.38 32.23 3h39 s VAL 15 CO 0.51 0.28 1.48 -0.67 0.00 0.00 0.00 175.10 176.70 3h39 n ASP 16 N 0.93 3.57 -0.13 3.32 -0.08 -1.26 -4.73 116.55 118.16 3h39 n ASP 16 Ca -0.00 1.20 -0.05 0.00 -1.51 0.00 0.00 54.79 54.43 3h39 n ASP 16 Cb 0.49 -1.58 0.04 0.00 2.34 0.00 0.00 41.12 42.41 3h39 n ASP 16 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3h39 h PRO 17 N 3.45 0.27 -0.70 -0.67 0.11 -1.95 0.16 132.00 132.67 3h39 h PRO 17 Ca -0.49 -0.02 0.15 0.00 0.11 0.00 0.00 66.00 65.76 3h39 h PRO 17 Cb 1.25 -0.06 -0.12 0.00 0.11 0.00 0.00 31.00 32.18 3h39 h PRO 17 CO 0.68 0.18 0.07 0.87 -0.21 0.00 0.00 178.00 179.60 3h39 h LYS 18 N 0.28 0.16 -0.13 1.05 6.56 -1.99 0.26 116.57 122.76 3h39 h LYS 18 Ca 0.20 -0.01 -0.05 0.00 -1.06 0.00 0.00 60.65 59.73 3h39 h LYS 18 Cb 0.21 -0.04 -0.00 0.00 -0.57 0.00 0.00 32.23 31.83 3h39 h LYS 18 CO -0.23 0.11 -0.10 0.82 -2.06 0.00 0.00 179.45 177.99 3h39 h ILE 19 N 0.17 1.34 -0.50 1.86 2.04 -1.62 -2.44 117.51 118.35 3h39 h ILE 19 Ca 0.39 -1.21 0.10 0.00 1.00 0.00 0.00 64.86 65.13 3h39 h ILE 19 Cb 0.66 1.84 -0.10 0.00 -0.74 0.00 0.00 36.82 38.48 3h39 h ILE 19 CO -0.57 0.35 -0.26 -0.07 0.00 0.00 0.00 178.15 177.61 3h39 h LEU 20 N -0.06 -0.89 -1.94 1.44 3.38 -0.35 0.11 115.31 117.00 3h39 h LEU 20 Ca 0.03 0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.23 3h39 h LEU 20 Cb 0.60 0.47 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 3h39 h LEU 20 CO 0.03 -0.27 0.14 0.78 0.09 0.00 0.00 178.44 179.20 3h39 h ASN 21 N -0.14 0.07 0.09 -0.43 2.35 -0.93 0.16 115.58 116.75 3h39 h ASN 21 Ca 0.23 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.97 3h39 h ASN 21 Cb 0.50 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.86 3h39 h ASN 21 CO -0.59 0.05 -0.04 0.25 -1.65 0.00 0.00 177.43 175.44 3h39 h LEU 22 N 0.08 -0.10 -0.37 1.61 5.85 -0.42 -1.02 115.31 120.94 3h39 h LEU 22 Ca 0.09 -0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.67 3h39 h LEU 22 Cb 0.25 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 3h39 h LEU 22 CO -0.01 0.13 0.12 -0.26 -0.34 0.00 0.00 178.44 178.08 3h39 h PHE 23 N -0.33 0.22 -0.65 1.25 0.04 0.15 0.34 116.94 117.97 3h39 h PHE 23 Ca -0.01 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.78 3h39 h PHE 23 Cb 0.28 -0.04 -0.03 0.00 2.20 0.00 0.00 35.95 38.36 3h39 h PHE 23 CO -0.00 0.09 0.42 0.00 -0.60 0.00 0.00 178.31 178.21 3h39 h ARG 24 N 0.27 0.85 -0.14 1.51 3.08 -0.90 -0.75 114.38 118.31 3h39 h ARG 24 Ca 0.17 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 3h39 h ARG 24 Cb 0.15 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 3h39 h ARG 24 CO -0.18 0.57 0.04 -0.07 -1.07 0.00 0.00 179.97 179.27 3h39 h LEU 25 N 0.88 0.20 -0.31 3.04 3.38 -0.31 -0.97 115.31 121.21 3h39 h LEU 25 Ca 0.24 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 58.05 3h39 h LEU 25 Cb -0.09 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 3h39 h LEU 25 CO -0.05 0.34 0.10 -0.07 0.09 0.00 0.00 178.44 178.85 3h39 h LEU 26 N 0.04 0.09 -0.49 1.67 3.38 -0.19 0.19 115.31 120.01 3h39 h LEU 26 Ca 0.04 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.11 3h39 h LEU 26 Cb 0.21 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 3h39 h LEU 26 CO -0.00 0.09 0.20 1.23 0.09 0.00 0.00 178.44 180.04 3h39 h GLY 27 N 0.23 0.66 0.89 0.83 0.00 -1.07 -2.06 103.07 102.54 3h39 h GLY 27 Ca 0.14 -0.12 0.03 0.00 0.00 0.00 0.00 47.33 47.38 3h39 h GLY 27 CO -0.16 0.04 0.53 1.70 0.00 0.00 0.00 176.54 178.65 3h39 h LYS 28 N 0.39 1.01 -0.49 4.80 3.11 -0.06 -2.17 116.57 123.15 3h39 h LYS 28 Ca 0.23 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 58.01 3h39 h LYS 28 Cb 0.21 -0.23 -0.02 0.00 -1.00 0.00 0.00 32.23 31.19 3h39 h LYS 28 CO -0.21 0.67 0.32 0.74 -2.81 0.00 0.00 179.45 178.15 3h39 h PHE 29 N 1.04 0.62 -0.57 1.91 0.05 -0.19 -2.41 116.94 117.38 3h39 h PHE 29 Ca 0.33 0.01 0.09 0.00 3.82 0.00 0.00 57.97 62.22 3h39 h PHE 29 Cb -0.00 -0.21 -0.07 0.00 2.00 0.00 0.00 35.95 37.67 3h39 h PHE 29 CO -0.02 0.40 0.18 0.78 -0.18 0.00 0.00 178.31 179.47 3h39 h GLY 30 N 0.66 0.77 1.17 -1.45 0.00 -0.76 0.50 103.07 103.96 3h39 h GLY 30 Ca 0.18 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.46 3h39 h GLY 30 CO -0.04 -0.04 0.47 -0.55 0.00 0.00 0.00 176.54 176.38 3h39 h ASP 31 N 0.35 0.72 0.85 0.19 5.19 -1.08 0.25 116.42 122.89 3h39 h ASP 31 Ca 0.29 -0.01 -0.07 0.00 -0.62 0.00 0.00 57.03 56.62 3h39 h ASP 31 Cb 0.37 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.70 3h39 h ASP 31 CO -0.31 0.49 -0.33 -0.33 -3.12 0.00 0.00 179.24 175.64 3h39 h GLU 32 N 0.83 0.00 -0.16 3.56 5.08 -0.47 -3.09 114.58 120.33 3h39 h GLU 32 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 3h39 h GLU 32 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3h39 h GLU 32 CO -0.08 0.33 0.00 1.33 -1.00 0.00 0.00 179.01 179.59 3h39 n VAL 33 N -3.51 1.86 -3.72 3.13 0.24 -0.58 -4.99 118.33 110.75 3h39 n VAL 33 Ca -0.00 -1.81 -0.23 0.00 -2.04 0.00 0.00 64.34 60.26 3h39 n VAL 33 Cb 0.48 -0.08 0.04 0.00 -1.47 0.00 0.00 33.84 32.82 3h39 n VAL 33 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3h39 n ASN 34 N -0.69 -2.51 -3.95 -1.34 2.85 0.46 -5.02 115.26 105.07 3h39 n ASN 34 Ca 0.16 -0.77 -0.26 0.00 -0.11 0.00 0.00 54.58 53.60 3h39 n ASN 34 Cb 0.68 -4.18 -0.17 0.00 1.24 0.00 0.00 39.78 37.36 3h39 n ASN 34 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 3h39 s MET 35 N -6.11 1.56 0.27 1.20 1.00 0.58 -4.93 119.30 112.87 3h39 s MET 35 Ca 0.21 -0.30 -0.31 0.00 0.00 0.00 0.00 55.69 55.29 3h39 s MET 35 Cb -0.10 -1.50 -0.12 0.00 0.00 0.00 0.00 34.83 33.10 3h39 s MET 35 CO 0.80 -0.16 1.53 -2.30 0.00 0.00 0.00 175.02 174.89 3h39 n PRO 36 N 4.53 2.44 -4.09 2.03 -0.02 -1.26 -4.08 135.00 134.56 3h39 n PRO 36 Ca -0.16 0.87 -0.26 0.00 -2.02 0.00 0.00 63.50 61.92 3h39 n PRO 36 Cb 0.51 -2.61 -0.17 0.00 -0.02 0.00 0.00 33.50 31.21 3h39 n PRO 36 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3h39 s VAL 37 N 0.01 1.09 0.18 -1.45 1.01 -1.26 -1.19 120.40 118.79 3h39 s VAL 37 Ca 0.66 -0.36 0.10 0.00 0.00 0.00 0.00 61.98 62.38 3h39 s VAL 37 Cb -0.56 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 3h39 s VAL 37 CO 0.48 0.37 -0.21 -0.31 0.00 0.00 0.00 175.10 175.44 3h39 s TYR 38 N 1.42 2.03 -0.11 5.22 1.51 0.27 -0.34 117.35 127.34 3h39 s TYR 38 Ca -0.00 -0.42 -0.03 0.00 -1.01 0.00 0.00 57.07 55.61 3h39 s TYR 38 Cb -0.13 -1.00 -0.03 0.00 -0.11 0.00 0.00 41.96 40.68 3h39 s TYR 38 CO -0.05 0.41 0.00 0.54 -1.11 0.00 0.00 175.55 175.34 3h39 s VAL 39 N -1.90 4.31 0.26 0.71 0.11 0.33 -1.56 120.40 122.67 3h39 s VAL 39 Ca 0.18 -0.23 0.03 0.00 -2.93 0.00 0.00 61.98 59.03 3h39 s VAL 39 Cb -0.07 -2.85 -0.04 0.00 -1.53 0.00 0.00 36.38 31.90 3h39 s VAL 39 CO 0.08 0.57 0.20 0.68 -3.33 0.00 0.00 175.10 173.30 3h39 s VAL 40 N -0.49 0.00 0.00 2.04 -7.23 -0.66 -0.50 120.40 113.56 3h39 s VAL 40 Ca 0.09 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.26 3h39 s VAL 40 Cb -0.12 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.32 3h39 s VAL 40 CO 0.02 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.42 3h39 n GLY 41 N -0.44 0.27 0.18 2.32 0.00 -1.20 -4.13 105.19 102.18 3h39 n GLY 41 Ca 0.05 -1.00 0.05 0.00 0.00 0.00 0.00 46.02 45.12 3h39 n GLY 41 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h39 h GLY 42 N 0.00 0.00 0.63 -0.02 0.00 -1.90 -2.91 103.07 98.86 3h39 h GLY 42 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.38 3h39 h GLY 42 CO 0.00 0.00 0.11 -2.75 0.00 0.00 0.00 176.54 173.90 3h39 h PHE 43 N 0.00 0.19 -0.28 5.60 3.57 -1.87 0.30 116.94 124.45 3h39 h PHE 43 Ca -0.00 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.53 3h39 h PHE 43 Cb 1.07 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.76 3h39 h PHE 43 CO 0.00 0.06 0.16 0.28 -2.23 0.00 0.00 178.31 176.58 3h39 h VAL 44 N 0.25 1.03 -0.43 1.41 2.07 -1.74 0.16 116.25 118.99 3h39 h VAL 44 Ca 0.17 -0.11 0.07 0.00 0.82 0.00 0.00 66.70 67.65 3h39 h VAL 44 Cb 0.17 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 3h39 h VAL 44 CO -0.20 0.06 0.07 -0.09 0.02 0.00 0.00 177.57 177.44 3h39 h ARG 45 N 0.33 0.20 -0.18 1.57 2.43 -1.42 -2.62 114.38 114.69 3h39 h ARG 45 Ca 0.11 -0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.14 3h39 h ARG 45 Cb 0.00 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 3h39 h ARG 45 CO -0.05 0.13 -0.38 -0.44 -1.51 0.00 0.00 179.97 177.72 3h39 h ASP 46 N 0.20 0.64 -0.32 -3.80 3.32 0.23 -2.51 116.42 114.18 3h39 h ASP 46 Ca 0.21 -0.56 0.04 0.00 0.02 0.00 0.00 57.03 56.74 3h39 h ASP 46 Cb 0.27 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.57 3h39 h ASP 46 CO -0.29 1.08 -0.44 0.25 -1.72 0.00 0.00 179.24 178.12 3h39 h LEU 47 N 0.23 -1.49 -1.84 1.55 5.85 -0.74 0.21 115.31 119.09 3h39 h LEU 47 Ca 0.00 0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.98 3h39 h LEU 47 Cb 0.98 0.61 -0.01 0.00 0.37 0.00 0.00 40.66 42.61 3h39 h LEU 47 CO 0.08 -0.32 0.46 -0.07 -0.34 0.00 0.00 178.44 178.25 3h39 h LEU 48 N -0.32 0.00 -0.99 2.25 3.38 -1.42 -0.42 115.31 117.79 3h39 h LEU 48 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3h39 h LEU 48 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3h39 h LEU 48 CO -0.47 0.00 -0.36 0.18 0.09 0.00 0.00 178.44 177.87 3h39 n LEU 49 N -3.25 1.84 0.00 1.67 4.77 -0.51 -4.95 117.00 116.57 3h39 n LEU 49 Ca 0.03 -0.78 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 3h39 n LEU 49 Cb 0.57 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 3h39 n LEU 49 CO 0.19 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3h39 n GLY 50 N 1.25 0.73 3.75 -0.72 0.00 -0.01 -5.01 105.19 105.18 3h39 n GLY 50 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 3h39 n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3h39 s ILE 51 N -2.87 4.62 0.47 -0.61 1.01 0.54 -4.97 121.20 119.39 3h39 s ILE 51 Ca 0.00 1.69 -0.24 0.00 0.00 0.00 0.00 60.65 62.10 3h39 s ILE 51 Cb 0.00 -4.14 -0.07 0.00 0.01 0.00 0.00 42.46 38.26 3h39 s ILE 51 CO 0.00 0.40 1.37 -0.54 0.00 0.00 0.00 174.94 176.17 3h39 s LYS 52 N -0.33 3.58 -0.28 2.79 1.02 -1.26 -3.93 119.74 121.32 3h39 s LYS 52 Ca 0.39 2.27 -0.14 0.00 0.02 0.00 0.00 55.97 58.51 3h39 s LYS 52 Cb -0.21 -2.54 0.09 0.00 -0.52 0.00 0.00 37.83 34.65 3h39 s LYS 52 CO 0.24 -0.85 0.68 1.21 -0.92 0.00 0.00 175.35 175.71 3h39 s ASN 53 N -0.74 -1.00 -0.02 2.83 3.84 -1.26 -4.98 114.94 113.62 3h39 s ASN 53 Ca 0.64 1.53 0.17 0.00 0.21 0.00 0.00 52.86 55.40 3h39 s ASN 53 Cb -0.41 1.62 -0.24 0.00 -0.55 0.00 0.00 41.25 41.68 3h39 s ASN 53 CO 0.51 -0.23 0.48 0.18 -2.79 0.00 0.00 177.10 175.25 3h39 n LEU 54 N 4.61 0.26 -4.64 3.21 4.77 -1.26 -4.98 117.00 118.97 3h39 n LEU 54 Ca -0.18 -0.17 -0.47 0.00 -0.03 0.00 0.00 56.01 55.16 3h39 n LEU 54 Cb 0.56 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.61 3h39 n LEU 54 CO -0.02 0.06 1.03 0.47 -1.33 0.00 0.00 177.39 177.60 3h39 n ASP 55 N -1.86 2.52 -4.12 -1.43 8.00 -1.26 -4.88 116.55 113.52 3h39 n ASP 55 Ca -0.01 1.11 -0.36 0.00 0.71 0.00 0.00 54.79 56.24 3h39 n ASP 55 Cb 0.38 -1.36 -0.12 0.00 -0.02 0.00 0.00 41.12 40.01 3h39 n ASP 55 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3h39 s ILE 56 N 0.44 3.28 -0.33 0.53 1.09 -1.26 -4.78 121.20 120.17 3h39 s ILE 56 Ca 0.76 -2.03 -0.07 0.00 -1.10 0.00 0.00 60.65 58.21 3h39 s ILE 56 Cb -0.75 -3.24 0.03 0.00 -1.06 0.00 0.00 42.46 37.45 3h39 s ILE 56 CO 0.44 -0.67 0.10 -0.62 -0.10 0.00 0.00 174.94 174.10 3h39 s ASP 57 N 1.80 5.28 0.02 3.58 -1.08 -1.26 -1.80 116.67 123.22 3h39 s ASP 57 Ca 0.08 -0.99 0.08 0.00 -0.52 0.00 0.00 52.55 51.19 3h39 s ASP 57 Cb -0.23 -1.88 -0.03 0.00 -1.46 0.00 0.00 42.92 39.32 3h39 s ASP 57 CO -0.04 -0.29 -0.22 -0.63 0.52 0.00 0.00 175.17 174.52 3h39 s ILE 58 N 1.45 2.50 -0.04 4.11 1.01 0.14 -1.65 121.20 128.72 3h39 s ILE 58 Ca -0.00 -1.19 0.03 0.00 0.00 0.00 0.00 60.65 59.49 3h39 s ILE 58 Cb -0.19 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.29 3h39 s ILE 58 CO 0.03 0.41 -0.14 -0.69 0.00 0.00 0.00 174.94 174.55 3h39 s VAL 59 N -0.82 1.20 0.10 2.92 1.01 -0.60 -1.18 120.40 123.03 3h39 s VAL 59 Ca 0.13 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 61.61 3h39 s VAL 59 Cb -0.10 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 3h39 s VAL 59 CO 0.03 0.36 -0.21 0.68 0.00 0.00 0.00 175.10 175.96 3h39 s VAL 60 N 0.18 1.70 -1.03 2.92 -7.23 -0.47 -0.57 120.40 115.91 3h39 s VAL 60 Ca -0.05 -1.51 -0.14 0.00 -1.81 0.00 0.00 61.98 58.46 3h39 s VAL 60 Cb -0.11 -1.54 0.19 0.00 0.56 0.00 0.00 36.38 35.48 3h39 s VAL 60 CO 0.02 -0.04 1.15 -1.61 -0.31 0.00 0.00 175.10 174.30 3h39 s GLU 61 N -1.85 3.87 0.00 4.82 2.02 -0.33 -0.04 118.70 127.19 3h39 s GLU 61 Ca 0.06 -2.45 0.00 0.00 0.02 0.00 0.00 54.97 52.60 3h39 s GLU 61 Cb -0.10 -4.79 0.00 0.00 0.10 0.00 0.00 34.13 29.34 3h39 s GLU 61 CO 0.04 -1.57 0.00 0.41 0.02 0.00 0.00 175.26 174.16 3h39 n GLY 62 N 4.20 -0.70 0.00 -1.39 0.00 -1.26 -4.17 105.19 101.87 3h39 n GLY 62 Ca 0.26 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.48 3h39 n GLY 62 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3h39 n ASN 63 N 0.00 0.00 -0.13 1.61 2.85 -1.26 -5.02 115.26 113.31 3h39 n ASN 63 Ca 0.00 0.00 0.01 0.00 -0.11 0.00 0.00 54.58 54.48 3h39 n ASN 63 Cb 0.00 0.00 0.03 0.00 1.24 0.00 0.00 39.78 41.05 3h39 n ASN 63 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3h39 n ALA 64 N 0.00 0.03 0.02 5.20 0.00 -1.26 -0.74 120.51 123.75 3h39 n ALA 64 Ca 0.00 0.36 -0.13 0.00 0.00 0.00 0.00 53.44 53.68 3h39 n ALA 64 Cb 0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 19.45 19.17 3h39 n ALA 64 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3h39 h LEU 65 N 0.00 -0.04 -0.99 0.00 3.38 -1.86 0.56 115.31 116.36 3h39 h LEU 65 Ca 0.14 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.85 3h39 h LEU 65 Cb 0.23 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 3h39 h LEU 65 CO -0.35 0.28 0.65 -0.33 0.09 0.00 0.00 178.44 178.78 3h39 h GLU 66 N -0.35 1.25 0.74 1.13 5.08 -1.34 0.43 114.58 121.53 3h39 h GLU 66 Ca -0.00 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 3h39 h GLU 66 Cb 0.33 -0.28 0.01 0.00 0.50 0.00 0.00 28.75 29.30 3h39 h GLU 66 CO 0.01 0.83 -0.36 0.35 -1.00 0.00 0.00 179.01 178.84 3h39 h PHE 67 N 1.29 -0.93 -0.82 4.33 3.57 -1.13 0.24 116.94 123.48 3h39 h