#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h60 n ALA 2 N 0.00 -1.73 -0.07 -1.46 0.00 -1.26 -4.84 120.51 111.14 1h60 n ALA 2 Ca 0.00 0.49 -0.07 0.00 0.00 0.00 0.00 53.44 53.87 1h60 n ALA 2 Cb 0.00 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.02 1h60 n ALA 2 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1h60 h GLU 3 N 4.26 0.03 0.00 0.00 4.39 -2.00 -3.35 114.58 117.90 1h60 h GLU 3 Ca -0.07 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1h60 h GLU 3 Cb 0.15 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1h60 h GLU 3 CO 0.00 0.02 0.00 1.63 -1.16 0.00 0.00 179.01 179.50 1h60 n LYS 4 N -5.21 4.84 0.26 2.33 4.01 -1.26 -4.62 118.16 118.50 1h60 n LYS 4 Ca -0.00 -0.12 0.18 0.00 -0.51 0.00 0.00 58.31 57.85 1h60 n LYS 4 Cb 0.16 -0.60 0.91 0.00 -0.51 0.00 0.00 35.03 34.98 1h60 n LYS 4 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1h60 h LEU 5 N 0.00 0.00 -3.25 -0.35 3.38 -1.91 -2.34 115.31 110.84 1h60 h LEU 5 Ca 0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1h60 h LEU 5 Cb 0.01 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.69 1h60 h LEU 5 CO 0.00 0.00 -0.13 0.49 0.09 0.00 0.00 178.44 178.89 1h60 n PHE 6 N -2.73 0.80 -4.11 1.13 3.72 -1.26 -1.20 117.46 113.81 1h60 n PHE 6 Ca -0.02 -1.44 -0.29 0.00 -0.05 0.00 0.00 57.45 55.65 1h60 n PHE 6 Cb 0.09 -0.40 -0.07 0.00 -0.94 0.00 0.00 39.48 38.15 1h60 n PHE 6 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1h60 s THR 7 N -3.16 4.16 0.78 4.37 -4.23 -0.88 -4.77 115.64 111.90 1h60 s THR 7 Ca 0.42 -1.00 -0.11 0.00 -1.18 0.00 0.00 61.69 59.82 1h60 s THR 7 Cb 0.38 -3.02 0.06 0.00 1.34 0.00 0.00 72.50 71.27 1h60 s THR 7 CO 0.00 0.07 1.11 -2.84 -0.54 0.00 0.00 174.62 172.42 1h60 s PRO 8 N -2.49 2.12 -0.14 3.99 0.02 -1.22 -3.77 135.00 133.51 1h60 s PRO 8 Ca 0.27 1.28 -0.07 0.00 0.02 0.00 0.00 61.00 62.51 1h60 s PRO 8 Cb -0.11 -1.87 0.05 0.00 0.02 0.00 0.00 34.50 32.59 1h60 s PRO 8 CO 0.20 -1.76 0.32 -1.17 -0.33 0.00 0.00 177.00 174.26 1h60 s LEU 9 N -5.86 0.12 -0.14 -5.54 2.96 -0.14 -4.92 118.68 105.16 1h60 s LEU 9 Ca 0.63 0.70 -0.28 0.00 -0.22 0.00 0.00 54.13 54.97 1h60 s LEU 9 Cb -0.19 1.01 -0.01 0.00 0.50 0.00 0.00 46.19 47.50 1h60 s LEU 9 CO 0.54 -0.18 0.93 -0.75 -1.32 0.00 0.00 176.35 175.57 1h60 s LYS 10 N 1.44 4.36 -0.42 1.98 2.20 -1.26 -0.40 119.74 127.64 1h60 s LYS 10 Ca -0.09 1.23 0.03 0.00 -0.36 0.00 0.00 55.97 56.78 1h60 s LYS 10 Cb -0.10 -3.56 0.11 0.00 -1.51 0.00 0.00 37.83 32.78 1h60 s LYS 10 CO -0.10 -0.33 0.16 0.08 -0.36 0.00 0.00 175.35 174.79 1h60 s VAL 11 N 2.12 2.56 0.00 4.02 1.01 0.11 -4.81 120.40 125.42 1h60 s VAL 11 Ca 0.44 -2.68 0.00 0.00 0.00 0.00 0.00 61.98 59.73 1h60 s