PHE 67 Ca 0.39 -0.02 0.13 0.00 3.53 0.00 0.00 57.97 62.00 3h39 h PHE 67 Cb -0.05 0.31 -0.06 0.00 2.79 0.00 0.00 35.95 38.93 3h39 h PHE 67 CO -0.00 -0.56 0.54 0.00 -2.23 0.00 0.00 178.31 176.06 3h39 h ALA 68 N -1.01 1.91 -0.12 2.41 0.00 0.57 0.27 119.26 123.28 3h39 h ALA 68 Ca -0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3h39 h ALA 68 Cb 0.79 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3h39 h ALA 68 CO 0.17 -0.12 0.01 0.93 0.00 0.00 0.00 179.25 180.24 3h39 h GLU 69 N 0.61 0.20 -0.50 0.00 4.39 -0.07 -1.74 114.58 117.47 3h39 h GLU 69 Ca 0.40 -0.06 0.05 0.00 0.34 0.00 0.00 59.36 60.09 3h39 h GLU 69 Cb 0.70 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.28 3h39 h GLU 69 CO -0.16 0.42 0.24 -0.92 -1.16 0.00 0.00 179.01 177.43 3h39 h TYR 70 N -0.05 0.44 -0.30 4.33 3.20 0.13 -2.33 116.97 122.40 3h39 h TYR 70 Ca 0.03 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 3h39 h TYR 70 Cb 0.32 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 3h39 h TYR 70 CO 0.03 0.21 0.05 0.00 -1.64 0.00 0.00 178.16 176.80 3h39 h ALA 71 N 1.28 1.53 0.00 1.82 0.00 -0.50 -2.80 119.26 120.59 3h39 h ALA 71 Ca 0.23 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3h39 h ALA 71 Cb 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3h39 h ALA 71 CO -0.17 0.35 -0.08 -0.22 0.00 0.00 0.00 179.25 179.13 3h39 h LYS 72 N 0.43 0.00 0.00 0.00 3.64 -0.73 -1.25 116.57 118.65 3h39 h LYS 72 Ca 0.10 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3h39 h LYS 72 Cb 0.21 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3h39 h LYS 72 CO 0.00 0.08 -0.01 0.00 -2.27 0.00 0.00 179.45 177.25 3h39 h ARG 73 N 0.00 0.00 -0.00 1.90 3.08 -1.50 -2.95 114.38 114.91 3h39 h ARG 73 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3h39 h ARG 73 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 3h39 h ARG 73 CO 0.01 0.01 -0.00 1.19 -1.07 0.00 0.00 179.97 180.11 3h39 n PHE 74 N -3.74 0.00 -4.01 3.04 3.01 -0.52 -4.98 117.46 110.26 3h39 n PHE 74 Ca -0.03 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.20 3h39 n PHE 74 Cb 0.09 0.00 -0.17 0.00 -0.01 0.00 0.00 39.48 39.40 3h39 n PHE 74 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3h39 s LEU 75 N -0.16 1.09 -0.33 4.37 1.02 -0.89 -5.11 118.68 118.66 3h39 s LEU 75 Ca 0.01 -0.19 -0.29 0.00 0.02 0.00 0.00 54.13 53.68 3h39 s LEU 75 Cb 0.01 -0.61 -0.01 0.00 0.02 0.00 0.00 46.19 45.60 3h39 s LEU 75 CO 0.01 -0.11 1.51 -2.16 0.02 0.00 0.00 176.35 175.62 3h39 s PRO 76 N 1.47 3.65 0.00 1.29 0.04 -1.26 -4.65 135.00 135.54 3h39 s PRO 76 Ca -0.01 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.28 3h39 s PRO 76 Cb -0.13 -4.03 0.00 0.00 0.04 0.00 0.00 34.50 30.38 3h39 s PRO 76 CO -0.04 -1.47 0.00 0.41 0.04 0.00 0.00 177.00 175.94 3h39 n GLY 77 N 4.90 0.64 3.73 0.56 0.00 -1.26 -4.63 105.19 109.13 3h39 n GLY 77 Ca 0.18 -1.00 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 3h39 n GLY 77 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h39 s LYS 78 N -2.00 4.52 -0.48 1.61 2.20 -1.07 -4.74 119.74 119.78 3h39 s LYS 78 Ca 0.00 1.73 -0.10 0.00 -0.36 0.00 0.00 55.97 57.24 3h39 s LYS 78 Cb 0.00 -3.31 0.12 0.00 -1.51 0.00 0.00 37.83 33.13 3h39 s LYS 78 CO 0.00 -0.08 0.37 -1.17 -0.36 0.00 0.00 175.35 174.11 3h39 s LEU 79 N 0.29 5.76 -0.02 5.43 2.96 -1.26 0.04 118.68 131.88 3h39 s LEU 79 Ca 0.53 -1.92 -0.23 0.00 -0.22 0.00 0.00 54.13 52.30 3h39 s LEU 79 Cb -0.29 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.32 3h39 s LEU 79 CO 0.32 -0.71 0.68 -0.69 -1.32 0.00 0.00 176.35 174.64 3h39 s VAL 80 N 1.36 4.92 -0.17 1.68 1.01 -0.79 -4.97 120.40 123.43 3h39 s VAL 80 Ca 0.06 1.43 0.01 0.00 0.00 0.00 0.00 61.98 63.47 3h39 s VAL 80 Cb -0.26 -4.02 0.01 0.00 0.00 0.00 0.00 36.38 32.11 3h39 s VAL 80 CO -0.00 0.33 -0.19 -0.54 0.00 0.00 0.00 175.10 174.70 3h39 s LYS 81 N 0.28 3.04 -1.42 2.72 1.02 -1.26 -0.97 119.74 123.14 3h39 s LYS 81 Ca 0.36 -0.81 -0.08 0.00 0.02 0.00 0.00 55.97 55.45 3h39 s LYS 81 Cb -0.19 -2.58 0.06 0.00 -0.52 0.00 0.00 37.83 34.60 3h39 s LYS 81 CO 0.19 -0.16 2.49 0.72 -0.92 0.00 0.00 175.35 177.67 3h39 n HIS 82 N 4.50 2.64 -0.29 3.18 8.25 -0.15 -4.78 115.22 128.56 3h39 n HIS 82 Ca -0.20 -2.91 0.28 0.00 -0.26 0.00 0.00 57.72 54.62 3h39 n HIS 82 Cb 0.50 -2.09 0.51 0.00 1.12 0.00 0.00 29.99 30.04 3h39 n HIS 82 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 3h39 n ASP 83 N 2.79 0.28 -4.74 0.41 10.43 -1.26 -3.02 116.55 121.45 3h39 n ASP 83 Ca 0.64 1.51 -0.41 0.00 2.57 0.00 0.00 54.79 59.10 3h39 n ASP 83 Cb 0.26 -0.72 -0.04 0.00 1.84 0.00 0.00 41.12 42.47 3h39 n ASP 83 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 3h39 s LYS 84 N -5.42 4.53 -0.50 -1.24 2.20 -1.26 -2.72 119.74 115.33 3h39 s LYS 84 Ca -0.08 1.83 0.00 0.00 -0.36 0.00 0.00 55.97 57.36 3h39 s LYS 84 Cb 0.30 -3.24 0.00 0.00 -1.51 0.00 0.00 37.83 33.38 3h39 s LYS 84 CO 0.71 -0.02 0.00 1.19 -0.36 0.00 0.00 175.35 176.86 3h39 n PHE 85 N 2.35 0.00 -3.73 4.03 3.72 -1.26 -4.37 117.46 118.19 3h39 n PHE 85 Ca 0.03 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.12 3h39 n PHE 85 Cb 0.45 -1.47 0.03 0.00 -0.94 0.00 0.00 39.48 37.56 3h39 n PHE 85 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3h39 n MET 86 N -1.70 -1.58 -4.42 -1.08 2.81 -1.10 -4.86 117.12 105.19 3h39 n MET 86 Ca -0.05 0.44 -0.21 0.00 -1.81 0.00 0.00 57.70 56.08 3h39 n MET 86 Cb 0.30 -4.16 -0.10 0.00 -0.71 0.00 0.00 33.22 28.55 3h39 n MET 86 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3h39 s THR 87 N -3.54 1.34 0.27 2.03 2.01 -1.17 -3.64 115.64 112.95 3h39 s THR 87 Ca 0.40 -2.05 -0.10 0.00 0.31 0.00 0.00 61.69 60.25 3h39 s THR 87 Cb -0.15 -2.56 -0.00 0.00 0.01 0.00 0.00 72.50 69.80 3h39 s THR 87 CO 0.87 -0.19 0.46 0.00 -0.69 0.00 0.00 174.62 175.06 3h39 s ALA 88 N -3.20 0.08 -0.03 7.40 0.00 0.15 -0.98 121.76 125.17 3h39 s ALA 88 Ca 0.32 -1.09 -0.01 0.00 0.00 0.00 0.00 51.96 51.18 3h39 s ALA 88 Cb 0.06 1.10 0.03 0.00 0.00 0.00 0.00 23.12 24.31 3h39 s ALA 88 CO 0.13 -0.82 0.06 -1.12 0.00 0.00 0.00 175.76 174.00 3h39 s SER 89 N -3.08 0.26 -0.31 0.00 0.01 -0.14 -1.67 113.70 108.76 3h39 s SER 89 Ca 0.25 0.10 -0.11 0.00 1.31 0.00 0.00 55.95 57.50 3h39 s SER 89 Cb -0.00 -0.03 -0.02 0.00 0.21 0.00 0.00 66.02 66.18 3h39 s SER 89 CO 0.12 -0.16 0.20 -0.22 0.41 0.00 0.00 173.24 173.59 3h39 s LEU 90 N 1.34 4.24 -0.19 2.44 1.98 0.33 -1.89 118.68 126.93 3h39 s LEU 90 Ca -0.06 -0.34 -0.14 0.00 -2.89 0.00 0.00 54.13 50.69 3h39 s LEU 90 Cb -0.13 -2.09 -0.04 0.00 0.66 0.00 0.00 46.19 44.59 3h39 s LEU 90 CO -0.04 -0.17 0.33 -0.36 -1.89 0.00 0.00 176.35 174.22 3h39 s PHE 91 N 1.70 3.41 0.29 5.38 0.08 0.11 -0.78 117.98 128.16 3h39 s PHE 91 Ca 0.06 0.57 0.03 0.00 0.12 0.00 0.00 56.93 57.70 3h39 s PHE 91 Cb -0.17 -2.42 -0.04 0.00 -0.57 0.00 0.00 43.02 39.82 3h39 s PHE 91 CO 0.09 0.11 0.14 -0.51 -0.10 0.00 0.00 175.22 174.95 3h39 s LEU 92 N 0.91 1.67 0.97 -0.37 1.43 -0.20 -2.61 118.68 120.47 3h39 s LEU 92 Ca 0.17 -1.50 -0.15 0.00 -1.03 0.00 0.00 54.13 51.61 3h39 s LEU 92 Cb -0.14 0.13 0.22 0.00 0.03 0.00 0.00 46.19 46.43 3h39 s LEU 92 CO 0.06 -0.84 1.32 -1.59 0.23 0.00 0.00 176.35 175.53 3h39 s LYS 93 N -3.89 0.47 0.00 1.70 0.00 -1.26 -3.10 119.74 113.66 3h39 s LYS 93 Ca 0.36 -0.61 0.00 0.00 0.00 0.00 0.00 55.97 55.72 3h39 s LYS 93 Cb 0.06 -1.88 0.00 0.00 0.00 0.00 0.00 37.83 36.01 3h39 s LYS 93 CO 0.16 -2.49 0.00 0.41 0.00 0.00 0.00 175.35 173.43 3h39 n GLY 94 N -3.76 0.82 0.92 0.59 0.00 -1.26 -2.70 105.19 99.79 3h39 n GLY 94 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3h39 n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h39 n GLY 95 N -2.16 1.10 3.21 -0.02 0.00 -1.26 -5.06 105.19 101.00 3h39 n GLY 95 Ca 0.00 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 3h39 n GLY 95 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h39 s LEU 96 N 0.00 2.68 0.01 0.99 2.96 -1.10 -5.07 118.68 119.16 3h39 s LEU 96 Ca 0.00 -0.62 -0.07 0.00 -0.22 0.00 0.00 54.13 53.22 3h39 s LEU 96 Cb 0.00 -1.62 0.00 0.00 0.50 0.00 0.00 46.19 45.07 3h39 s LEU 96 CO 0.00 -0.04 0.14 0.00 -1.32 0.00 0.00 176.35 175.13 3h39 s ARG 97 N 1.36 0.52 -0.31 1.98 3.03 -1.26 -1.04 118.95 123.23 3h39 s ARG 97 Ca 0.04 -0.45 -0.13 0.00 2.03 0.00 0.00 55.73 57.22 3h39 s ARG 97 Cb -0.14 0.21 -0.03 0.00 -1.03 0.00 0.00 34.95 33.96 3h39 s ARG 97 CO -0.07 -0.13 0.24 0.42 -1.13 0.00 0.00 175.30 174.63 3h39 s ILE 98 N -1.62 5.28 -0.29 4.99 1.01 0.04 -4.18 121.20 126.42 3h39 s ILE 98 Ca -0.13 0.01 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 3h39 s ILE 98 Cb -0.06 -3.65 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 3h39 s ILE 98 CO 0.01 0.09 0.41 -1.81 0.00 0.00 0.00 174.94 173.64 3h39 s ASP 99 N 1.73 6.27 -0.14 3.58 1.01 -0.74 -0.51 116.67 127.87 3h39 s ASP 99 Ca 0.08 0.19 0.01 0.00 0.71 0.00 0.00 52.55 53.53 3h39 s ASP 99 Cb -0.17 -2.23 -0.01 0.00 1.01 0.00 0.00 42.92 41.53 3h39 s ASP 99 CO 0.11 -0.27 -0.16 -0.63 0.21 0.00 0.00 175.17 174.44 3h39 s ILE 100 N 2.14 2.71 0.28 0.77 1.01 -0.67 0.27 121.20 127.72 3h39 s ILE 100 Ca 0.16 -0.77 0.03 0.00 0.00 0.00 0.00 60.65 60.06 3h39 s ILE 100 Cb -0.16 -2.13 -0.06 0.00 0.01 0.00 0.00 42.46 40.13 3h39 s ILE 100 CO 0.11 0.52 0.07 0.00 0.00 0.00 0.00 174.94 175.64 3h39 s ALA 101 N 0.61 1.98 -0.17 9.38 0.00 -0.33 -0.68 121.76 132.57 3h39 s ALA 101 Ca -0.09 -1.93 -0.15 0.00 0.00 0.00 0.00 51.96 49.79 3h39 s ALA 101 Cb -0.16 0.82 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 3h39 s ALA 101 CO 0.03 -0.37 0.37 0.99 0.00 0.00 0.00 175.76 176.78 3h39 s THR 102 N -3.53 5.24 -0.41 0.00 2.01 -1.24 -1.36 115.64 116.35 3h39 s THR 102 Ca 0.36 0.69 -0.27 0.00 0.31 0.00 0.00 61.69 62.78 3h39 s THR 102 Cb 0.08 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 3h39 s THR 102 CO 0.14 0.33 2.05 0.00 -0.69 0.00 0.00 174.62 176.44 3h39 s ALA 103 N 0.79 2.37 0.63 7.40 0.00 0.94 -4.86 121.76 129.03 3h39 s ALA 103 Ca 0.19 0.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.07 3h39 s ALA 103 Cb -0.14 -4.18 -0.06 0.00 0.00 0.00 0.00 23.12 18.74 3h39 s ALA 103 CO 0.07 -3.41 0.61 0.54 0.00 0.00 0.00 175.76 173.56 3h39 n ARG 104 N 8.82 0.51 0.00 0.00 1.74 -1.26 -4.76 116.66 121.71 3h39 n ARG 104 Ca 0.27 0.21 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 3h39 n ARG 104 Cb 0.50 -1.83 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 3h39 n ARG 104 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3h39 n LEU 105 N -0.00 0.00 0.00 0.55 7.94 -1.26 -4.61 117.00 119.62 3h39 n LEU 105 Ca 0.12 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 3h39 n LEU 105 Cb 0.48 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.43 3h39 n LEU 105 CO 0.50 0.00 0.00 1.21 -1.11 0.00 0.00 177.39 177.99 3h39 n GLU 118 N 0.00 0.00 0.29 1.96 0.00 -1.26 -5.04 120.64 116.59 3h39 n GLU 118 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.28 3h39 n GLU 118 Cb 0.00 0.00 0.63 0.00 0.00 0.00 0.00 31.44 32.07 3h39 n GLU 118 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 3h39 h MET 119 N 0.00 0.00 -2.37 5.31 2.86 -2.06 -3.26 114.93 115.41 3h39 h MET 119 Ca 0.00 0.00 -0.45 0.00 -2.06 0.00 0.00 59.70 57.19 3h39 h MET 119 Cb 0.00 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 31.59 3h39 h MET 119 CO 0.00 0.00 1.34 0.43 1.06 0.00 0.00 176.91 179.74 3h39 n SER 120 N -2.63 6.84 0.11 1.22 7.64 -1.26 -3.52 113.62 122.02 3h39 n SER 120 Ca -0.02 -2.71 0.12 0.00 1.01 0.00 0.00 58.87 57.27 3h39 n SER 120 Cb 0.41 -1.42 0.08 0.00 -1.01 0.00 0.00 64.21 62.27 3h39 n SER 120 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 3h39 h THR 121 N 2.37 0.00 0.00 0.44 2.02 -1.93 -3.27 112.91 112.54 3h39 h THR 121 Ca 0.49 -0.86 -0.06 0.00 0.77 0.00 0.00 66.41 66.76 3h39 h THR 121 Cb 0.87 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 3h39 h THR 121 CO 0.95 0.00 -0.27 0.16 0.37 0.00 0.00 175.52 176.73 3h39 h ILE 122 N 0.00 1.10 0.22 3.11 3.07 -1.88 -2.20 117.51 120.94 3h39 h ILE 122 Ca 0.00 -0.95 0.00 0.00 1.55 0.00 0.00 64.86 65.46 3h39 h ILE 122 Cb 0.93 1.53 -0.01 0.00 -0.27 0.00 0.00 36.82 38.99 3h39 h ILE 122 CO 0.00 0.27 -0.20 0.50 -1.05 0.00 0.00 178.15 177.67 3h39 h LYS 123 N 0.00 -0.43 -0.63 0.16 3.64 -1.87 1.30 116.57 118.74 3h39 h LYS 123 Ca -0.00 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.50 3h39 h LYS 123 Cb 0.51 0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 32.35 3h39 h LYS 123 CO 0.04 -0.28 0.26 0.87 -2.27 0.00 0.00 179.45 178.06 3h39 h LYS 124 N -0.44 0.44 -0.23 1.90 1.57 -1.67 0.35 116.57 118.49 3h39 h LYS 124 Ca -0.01 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 3h39 h LYS 124 Cb 0.40 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3h39 h LYS 124 CO -0.03 0.29 -0.09 0.22 -0.57 0.00 0.00 179.45 179.27 3h39 h ASP 125 N 0.45 0.35 1.65 0.86 3.58 -0.71 -2.12 116.42 120.47 3h39 h ASP 125 Ca 0.32 -0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.64 3h39 h ASP 125 Cb 0.38 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.33 3h39 h ASP 125 CO -0.30 0.48 -0.24 -0.07 -2.88 0.00 0.00 179.24 176.23 3h39 h LEU 126 N 0.35 0.00 -0.61 2.28 4.07 0.28 -3.27 115.31 118.41 3h39 h LEU 126 Ca 0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.03 3h39 h LEU 126 Cb 0.38 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.12 3h39 h LEU 126 CO 0.02 0.24 0.00 0.22 -1.08 0.00 0.00 178.44 177.84 3h39 h TYR 127 N 0.00 0.00 0.00 1.13 -0.00 0.35 -3.13 116.97 115.32 3h39 h TYR 127 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3h39 h TYR 127 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.85 3h39 h TYR 127 CO 0.00 0.00 -0.32 0.54 -0.00 0.00 0.00 178.16 178.38 3h39 n ARG 128 N -2.94 0.19 -1.04 1.82 1.74 -1.17 -4.91 116.66 110.35 3h39 n ARG 128 Ca 0.03 0.10 -0.29 0.00 -0.77 0.00 0.00 57.85 56.91 3h39 n ARG 128 Cb 0.41 -1.66 0.22 0.00 -1.02 0.00 0.00 32.46 30.41 3h39 n ARG 128 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3h39 s ARG 129 N -3.09 -0.66 -0.10 5.56 0.52 -1.19 -5.02 118.95 114.97 3h39 s ARG 129 Ca 0.10 0.24 -0.00 0.00 -0.52 0.00 0.00 55.73 55.54 3h39 s ARG 129 Cb 0.15 -1.63 -0.00 0.00 0.52 0.00 0.00 34.95 33.98 3h39 s ARG 129 CO 0.65 -3.40 -0.00 0.38 0.02 0.00 0.00 175.30 172.94 3h39 h ASP 130 N -2.37 0.00 -4.01 0.23 -0.00 -1.89 -3.43 116.42 