VAL 11 Cb -0.17 -2.82 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1h60 s VAL 11 CO 0.15 -0.69 0.00 0.61 0.00 0.00 0.00 175.10 175.17 1h60 n GLY 12 N 3.86 2.92 0.00 4.51 0.00 -1.26 -1.50 105.19 113.71 1h60 n GLY 12 Ca 0.04 0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.36 1h60 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h60 n ALA 13 N 10.46 2.07 -2.60 4.61 0.00 -0.45 -4.84 120.51 129.75 1h60 n ALA 13 Ca 0.00 -0.09 -0.27 0.00 0.00 0.00 0.00 53.44 53.07 1h60 n ALA 13 Cb 0.00 -1.35 -0.10 0.00 0.00 0.00 0.00 19.45 18.00 1h60 n ALA 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1h60 s VAL 14 N -2.74 1.39 -0.18 0.00 -7.23 -0.56 -5.13 120.40 105.94 1h60 s VAL 14 Ca 0.16 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.34 1h60 s VAL 14 Cb 0.14 -2.64 0.02 0.00 0.56 0.00 0.00 36.38 34.46 1h60 s VAL 14 CO 0.35 0.00 -0.20 -0.89 -0.31 0.00 0.00 175.10 174.06 1h60 s THR 15 N -2.96 2.08 0.13 5.32 2.01 -1.26 -0.71 115.64 120.25 1h60 s THR 15 Ca 0.26 -0.93 -0.29 0.00 0.31 0.00 0.00 61.69 61.04 1h60 s THR 15 Cb 0.06 -1.87 -0.06 0.00 0.01 0.00 0.00 72.50 70.64 1h60 s THR 15 CO 0.13 0.54 0.93 0.00 -0.69 0.00 0.00 174.62 175.53 1h60 s ALA 16 N 1.29 3.28 -1.66 7.40 0.00 0.47 -4.93 121.76 127.61 1h60 s ALA 16 Ca 0.05 0.54 0.29 0.00 0.00 0.00 0.00 51.96 52.84 1h60 s ALA 16 Cb -0.13 -3.22 1.30 0.00 0.00 0.00 0.00 23.12 21.07 1h60 s ALA 16 CO -0.13 0.04 1.90 -0.35 0.00 0.00 0.00 175.76 177.23 1h60 n PRO 17 N 2.50 0.70 -3.92 0.00 -0.04 -1.26 -0.96 135.00 132.02 1h60 n PRO 17 Ca 0.01 -0.21 -0.10 0.00 -0.04 0.00 0.00 63.50 63.16 1h60 n PRO 17 Cb 0.49 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.44 1h60 n PRO 17 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1h60 s ASN 18 N -2.44 0.11 -0.11 3.54 2.20 -1.25 -3.45 114.94 113.53 1h60 s ASN 18 Ca 0.30 -1.05 0.14 0.00 -0.94 0.00 0.00 52.86 51.32 1h60 s ASN 18 Cb 0.20 0.73 0.44 0.00 -2.00 0.00 0.00 41.25 40.62 1h60 s ASN 18 CO 0.46 -1.42 1.36 0.54 -2.94 0.00 0.00 177.10 175.10 1h60 n ARG 19 N -0.49 2.92 -3.20 3.55 1.74 -0.34 -4.33 116.66 116.50 1h60 n ARG 19 Ca -0.04 -2.53 -0.46 0.00 -0.77 0.00 0.00 57.85 54.06 1h60 n ARG 19 Cb 0.60 -1.62 -0.03 0.00 -1.02 0.00 0.00 32.46 30.39 1h60 n ARG 19 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1h60 s VAL 20 N -2.10 5.17 0.18 1.55 1.01 -1.26 -1.70 120.40 123.26 1h60 s VAL 20 Ca 0.34 -1.72 0.01 0.00 0.00 0.00 0.00 61.98 60.62 1h60 s VAL 20 Cb 0.25 -4.