104.95 3h39 h ASP 130 Ca -0.50 0.00 -0.48 0.00 -0.00 0.00 0.00 57.03 56.04 3h39 h ASP 130 Cb 1.32 0.00 -0.20 0.00 -0.00 0.00 0.00 39.33 40.45 3h39 h ASP 130 CO 0.45 0.48 -0.79 -0.36 -0.00 0.00 0.00 179.24 179.03 3h39 s PHE 131 N -1.54 1.60 0.26 4.15 0.08 -1.26 -3.66 117.98 117.60 3h39 s PHE 131 Ca -0.00 -0.48 -0.05 0.00 0.12 0.00 0.00 56.93 56.52 3h39 s PHE 131 Cb 0.00 -0.84 0.50 0.00 -0.57 0.00 0.00 43.02 42.11 3h39 s PHE 131 CO 0.00 0.20 1.64 1.79 -0.10 0.00 0.00 175.22 178.75 3h39 h THR 132 N 3.72 0.33 0.00 0.64 1.35 -1.60 0.23 112.91 117.57 3h39 h THR 132 Ca -0.42 -0.04 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 3h39 h THR 132 Cb 1.19 0.19 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 3h39 h THR 132 CO 0.46 0.02 0.00 0.16 -0.25 0.00 0.00 175.52 175.91 3h39 h ILE 133 N 0.13 0.00 -0.02 6.82 3.07 -1.86 -1.02 117.51 124.63 3h39 h ILE 133 Ca 0.45 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 66.53 3h39 h ILE 133 Cb 0.82 1.14 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 3h39 h ILE 133 CO -0.67 0.00 -0.20 0.59 -1.05 0.00 0.00 178.15 176.82 3h39 n ASN 134 N -2.37 2.48 -1.45 2.16 3.02 0.66 -4.28 115.26 115.48 3h39 n ASN 134 Ca 0.02 -1.75 0.05 0.00 -0.03 0.00 0.00 54.58 52.88 3h39 n ASN 134 Cb 0.28 0.20 0.29 0.00 -0.61 0.00 0.00 39.78 39.93 3h39 n ASN 134 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h39 n ALA 135 N 0.68 3.39 -2.02 5.41 0.00 -0.35 -4.10 120.51 123.53 3h39 n ALA 135 Ca 0.12 -1.33 -0.19 0.00 0.00 0.00 0.00 53.44 52.04 3h39 n ALA 135 Cb 0.53 -1.08 0.05 0.00 0.00 0.00 0.00 19.45 18.95 3h39 n ALA 135 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3h39 s MET 136 N -2.16 2.41 0.02 0.00 -1.94 -1.26 -4.84 119.30 111.52 3h39 s MET 136 Ca 0.39 -1.42 -0.14 0.00 -1.71 0.00 0.00 55.69 52.80 3h39 s MET 136 Cb 0.29 -2.64 0.02 0.00 2.01 0.00 0.00 34.83 34.51 3h39 s MET 136 CO 0.13 -0.74 0.31 0.00 -0.01 0.00 0.00 175.02 174.70 3h39 s ALA 137 N -2.63 -0.74 -0.12 3.03 0.00 -1.10 -3.24 121.76 116.96 3h39 s ALA 137 Ca 0.60 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.74 3h39 s ALA 137 Cb -0.07 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.27 3h39 s ALA 137 CO 0.38 -0.34 -0.16 0.42 0.00 0.00 0.00 175.76 176.05 3h39 s ILE 138 N -1.98 1.62 0.56 0.00 1.01 0.34 -0.02 121.20 122.73 3h39 s ILE 138 Ca -0.09 -0.70 -0.17 0.00 0.00 0.00 0.00 60.65 59.69 3h39 s ILE 138 Cb -0.03 -1.48 -0.05 0.00 0.01 0.00 0.00 42.46 40.91 3h39 s ILE 138 CO 0.00 0.46 1.05 -0.75 0.00 0.00 0.00 174.94 175.70 3h39 s LYS 139 N 1.09 3.50 0.00 2.79 2.20 -0.59 -0.51 119.74 128.21 3h39 s LYS 139 Ca -0.04 1.21 0.00 0.00 -0.36 0.00 0.00 55.97 56.79 3h39 s LYS 139 Cb -0.14 -2.06 0.00 0.00 -1.51 0.00 0.00 37.83 34.12 3h39 s LYS 139 CO -0.04 -0.67 0.00 1.28 -0.36 0.00 0.00 175.35 175.56 3h39 n LEU 140 N -1.74 0.00 -4.63 5.43 4.77 0.53 -4.01 117.00 117.36 3h39 n LEU 140 Ca 0.09 0.00 -0.46 0.00 -0.03 0.00 0.00 56.01 55.61 3h39 n LEU 140 Cb 0.53 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 3h39 n LEU 140 CO 0.45 0.00 0.80 0.59 -1.33 0.00 0.00 177.39 177.90 3h39 n ASN 141 N -1.29 1.97 -0.28 -1.43 3.02 -1.26 -4.16 115.26 111.84 3h39 n ASN 141 Ca 0.00 1.16 0.33 0.00 -0.03 0.00 0.00 54.58 56.04 3h39 n ASN 141 Cb 0.09 -1.34 0.74 0.00 -0.61 0.00 0.00 39.78 38.66 3h39 n ASN 141 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 3h39 h PRO 142 N 3.19 0.00 -0.01 3.52 0.11 -1.92 -0.78 132.00 136.10 3h39 h PRO 142 Ca -0.43 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.54 3h39 h PRO 142 Cb 1.31 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.41 3h39 h PRO 142 CO 0.69 0.00 -0.63 -0.22 -0.21 0.00 0.00 178.00 177.63 3h39 h LYS 143 N 0.00 0.05 -0.98 1.05 3.64 -1.98 -3.26 116.57 115.09 3h39 h LYS 143 Ca 0.52 -0.04 -0.48 0.00 -1.27 0.00 0.00 60.65 59.39 3h39 h LYS 143 Cb 2.15 0.01 -0.42 0.00 -0.41 0.00 0.00 32.23 33.56 3h39 h LYS 143 CO -0.01 0.66 -0.91 -0.25 -2.27 0.00 0.00 179.45 176.68 3h39 n ASP 144 N -3.81 3.68 0.25 4.20 9.92 -0.37 -4.98 116.55 125.44 3h39 n ASP 144 Ca -0.01 -3.26 -0.16 0.00 -0.53 0.00 0.00 54.79 50.83 3h39 n ASP 144 Cb 0.62 -0.43 -0.08 0.00 -0.64 0.00 0.00 41.12 40.59 3h39 n ASP 144 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 3h39 h PHE 145 N 2.52 -0.56 -0.41 1.24 3.04 -1.42 -3.10 116.94 118.25 3h39 h PHE 145 Ca 0.18 -0.01 -0.26 0.00 3.98 0.00 0.00 57.97 61.86 3h39 h PHE 145 Cb 1.23 0.18 -0.12 0.00 2.56 0.00 0.00 35.95 39.81 3h39 h PHE 145 CO 0.72 -0.30 0.33 0.41 -2.02 0.00 0.00 178.31 177.45 3h39 n GLY 146 N -1.10 3.61 3.57 2.40 0.00 -1.26 -4.08 105.19 108.32 3h39 n GLY 146 Ca -0.11 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.70 3h39 n GLY 146 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h39 s LEU 147 N -1.51 4.20 0.28 0.99 2.96 -1.17 -0.12 118.68 124.31 3h39 s LEU 147 Ca 0.26 0.17 -0.29 0.00 -0.22 0.00 0.00 54.13 54.04 3h39 s LEU 147 Cb 0.21 -2.94 -0.10 0.00 0.50 0.00 0.00 46.19 43.86 3h39 s LEU 147 CO 0.01 -0.74 1.21 -0.22 -1.32 0.00 0.00 176.35 175.29 3h39 s LEU 148 N 3.04 4.48 -0.31 -0.68 0.20 -0.11 -1.54 118.68 123.76 3h39 s LEU 148 Ca 0.29 2.44 0.00 0.00 0.69 0.00 0.00 54.13 57.55 3h39 s LEU 148 Cb -0.13 -3.63 0.09 0.00 -0.43 0.00 0.00 46.19 42.09 3h39 s LEU 148 CO 0.18 -0.35 0.07 -0.63 -0.29 0.00 0.00 176.35 175.32 3h39 s ILE 149 N -0.91 1.28 -0.67 6.68 1.01 0.97 -3.01 121.20 126.54 3h39 s ILE 149 Ca 0.48 -1.59 0.05 0.00 0.00 0.00 0.00 60.65 59.60 3h39 s ILE 149 Cb -0.35 -1.91 0.19 0.00 0.01 0.00 0.00 42.46 40.39 3h39 s ILE 149 CO 0.45 -0.59 0.54 -0.67 0.00 0.00 0.00 174.94 174.67 3h39 n ASP 150 N 4.69 2.91 0.23 3.58 2.03 -0.27 -2.70 116.55 127.01 3h39 n ASP 150 Ca -0.02 -3.20 0.06 0.00 0.52 0.00 0.00 54.79 52.16 3h39 n ASP 150 Cb 0.42 -0.73 0.55 0.00 -0.72 0.00 0.00 41.12 40.64 3h39 n ASP 150 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 3h39 h PHE 151 N 5.14 0.00 -0.02 -0.67 0.04 -1.88 -3.28 116.94 116.26 3h39 h PHE 151 Ca 0.17 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.94 3h39 h PHE 151 Cb 0.75 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.90 3h39 h PHE 151 CO 0.66 0.13 -0.04 1.19 -0.60 0.00 0.00 178.31 179.66 3h39 n PHE 152 N -4.36 0.00 -2.01 -0.55 3.72 -1.26 -4.98 117.46 108.03 3h39 n PHE 152 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 3h39 n PHE 152 Cb 0.21 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.75 3h39 n PHE 152 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h39 n GLY 153 N 1.02 0.66 0.10 1.37 0.00 -1.24 -4.94 105.19 102.17 3h39 n GLY 153 Ca 0.10 -0.51 -0.03 0.00 0.00 0.00 0.00 46.02 45.58 3h39 n GLY 153 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h39 h GLY 154 N 0.00 0.00 0.89 -0.02 0.00 -1.85 -2.97 103.07 99.12 3h39 h GLY 154 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3h39 h GLY 154 CO 0.00 0.00 -0.19 -1.82 0.00 0.00 0.00 176.54 174.53 3h39 h TYR 155 N 0.00 -0.50 -0.42 5.60 3.20 -1.92 0.42 116.97 123.35 3h39 h TYR 155 Ca -0.03 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.90 3h39 h TYR 155 Cb 1.61 0.17 -0.06 0.00 1.54 0.00 0.00 36.73 39.98 3h39 h TYR 155 CO 0.00 -0.25 0.03 -0.09 -1.64 0.00 0.00 178.16 176.22 3h39 h ARG 156 N -0.66 0.14 -0.06 1.82 2.43 -1.98 -1.02 114.38 115.06 3h39 h ARG 156 Ca -0.06 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.00 3h39 h ARG 156 Cb 0.48 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 3h39 h ARG 156 CO 0.09 0.10 -0.43 -0.44 -1.51 0.00 0.00 179.97 177.78 3h39 h ASP 157 N 0.15 0.15 -0.29 -3.80 3.45 -1.45 -1.06 116.42 113.56 3h39 h ASP 157 Ca 0.21 -0.06 -0.03 0.00 0.43 0.00 0.00 57.03 57.57 3h39 h ASP 157 Cb 0.28 -0.04 -0.01 0.00 -0.56 0.00 0.00 39.33 39.00 3h39 h ASP 157 CO -0.31 0.56 0.05 0.25 -1.57 0.00 0.00 179.24 178.21 3h39 h LEU 158 N 0.12 0.45 -0.46 1.55 6.46 0.84 0.35 115.31 124.62 3h39 h LEU 158 Ca 0.01 -0.26 -0.16 0.00 -0.12 0.00 0.00 57.88 57.35 3h39 h LEU 158 Cb 0.81 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.61 3h39 h LEU 158 CO 0.06 0.60 -0.50 0.11 -0.62 0.00 0.00 178.44 178.08 3h39 h LYS 159 N 0.30 0.71 -0.00 1.25 6.56 -1.05 -2.60 116.57 121.74 3h39 h LYS 159 Ca 0.09 -0.42 0.00 0.00 -1.06 0.00 0.00 60.65 59.26 3h39 h LYS 159 Cb 0.33 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.03 3h39 h LYS 159 CO 0.01 1.04 -0.06 0.39 -2.06 0.00 0.00 179.45 178.77 3h39 n GLU 160 N -4.00 0.44 -2.96 3.15 1.02 -0.42 -4.96 120.64 112.91 3h39 n GLU 160 Ca -0.03 -0.07 -0.12 0.00 -0.02 0.00 0.00 57.16 56.92 3h39 n GLU 160 Cb 0.59 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.57 3h39 n GLU 160 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h39 n GLY 161 N 1.32 -0.33 3.29 0.62 0.00 0.70 -4.90 105.19 105.88 3h39 n GLY 161 Ca 0.13 0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 3h39 n GLY 161 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h39 s VAL 162 N -3.28 2.14 -0.21 1.61 1.01 0.88 -1.73 120.40 120.83 3h39 s VAL 162 Ca 0.13 -1.05 -0.07 0.00 0.00 0.00 0.00 61.98 60.99 3h39 s VAL 162 Cb -0.02 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.56 3h39 s VAL 162 CO 0.54 0.57 0.05 -0.63 0.00 0.00 0.00 175.10 175.64 3h39 s ILE 163 N -0.29 4.47 -0.23 2.22 -1.09 -0.11 -4.67 121.20 121.50 3h39 s ILE 163 Ca 0.00 -0.13 -0.10 0.00 -2.23 0.00 0.00 60.65 58.19 3h39 s ILE 163 Cb -0.13 -3.04 0.09 0.00 -1.58 0.00 0.00 42.46 37.80 3h39 s ILE 163 CO 0.02 0.41 0.52 -0.60 -1.23 0.00 0.00 174.94 174.06 3h39 s ARG 164 N 0.90 0.47 0.86 2.79 3.52 -1.26 -1.92 118.95 124.31 3h39 s ARG 164 Ca 0.03 1.08 -0.11 0.00 -0.13 0.00 0.00 55.73 56.61 3h39 s ARG 164 Cb -0.14 0.29 0.11 0.00 -1.56 0.00 0.00 34.95 33.65 3h39 s ARG 164 CO 0.02 -0.19 1.10 0.14 -0.81 0.00 0.00 175.30 175.56 3h39 s VAL 165 N 2.10 2.82 -0.14 7.11 -7.23 -1.26 -1.61 120.40 122.18 3h39 s VAL 165 Ca -0.07 0.27 0.15 0.00 -1.81 0.00 0.00 61.98 60.52 3h39 s VAL 165 Cb -0.09 -2.66 -0.00 0.00 0.56 0.00 0.00 36.38 34.19 3h39 s VAL 165 CO -0.15 -0.35 1.25 -0.07 -0.31 0.00 0.00 175.10 175.47 3h39 h LEU 166 N -1.48 0.00 0.00 1.32 3.38 -1.83 -3.44 115.31 113.26 3h39 h LEU 166 Ca -0.47 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.39 3h39 h LEU 166 Cb 1.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 3h39 h LEU 166 CO 0.51 0.52 0.10 0.00 0.09 0.00 0.00 178.44 179.66 3h39 n HIS 167 N -3.12 -1.87 0.01 1.13 1.44 -1.26 -5.09 115.22 106.47 3h39 n HIS 167 Ca -0.01 -1.81 -0.10 0.00 -2.01 0.00 0.00 57.72 53.79 3h39 n HIS 167 Cb 0.77 0.69 0.05 0.00 0.12 0.00 0.00 29.99 31.61 3h39 n HIS 167 CO 0.00 0.00 0.00 1.15 -2.81 0.00 0.00 176.34 174.68 3h39 h THR 168 N 1.88 1.32 0.00 0.61 2.02 -2.01 -3.16 112.91 113.57 3h39 h THR 168 Ca -0.27 -1.82 0.00 0.00 0.77 0.00 0.00 66.41 65.09 3h39 h THR 168 Cb 1.07 1.79 0.00 0.00 -1.74 0.00 0.00 68.15 69.28 3h39 h THR 168 CO 0.36 0.56 -0.45 0.18 0.37 0.00 0.00 175.52 176.54 3h39 n LEU 169 N -3.95 0.49 -0.21 2.58 4.32 -1.26 -4.52 117.00 114.45 3h39 n LEU 169 Ca -0.03 0.15 0.16 0.00 -0.02 0.00 0.00 56.01 56.27 3h39 n LEU 169 Cb 0.61 -0.27 0.30 0.00 -1.62 0.00 0.00 43.42 42.44 3h39 n LEU 169 CO 0.47 0.05 0.60 -0.24 -1.22 0.00 0.00 177.39 177.05 3h39 n SER 170 N -1.69 0.11 0.08 -1.43 2.88 -1.20 0.23 113.62 112.59 3h39 n SER 170 Ca 0.05 1.05 -0.09 0.00 -1.33 0.00 0.00 58.87 58.55 3h39 n SER 170 Cb 0.37 -0.46 -0.10 0.00 -0.75 0.00 0.00 64.21 63.27 3h39 n SER 170 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 3h39 h PHE 171 N 0.00 0.14 -0.49 0.66 0.04 -1.83 -2.58 116.94 112.88 3h39 h PHE 171 Ca 0.47 -0.10 -0.12 0.00 2.80 0.00 0.00 57.97 61.03 3h39 h PHE 171 Cb 1.17 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 39.29 3h39 h PHE 171 CO -0.13 1.04 -0.17 0.28 -0.60 0.00 0.00 178.31 178.73 3h39 h VAL 172 N 0.03 1.27 -0.49 -0.55 2.07 0.26 -2.04 116.25 116.79 3h39 h VAL 172 Ca -0.04 -1.32 -0.07 0.00 0.82 0.00 0.00 66.70 66.09 3h39 h VAL 172 Cb 1.76 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 3h39 h VAL 172 CO 0.14 0.46 0.03 0.44 0.02 0.00 0.00 177.57 178.66 3h39 h ASP 173 N 0.84 0.76 -1.63 0.57 5.19 -1.14 -3.40 116.42 117.61 3h39 h ASP 173 Ca 0.12 -0.17 -0.30 0.00 -0.62 0.00 0.00 57.03 56.06 3h39 h ASP 173 Cb 0.73 -0.20 -0.27 0.00 0.18 0.00 0.00 39.33 39.77 3h39 h ASP 173 CO 0.06 0.81 -0.64 -0.62 -3.12 0.00 0.00 179.24 175.72 3h39 s ASP 174 N -6.63 0.13 0.61 6.45 -1.08 -0.98 -5.01 116.67 110.16 3h39 s ASP 174 Ca -0.09 -1.69 0.30 0.00 -0.52 0.00 0.00 52.55 50.55 3h39 s ASP 174 Cb 0.15 0.96 1.67 0.00 -1.46 0.00 0.00 42.92 44.24 3h39 s ASP 174 CO 0.81 -0.18 2.03 -0.65 0.52 0.00 0.00 175.17 177.69 3h39 h PRO 175 N 6.40 0.00 -1.23 4.34 0.11 -1.59 -0.88 132.00 139.15 3h39 h PRO 175 Ca 0.09 0.00 0.38 0.00 0.11 0.00 0.00 66.00 66.58 3h39 h PRO 175 Cb 1.07 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.07 3h39 h PRO 175 CO 0.16 0.00 0.80 1.15 -0.21 0.00 0.00 178.00 179.91 3h39 h THR 176 N 0.00 0.26 0.00 -1.15 2.02 -1.94 -0.90 112.91 111.20 3h39 h THR 176 Ca 0.09 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.21 3h39 h THR 176 Cb 0.66 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 3h39 h THR 176 CO -0.00 0.03 0.00 0.54 0.37 0.00 0.00 175.52 176.46 3h39 n ARG 177 N -4.64 0.03 -0.02 6.66 1.74 -0.34 -1.81 116.66 118.29 3h39 n ARG 177 Ca 0.33 0.32 -0.16 0.00 -0.77 0.00 0.00 57.85 57.58 3h39 n ARG 177 Cb 1.25 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 31.09 3h39 n ARG 177 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3h39 h ILE 178 N 0.00 1.45 -0.37 0.55 2.04 -1.39 0.40 117.51 120.20 3h39 h ILE 178 Ca 0.00 -1.88 -0.16 0.00 1.00 0.00 0.00 64.86 63.82 3h39 h ILE 178 Cb 0.12 2.51 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 3h39 h ILE 178 CO 0.00 0.54 -0.40 -0.07 0.00 0.00 0.00 178.15 178.22 3h39 h LEU 179 N -0.22 0.99 -0.20 1.44 3.38 -1.59 -3.09 115.31 116.02 3h39 h LEU 179 Ca -0.04 -0.46 0.03 0.00 0.09 0.00 0.00 57.88 57.51 3h39 h LEU 179 Cb 1.08 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 3h39 h LEU 179 CO 0.08 1.26 -0.00 0.03 0.09 0.00 0.00 178.44 179.89 3h39 h ARG 180 N 0.75 0.06 -0.87 1.13 3.08 -1.35 -0.92 114.38 116.26 3h39 h ARG 180 Ca 0.06 -0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.21 3h39 h ARG 180 Cb 0.99 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.97 3h39 h ARG 180 CO 0.10 0.04 0.56 0.00 -1.07 0.00 0.00 179.97 179.60 3h39 h ALA 181 N 1.18 1.68 0.05 0.04 0.00 -0.91 -1.13 119.26 120.17 3h39 h ALA 181 Ca 0.10 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3h39 h ALA 181 Cb 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3h39 h ALA 181 CO -0.17 0.13 -0.02 0.82 0.00 0.00 0.00 179.25 180.01 3h39 h ILE 182 N 0.83 1.29 -0.77 0.00 2.04 -1.41 -2.00 117.51 117.49 3h39 h ILE 182 Ca 0.41 -1.25 0.18 0.00 1.00 0.00 0.00 64.86 65.20 3h39 h ILE 182 Cb 0.45 2.10 -0.13 0.00 -0.74 0.00 0.00 36.82 38.51 3h39 h ILE 182 CO -0.17 0.31 0.08 -0.09 0.00 0.00 0.00 178.15 178.28 3h39 h ARG 183 N -0.64 0.15 -0.34 2.37 2.43 -0.27 0.01 114.38 118.10 3h39 h ARG 183 Ca -0.01 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 3h39 h ARG 183 Cb 0.56 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 3h39 h ARG 183 CO 0.01 0.10 -0.32 0.74 -1.51 0.00 0.00 179.97 178.99 3h39 h PHE 184 N 0.16 0.98 -0.85 2.20 0.05 -1.30 -1.86 116.94 116.32 3h39 h PHE 184 Ca 0.44 -0.29 0.21 0.00 3.82 0.00 0.00 57.97 62.15 3h39 h PHE 184 Cb 0.80 -0.21 -0.13 0.00 2.00 0.00 0.00 35.95 38.42 3h39 h PHE 184 CO -0.36 1.07 0.28 1.49 -0.18 0.00 0.00 178.31 180.62 3h39 h GLU 185 N 0.60 0.30 0.00 1.51 4.81 -0.23 -1.56 114.58 120.01 3h39 h GLU 185 Ca 0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3h39 h GLU 185 Cb 0.90 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.21 3h39 h GLU 185 CO 0.08 0.20 -1.07 1.04 -0.73 0.00 0.00 179.01 178.53 3h39 n GLN 186 N -5.13 0.55 -0.00 1.92 1.13 -0.76 -0.50 117.38 114.59 3h39 n GLN 186 Ca 0.20 0.08 -0.18 0.00 -1.94 0.00 0.00 57.00 55.15 3h39 n GLN 186 Cb 0.61 -1.76 -0.09 0.00 0.11 0.00 0.00 30.24 29.10 3h39 n GLN 186 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 3h39 h ARG 187 N 0.00 0.65 -0.22 -1.09 2.43 -0.52 -3.31 114.38 112.31 3h39 h ARG 187 Ca 0.00 -0.60 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 3h39 h ARG 187 Cb 0.95 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 3h39 h ARG 187 CO 0.00 1.21 0.00 1.19 -1.51 0.00 0.00 179.97 180.86 3h39 n PHE 188 N -4.03 0.27 -3.78 2.20 0.99 -0.67 -4.95 117.46 107.50 3h39 n PHE 188 Ca -0.09 -0.14 -0.25 0.00 -0.00 0.00 0.00 57.45 56.97 3h39 n PHE 188 Cb 0.74 -0.00 0.03 0.00 -1.00 0.00 0.00 39.48 39.25 3h39 n PHE 188 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 3h39 n ASP 189 N 1.36 -2.98 -5.03 4.37 10.43 -0.85 -4.99 116.55 118.85 3h39 n ASP 189 Ca 0.16 -0.78 -0.20 0.00 2.57 0.00 0.00 54.79 56.54 3h39 n ASP 189 Cb 0.58 -4.07 0.06 0.00 1.84 0.00 0.00 41.12 39.53 3h39 n ASP 189 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 3h39 s PHE 190 N -3.49 1.40 0.08 1.24 2.99 0.35 -5.01 117.98 115.54 3h39 s PHE 190 Ca 0.31 -0.73 0.03 0.00 0.00 0.00 0.00 56.93 56.54 3h39 s PHE 190 Cb -0.15 -2.20 -0.03 0.00 0.00 0.00 0.00 43.02 40.63 3h39 s PHE 190 CO 0.81 -1.15 -0.09 -0.98 -0.00 0.00 0.00 175.22 173.82 3h39 s ARG 191 N -4.66 0.76 -0.44 0.44 1.70 -0.71 -4.67 118.95 111.38 3h39 s ARG 191 Ca 0.61 -1.09 -0.24 0.00 -0.47 0.00 0.00 55.73 54.54 3h39 s ARG 191 Cb -0.06 -0.42 0.02 0.00 -0.57 0.00 0.00 34.95 33.93 3h39 s ARG 191 CO 0.39 0.06 0.85 0.42 -1.08 0.00 0.00 175.30 175.93 3h39 s ILE 192 N -2.38 4.59 0.60 4.99 1.01 -1.26 -0.94 121.20 127.81 3h39 s ILE 192 Ca 0.03 0.66 -0.19 0.00 0.00 0.00 0.00 60.65 61.15 3h39 s ILE 192 Cb -0.03 -4.35 -0.04 0.00 0.01 0.00 0.00 42.46 38.05 3h39 s ILE 192 CO -0.01 -0.71 1.03 -1.84 0.00 0.00 0.00 174.94 173.42 3h39 n GLU 193 N 6.85 0.97 -0.29 2.79 -0.00 -0.81 -4.33 120.64 125.82 3h39 n GLU 193 Ca 0.04 0.38 -0.00 0.00 -0.00 0.00 0.00 57.16 57.58 3h39 n GLU 193 Cb 0.48 -2.24 0.13 0.00 -0.00 0.00 0.00 31.44 29.81 3h39 n GLU 193 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 3h39 h GLU 194 N 0.54 0.89 0.00 3.44 4.11 -1.95 0.67 114.58 122.30 3h39 h GLU 194 Ca -0.49 -0.05 -0.04 0.00 0.07 0.00 0.00 59.36 58.85 3h39 h GLU 194 Cb 1.36 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 3h39 h GLU 194 CO 0.51 0.59 -0.20 1.15 0.07 0.00 0.00 179.01 181.14 3h39 h THR 195 N 0.92 0.91 0.10 -1.06 2.02 -1.97 0.28 112.91 114.11 3h39 h THR 195 Ca 0.35 -0.73 -0.26 0.00 0.77 0.00 0.00 66.41 66.54 3h39 h THR 195 Cb 0.15 1.42 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 3h39 h THR 195 CO -0.17 0.19 -1.18 0.74 0.37 0.00 0.00 175.52 175.47 3h39 h THR 196 N 0.00 1.55 0.20 3.16 2.02 -1.27 -1.88 112.91 116.70 3h39 h THR 196 Ca -0.00 -3.14 -0.01 0.00 0.77 0.00 0.00 66.41 64.03 3h39 h THR 196 Cb 0.41 2.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.74 3h39 h THR 196 CO 0.03 0.91 -0.10 -0.08 0.37 0.00 0.00 175.52 176.65 3h39 h GLU 197 N 0.06 -0.26 -0.54 6.66 4.81 -0.26 0.97 114.58 126.01 3h39 h GLU 197 Ca -0.10 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.19 3h39 h GLU 197 Cb 1.92 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 31.33 3h39 h GLU 197 CO 0.19 -0.09 0.36 -0.09 -0.73 0.00 0.00 179.01 178.64 3h39 h ARG 198 N -0.38 0.54 0.00 1.92 2.43 -0.53 -2.00 114.38 116.36 3h39 h ARG 198 Ca -0.03 -0.03 -0.20 0.00 -0.81 0.00 0.00 59.98 58.91 3h39 h ARG 198 Cb 0.29 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 3h39 h ARG 198 CO 0.05 0.36 -0.94 1.25 -1.51 0.00 0.00 179.97 179.17 3h39 h LEU 199 N 0.56 0.00 0.40 3.80 5.85 -0.93 -2.78 115.31 122.21 3h39 h LEU 199 Ca 0.23 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 3h39 h LEU 199 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3h39 h LEU 199 CO -0.06 0.94 -0.19 0.25 -0.34 0.00 0.00 178.44 179.03 3h39 h LEU 200 N 0.00 -0.46 -0.88 2.25 6.46 -0.42 -2.50 115.31 119.76 3h39 h LEU 200 Ca -0.01 -0.03 0.17 0.00 -0.12 0.00 0.00 57.88 57.89 3h39 h LEU 200 Cb 1.69 0.12 -0.17 0.00 -0.73 0.00 0.00 40.66 41.57 3h39 h LEU 200 CO 0.12 -0.02 -0.24 0.11 -0.62 0.00 0.00 178.44 177.79 3h39 h LYS 201 N -1.11 -0.01 -0.60 1.25 1.57 -1.45 0.51 116.57 116.73 3h39 h LYS 201 Ca -0.06 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.81 3h39 h LYS 201 Cb 0.47 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.71 3h39 h LYS 201 CO 0.09 -0.00 0.24 0.37 -0.57 0.00 0.00 179.45 179.58 3h39 h GLN 202 N -0.01 0.42 -0.10 3.15 4.15 -1.54 0.49 115.11 121.68 3h39 h GLN 202 Ca 0.41 -0.03 -0.07 0.00 0.77 0.00 0.00 58.65 59.74 3h39 h GLN 202 Cb 0.64 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.22 3h39 h GLN 202 CO -0.91 0.28 -0.25 0.00 -1.93 0.00 0.00 178.83 176.02 3h39 h ALA 203 N 1.39 1.39 0.00 3.38 0.00 0.37 -2.21 119.26 123.59 3h39 h ALA 203 Ca 0.29 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3h39 h ALA 203 Cb 0.33 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3h39 h ALA 203 CO -0.28 0.43 -0.14 0.28 0.00 0.00 0.00 179.25 179.54 3h39 h VAL 204 N 0.16 1.59 -0.73 0.00 2.07 0.20 -2.90 116.25 116.64 3h39 h VAL 204 Ca 0.03 -1.93 0.01 0.00 0.82 0.00 0.00 66.70 65.62 3h39 h VAL 204 Cb 0.54 2.85 -0.04 0.00 -1.52 0.00 0.00 31.29 33.13 3h39 h VAL 204 CO 0.04 0.52 0.48 -0.33 0.02 0.00 0.00 177.57 178.29 3h39 h GLU 205 N -0.64 0.97 0.00 1.57 4.39 -0.95 -2.13 114.58 117.79 3h39 h GLU 205 Ca -0.02 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.62 3h39 h GLU 205 Cb 0.92 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 3h39 h GLU 205 CO 0.03 0.64 0.00 0.39 -1.16 0.00 0.00 179.01 178.91 3h39 n GLU 206 N -4.57 0.51 -2.63 2.33 1.02 -0.83 -4.82 120.64 111.65 3h39 n GLU 206 Ca 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.17 3h39 n GLU 206 Cb 0.02 -1.34 0.01 0.00 -0.02 0.00 0.00 31.44 30.10 3h39 n GLU 206 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h39 n GLY 207 N 0.01 -1.14 0.03 0.62 0.00 -0.80 -5.01 105.19 98.91 3h39 n GLY 207 Ca 0.08 0.76 -0.03 0.00 0.00 0.00 0.00 46.02 46.83 3h39 n GLY 207 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3h39 n TYR 208 N -0.79 0.00 -0.06 1.61 4.01 -1.09 -4.46 117.16 116.37 3h39 n TYR 208 Ca 0.06 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.71 3h39 n TYR 208 Cb 0.41 -0.31 -0.02 0.00 -0.31 0.00 0.00 39.34 39.11 3h39 n TYR 208 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3h39 h LEU 209 N 0.00 0.23 -1.65 7.72 4.07 -1.86 -2.41 115.31 121.41 3h39 h LEU 209 Ca -0.16 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.80 3h39 h LEU 209 Cb 1.30 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 43.00 3h39 h LEU 209 CO 0.01 0.17 0.00 1.05 -1.08 0.00 0.00 178.44 178.59 3h39 h GLU 210 N 0.30 0.00 -0.00 1.13 9.09 -1.81 -1.46 114.58 121.84 3h39 h GLU 210 Ca 0.10 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.51 3h39 h GLU 210 Cb -0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.09 3h39 h GLU 210 CO -0.04 0.00 -0.05 -2.13 0.05 0.00 0.00 179.01 176.84 3h39 n ARG 211 N -2.75 0.15 -5.17 1.06 0.00 -0.91 -4.82 116.66 104.22 3h39 n ARG 211 Ca -0.00 -0.02 -0.30 0.00 -0.00 0.00 0.00 57.85 57.53 3h39 n ARG 211 Cb 0.19 -1.50 -0.16 0.00 0.00 0.00 0.00 32.46 30.99 3h39 n ARG 211 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 3h39 s THR 212 N -2.86 1.99 0.80 5.15 -4.23 -0.55 -5.10 115.64 110.84 3h39 s THR 212 Ca 0.18 -1.13 -0.15 0.00 -1.18 0.00 0.00 61.69 59.42 3h39 s THR 212 Cb 0.19 -1.66 0.01 0.00 1.34 0.00 0.00 72.50 72.38 3h39 s THR 212 CO 0.52 0.51 0.65 0.35 -0.54 0.00 0.00 174.62 176.11 3h39 n THR 213 N 2.32 1.38 0.05 3.99 -2.24 -1.26 -4.80 114.28 113.72 3h39 n THR 213 Ca -0.16 -0.30 -0.13 0.00 -2.27 0.00 0.00 64.05 61.19 3h39 n THR 213 Cb 0.52 -0.81 -0.08 0.00 -2.10 0.00 0.00 70.33 67.85 3h39 n THR 213 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3h39 h GLY 214 N -0.81 -0.09 -0.15 3.38 0.00 -1.95 -2.88 103.07 100.57 3h39 h GLY 214 Ca -0.45 0.03 0.06 0.00 0.00 0.00 0.00 47.33 46.97 3h39 h GLY 214 CO 0.41 -0.03 -0.40 -2.55 0.00 0.00 0.00 176.54 173.97 3h39 h PRO 215 N -0.28 -0.35 -0.87 4.80 0.11 -1.91 0.56 132.00 134.05 3h39 h PRO 215 Ca -0.01 0.02 0.16 0.00 0.11 0.00 0.00 66.00 66.28 3h39 h PRO 215 Cb 0.25 0.08 -0.10 0.00 0.11 0.00 0.00 31.00 31.34 3h39 h PRO 215 CO 0.01 -0.23 0.46 0.00 -0.21 0.00 0.00 178.00 178.03 3h39 h ARG 216 N -0.36 0.61 -0.06 1.05 3.08 -1.91 0.26 114.38 117.04 3h39 h ARG 216 Ca 0.12 -0.04 -0.20 0.00 0.07 0.00 0.00 59.98 59.94 3h39 h ARG 216 Cb 0.58 -0.14 0.01 0.00 0.08 0.00 0.00 29.97 30.51 3h39 h ARG 216 CO -0.50 0.40 -0.73 -0.07 -1.07 0.00 0.00 179.97 178.00 3h39 h LEU 217 N 0.62 0.74 -0.82 3.04 4.07 -1.23 -3.07 115.31 118.66 3h39 h LEU 217 Ca 0.49 -0.70 0.04 0.00 0.08 0.00 0.00 57.88 57.78 3h39 h LEU 217 Cb 0.72 -0.22 -0.05 0.00 1.08 0.00 0.00 40.66 42.18 3h39 h LEU 217 CO -0.38 1.33 0.53 -0.09 -1.08 0.00 0.00 178.44 178.75 3h39 h ARG 218 N 0.21 0.99 -0.32 1.13 2.43 0.16 -1.81 114.38 117.17 3h39 h ARG 218 Ca -0.08 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 3h39 h ARG 218 Cb 1.39 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.71 3h39 h ARG 218 CO 0.15 0.65 0.07 0.37 -1.51 0.00 0.00 179.97 179.70 3h39 h GLN 219 N 1.02 0.53 0.00 0.20 4.15 -0.59 0.12 115.11 120.53 3h39 h GLN 219 Ca 0.33 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 3h39 h GLN 219 Cb 0.03 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.65 3h39 h GLN 219 CO -0.12 0.60 -0.06 0.93 -1.93 0.00 0.00 178.83 178.25 3h39 h GLU 220 N 0.36 0.00 0.08 1.69 4.39 -1.38 -0.99 114.58 118.73 3h39 h GLU 220 Ca 0.10 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.58 3h39 h GLU 220 Cb 0.32 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 3h39 h GLU 220 CO 0.00 0.06 -1.10 1.25 -1.16 0.00 0.00 179.01 178.06 3h39 h LEU 221 N 0.00 0.28 -0.49 1.33 5.85 -0.59 -2.29 115.31 119.39 3h39 h LEU 221 Ca -0.00 -0.83 0.02 0.00 0.84 0.00 0.00 57.88 57.91 3h39 h LEU 221 Cb 0.17 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3h39 h LEU 221 CO 0.01 1.48 0.29 -0.33 -0.34 0.00 0.00 178.44 179.55 3h39 h GLU 222 N -0.52 0.56 -0.95 1.25 5.08 -0.80 -1.54 114.58 117.65 3h39 h GLU 222 Ca -0.25 -0.03 0.19 0.00 -1.00 0.00 0.00 59.36 58.27 3h39 h GLU 222 Cb 1.56 -0.13 -0.11 0.00 0.50 0.00 0.00 28.75 30.58 3h39 h GLU 222 CO 0.02 0.37 0.54 -0.22 -1.00 0.00 0.00 179.01 178.72 3h39 h LYS 223 N 0.58 0.64 -0.05 2.33 1.63 -1.24 -0.03 116.57 120.43 3h39 h LYS 223 Ca 0.20 -0.04 -0.08 0.00 -0.85 0.00 0.00 60.65 59.88 3h39 h LYS 223 Cb 0.03 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 3h39 h LYS 223 CO -0.10 0.42 -0.36 0.82 -3.45 0.00 0.00 179.45 176.79 3h39 h ILE 224 N 0.66 1.27 0.00 2.00 2.04 -0.69 -3.07 117.51 119.72 3h39 h ILE 224 Ca 0.56 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 65.11 3h39 h ILE 224 Cb 0.91 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.62 3h39 h ILE 224 CO -0.41 0.38 -0.24 0.18 0.00 0.00 0.00 178.15 178.07 3h39 n LEU 225 N -4.09 0.52 0.18 1.44 4.77 -0.06 -3.06 117.00 116.69 3h39 n LEU 225 Ca -0.02 0.38 0.08 0.00 -0.03 0.00 0.00 56.01 56.42 3h39 n LEU 225 Cb 0.41 -0.32 0.09 0.00 -2.33 0.00 0.00 43.42 41.28 3h39 n LEU 225 CO 0.40 -0.05 0.59 -0.33 -1.33 0.00 0.00 177.39 176.66 3h39 h GLU 226 N 0.00 0.00 0.00 3.23 5.08 -1.36 -3.45 114.58 118.09 3h39 h GLU 226 Ca 0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.07 3h39 h GLU 226 Cb 0.64 0.00 0.15 0.00 0.50 0.00 0.00 28.75 30.04 3h39 h GLU 226 CO 0.00 0.19 0.02 0.39 -1.00 0.00 0.00 179.01 178.62 3h39 n GLU 227 N -3.11 -3.10 -0.10 2.33 -0.58 -1.17 -4.99 120.64 109.93 3h39 n GLU 227 Ca 0.02 -1.26 -0.10 0.00 -0.42 0.00 0.00 57.16 55.41 3h39 n GLU 227 Cb 0.62 -1.30 -0.03 0.00 -0.57 0.00 0.00 31.44 30.17 3h39 n GLU 227 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 3h39 h LYS 228 N 0.00 0.47 -3.78 3.49 3.64 -1.88 -3.38 116.57 115.14 3h39 h LYS 228 Ca -0.31 -0.10 -0.62 0.00 -1.27 0.00 0.00 60.65 58.35 3h39 h LYS 228 Cb 0.97 -0.07 -0.40 0.00 -0.41 0.00 0.00 32.23 32.31 3h39 h LYS 228 CO 0.20 0.50 -0.72 -0.80 -2.27 0.00 0.00 179.45 176.36 3h39 s ASN 229 N -5.79 4.24 0.13 4.20 0.02 -1.26 -4.94 114.94 111.54 3h39 s ASN 229 Ca -0.13 -2.26 -0.14 0.00 -1.02 0.00 0.00 52.86 49.30 3h39 s ASN 229 Cb 0.09 -1.29 -0.02 0.00 0.02 0.00 0.00 41.25 40.04 3h39 s ASN 229 CO 0.74 -0.34 1.54 -0.65 0.02 0.00 0.00 177.10 178.41 3h39 h PRO 230 N 7.36 0.75 -0.32 -0.60 0.11 -1.81 -1.84 132.00 135.65 3h39 h PRO 230 Ca -0.07 -0.27 0.06 0.00 0.11 0.00 0.00 66.00 65.83 3h39 h PRO 230 Cb 0.98 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 