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 1h60 s VAL 20 CO 0.11 -1.10 0.34 -0.36 0.00 0.00 0.00 175.10 174.10 1h60 s PHE 21 N 1.56 3.48 -0.30 5.22 0.40 -0.36 -0.90 117.98 127.08 1h60 s PHE 21 Ca 0.15 0.20 -0.15 0.00 -0.60 0.00 0.00 56.93 56.54 1h60 s PHE 21 Cb -0.17 -1.74 -0.03 0.00 0.51 0.00 0.00 43.02 41.59 1h60 s PHE 21 CO -0.02 0.44 0.37 1.41 0.70 0.00 0.00 175.22 178.12 1h60 s MET 22 N -3.37 3.84 0.73 0.44 -2.45 -0.23 -1.38 119.30 116.88 1h60 s MET 22 Ca 0.36 -0.14 -0.13 0.00 -1.25 0.00 0.00 55.69 54.53 1h60 s MET 22 Cb -0.11 -3.72 0.04 0.00 1.25 0.00 0.00 34.83 32.29 1h60 s MET 22 CO 0.29 -0.38 1.11 0.00 1.05 0.00 0.00 175.02 177.09 1h60 s ALA 23 N 2.06 2.30 0.16 4.11 0.00 -0.27 -1.07 121.76 129.05 1h60 s ALA 23 Ca 0.14 0.44 -0.31 0.00 0.00 0.00 0.00 51.96 52.23 1h60 s ALA 23 Cb -0.16 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 19.55 1h60 s ALA 23 CO 0.11 -1.61 1.49 -1.25 0.00 0.00 0.00 175.76 174.50 1h60 s PRO 24 N -4.48 4.26 -0.27 0.00 0.04 -1.24 -4.63 135.00 128.69 1h60 s PRO 24 Ca 0.65 2.25 -0.03 0.00 0.04 0.00 0.00 61.00 63.91 1h60 s PRO 24 Cb -0.20 -3.18 0.09 0.00 0.04 0.00 0.00 34.50 31.25 1h60 s PRO 24 CO 0.49 -0.53 0.09 -0.51 0.04 0.00 0.00 177.00 176.59 1h60 s LEU 25 N 0.99 1.25 0.08 -3.56 1.43 -1.26 -4.87 118.68 112.73 1h60 s LEU 25 Ca 0.67 -1.25 -0.32 0.00 -1.03 0.00 0.00 54.13 52.20 1h60 s LEU 25 Cb -0.41 -0.57 -0.11 0.00 0.03 0.00 0.00 46.19 45.12 1h60 s LEU 25 CO 0.32 -0.39 1.81 0.41 0.23 0.00 0.00 176.35 178.73 1h60 n THR 26 N 5.07 0.38 -0.04 5.49 -1.04 -1.26 -4.25 114.28 118.63 1h60 n THR 26 Ca -0.05 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 1h60 n THR 26 Cb 0.44 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 66.97 1h60 n THR 26 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1h60 n ARG 27 N 5.60 4.19 -3.90 -2.82 5.12 -1.26 -4.80 116.66 118.79 1h60 n ARG 27 Ca 0.19 -0.10 -0.26 0.00 -1.93 0.00 0.00 57.85 55.75 1h60 n ARG 27 Cb 0.34 -0.53 0.00 0.00 -1.16 0.00 0.00 32.46 31.12 1h60 n ARG 27 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1h60 n LEU 28 N -0.63 -2.50 -0.28 0.55 4.77 -1.26 -0.74 117.00 116.91 1h60 n LEU 28 Ca 0.00 -0.91 0.07 0.00 -0.03 0.00 0.00 56.01 55.13 1h60 n LEU 28 Cb 0.01 -2.40 0.13 0.00 -2.33 0.00 0.00 43.42 38.83 1h60 n LEU 28 CO 0.00 0.42 0.59 0.54 -1.33 0.00 0.00 177.39 177.60 1h60 n ARG 29 N -4.41 2.24 -1.75 3.23 1.74 -1.12 -3.50 116.66 113.10 1h60 n ARG 29 Ca -0.21 -2.28 -0.30 0.00 -0.77 0.00 0.00 57.85 54.29 1h60 n ARG 29 Cb 0.64 -1.41 0.07 0.00 -1.02 0.00 0.00 32.46 30.74 1h60 n ARG 29 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1h60 s SER 30 N -1.98 4.96 0.13 0.55 0.01 -0.15 -4.82 113.70 112.41 1h60 s SER 30 Ca 0.24 1.17 -0.30 0.00 1.31 0.00 0.00 55.95 58.37 1h60 s SER 30 Cb 0.20 -1.91 -0.06 0.00 0.21 0.00 0.00 66.02 64.45 1h60 s SER 30 CO 0.05 -1.66 1.03 -0.63 0.41 0.00 0.00 173.24 172.44 1h60 s ILE 31 N -3.30 4.23 0.01 1.44 1.01 -0.18 -4.66 121.20 119.75 1h60 s ILE 31 Ca 0.60 1.86 0.08 0.00 0.00 0.00 0.00 60.65 63.18 1h60 s ILE 31 Cb -0.12 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 1h60 s ILE 31 CO 0.53 0.29 -0.24 -1.61 0.00 0.00 0.00 174.94 173.91 1h60 s GLU 32 N -0.07 1.80 0.58 2.79 2.02 -1.26 -0.46 118.70 124.11 1h60 s GLU 32 Ca 0.49 -0.92 -0.17 0.00 0.02 0.00 0.00 54.97 54.38 1h60 s GLU 32 Cb -0.26 -1.82 -0.04 0.00 0.10 0.00 0.00 34.13 32.11 1h60 s GLU 32 CO 0.32 0.49 1.08 -1.25 0.02 0.00 0.00 175.26 175.92 1h60 s PRO 33 N -0.81 3.27 0.00 0.39 0.04 -1.26 -4.97 135.00 131.65 1h60 s PRO 33 Ca 0.09 1.36 0.00 0.00 0.04 0.00 0.00 61.00 62.50 1h60 s PRO 33 Cb -0.09 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1h60 s PRO 33 CO 0.00 -0.87 0.00 0.41 0.04 0.00 0.00 177.00 176.58 1h60 n GLY 34 N -0.50 1.74 3.76 0.56 0.00 -1.25 -4.69 105.19 104.81 1h60 n GLY 34 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1h60 n GLY 34 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1h60 n ASP 35 N 0.00 -0.95 -4.68 1.61 8.00 0.39 -4.76 116.55 116.17 1h60 n ASP 35 Ca 0.00 -0.87 -0.36 0.00 0.71 0.00 0.00 54.79 54.27 1h60 n ASP 35 Cb 0.00 -3.81 -0.09 0.00 -0.02 0.00 0.00 41.12 37.20 1h60 n ASP 35 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1h60 s ILE 36 N -3.74 5.38 0.63 0.53 1.01 -0.51 -1.89 121.20 122.60 1h60 s ILE 36 Ca 0.00 0.18 -0.18 0.00 0.00 0.00 0.00 60.65 60.66 1h60 s ILE 36 Cb -0.00 -3.49 -0.02 0.00 0.01 0.00 0.00 42.46 38.95 1h60 s ILE 36 CO 0.83 0.38 1.16 -2.65 0.00 0.00 0.00 174.94 174.66 1h60 n PRO 37 N 4.05 1.03 -4.36 2.79 -0.02 -1.26 -1.02 135.00 136.20 1h60 n PRO 37 Ca -0.15 0.40 -0.23 0.00 -2.02 0.00 0.00 63.50 61.50 1h60 n PRO 37 Cb 0.52 -2.39 -0.08 0.00 -0.02 0.00 0.00 33.50 31.53 1h60 n PRO 37 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1h60 s THR 38 N -1.44 3.08 0.40 3.45 -4.23 -1.26 -4.84 115.64 110.80 1h60 s THR 38 Ca 0.80 -2.10 0.12 0.00 -1.18 0.00 0.00 61.69 59.33 1h60 s THR 38 Cb -0.39 -2.63 0.33 0.00 1.34 0.00 0.00 72.50 71.15 1h60 s THR 38 CO 0.43 -0.38 1.92 -0.65 -0.54 0.00 0.00 174.62 175.40 1h60 h PRO 39 N 2.04 0.51 -0.54 3.99 0.11 -1.96 -0.61 132.00 135.54 1h60 h PRO 39 Ca -0.43 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1h60 h PRO 39 Cb 1.25 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1h60 h PRO 39 CO 0.60 0.34 0.20 1.25 -0.21 0.00 0.00 178.00 180.18 1h60 h LEU 40 N 0.53 0.76 -0.88 2.35 5.85 -1.98 -0.86 115.31 121.08 1h60 h LEU 40 Ca 0.36 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 1h60 h LEU 40 Cb 0.68 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 1h60 h LEU 40 CO -0.13 0.74 