31.98 3h39 h PRO 230 CO 0.53 0.87 -0.06 1.25 -0.21 0.00 0.00 178.00 180.37 3h39 h LEU 231 N 0.57 -0.26 -0.42 2.35 6.46 -1.95 -1.22 115.31 120.84 3h39 h LEU 231 Ca 0.11 0.09 -0.02 0.00 -0.12 0.00 0.00 57.88 57.93 3h39 h LEU 231 Cb 0.57 0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.66 3h39 h LEU 231 CO 0.03 -0.09 0.18 0.50 -0.62 0.00 0.00 178.44 178.44 3h39 h LYS 232 N 0.02 0.62 -0.43 1.25 3.64 -1.95 -1.68 116.57 118.05 3h39 h LYS 232 Ca 0.15 -0.11 0.10 0.00 -1.27 0.00 0.00 60.65 59.52 3h39 h LYS 232 Cb 0.23 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 3h39 h LYS 232 CO -0.31 0.57 0.30 0.77 -2.27 0.00 0.00 179.45 178.50 3h39 h SER 233 N 0.53 0.12 0.20 4.20 0.02 -0.79 -1.40 113.55 116.43 3h39 h SER 233 Ca 0.14 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.78 3h39 h SER 233 Cb 0.17 -0.02 0.02 0.00 0.14 0.00 0.00 62.40 62.71 3h39 h SER 233 CO -0.01 0.08 -1.49 0.40 -1.14 0.00 0.00 176.83 174.66 3h39 h ILE 234 N 0.14 1.15 -0.30 3.27 2.04 -0.35 -0.02 117.51 123.44 3h39 h ILE 234 Ca 0.20 -2.57 -0.09 0.00 1.00 0.00 0.00 64.86 63.40 3h39 h ILE 234 Cb 0.61 2.92 -0.02 0.00 -0.74 0.00 0.00 36.82 39.60 3h39 h ILE 234 CO -0.03 0.80 -0.18 0.03 0.00 0.00 0.00 178.15 178.77 3h39 h ARG 235 N 0.00 0.54 0.15 2.37 3.08 -1.27 0.17 114.38 119.43 3h39 h ARG 235 Ca -0.28 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.58 3h39 h ARG 235 Cb 2.02 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 32.03 3h39 h ARG 235 CO 0.20 0.70 -0.07 -0.09 -1.07 0.00 0.00 179.97 179.64 3h39 h ARG 236 N 0.49 -0.19 -0.80 0.04 9.65 -1.30 -1.67 114.38 120.60 3h39 h ARG 236 Ca 0.08 0.01 0.18 0.00 -1.10 0.00 0.00 59.98 59.16 3h39 h ARG 236 Cb 0.60 0.04 -0.12 0.00 -1.39 0.00 0.00 29.97 29.10 3h39 h ARG 236 CO 0.04 0.11 0.23 0.52 2.80 0.00 0.00 179.97 183.67 3h39 h MET 237 N -0.50 0.29 -0.61 0.20 2.86 -0.67 0.66 114.93 117.15 3h39 h MET 237 Ca -0.02 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.66 3h39 h MET 237 Cb 0.39 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.93 3h39 h MET 237 CO 0.03 0.19 0.32 0.00 1.06 0.00 0.00 176.91 178.52 3h39 h ALA 238 N 1.66 0.81 -0.92 6.32 0.00 -0.40 -2.25 119.26 124.47 3h39 h ALA 238 Ca 0.47 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.52 3h39 h ALA 238 Cb 0.84 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.46 3h39 h ALA 238 CO -0.54 -0.02 0.55 1.96 0.00 0.00 0.00 179.25 181.21 3h39 h GLN 239 N 0.60 0.85 -0.19 0.00 4.20 0.10 0.43 115.11 121.10 3h39 h GLN 239 Ca 0.28 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.94 3h39 h GLN 239 Cb 0.19 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3h39 h GLN 239 CO -0.19 0.56 0.00 1.19 -0.67 0.00 0.00 178.83 179.73 3h39 n PHE 240 N -4.69 0.25 -3.98 2.96 3.72 -0.89 -4.92 117.46 109.91 3h39 n PHE 240 Ca 0.17 -0.12 -0.28 0.00 -0.05 0.00 0.00 57.45 57.17 3h39 n PHE 240 Cb 0.34 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.87 3h39 n PHE 240 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3h39 n ASP 241 N 0.05 -1.45 -0.01 4.37 9.92 0.15 -4.91 116.55 124.67 3h39 n ASP 241 Ca 0.07 -0.97 -0.11 0.00 -0.53 0.00 0.00 54.79 53.26 3h39 n ASP 241 Cb 0.17 -3.18 -0.14 0.00 -0.64 0.00 0.00 41.12 37.33 3h39 n ASP 241 CO 0.00 0.00 0.00 -0.37 0.13 0.00 0.00 177.20 176.96 3h39 h VAL 242 N -1.80 0.86 -0.27 2.53 -1.51 -1.69 -3.35 116.25 111.03 3h39 h VAL 242 Ca -0.62 -2.68 0.05 0.00 -1.23 0.00 0.00 66.70 62.22 3h39 h VAL 242 Cb 1.38 2.47 -0.05 0.00 -2.13 0.00 0.00 31.29 32.96 3h39 h VAL 242 CO 0.65 0.60 -0.02 0.40 -1.23 0.00 0.00 177.57 177.97 3h39 h ILE 243 N 0.02 0.78 -0.39 7.19 2.04 -1.90 0.53 117.51 125.78 3h39 h ILE 243 Ca -0.29 -0.02 0.10 0.00 1.00 0.00 0.00 64.86 65.65 3h39 h ILE 243 Cb 2.01 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.79 3h39 h ILE 243 CO 0.09 0.01 0.28 0.50 0.00 0.00 0.00 178.15 179.02 3h39 h LYS 244 N 0.05 0.05 -0.02 2.37 3.64 -1.76 0.32 116.57 121.23 3h39 h LYS 244 Ca 0.13 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3h39 h LYS 244 Cb 0.18 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3h39 h LYS 244 CO -0.24 0.03 -0.19 0.72 -2.27 0.00 0.00 179.45 177.51 3h39 n HIS 245 N -4.43 0.00 -0.13 1.91 8.25 -0.21 -3.63 115.22 116.98 3h39 n HIS 245 Ca 0.06 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.28 3h39 n HIS 245 Cb 0.43 -0.04 -0.10 0.00 1.12 0.00 0.00 29.99 31.40 3h39 n HIS 245 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3h39 n LEU 246 N 0.11 2.31 -3.92 2.41 4.77 0.01 -4.49 117.00 118.20 3h39 n LEU 246 Ca 0.14 0.15 -0.30 0.00 -0.03 0.00 0.00 56.01 55.97 3h39 n LEU 246 Cb 0.43 -0.82 -0.14 0.00 -2.33 0.00 0.00 43.42 40.56 3h39 n LEU 246 CO 0.22 0.70 -0.16 -0.36 -1.33 0.00 0.00 177.39 176.46 3h39 s PHE 247 N -2.50 3.14 0.46 -1.77 0.40 -0.12 -5.01 117.98 112.58 3h39 s PHE 247 Ca -0.36 -3.14 0.31 0.00 -0.60 0.00 0.00 56.93 53.14 3h39 s PHE 247 Cb 0.12 -2.71 1.43 0.00 0.51 0.00 0.00 43.02 42.37 3h39 s PHE 247 CO 0.51 -0.71 1.66 -1.35 0.70 0.00 0.00 175.22 176.04 3h39 h PRO 248 N 6.31 0.11 -0.65 0.24 0.11 -1.80 0.22 132.00 136.56 3h39 h PRO 248 Ca -0.03 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.07 3h39 h PRO 248 Cb 0.87 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3h39 h PRO 248 CO 0.68 0.08 0.00 1.63 -0.21 0.00 0.00 178.00 180.17 3h39 n LYS 249 N -4.52 3.78 -3.59 1.05 4.01 -1.26 -4.86 118.16 112.77 3h39 n LYS 249 Ca 0.35 -2.91 -0.38 0.00 -0.51 0.00 0.00 58.31 54.86 3h39 n LYS 249 Cb 1.39 -1.91 -0.11 0.00 -0.51 0.00 0.00 35.03 33.89 3h39 n LYS 249 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 3h39 s THR 250 N -1.88 5.28 -0.33 -0.18 -1.32 0.79 -4.90 115.64 113.10 3h39 s THR 250 Ca 0.52 0.15 -0.03 0.00 -1.21 0.00 0.00 61.69 61.12 3h39 s THR 250 Cb 0.33 -3.52 0.06 0.00 -1.51 0.00 0.00 72.50 67.86 3h39 s THR 250 CO 0.25 0.25 0.06 -0.31 -2.21 0.00 0.00 174.62 172.65 3h39 s TYR 251 N 1.75 3.32 -1.06 9.09 2.02 -1.26 -4.35 117.35 126.86 3h39 s TYR 251 Ca 0.07 -1.88 -0.23 0.00 -0.37 0.00 0.00 57.07 54.66 3h39 s TYR 251 Cb -0.16 -2.33 -0.03 0.00 -0.40 0.00 0.00 41.96 39.04 3h39 s TYR 251 CO 0.11 -0.82 1.84 -0.47 -1.57 0.00 0.00 175.55 174.64 3h39 s TYR 252 N 1.26 2.09 0.45 2.71 5.04 -1.26 -4.81 117.35 122.83 3h39 s TYR 252 Ca -0.02 0.07 0.04 0.00 -2.44 0.00 0.00 57.07 54.72 3h39 s TYR 252 Cb -0.20 -4.22 0.01 0.00 0.35 0.00 0.00 41.96 37.90 3h39 s TYR 252 CO -0.01 -1.61 0.64 0.95 -1.34 0.00 0.00 175.55 174.18 3h39 s THR 253 N 8.87 3.31 0.45 4.34 -4.23 -1.26 -4.90 115.64 122.22 3h39 s THR 253 Ca 0.64 -0.79 0.40 0.00 -1.18 0.00 0.00 61.69 60.77 3h39 s THR 253 Cb -0.02 -3.18 0.43 0.00 1.34 0.00 0.00 72.50 71.06 3h39 s THR 253 CO 0.03 -0.10 2.23 -0.65 -0.54 0.00 0.00 174.62 175.59 3h39 h PRO 254 N 0.45 0.00 0.04 3.99 0.11 -1.98 0.48 132.00 135.10 3h39 h PRO 254 Ca -0.43 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 3h39 h PRO 254 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3h39 h PRO 254 CO 0.51 0.00 -0.02 0.77 -0.21 0.00 0.00 178.00 179.06 3h39 h SER 255 N 0.00 -0.04 -0.76 -2.05 0.02 -1.96 -1.20 113.55 107.56 3h39 h SER 255 Ca -0.00 0.00 0.31 0.00 -0.84 0.00 0.00 61.79 61.26 3h39 h SER 255 Cb 0.20 0.01 -0.14 0.00 0.14 0.00 0.00 62.40 62.61 3h39 h SER 255 CO 0.00 -0.02 0.38 0.80 -1.14 0.00 0.00 176.83 176.85 3h39 n MET 256 N -2.19 -0.05 -0.03 3.45 0.00 -0.94 -0.65 117.12 116.71 3h39 n MET 256 Ca -0.01 1.05 -0.14 0.00 -0.00 0.00 0.00 57.70 58.61 3h39 n MET 256 Cb 0.02 -1.87 -0.10 0.00 0.00 0.00 0.00 33.22 31.26 3h39 n MET 256 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 175.97 176.19 3h39 h ASP 257 N 0.00 0.08 0.62 6.12 1.82 -0.04 -2.84 116.42 122.18 3h39 h ASP 257 Ca 0.63 -0.63 -0.04 0.00 -0.39 0.00 0.00 57.03 56.60 3h39 h ASP 257 Cb 1.64 -0.02 -0.01 0.00 0.68 0.00 0.00 39.33 41.62 3h39 h ASP 257 CO -0.59 0.69 -0.20 -0.08 -1.61 0.00 0.00 179.24 177.45 3h39 h GLU 258 N -0.53 0.00 0.10 0.28 4.81 0.40 -0.90 114.58 118.75 3h39 h GLU 258 Ca -0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3h39 h GLU 258 Cb 0.69 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.07 3h39 h GLU 258 CO 0.01 0.20 -0.05 0.87 -0.73 0.00 0.00 179.01 179.31 3h39 h LYS 259 N 0.00 -0.13 -0.61 1.92 1.57 -1.26 -2.75 116.57 115.31 3h39 h LYS 259 Ca -0.00 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 3h39 h LYS 259 Cb 0.56 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.87 3h39 h LYS 259 CO 0.03 0.04 0.40 1.98 -0.57 0.00 0.00 179.45 181.33 3h39 h MET 260 N -0.29 0.58 0.25 3.15 4.05 -0.99 0.01 114.93 121.71 3h39 h MET 260 Ca -0.01 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.36 3h39 h MET 260 Cb 0.24 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 30.91 3h39 h MET 260 CO 0.02 0.38 -0.12 1.49 0.23 0.00 0.00 176.91 178.92 3h39 h GLU 261 N 0.60 -0.33 -0.62 0.39 4.81 -1.12 -2.70 114.58 115.61 3h39 h GLU 261 Ca 0.26 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.53 3h39 h GLU 261 Cb 0.26 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 3h39 h GLU 261 CO -0.08 -0.12 0.40 -0.91 -0.73 0.00 0.00 179.01 177.57 3h39 h ASN 262 N -0.47 0.67 -0.69 1.04 4.21 -1.12 -2.19 115.58 117.03 3h39 h ASN 262 Ca -0.03 -0.01 0.14 0.00 1.21 0.00 0.00 56.30 57.61 3h39 h ASN 262 Cb 0.36 -0.15 -0.13 0.00 -1.12 0.00 0.00 38.32 37.28 3h39 h ASN 262 CO 0.06 0.47 -0.09 0.25 -1.29 0.00 0.00 177.43 176.83 3h39 h LEU 263 N 0.80 -0.50 -0.13 1.61 6.46 -0.90 -1.30 115.31 121.36 3h39 h LEU 263 Ca 0.24 0.19 -0.13 0.00 -0.12 0.00 0.00 57.88 58.06 3h39 h LEU 263 Cb -0.03 0.38 -0.02 0.00 -0.73 0.00 0.00 40.66 40.25 3h39 h LEU 263 CO -0.08 -0.20 -0.63 -0.26 -0.62 0.00 0.00 178.44 176.65 3h39 h PHE 264 N 0.04 0.00 0.00 1.25 -1.00 -1.12 -0.51 116.94 115.61 3h39 h PHE 264 Ca 0.35 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.13 3h39 h PHE 264 Cb 0.57 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.13 3h39 h PHE 264 CO -0.48 0.63 0.00 -0.09 -1.61 0.00 0.00 178.31 176.76 3h39 h ARG 265 N 0.00 0.00 0.00 1.51 2.43 -0.74 -3.32 114.38 114.26 3h39 h ARG 265 Ca -0.01 0.00 -0.38 0.00 -0.81 0.00 0.00 59.98 58.79 3h39 h ARG 265 Cb 1.43 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.92 3h39 h ARG 265 CO 0.08 0.00 -2.40 0.09 -1.51 0.00 0.00 179.97 176.23 3h39 n ASN 266 N -2.93 0.94 -0.31 -3.80 3.02 -0.57 -4.39 115.26 107.21 3h39 n ASN 266 Ca 0.03 -0.04 0.17 0.00 -0.03 0.00 0.00 54.58 54.70 3h39 n ASN 266 Cb 0.40 0.31 0.34 0.00 -0.61 0.00 0.00 39.78 40.22 3h39 n ASN 266 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3h39 h ILE 267 N 0.00 0.20 -0.76 2.41 2.04 -1.19 0.52 117.51 120.73 3h39 h ILE 267 Ca -0.55 -0.05 0.08 0.00 1.00 0.00 0.00 64.86 65.34 3h39 h ILE 267 Cb 2.09 0.05 -0.07 0.00 -0.74 0.00 0.00 36.82 38.14 3h39 h ILE 267 CO -0.02 0.03 0.42 -0.65 0.00 0.00 0.00 178.15 177.93 3h39 h PRO 268 N 0.15 0.71 -0.28 2.37 0.11 -1.77 0.19 132.00 133.48 3h39 h PRO 268 Ca 0.62 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.59 3h39 h PRO 268 Cb 1.34 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3h39 h PRO 268 CO -0.73 0.47 -0.21 2.35 -0.21 0.00 0.00 178.00 179.67 3h39 h TRP 269 N 0.73 0.75 -0.13 0.65 7.01 -0.33 -1.35 115.95 123.28 3h39 h TRP 269 Ca 0.36 -0.21 0.01 0.00 2.11 0.00 0.00 58.89 61.16 3h39 h TRP 269 Cb 0.31 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.19 3h39 h TRP 269 CO -0.07 0.91 0.05 0.28 -2.79 0.00 0.00 178.44 176.82 3h39 h VAL 270 N 0.38 0.97 0.00 2.65 2.07 -0.36 -1.81 116.25 120.16 3h39 h VAL 270 Ca 0.05 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 3h39 h VAL 270 Cb 0.75 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 3h39 h VAL 270 CO 0.06 0.02 -0.10 -0.08 0.02 0.00 0.00 177.57 177.48 3h39 h GLU 271 N 0.11 0.00 0.50 1.57 4.81 -0.55 0.61 114.58 121.63 3h39 h GLU 271 Ca 0.05 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 3h39 h GLU 271 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 3h39 h GLU 271 CO -0.05 0.10 -0.24 1.49 -0.73 0.00 0.00 179.01 179.58 3h39 h GLU 272 N 0.00 -0.65 0.00 1.92 4.57 -0.42 -3.21 114.58 116.80 3h39 h GLU 272 Ca -0.00 0.04 -0.13 0.00 -1.18 0.00 0.00 59.36 58.09 3h39 h GLU 272 Cb 0.22 0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 3h39 h GLU 272 CO 0.01 -0.43 -0.67 -0.91 -1.18 0.00 0.00 179.01 175.83 3h39 h ASN 273 N -0.85 0.00 0.00 1.04 2.35 -1.09 -3.41 115.58 113.63 3h39 h ASN 273 Ca -0.07 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.46 3h39 h ASN 273 Cb 0.52 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.85 3h39 h ASN 273 CO 0.11 0.63 -1.74 0.49 -1.65 0.00 0.00 177.43 175.27 3h39 n PHE 274 N -3.24 0.00 -1.20 1.19 3.72 0.18 -5.12 117.46 112.99 3h39 n PHE 274 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 3h39 n PHE 274 Cb 0.79 -0.48 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 3h39 n PHE 274 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h39 n GLY 275 N 2.30 0.39 3.62 1.37 0.00 -1.21 -5.04 105.19 106.62 3h39 n GLY 275 Ca -0.26 -1.68 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 3h39 n GLY 275 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h39 n GLU 276 N 0.00 1.39 -4.11 1.61 2.13 -1.26 -3.98 120.64 116.43 3h39 n GLU 276 Ca 0.00 0.50 -0.33 0.00 0.66 0.00 0.00 57.16 57.99 3h39 n GLU 276 Cb 0.00 -2.06 -0.16 0.00 0.27 0.00 0.00 31.44 29.49 3h39 n GLU 276 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3h39 s VAL 277 N -1.26 2.00 -0.55 6.31 1.01 -1.26 -4.87 120.40 121.78 3h39 s VAL 277 Ca 0.63 -0.92 -0.28 0.00 0.00 0.00 0.00 61.98 61.41 3h39 s VAL 277 Cb -0.56 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.01 3h39 s VAL 277 CO 0.57 0.51 1.45 -0.62 0.00 0.00 0.00 175.10 177.02 3h39 s ASP 278 N 1.31 6.08 0.10 3.32 -1.08 -1.26 -4.89 116.67 120.24 3h39 s ASP 278 Ca 0.05 0.34 -0.18 0.00 -0.52 0.00 0.00 52.55 52.24 3h39 s ASP 278 Cb -0.13 -2.54 -0.07 0.00 -1.46 0.00 0.00 42.92 38.72 3h39 s ASP 278 CO -0.12 -1.74 1.57 0.03 0.52 0.00 0.00 175.17 175.42 3h39 h ARG 279 N 11.34 0.45 -0.42 4.34 3.08 -1.96 0.31 114.38 131.52 3h39 h ARG 279 Ca -0.27 -0.12 0.07 0.00 0.07 0.00 0.00 59.98 59.73 3h39 h ARG 279 Cb 1.10 -0.05 -0.09 0.00 0.08 0.00 0.00 29.97 31.01 3h39 h ARG 279 CO 1.17 0.57 -0.45 0.35 -1.07 0.00 0.00 179.97 180.54 3h39 h PHE 280 N 0.27 -1.32 -0.56 3.04 3.57 -1.93 0.35 116.94 120.36 3h39 h PHE 280 Ca 0.08 0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 3h39 h PHE 280 Cb 0.34 0.64 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 3h39 h PHE 280 CO 0.02 -0.45 0.14 1.88 -2.23 0.00 0.00 178.31 177.67 3h39 h TYR 281 N -0.33 0.94 -0.05 0.41 0.05 -1.93 -1.10 116.97 114.96 3h39 h TYR 281 Ca 0.13 -0.11 0.01 0.00 0.05 0.00 0.00 58.73 58.82 3h39 h TYR 281 Cb 0.58 -0.27 -0.00 0.00 1.01 0.00 0.00 36.73 38.06 3h39 h TYR 281 CO -0.65 0.81 0.07 0.00 -1.05 0.00 0.00 178.16 177.34 3h39 h ALA 282 N 1.02 1.46 0.10 3.88 0.00 0.56 -0.28 119.26 126.00 3h39 h ALA 282 Ca 0.18 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.81 3h39 h ALA 282 Cb 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3h39 h ALA 282 CO 0.00 -0.10 -1.46 0.28 0.00 0.00 0.00 179.25 177.98 3h39 h VAL 283 N 0.00 0.96 -0.61 0.00 2.07 0.07 -3.35 116.25 115.39 3h39 h VAL 283 Ca 0.02 -2.35 0.10 0.00 0.82 0.00 0.00 66.70 65.29 3h39 h VAL 283 Cb 0.17 2.61 -0.04 0.00 -1.52 0.00 0.00 31.29 32.51 3h39 h VAL 283 CO -0.00 0.67 0.41 -0.07 0.02 0.00 0.00 177.57 178.60 3h39 h LEU 284 N -0.37 0.35 -0.79 2.57 3.38 -0.15 0.36 115.31 120.67 3h39 h LEU 284 Ca -0.33 0.01 0.17 0.00 0.09 0.00 0.00 57.88 57.83 3h39 h LEU 284 Cb 1.72 -0.06 -0.11 0.00 0.09 0.00 0.00 40.66 42.29 3h39 h LEU 284 CO 0.02 0.21 0.26 0.45 0.09 0.00 0.00 178.44 179.46 3h39 h HIS 285 N 0.39 0.41 0.20 1.13 3.86 -1.23 0.40 115.15 120.32 3h39 h HIS 285 Ca 0.28 0.04 -0.28 0.00 -1.16 0.00 0.00 60.37 59.25 3h39 h HIS 285 Cb 0.58 -0.06 0.03 0.00 1.06 0.00 0.00 27.41 29.02 3h39 h HIS 285 CO -0.00 -0.05 -1.26 0.28 0.86 0.00 0.00 177.93 177.75 3h39 h VAL 286 N 0.33 1.32 -0.04 2.45 2.07 -1.15 -3.29 116.25 117.95 3h39 h VAL 286 Ca 0.46 -2.61 0.01 0.00 0.82 0.00 0.00 66.70 65.38 3h39 h VAL 286 Cb 0.80 3.06 -0.01 0.00 -1.52 0.00 0.00 31.29 33.62 3h39 h VAL 286 CO -0.50 0.77 -0.02 -0.26 0.02 0.00 0.00 177.57 177.58 3h39 h PHE 287 N -0.07 -0.05 -0.02 1.57 0.04 -0.80 -3.17 116.94 114.43 3h39 h PHE 287 Ca -0.23 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.55 3h39 h PHE 287 Cb 1.95 0.03 0.00 0.00 2.20 0.00 0.00 35.95 40.13 3h39 h PHE 287 CO 0.15 -0.04 0.00 1.28 -0.60 0.00 0.00 178.31 179.10 3h39 n LEU 288 N -5.13 0.25 -4.65 1.54 4.32 0.14 -4.51 117.00 108.96 3h39 n LEU 288 Ca -0.06 -0.10 -0.45 0.00 -0.02 0.00 0.00 56.01 55.38 3h39 n LEU 288 Cb 0.06 -0.01 -0.03 0.00 -1.62 0.00 0.00 43.42 41.83 3h39 n LEU 288 CO 0.31 0.05 0.89 -0.62 -1.22 0.00 0.00 177.39 176.80 3h39 n GLU 289 N -0.69 1.79 -1.18 3.23 1.02 -1.20 -2.37 120.64 121.25 3h39 n GLU 289 Ca 0.17 0.64 -0.06 0.00 -0.02 0.00 0.00 57.16 57.89 3h39 n GLU 289 Cb 0.12 -2.22 -0.03 0.00 -0.02 0.00 0.00 31.44 29.29 3h39 n GLU 289 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3h39 n PHE 290 N 1.48 0.00 -2.31 -0.32 0.99 -1.26 -4.96 117.46 111.08 3h39 n PHE 290 Ca 0.11 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.14 3h39 n PHE 290 Cb 0.31 -1.52 -0.03 0.00 -1.00 0.00 0.00 39.48 37.23 3h39 n PHE 290 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.76 177.47 3h39 s TYR 291 N -2.06 3.13 0.91 1.38 4.12 -1.00 -5.00 117.35 118.83 3h39 s TYR 291 Ca 0.00 1.04 -0.11 0.00 0.02 0.00 0.00 57.07 58.02 3h39 s TYR 291 Cb 0.00 -3.56 0.14 0.00 -1.52 0.00 0.00 41.96 37.02 3h39 s TYR 291 CO 0.00 -1.91 1.09 0.16 0.02 0.00 0.00 175.55 174.91 3h39 s ASP 292 N 1.48 3.23 0.30 2.29 3.84 -1.26 -4.70 116.67 121.84 3h39 s ASP 292 Ca 0.61 1.64 0.06 0.00 -0.00 0.00 0.00 52.55 54.86 3h39 s ASP 292 Cb -0.30 -2.29 0.83 0.00 -1.38 0.00 0.00 42.92 39.77 3h39 s ASP 292 CO 0.27 -2.82 1.67 -0.78 -0.00 0.00 0.00 175.17 173.51 3h39 h ASP 293 N -1.67 0.27 1.41 2.11 -0.00 -2.01 -1.61 116.42 114.92 3h39 h ASP 293 Ca -0.49 0.18 -0.12 0.00 -0.00 0.00 0.00 57.03 56.60 3h39 h ASP 293 Cb 1.28 0.18 -0.02 0.00 -0.00 0.00 0.00 39.33 40.77 3h39 h ASP 293 CO 0.52 -0.09 -0.58 -0.08 -0.00 0.00 0.00 179.24 179.01 3h39 h GLU 294 N 0.31 0.00 0.22 0.28 4.57 -2.02 -3.23 114.58 114.72 3h39 h GLU 294 Ca 0.61 0.00 -0.30 0.00 -1.18 0.00 0.00 59.36 58.48 3h39 h GLU 294 Cb 1.25 0.00 0.03 0.00 -0.16 0.00 0.00 28.75 29.88 3h39 h GLU 294 CO -0.60 0.58 -1.35 0.77 -1.18 0.00 0.00 179.01 177.23 3h39 h SER 295 N 0.00 0.74 -0.46 1.04 0.02 -1.66 -3.25 113.55 109.98 3h39 h SER 295 Ca -0.01 -0.93 0.08 0.00 -0.84 0.00 0.00 61.79 60.09 3h39 h SER 295 Cb 1.44 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.71 3h39 h SER 295 CO 0.07 1.65 0.31 -0.25 -1.14 0.00 0.00 176.83 177.48 3h39 h TRP 296 N 0.01 0.31 -0.35 3.45 2.91 -1.48 -2.25 115.95 118.55 3h39 h TRP 296 Ca -0.24 0.01 0.03 0.00 1.13 0.00 0.00 58.89 59.81 3h39 h TRP 296 Cb 2.04 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 30.56 3h39 h TRP 296 CO 0.14 0.16 0.17 0.87 -1.03 0.00 0.00 178.44 178.76 3h39 h LYS 297 N 0.30 0.35 0.23 2.65 1.79 -1.59 -1.78 116.57 118.53 3h39 h LYS 297 Ca 0.21 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.65 3h39 h LYS 297 Cb 0.43 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.00 3h39 h LYS 297 CO -0.05 0.23 -0.11 0.93 -1.08 0.00 0.00 179.45 179.38 3h39 h GLU 298 N 0.36 -0.30 0.20 3.15 5.08 -1.51 -2.35 114.58 119.22 3h39 h GLU 298 Ca 0.15 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3h39 h GLU 298 Cb 0.06 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 3h39 h GLU 298 CO -0.10 0.07 -0.47 0.28 -1.00 0.00 0.00 179.01 177.79 3h39 h VAL 299 N -0.82 0.09 -0.99 3.13 2.07 -1.58 -1.22 116.25 116.93 3h39 h VAL 299 Ca -0.03 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.75 3h39 h VAL 299 Cb 0.51 0.09 -0.13 0.00 -1.52 0.00 0.00 31.29 30.24 3h39 h VAL 299 CO 0.05 0.00 0.56 -0.09 0.02 0.00 0.00 177.57 178.11 3h39 h ARG 300 N -0.76 0.47 -0.07 1.57 2.43 -1.38 -0.50 114.38 116.14 3h39 h ARG 300 Ca -0.00 -0.03 -0.19 0.00 -0.81 0.00 0.00 59.98 58.95 3h39 h ARG 300 Cb 0.74 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.18 3h39 h ARG 300 CO -0.22 0.31 -0.74 -0.44 -1.51 0.00 0.00 179.97 177.38 3h39 h ASP 301 N 0.48 0.48 -0.01 -3.80 3.32 -0.84 0.09 116.42 116.14 3h39 h ASP 301 Ca 0.66 -0.32 -0.10 0.00 0.02 0.00 0.00 57.03 57.29 3h39 h ASP 301 Cb 1.33 -0.14 0.01 0.00 0.22 0.00 0.00 39.33 40.74 3h39 h ASP 301 CO -0.52 1.06 -0.38 -0.09 -1.72 0.00 0.00 179.24 177.59 3h39 h ARG 302 N 0.27 0.27 -0.26 3.56 2.43 0.08 -3.30 114.38 117.44 3h39 h ARG 302 Ca -0.03 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.86 3h39 h ARG 302 Cb 1.32 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 3h39 h ARG 302 CO 0.13 0.98 0.00 0.66 -1.51 0.00 0.00 179.97 180.23 3h39 n TYR 303 N -4.40 0.33 -3.13 2.20 4.02 -0.79 -4.29 117.16 111.09 3h39 n TYR 303 Ca -0.10 -0.16 -0.14 0.00 -0.01 0.00 0.00 57.90 57.49 3h39 n TYR 303 Cb 0.56 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.95 3h39 n TYR 303 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3h39 n SER 304 N 1.10 -2.39 -4.90 7.72 7.64 -0.66 -4.91 113.62 117.22 3h39 n SER 304 Ca 0.18 -0.51 -0.28 0.00 1.01 0.00 0.00 58.87 59.27 3h39 n SER 304 Cb 0.52 -4.25 0.05 0.00 -1.01 0.00 0.00 64.21 59.52 3h39 n SER 304 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3h39 s LEU 305 N -5.46 2.95 0.21 -3.43 1.43 -0.07 -5.02 118.68 109.28 3h39 s LEU 305 Ca 0.04 0.87 -0.30 0.00 -1.03 0.00 0.00 54.13 53.70 3h39 s LEU 305 Cb -0.00 -3.61 -0.09 0.00 0.03 0.00 0.00 46.19 42.51 3h39 s LEU 305 CO 0.59 -1.35 1.26 -0.13 0.23 0.00 0.00 176.35 176.95 3h39 s ARG 306 N -5.25 4.43 0.44 1.70 0.52 -1.26 -4.87 118.95 114.66 3h39 s ARG 306 Ca 0.57 1.99 0.23 0.00 -0.52 0.00 0.00 55.73 58.01 3h39 s ARG 306 Cb -0.11 -3.20 1.23 0.00 0.52 0.00 0.00 34.95 33.39 3h39 s ARG 306 CO 0.48 -0.16 1.81 0.00 0.02 0.00 0.00 175.30 177.45 3h39 h ARG 307 N 5.06 0.27 0.00 3.54 3.08 -1.95 -2.31 114.38 122.07 3h39 h ARG 307 Ca -0.45 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 59.41 3h39 h ARG 307 Cb 1.21 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.18 3h39 h ARG 307 CO 0.75 0.18 -1.14 -0.97 -1.07 0.00 0.00 179.97 177.71 3h39 h ASN 308 N 0.28 0.00 -0.99 7.04 -1.24 -2.03 -3.37 115.58 115.27 3h39 h ASN 308 Ca 0.55 0.00 0.35 0.00 0.71 0.00 0.00 56.30 57.90 3h39 h ASN 308 Cb 1.61 0.00 -0.17 0.00 0.73 0.00 0.00 38.32 40.48 3h39 h ASN 308 CO -0.19 0.65 0.39 0.25 -1.29 0.00 0.00 177.43 177.25 3h39 h LEU 309 N 0.00 0.12 -0.68 0.34 5.85 -1.80 0.36 115.31 119.50 3h39 h LEU 309 Ca -0.11 0.25 0.05 0.00 0.84 0.00 0.00 57.88 58.91 3h39 h LEU 309 Cb 1.60 0.30 -0.05 0.00 0.37 0.00 0.00 40.66 42.88 3h39 h LEU 309 CO 0.07 -0.34 0.39 -0.29 -0.34 0.00 0.00 178.44 177.92 3h39 h ILE 310 N 0.08 0.99 0.68 4.05 6.09 -1.77 0.19 117.51 127.81 3h39 h ILE 310 Ca 0.74 -0.25 -0.03 0.00 -1.37 0.00 0.00 64.86 63.96 3h39 h ILE 310 Cb 1.79 0.21 -0.01 0.00 0.47 0.00 0.00 36.82 39.28 3h39 h ILE 310 CO -0.77 0.13 -0.46 0.78 -3.07 0.00 0.00 178.15 174.76 3h39 h ASN 311 N 0.72 -1.17 -0.73 2.19 2.35 -0.56 0.22 115.58 118.59 3h39 h ASN 311 Ca 0.30 0.07 0.15 0.00 -0.55 0.00 0.00 56.30 56.27 3h39 h ASN 311 Cb 0.16 0.35 -0.10 0.00 0.05 0.00 0.00 38.32 38.78 3h39 h ASN 311 CO -0.17 -0.69 0.22 -0.33 -1.65 0.00 0.00 177.43 174.81 3h39 h GLU 312 N -1.09 0.32 0.01 0.81 5.08 -1.19 0.97 114.58 119.50 3h39 h GLU 312 Ca -0.09 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3h39 h GLU 312 Cb 0.89 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.06 3h39 h GLU 312 CO 0.06 0.21 -0.01 0.82 -1.00 0.00 0.00 179.01 179.10 3h39 h ILE 313 N 0.33 1.16 -0.72 3.13 2.04 -0.40 -3.02 117.51 120.03 3h39 h ILE 313 Ca 0.41 -0.52 0.06 0.00 1.00 0.00 0.00 64.86 65.80 3h39 h ILE 313 Cb 0.67 1.52 -0.05 0.00 -0.74 0.00 0.00 36.82 38.21 3h39 h ILE 313 CO -0.46 0.14 0.42 0.03 0.00 0.00 0.00 178.15 178.28 3h39 h ARG 314 N -0.24 0.76 -0.90 2.37 3.08 -0.04 -1.97 114.38 117.44 3h39 h ARG 314 Ca -0.00 -0.05 0.24 0.00 0.07 0.00 0.00 59.98 60.24 3h39 h ARG 314 Cb 0.23 -0.17 -0.16 0.00 0.08 0.00 0.00 29.97 29.95 3h39 h ARG 314 CO 0.00 0.50 0.08 1.25 -1.07 0.00 0.00 179.97 180.74 3h39 h HIS 315 N 0.78 0.06 0.00 3.04 2.76 -0.70 -2.32 115.15 118.78 3h39 h HIS 315 Ca 0.32 0.06 -0.08 0.00 -2.20 0.00 0.00 60.37 58.47 3h39 h HIS 315 Cb 0.16 0.12 0.01 0.00 1.55 0.00 0.00 27.41 29.24 3h39 h HIS 315 CO -0.06 -0.33 -0.30 0.28 -1.30 0.00 0.00 177.93 176.22 3h39 h VAL 316 N 0.08 1.54 -0.38 5.26 2.07 -1.30 -2.24 116.25 121.28 3h39 h VAL 316 Ca 0.54 -2.00 0.09 0.00 0.82 0.00 0.00 66.70 66.15 3h39 h VAL 316 Cb 1.09 2.80 -0.02 0.00 -1.52 0.00 0.00 31.29 33.64 3h39 h VAL 316 CO -0.79 0.55 0.27 1.05 0.02 0.00 0.00 177.57 178.67 3h39 h GLU 317 N -0.48 0.11 0.00 1.57 4.11 -1.20 -0.80 114.58 117.89 3h39 h GLU 317 Ca -0.04 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.38 3h39 h GLU 317 Cb 1.06 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 3h39 h GLU 317 CO 0.06 0.07 -0.04 0.87 0.07 0.00 0.00 179.01 180.04 3h39 h LYS 318 N 0.11 0.00 0.00 1.06 1.57 -1.46 -3.35 116.57 114.50 3h39 h LYS 318 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3h39 h LYS 318 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 3h39 h LYS 318 CO -0.02 0.65 0.00 -1.13 -0.57 0.00 0.00 179.45 178.38 3h39 n SER 319 N -4.66 0.00 0.16 0.86 3.41 -0.84 -4.15 113.62 108.39 3h39 n SER 319 Ca -0.07 -1.32 -0.12 0.00 -0.26 0.00 0.00 58.87 57.10 3h39 n SER 319 Cb 0.32 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.20 3h39 n SER 319 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h39 h ALA 320 N 3.28 -0.45 -0.67 7.33 0.00 -1.28 -3.15 119.26 124.32 3h39 h ALA 320 Ca 0.00 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 54.87 3h39 h ALA 320 Cb 0.00 0.17 -0.11 0.00 0.00 0.00 0.00 17.79 17.85 3h39 h ALA 320 CO 0.00 -0.51 -0.00 -1.35 0.00 0.00 0.00 179.25 177.39 3h39 h PRO 321 N -0.94 0.11 -0.98 0.00 0.11 -1.83 -0.78 132.00 127.70 3h39 h PRO 321 Ca -0.05 -0.01 0.24 0.00 0.11 0.00 0.00 66.00 66.30 3h39 h PRO 321 Cb 0.52 -0.02 -0.07 0.00 0.11 0.00 0.00 31.00 31.53 3h39 h PRO 321 CO 0.08 0.07 0.65 0.00 -0.21 0.00 0.00 178.00 178.59 3h39 h ALA 322 N 1.62 2.35 -0.28 -0.75 0.00 -1.81 -1.85 119.26 118.54 3h39 h ALA 322 Ca 0.36 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.17 3h39 h ALA 322 Cb 0.59 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3h39 h ALA 322 CO -0.58 -0.68 -0.34 1.25 0.00 0.00 0.00 179.25 178.90 3h39 h LEU 323 N 0.33 0.63 0.46 0.00 6.46 -1.10 -2.98 115.31 119.11 3h39 h LEU 323 Ca 0.52 -0.26 -0.01 0.00 -0.12 0.00 0.00 57.88 58.01 3h39 h LEU 323 Cb 1.43 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 41.18 3h39 h LEU 323 CO -0.19 0.92 -0.33 -0.07 -0.62 0.00 0.00 178.44 178.15 3h39 h LEU 324 N 0.51 -0.87 0.00 2.25 -0.00 -1.36 -1.41 115.31 114.44 3h39 h LEU 324 Ca 0.06 0.06 0.00 0.00 -0.00 0.00 0.00 57.88 58.00 3h39 h LEU 324 Cb 0.83 0.27 0.00 0.00 -0.00 0.00 0.00 40.66 41.76 3h39 h LEU 324 CO 0.07 -0.50 0.00 -0.62 -0.00 0.00 0.00 178.44 177.39 3h39 n GLU 325 N -5.46 0.00 0.06 1.13 4.71 -1.22 -0.27 120.64 119.59 3h39 n GLU 325 Ca -0.11 0.33 -0.08 0.00 -0.01 0.00 0.00 57.16 57.30 3h39 n GLU 325 Cb 0.36 -1.50 -0.12 0.00 -1.01 0.00 0.00 31.44 29.17 3h39 n GLU 325 CO 0.00 0.00 0.00 0.52 0.09 0.00 0.00 177.13 177.74 3h39 h MET 326 N 0.00 0.01 0.09 3.49 2.86 -1.13 -3.37 114.93 116.89 3h39 h MET 326 Ca 0.00 -0.03 -0.28 0.00 -2.06 0.00 0.00 59.70 57.34 3h39 h MET 326 Cb 0.16 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 3h39 h MET 326 CO 0.00 0.99 -1.46 -0.07 1.06 0.00 0.00 176.91 177.43 3h39 h LEU 327 N 0.00 0.31 -9.27 1.22 3.38 0.21 -3.11 115.31 108.06 3h39 h LEU 327 Ca -0.03 -0.82 -0.55 0.00 0.09 0.00 0.00 57.88 56.58 3h39 h LEU 327 Cb 1.79 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.43 3h39 h LEU 327 CO 0.13 1.63 1.10 -0.94 0.09 0.00 0.00 178.44 180.45 3h39 s SER 328 N -6.99 6.64 0.00 -0.43 1.04 0.02 -3.28 113.70 110.71 3h39 s SER 328 Ca -0.22 2.28 0.00 0.00 0.48 0.00 0.00 55.95 58.49 3h39 s SER 328 Cb 0.05 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.64 3h39 s SER 328 CO 0.73 -0.94 0.00 -0.62 0.98 0.00 0.00 173.24 173.39 3h39 n GLU 329 N 7.18 0.00 -2.06 4.02 4.71 -1.26 -4.62 120.64 128.61 3h39 n GLU 329 Ca 0.18 0.46 -0.28 0.00 -0.01 0.00 0.00 57.16 57.51 3h39 n GLU 329 Cb 0.43 -1.38 -0.06 0.00 -1.01 0.00 0.00 31.44 29.42 3h39 n GLU 329 CO 0.00 0.00 0.00 0.50 0.09 0.00 0.00 177.13 177.72 3h39 s ARG 330 N -1.05 2.49 0.56 3.49 3.52 -1.21 -4.73 118.95 122.04 3h39 s ARG 330 Ca 0.00 -0.98 -0.21 0.00 -0.13 0.00 0.00 55.73 54.41 3h39 s ARG 330 Cb 0.00 -5.20 -0.04 0.00 -1.56 0.00 0.00 34.95 28.14 3h39 s ARG 330 CO 0.00 -3.87 1.34 0.08 -0.81 0.00 0.00 175.30 172.03 3h39 s VAL 331 N 10.88 2.12 0.75 7.11 1.01 -1.18 -4.93 120.40 136.17 3h39 s VAL 331 Ca 0.69 0.09 -0.15 0.00 0.00 0.00 0.00 61.98 62.60 3h39 s VAL 331 Cb -0.02 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.33 3h39 s VAL 331 CO 0.10 -0.00 0.89 -0.81 0.00 0.00 0.00 175.10 175.28 3h39 n PRO 332 N -1.18 0.36 -0.32 2.72 -0.04 -1.26 -4.85 135.00 130.43 3h39 n PRO 332 Ca 0.11 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.86 3h39 n PRO 332 Cb 0.46 -2.16 0.24 0.00 -0.04 0.00 0.00 33.50 32.00 3h39 n PRO 332 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h39 h ALA 333 N -0.48 1.04 -1.01 0.55 0.00 -1.92 -2.27 119.26 115.17 3h39 h ALA 333 Ca -0.47 0.31 0.30 0.00 0.00 0.00 0.00 54.91 55.05 3h39 h ALA 333 Cb 1.33 0.54 -0.14 0.00 0.00 0.00 0.00 17.79 19.52 3h39 h ALA 333 CO 0.45 -0.51 0.59 1.03 0.00 0.00 0.00 179.25 180.81 3h39 h SER 334 N 0.05 0.56 0.37 0.00 0.87 -1.86 -2.62 113.55 110.92 3h39 h SER 334 Ca 0.54 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 61.27 3h39 h SER 334 Cb 1.05 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 3h39 h SER 334 CO -0.85 -0.05 0.00 0.49 -0.53 0.00 0.00 176.83 175.89 3h39 n PHE 335 N -4.98 0.55 -0.03 2.24 3.01 -0.85 -2.85 117.46 114.54 3h39 n PHE 335 Ca 0.30 0.24 0.01 0.00 1.01 0.00 0.00 57.45 59.01 3h39 n PHE 335 Cb 0.91 -0.89 -0.10 0.00 -0.01 0.00 0.00 39.48 39.40 3h39 n PHE 335 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 3h39 n VAL 336 N -2.02 0.36 -0.34 -4.37 0.24 -0.99 -4.70 118.33 106.51 3h39 n VAL 336 Ca 0.01 -0.38 0.08 0.00 -2.04 0.00 0.00 64.34 62.01 3h39 n VAL 336 Cb 0.13 -0.19 0.17 0.00 -1.47 0.00 0.00 33.84 32.48 3h39 n VAL 336 CO 0.00 0.00 0.00 0.22 -2.14 0.00 0.00 176.83 174.91 3h39 h TYR 337 N 0.00 -0.36 -0.60 6.34 3.20 -1.60 0.13 116.97 124.08 3h39 h TYR 337 Ca -0.14 0.08 0.17 0.00 3.14 0.00 0.00 58.73 61.98 3h39 h TYR 337 Cb 1.08 0.31 -0.02 0.00 1.54 0.00 0.00 36.73 39.64 3h39 h TYR 337 CO 0.00 -0.41 0.58 -1.00 -1.64 0.00 0.00 178.16 175.69 3h39 h PRO 338 N 0.01 0.00 0.00 1.82 0.13 -1.84 -1.74 132.00 130.38 3h39 h PRO 338 Ca 0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.62 3h39 h PRO 338 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 3h39 h PRO 338 CO -0.95 0.00 -0.74 -0.07 -0.23 0.00 0.00 178.00 176.02 3h39 h LEU 339 N 0.00 0.00 -2.66 1.56 3.38 -1.07 -3.35 115.31 113.17 3h39 h LEU 339 Ca 0.28 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.22 3h39 h LEU 339 Cb 1.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.19 3h39 h LEU 339 CO -0.00 0.02 -0.06 1.33 0.09 0.00 0.00 178.44 179.81 3h39 n VAL 340 N -2.65 1.13 0.09 1.22 0.24 -0.71 -4.92 118.33 112.74 3h39 n VAL 340 Ca 0.01 -1.29 -0.13 0.00 -2.04 0.00 0.00 64.34 60.89 3h39 n VAL 340 Cb 0.53 0.25 -0.07 0.00 -1.47 0.00 0.00 33.84 33.07 3h39 n VAL 340 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 3h39 h LYS 341 N 0.00 -0.14 -0.12 7.34 3.64 -1.55 -3.26 116.57 122.47 3h39 h LYS 341 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3h39 h LYS 341 Cb 0.87 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 3h39 h LYS 341 CO 0.00 -0.09 0.00 0.41 -2.27 0.00 0.00 179.45 177.50 3h39 n GLY 342 N -1.15 0.71 3.73 5.01 0.00 -1.26 -5.07 105.19 107.16 3h39 n GLY 342 Ca -0.08 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 3h39 n GLY 342 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h39 s VAL 343 N -0.88 2.63 0.83 1.61 -7.23 -1.23 -5.00 120.40 111.12 3h39 s VAL 343 Ca 0.15 0.28 -0.11 0.00 -1.81 0.00 0.00 61.98 60.48 3h39 s VAL 343 Cb 0.09 -2.74 0.09 0.00 0.56 0.00 0.00 36.38 34.38 3h39 s VAL 343 CO 0.13 -0.20 1.09 -0.94 -0.31 0.00 0.00 175.10 174.87 3h39 s SER 344 N -2.43 4.14 0.36 4.85 1.04 -1.26 -4.85 113.70 115.55 3h39 s SER 344 Ca 0.70 1.47 0.05 0.00 0.48 0.00 0.00 55.95 58.64 3h39 s SER 344 Cb -0.24 -2.18 0.69 0.00 0.10 0.00 0.00 66.02 64.38 3h39 s SER 344 CO 0.47 -2.21 1.95 0.78 0.98 0.00 0.00 173.24 175.21 3h39 h ASN 345 N -1.25 0.50 -0.60 7.02 -0.26 -1.95 -1.18 115.58 117.85 3h39 h ASN 345 Ca -0.47 -0.06 0.01 0.00 -0.56 0.00 0.00 56.30 55.22 3h39 h ASN 345 Cb 1.27 -0.13 -0.03 0.00 -1.06 0.00 0.00 38.32 38.36 3h39 h ASN 345 CO 0.56 0.48 0.39 -0.33 -1.06 0.00 0.00 177.43 177.48 3h39 h GLU 346 N 0.54 0.77 -0.09 0.81 3.07 -1.91 -1.25 114.58 116.52 3h39 h GLU 346 Ca 0.13 -0.05 0.04 0.00 -0.50 0.00 0.00 59.36 58.98 3h39 h GLU 346 Cb 0.17 -0.17 -0.05 0.00 -0.84 0.00 0.00 28.75 27.86 3h39 h GLU 346 CO -0.01 0.51 -0.17 1.15 -1.40 0.00 0.00 179.01 179.09 3h39 h THR 347 N 0.79 0.56 -0.53 1.13 2.02 -1.60 0.17 112.91 115.45 3h39 h THR 347 Ca 0.23 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.51 3h39 h THR 347 Cb -0.06 0.56 -0.10 0.00 -1.74 0.00 0.00 68.15 66.81 3h39 h THR 347 CO -0.06 0.00 -0.13 0.40 0.37 0.00 0.00 175.52 176.09 3h39 h ILE 348 N -0.24 0.47 -0.36 3.11 2.04 -0.88 -0.07 117.51 121.58 3h39 h ILE 348 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 3h39 h ILE 348 Cb 0.36 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 3h39 h ILE 348 CO -0.23 0.00 0.23 0.00 0.00 0.00 0.00 178.15 178.15 3h39 h HIS 350 N 0.48 0.38 -0.15 0.00 -0.00 0.75 0.39 115.15 117.00 3h39 h HIS 350 Ca 0.13 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.53 3h39 h HIS 350 Cb -0.05 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.30 3h39 h HIS 350 CO -0.05 -0.01 0.05 0.74 -0.00 0.00 0.00 177.93 178.65 3h39 h PHE 351 N 0.35 0.23 -0.07 5.26 -1.00 -0.72 -2.83 116.94 118.15 3h39 h PHE 351 Ca 0.41 -0.02 0.02 0.00 2.81 0.00 0.00 57.97 61.19 3h39 h PHE 351 Cb 0.66 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 40.15 3h39 h PHE 351 CO -0.21 0.33 0.10 -0.07 -1.61 0.00 0.00 178.31 176.85 3h39 h LEU 352 N 0.07 0.00 -0.09 1.54 3.38 0.96 -1.84 115.31 119.33 3h39 h LEU 352 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3h39 h LEU 352 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3h39 h LEU 352 CO -0.00 0.00 0.06 0.00 0.09 0.00 0.00 178.44 178.59 3h39 n ALA 353 N -2.24 0.88 0.37 1.53 0.00 0.11 -1.64 120.51 119.52 3h39 n ALA 353 Ca -0.01 0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3h39 n ALA 353 Cb 0.19 -0.90 -0.11 0.00 0.00 0.00 0.00 19.45 18.64 3h39 n ALA 353 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h39 n TYR 354 N -1.49 0.00 -3.83 0.00 4.02 -0.69 -4.29 117.16 110.88 3h39 n TYR 354 Ca -0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.53 3h39 n TYR 354 Cb 0.07 -0.20 -0.07 0.00 -0.02 0.00 0.00 39.34 39.12 3h39 n TYR 354 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 3h39 s LEU 355 N -3.49 4.33 0.03 7.72 2.01 -0.65 -5.08 118.68 123.55 3h39 s LEU 355 Ca -0.00 0.39 0.07 0.00 0.01 0.00 0.00 54.13 54.60 3h39 s LEU 355 Cb 0.12 -2.08 -0.02 0.00 0.01 0.00 0.00 46.19 44.21 3h39 s LEU 355 CO 0.69 0.33 -0.21 -0.44 1.01 0.00 0.00 176.35 177.73 3h39 s SER 356 N -0.57 2.51 1.62 2.29 0.01 -1.26 -4.80 113.70 113.50 3h39 s SER 356 Ca 0.13 -0.49 0.00 0.00 1.31 0.00 0.00 55.95 56.90 3h39 s SER 356 Cb -0.12 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 65.89 3h39 s SER 356 CO 0.02 0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.47 3h39 n GLY 357 N 2.03 3.56 0.12 3.44 0.00 -1.26 -2.77 105.19 110.32 3h39 n GLY 357 Ca -0.17 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 45.96 3h39 n GLY 357 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h39 n GLU 358 N 14.00 0.19 0.10 1.61 2.13 -1.26 -1.43 120.64 135.98 3h39 n GLU 358 Ca 0.00 0.39 -0.04 0.00 0.66 0.00 0.00 57.16 58.16 3h39 n GLU 358 Cb 0.00 -1.84 0.09 0.00 0.27 0.00 0.00 31.44 29.96 3h39 n GLU 358 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 3h39 h LYS 359 N 0.00 0.11 0.16 5.31 1.57 -1.92 -3.20 116.57 118.60 3h39 h LYS 359 Ca 0.00 -0.10 -0.33 0.00 -1.87 0.00 0.00 60.65 58.36 3h39 h LYS 359 Cb 0.41 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3h39 h LYS 359 CO 0.00 0.77 -1.67 1.05 -0.57 0.00 0.00 179.45 179.03 3h39 h GLU 360 N 0.08 0.34 -0.12 3.15 4.11 -1.36 -1.98 114.58 118.79 3h39 h GLU 360 Ca -0.01 -0.57 0.04 0.00 0.07 0.00 0.00 59.36 58.88 3h39 h GLU 360 Cb 1.25 0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.71 3h39 h GLU 360 CO 0.10 1.27 0.12 0.78 0.07 0.00 0.00 179.01 181.35 3h39 h GLY 361 N 0.50 0.00 0.00 1.06 0.00 -1.58 1.59 103.07 104.65 3h39 h GLY 361 Ca -0.34 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 3h39 h GLY 361 CO 0.13 0.00 -0.15 -2.00 0.00 0.00 0.00 176.54 174.52 3h39 h LEU 362 N 0.00 0.00 -1.93 3.11 6.46 -1.63 -2.77 115.31 118.55 3h39 h LEU 362 Ca 0.06 -0.65 -0.02 0.00 -0.12 0.00 0.00 57.88 57.15 3h39 h LEU 362 Cb 0.30 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.22 3h39 h LEU 362 CO -0.00 0.91 -0.08 0.15 -0.62 0.00 0.00 178.44 178.81 3h39 h PHE 363 N -1.00 0.00 -0.18 1.25 3.57 -0.50 -1.25 116.94 118.83 3h39 h PHE 363 Ca -0.04 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.37 3h39 h PHE 363 Cb 0.76 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 3h39 h PHE 363 CO 0.17 0.08 -0.27 0.87 -2.23 0.00 0.00 178.31 176.93 3h39 h LYS 364 N 0.00 0.50 -0.01 1.11 1.57 0.22 -2.72 116.57 117.23 3h39 h LYS 364 Ca -0.00 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.44 3h39 h LYS 364 Cb 0.14 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3h39 h LYS 364 CO 0.01 0.89 -0.19 0.66 -0.57 0.00 0.00 179.45 180.25 3h39 h SER 365 N 0.14 0.02 0.59 0.86 4.64 -1.05 -2.15 113.55 116.60 3h39 h SER 365 Ca 0.02 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.30 3h39 h SER 365 Cb 0.85 -0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.94 3h39 h SER 365 CO 0.06 0.21 -0.28 1.88 -0.87 0.00 0.00 176.83 177.83 3h39 h TYR 366 N 0.02 -0.73 -0.86 4.77 0.99 -1.16 -1.15 116.97 118.84 3h39 h TYR 366 Ca 0.00 -0.02 0.20 0.00 2.00 0.00 0.00 58.73 60.92 3h39 h TYR 366 Cb 0.35 0.24 -0.12 0.00 1.00 0.00 0.00 36.73 38.21 3h39 h TYR 366 CO 0.00 -0.40 0.33 -0.07 -0.00 0.00 0.00 178.16 178.02 3h39 h LEU 367 N -1.00 0.24 -1.08 3.88 3.38 -1.32 0.19 115.31 119.60 3h39 h LEU 367 Ca -0.08 0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 3h39 h LEU 367 Cb 0.66 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 3h39 h LEU 367 CO 0.13 -0.01 -0.15 -0.07 0.09 0.00 0.00 178.44 178.44 3h39 h LEU 368 N 0.37 0.47 0.71 1.67 3.38 -1.29 0.28 115.31 120.89 3h39 h LEU 368 Ca 0.52 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.33 3h39 h LEU 368 Cb 0.96 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.59 3h39 h LEU 368 CO -0.52 0.64 -0.34 0.50 0.09 0.00 0.00 178.44 178.81 3h39 h LYS 369 N 0.44 -0.92 -0.72 1.13 1.63 0.60 -3.09 116.57 115.65 3h39 h LYS 369 Ca 0.08 0.06 0.01 0.00 -0.85 0.00 0.00 60.65 59.95 3h39 h LYS 369 Cb 0.52 0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 32.32 3h39 h LYS 369 CO 0.03 -0.59 0.48 -0.84 -3.45 0.00 0.00 179.45 175.08 3h39 h ILE 370 N -1.09 1.17 -0.42 2.00 3.07 -0.87 0.81 117.51 122.19 3h39 h ILE 370 Ca -0.10 -0.33 0.07 0.00 1.55 0.00 0.00 64.86 66.05 3h39 h ILE 370 Cb 0.76 0.13 -0.09 0.00 -0.27 0.00 0.00 36.82 37.34 3h39 h ILE 370 CO 0.16 0.18 -0.45 0.50 -1.05 0.00 0.00 178.15 177.49 3h39 h LYS 371 N 0.96 -0.32 -0.31 0.16 3.64 -0.86 -2.88 116.57 116.97 3h39 h LYS 371 Ca 0.27 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.67 3h39 h LYS 371 Cb -0.09 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3h39 h LYS 371 CO -0.06 -0.21 0.00 0.27 -2.27 0.00 0.00 179.45 177.18 3h39 n ASN 372 N -5.41 2.80 -1.28 4.20 2.04 -1.12 -4.07 115.26 112.43 3h39 n ASN 372 Ca -0.01 -1.91 0.11 0.00 -0.44 0.00 0.00 54.58 52.33 3h39 n ASN 372 Cb 0.35 -0.20 0.30 0.00 -2.53 0.00 0.00 39.78 37.70 3h39 n ASN 372 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 3h39 n THR 373 N 0.58 1.00 -0.13 5.53 -2.24 0.26 -4.16 114.28 115.12 3h39 n THR 373 Ca 0.11 -1.00 -0.13 0.00 -2.27 0.00 0.00 64.05 60.76 3h39 n THR 373 Cb 0.41 0.50 -0.09 0.00 -2.10 0.00 0.00 70.33 69.05 3h39 n THR 373 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3h39 h LYS 374 N 4.04 -0.36 -4.28 -0.78 6.56 -1.65 -3.43 116.57 116.67 3h39 h LYS 374 Ca 0.00 0.02 -0.13 0.00 -1.06 0.00 0.00 60.65 59.49 3h39 h LYS 374 Cb 0.96 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.70 3h39 h LYS 374 CO 0.00 -0.24 -0.16 -0.11 -2.06 0.00 0.00 179.45 176.88 3h39 n LEU 375 N -5.19 -0.58 -4.57 2.94 0.00 -1.26 -4.76 117.00 103.58 3h39 n LEU 375 Ca -0.03 0.34 -0.40 0.00 0.00 0.00 0.00 56.01 55.91 3h39 n LEU 375 Cb 0.32 -1.57 -0.03 0.00 0.00 0.00 0.00 43.42 42.14 3h39 n LEU 375 CO 0.01 -0.08 1.60 -1.61 0.00 0.00 0.00 177.39 177.31 3h39 s GLU 376 N -4.91 2.92 -0.16 1.96 0.41 -1.26 -4.79 118.70 112.87 3h39 s GLU 376 Ca 0.00 1.05 -0.12 0.00 -0.41 0.00 0.00 54.97 55.49 3h39 s GLU 376 Cb 0.00 -4.31 -0.07 0.00 -1.78 0.00 0.00 34.13 27.97 3h39 s GLU 376 CO 0.00 -2.36 -0.09 0.36 -0.49 0.00 0.00 175.26 172.69 3h39 n LYS 377 N 8.81 0.48 0.00 1.61 2.85 -1.26 -4.81 118.16 125.84 3h39 n LYS 377 Ca 0.23 0.54 0.00 0.00 -1.05 0.00 0.00 58.31 58.02 3h39 n LYS 377 Cb 0.50 -1.70 0.00 0.00 -0.65 0.00 0.00 35.03 33.17 3h39 n LYS 377 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 177.40 178.86 3h39 n ILE 378 N -4.57 0.00 -1.90 0.58 0.13 -1.26 -4.84 119.36 107.50 3h39 n ILE 378 Ca -0.14 0.00 -0.40 0.00 -1.10 0.00 0.00 62.75 61.11 3h39 n ILE 378 Cb 0.38 0.36 -0.01 0.00 -0.84 0.00 0.00 39.64 39.53 3h39 n ILE 378 CO 0.00 0.00 0.00 -3.20 2.80 0.00 0.00 176.55 176.15 3h39 n ASN 379 N -1.25 8.14 -4.38 9.51 5.15 -1.26 -4.89 115.26 126.27 3h39 n ASN 379 Ca 0.00 -3.07 -0.44 0.00 -0.60 0.00 0.00 54.58 50.47 3h39 n ASN 379 Cb 0.02 -1.39 -0.04 0.00 -0.53 0.00 0.00 39.78 37.84 3h39 n ASN 379 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3h39 s GLY 380 N 0.62 1.74 0.00 8.20 0.00 -1.26 -4.94 107.32 111.68 3h39 s GLY 380 Ca 0.56 -2.21 0.00 0.00 0.00 0.00 0.00 44.72 43.07 3h39 s GLY 380 CO -0.09 1.65 0.00 -1.84 0.00 0.00 0.00 173.10 172.82 3h39 n GLU 381 N 6.48 0.00 0.00 2.90 0.28 -1.26 -3.15 120.64 125.89 3h39 n GLU 381 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 3h39 n GLU 381 Cb 0.43 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.30 3h39 n GLU 381 CO 0.00 0.00 0.00 2.48 -0.16 0.00 0.00 177.13 179.45 3h39 n TYR 382 N 0.00 0.00 0.12 -1.84 4.11 -1.26 0.26 117.16 118.55 3h39 n TYR 382 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.77 3h39 n TYR 382 Cb 0.00 -0.17 -0.08 0.00 -0.00 0.00 0.00 39.34 39.09 3h39 n TYR 382 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.86 178.11 3h39 h LEU 383 N 0.00 -0.25 -1.57 -3.48 6.46 -1.91 -2.15 115.31 112.41 3h39 h LEU 383 Ca 0.00 -0.16 -0.03 0.00 -0.12 0.00 0.00 57.88 57.56 3h39 h LEU 383 Cb 0.08 0.06 -0.00 0.00 -0.73 0.00 0.00 40.66 40.07 3h39 h LEU 383 CO 0.00 0.03 -0.16 -0.29 -0.62 0.00 0.00 178.44 177.40 3h39 h ILE 384 N -0.54 0.51 0.00 4.05 2.10 0.33 -1.84 117.51 122.12 3h39 h ILE 384 Ca -0.03 -0.78 0.00 0.00 1.08 0.00 0.00 64.86 65.13 3h39 h ILE 384 Cb 0.40 1.53 0.00 0.00 -1.09 0.00 0.00 36.82 37.66 3h39 h ILE 384 CO 0.05 0.15 0.00 -0.09 -1.08 0.00 0.00 178.15 177.18 3h39 h ARG 385 N 0.00 0.00 0.00 2.19 2.43 -1.13 -3.04 114.38 114.83 3h39 h ARG 385 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h39 h ARG 385 Cb 0.52 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 3h39 h ARG 385 CO 0.02 0.00 -0.43 1.63 -1.51 0.00 0.00 179.97 179.68 3h39 n LYS 386 N -2.85 0.21 -0.65 0.20 5.02 -0.69 -4.45 118.16 114.94 3h39 n LYS 386 Ca 0.02 0.09 -0.11 0.00 -2.02 0.00 0.00 58.31 56.29 3h39 n LYS 386 Cb 0.37 -1.66 0.08 0.00 -0.02 0.00 0.00 35.03 33.80 3h39 n LYS 386 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h39 n GLY 387 N 1.38 -1.51 3.07 0.72 0.00 -1.15 -5.08 105.19 102.63 3h39 n GLY 387 Ca 0.04 -1.65 -0.26 0.00 0.00 0.00 0.00 46.02 44.16 3h39 n GLY 387 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3h39 n ILE 388 N -2.81 0.00 0.00 -0.61 -0.00 -1.26 -4.96 119.36 109.71 3h39 n ILE 388 Ca 0.06 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.31 3h39 n ILE 388 Cb 0.22 -1.28 0.00 0.00 -0.00 0.00 0.00 39.64 38.57 3h39 n ILE 388 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 3h39 n THR 389 N -4.33 0.00 -3.66 1.39 -2.24 -1.26 -4.59 114.28 99.59 3h39 n THR 389 Ca 0.13 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.85 3h39 n THR 389 Cb 0.50 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.66 3h39 n THR 389 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3h39 s SER 390 N 0.00 -0.56 0.00 3.42 0.01 -1.26 -4.93 113.70 110.38 3h39 s SER 390 Ca 0.00 1.19 0.00 0.00 1.31 0.00 0.00 55.95 58.45 3h39 s SER 390 Cb 0.00 1.66 0.00 0.00 0.21 0.00 0.00 66.02 67.89 3h39 s SER 390 CO 0.00 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.03 3h39 n GLY 391 N 5.38 0.00 4.63 3.44 0.00 -1.26 -4.17 105.19 113.21 3h39 n GLY 391 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3h39 n GLY 391 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h39 n LYS 392 N -1.26 0.00 -0.11 1.61 5.02 -1.26 -4.20 118.16 117.96 3h39 n LYS 392 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 3h39 n LYS 392 Cb 0.00 -3.63 -0.10 0.00 -0.02 0.00 0.00 35.03 31.28 3h39 n LYS 392 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3h39 n ILE 393 N -1.76 1.25 -0.18 -0.18 5.41 -1.26 -4.20 119.36 118.45 3h39 n ILE 393 Ca 0.00 -0.49 -0.03 0.00 1.00 0.00 0.00 62.75 63.23 3h39 n ILE 393 Cb 0.00 -1.26 0.03 0.00 -0.71 0.00 0.00 39.64 37.71 3h39 n ILE 393 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 3h39 h ILE 394 N 0.00 0.35 -0.82 1.39 2.04 -1.83 -0.84 117.51 117.81 3h39 h ILE 394 Ca -0.49 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.36 3h39 h ILE 394 Cb 1.76 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 38.16 3h39 h ILE 394 CO -0.07 0.00 0.44 1.23 0.00 0.00 0.00 178.15 179.75 3h39 h GLY 395 N -0.07 1.22 0.93 5.37 0.00 -1.89 -2.02 103.07 106.60 3h39 h GLY 395 Ca 0.25 -0.56 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 3h39 h GLY 395 CO -0.59 0.53 0.05 0.83 0.00 0.00 0.00 176.54 177.36 3h39 h GLU 396 N 1.14 0.63 -0.20 4.80 5.08 -1.55 -1.76 114.58 122.72 3h39 h GLU 396 Ca 0.29 -0.18 -0.18 0.00 -1.00 0.00 0.00 59.36 58.29 3h39 h GLU 396 Cb 0.04 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.22 3h39 h GLU 396 CO -0.05 0.70 -0.59 -0.39 -1.00 0.00 0.00 179.01 177.68 3h39 h VAL 397 N 0.47 1.30 -0.31 3.13 -1.51 -1.03 -2.31 116.25 115.98 3h39 h VAL 397 Ca 0.11 -1.81 0.07 0.00 -1.23 0.00 0.00 66.70 63.85 3h39 h VAL 397 Cb 0.38 1.87 -0.07 0.00 -2.13 0.00 0.00 31.29 31.35 3h39 h VAL 397 CO 0.01 0.57 -0.13 -0.07 -1.23 0.00 0.00 177.57 176.72 3h39 h LEU 398 N 0.48 -0.46 -0.35 4.19 4.07 -1.40 -2.41 115.31 119.43 3h39 h LEU 398 Ca -0.02 0.12 0.05 0.00 0.08 0.00 0.00 57.88 58.10 3h39 h LEU 398 Cb 1.21 0.26 -0.04 0.00 1.08 0.00 0.00 40.66 43.17 3h39 h LEU 398 CO 0.13 -0.17 0.10 -0.08 -1.08 0.00 0.00 178.44 177.34 3h39 h GLU 399 N -0.08 0.23 -0.01 1.13 4.81 -1.17 -1.74 114.58 117.75 3h39 h GLU 399 Ca 0.16 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3h39 h GLU 399 Cb 0.32 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 3h39 h GLU 399 CO -0.37 0.15 0.01 0.87 -0.73 0.00 0.00 179.01 178.95 3h39 h LYS 400 N 0.24 0.00 0.00 1.92 1.57 -0.95 0.32 116.57 119.67 3h39 h LYS 400 Ca 0.16 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.94 3h39 h LYS 400 Cb 0.16 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 3h39 h LYS 400 CO -0.19 0.00 -0.05 0.82 -0.57 0.00 0.00 179.45 179.46 3h39 h ILE 401 N 0.00 0.45 -1.05 1.86 2.04 -0.89 -2.80 117.51 117.12 3h39 h ILE 401 Ca 0.00 -1.35 0.30 0.00 1.00 0.00 0.00 64.86 64.82 3h39 h ILE 401 Cb 0.03 0.86 -0.13 0.00 -0.74 0.00 0.00 36.82 36.84 3h39 h ILE 401 CO -0.00 0.15 0.63 0.25 0.00 0.00 0.00 178.15 179.18 3h39 h LEU 402 N -1.00 0.52 -0.47 1.44 7.12 -0.94 0.67 115.31 122.64 3h39 h LEU 402 Ca -0.01 0.15 -0.07 0.00 0.13 0.00 0.00 57.88 58.08 3h39 h LEU 402 Cb 0.29 0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 40.49 3h39 h LEU 402 CO -0.00 -0.03 0.00 -0.03 -0.13 0.00 0.00 178.44 178.25 3h39 h MET 403 N 0.38 0.83 -0.38 1.25 4.05 -0.46 -2.10 114.93 118.50 3h39 h MET 403 Ca 0.69 -0.26 -0.06 0.00 -0.28 0.00 0.00 59.70 59.79 3h39 h MET 403 Cb 1.62 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 32.33 3h39 h MET 403 CO -0.49 0.88 -0.02 0.87 0.23 0.00 0.00 176.91 178.38 3h39 h LYS 404 N 0.68 0.62 -0.86 0.39 1.79 -0.65 -2.86 116.57 115.68 3h39 h LYS 404 Ca 0.13 -0.15 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 3h39 h LYS 404 Cb 0.50 -0.08 -0.04 0.00 -1.58 0.00 0.00 32.23 31.03 3h39 h LYS 404 CO 0.02 0.66 0.52 0.87 -1.08 0.00 0.00 179.45 180.44 3h39 h LYS 405 N 0.58 1.17 -1.36 3.15 1.57 -0.68 -2.34 116.57 118.68 3h39 h LYS 405 Ca 0.12 -0.11 0.39 0.00 -1.87 0.00 0.00 60.65 59.18 3h39 h LYS 405 Cb 0.40 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 3h39 h LYS 405 CO 0.02 0.83 0.98 -0.07 -0.57 0.00 0.00 179.45 180.63 3h39 h LEU 406 N 1.19 0.00 -4.65 2.94 3.38 -1.14 -2.30 115.31 114.73 3h39 h LEU 406 Ca 0.31 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.72 3h39 h LEU 406 Cb -0.05 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 40.29 3h39 h LEU 406 CO -0.06 -0.00 -0.79 0.47 0.09 0.00 0.00 178.44 178.15 3h39 n ASP 407 N -4.13 4.22 0.00 -0.43 10.43 -0.88 -4.62 116.55 121.15 3h39 n ASP 407 Ca 0.30 -3.58 0.00 0.00 2.57 0.00 0.00 54.79 54.08 3h39 n ASP 407 Cb 1.41 -0.48 0.00 0.00 1.84 0.00 0.00 41.12 43.89 3h39 n ASP 407 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3h39 n GLY 408 N -0.40 1.06 3.85 0.44 0.00 -0.86 -5.05 105.19 104.22 3h39 n GLY 408 Ca 0.34 -1.94 -0.07 0.00 0.00 0.00 0.00 46.02 44.35 3h39 n GLY 408 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3h39 s ASP 409 N -0.50 -0.19 0.00 1.61 1.47 -1.26 -3.40 116.67 114.40 3h39 s ASP 409 Ca 0.00 -0.75 0.00 0.00 1.18 0.00 0.00 52.55 52.98 3h39 s ASP 409 Cb 0.00 0.76 0.00 0.00 -0.34 0.00 0.00 42.92 43.34 3h39 s ASP 409 CO 0.00 -1.44 0.00 0.41 0.68 0.00 0.00 175.17 174.82 3h39 n THR 410 N -0.48 0.00 -0.10 2.11 -1.04 -1.26 -5.05 114.28 108.45 3h39 n THR 410 Ca -0.05 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.85 3h39 n THR 410 Cb 0.59 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.13 3h39 n THR 410 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 3h39 h ARG 411 N 0.00 0.85 0.00 -2.82 9.65 -2.02 -3.48 114.38 116.57 3h39 h ARG 411 Ca 0.00 -0.40 0.00 0.00 -1.10 0.00 0.00 59.98 58.48 3h39 h ARG 411 Cb 0.00 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.57 3h39 h ARG 411 CO 0.00 1.04 0.00 -3.47 2.80 0.00 0.00 179.97 180.34 3h39 n ASP 412 N -4.08 0.00 0.00 -3.80 -0.08 -1.26 -4.85 116.55 102.49 3h39 n ASP 412 Ca -0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 3h39 n ASP 412 Cb 0.49 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.95 3h39 n ASP 412 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 3h39 n GLU 413 N -1.06 2.41 0.18 -0.67 2.13 -1.26 -4.48 120.64 117.89 3h39 n GLU 413 Ca 0.00 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.85 3h39 n GLU 413 Cb 0.00 -0.79 0.34 0.00 0.27 0.00 0.00 31.44 31.26 3h39 n GLU 413 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 3h39 h GLU 414 N 0.00 0.00 0.06 5.31 4.57 -1.96 -2.97 114.58 119.59 3h39 h GLU 414 Ca 0.00 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.93 3h39 h GLU 414 Cb 0.31 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.91 3h39 h GLU 414 CO 0.00 0.41 -1.08 0.93 -1.18 0.00 0.00 179.01 178.09 3h39 h GLU 415 N 0.00 0.39 -0.72 1.92 5.08 -1.96 -2.09 114.58 117.20 3h39 h GLU 415 Ca -0.00 -0.50 -0.02 0.00 -1.00 0.00 0.00 59.36 57.83 3h39 h GLU 415 Cb 0.76 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 3h39 h GLU 415 CO 0.05 1.18 0.36 0.97 -1.00 0.00 0.00 179.01 180.57 3h39 h ILE 416 N 0.19 1.23 0.00 3.13 2.10 -1.77 -1.39 117.51 120.99 3h39 h ILE 416 Ca -0.11 -0.62 -0.12 0.00 1.08 0.00 0.00 64.86 65.08 3h39 h ILE 416 Cb 1.75 0.29 -0.02 0.00 -1.09 0.00 0.00 36.82 37.75 3h39 h ILE 416 CO 0.19 0.27 -0.57 -0.07 -1.08 0.00 0.00 178.15 176.88 3h39 h LEU 417 N 1.02 0.00 -1.08 2.19 3.38 -1.44 0.18 115.31 119.56 3h39 h LEU 417 Ca 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 3h39 h LEU 417 Cb 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3h39 h LEU 417 CO -0.03 0.57 -0.16 -0.08 0.09 0.00 0.00 178.44 178.82 3h39 h GLU 418 N 0.00 0.00 0.05 1.13 4.81 -0.82 -2.90 114.58 116.85 3h39 h GLU 418 Ca -0.01 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.84 3h39 h GLU 418 Cb 1.25 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 3h39 h GLU 418 CO 0.07 0.16 -2.27 0.39 -0.73 0.00 0.00 179.01 176.63 3h39 n GLU 419 N -3.29 0.69 -0.20 1.92 -0.58 -0.57 -1.40 120.64 117.21 3h39 n GLU 419 Ca 0.01 0.20 -0.03 0.00 -0.42 0.00 0.00 57.16 56.92 3h39 n GLU 419 Cb 0.42 -1.60 0.07 0.00 -0.57 0.00 0.00 31.44 29.76 3h39 n GLU 419 CO 0.00 0.00 0.00 -0.39 -0.48 0.00 0.00 177.13 176.26 3h39 h VAL 420 N 0.01 0.96 -0.47 2.62 -1.51 -1.10 0.75 116.25 117.50 3h39 h VAL 420 Ca -0.52 -0.20 0.10 0.00 -1.23 0.00 0.00 66.70 64.85 3h39 h VAL 420 Cb 1.95 0.33 -0.09 0.00 -2.13 0.00 0.00 31.29 31.34 3h39 h VAL 420 CO -0.02 0.11 -0.17 0.25 -1.23 0.00 0.00 177.57 176.50 3h39 h LEU 421 N 0.58 -0.61 -0.62 4.19 6.46 -1.62 2.07 115.31 125.76 3h39 h LEU 421 Ca 0.26 0.16 0.00 0.00 -0.12 0.00 0.00 57.88 58.18 3h39 h LEU 421 Cb 0.15 0.36 0.00 0.00 -0.73 0.00 0.00 40.66 40.44 3h39 h LEU 421 CO -0.17 -0.21 0.00 0.00 -0.62 0.00 0.00 178.44 177.44 3h39 n ALA 422 N -2.90 1.50 0.11 1.25 0.00 -0.50 -1.57 120.51 118.40 3h39 n ALA 422 Ca 0.04 0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.56 3h39 n ALA 422 Cb 0.29 -1.31 0.35 0.00 0.00 0.00 0.00 19.45 18.77 3h39 n ALA 422 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3h39 h SER 423 N 0.00 0.23 0.00 0.00 0.02 0.99 -3.32 113.55 111.47 3h39 h SER 423 Ca 0.00 -0.06 -0.48 0.00 -0.84 0.00 0.00 61.79 60.41 3h39 h SER 423 Cb 0.25 -0.06 0.02 0.00 0.14 0.00 0.00 62.40 62.75 3h39 h SER 423 CO 0.00 0.45 2.95 0.18 -1.14 0.00 0.00 176.83 179.27 3h39 n LEU 424 N -4.21 5.98 -0.04 5.07 4.32 -0.61 0.18 117.00 127.70 3h39 n LEU 424 Ca -0.01 -3.33 -0.02 0.00 -0.02 0.00 0.00 56.01 52.63 3h39 n LEU 424 Cb 0.32 -1.24 -0.09 0.00 -1.62 0.00 0.00 43.42 40.79 3h39 n LEU 424 CO 0.39 0.97 -0.79 -0.62 -1.22 0.00 0.00 177.39 176.12 3h39 n GLU 425 N 4.26 1.61 0.00 3.23 1.02 -1.25 -5.05 120.64 124.46 3h39 n GLU 425 Ca 0.54 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.64 3h39 n GLU 425 Cb 0.18 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 3h39 n GLU 425 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 3h39 n THR 426 N -2.25 0.00 0.00 2.62 5.66 0.47 -5.13 114.28 115.65 3h39 n THR 426 Ca -0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 3h39 n THR 426 Cb 0.68 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.46 3h39 n THR 426 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 3h39 n GLU 427 N -0.98 0.00 0.00 1.09 0.28 -1.26 -4.96 120.64 114.81 3h39 n GLU 427 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 3h39 n GLU 427 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 3h39 n GLU 427 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3h39 n GLY 428 N 1.02 0.00 0.00 -1.84 0.00 -1.26 -5.17 105.19 97.94 3h39 n GLY 428 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3h39 n GLY 428 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3h39 n LYS 429 N 0.00 0.00 0.00 1.61 4.81 -1.26 -5.12 118.16 118.20 3h39 n LYS 429 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3h39 n LYS 429 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 3h39 n LYS 429 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 3h39 n LEU 430 N 0.00 0.00 0.00 3.14 7.94 -1.26 -5.00 117.00 121.82 3h39 n LEU 430 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3h39 n LEU 430 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3h39 n LEU 430 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.28 3h39 n ALA 431 N -0.72 0.00 0.00 1.96 0.00 -1.26 -5.13 120.51 115.37 3h39 n ALA 431 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h39 n ALA 431 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3h39 n ALA 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50