0.51 0.24 -0.34 0.00 0.00 178.44 179.46 1h60 h MET 41 N 0.74 1.22 -0.77 1.25 2.86 -1.66 -0.77 114.93 117.80 1h60 h MET 41 Ca 0.18 -0.13 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 1h60 h MET 41 Cb 0.23 -0.25 -0.05 0.00 0.06 0.00 0.00 31.60 31.59 1h60 h MET 41 CO -0.01 0.87 0.47 0.78 1.06 0.00 0.00 176.91 180.08 1h60 h GLY 42 N 1.22 1.13 0.92 8.32 0.00 -0.44 -1.67 103.07 112.55 1h60 h GLY 42 Ca 0.31 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1h60 h GLY 42 CO -0.05 0.25 0.10 -2.09 0.00 0.00 0.00 176.54 174.74 1h60 h GLU 43 N 0.88 0.30 -0.86 4.80 4.81 -0.60 -0.75 114.58 123.16 1h60 h GLU 43 Ca 0.33 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.59 1h60 h GLU 43 Cb 0.12 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.38 1h60 h GLU 43 CO -0.15 0.33 0.52 -0.92 -0.73 0.00 0.00 179.01 178.05 1h60 h TYR 44 N 0.20 0.95 -0.25 0.92 3.20 -0.87 -0.15 116.97 120.97 1h60 h TYR 44 Ca 0.07 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.80 1h60 h TYR 44 Cb 0.13 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.09 1h60 h TYR 44 CO -0.02 0.44 -0.52 1.88 -1.64 0.00 0.00 178.16 178.30 1h60 h TYR 45 N 0.91 0.91 -0.60 -3.82 0.05 -1.14 -3.05 116.97 110.23 1h60 h TYR 45 Ca 0.39 -0.31 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 1h60 h TYR 45 Cb 0.27 -0.17 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 1h60 h TYR 45 CO -0.04 1.09 0.28 -0.09 -1.05 0.00 0.00 178.16 178.35 1h60 h ARG 46 N 0.57 0.84 -0.03 4.88 2.43 -0.49 -1.28 114.38 121.30 1h60 h ARG 46 Ca 0.02 -0.11 0.01 0.00 -0.81 0.00 0.00 59.98 59.09 1h60 h ARG 46 Cb 1.09 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 30.48 1h60 h ARG 46 CO 0.11 0.66 0.02 1.96 -1.51 0.00 0.00 179.97 181.22 1h60 h GLN 47 N 0.84 0.00 -0.52 0.20 4.20 -0.94 -2.70 115.11 116.20 1h60 h GLN 47 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 1h60 h GLN 47 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 1h60 h GLN 47 CO -0.03 0.00 0.00 0.54 -0.67 0.00 0.00 178.83 178.67 1h60 n ARG 48 N -4.38 3.51 0.02 1.46 1.74 -0.51 -4.45 116.66 114.05 1h60 n ARG 48 Ca -0.02 -2.76 0.08 0.00 -0.77 0.00 0.00 57.85 54.38 1h60 n ARG 48 Cb 0.12 -1.80 0.35 0.00 -1.02 0.00 0.00 32.46 30.11 1h60 n ARG 48 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1h60 n ALA 49 N 0.68 1.69 1.13 7.54 0.00 -1.02 -2.15 120.51 128.39 1h60 n ALA 49 Ca 0.23 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.76 1h60 n ALA 49 Cb 0.83 -1.27 0.62 0.00 0.00 0.00 0.00 19.45 19.63 1h60 n ALA 49 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1h60 n SER 50 N -1.60 0.00 -4.62 0.00 3.41 -1.26 -4.10 113.62 105.45 1h60 n SER 50 Ca 0.03 0.04 -0.40 0.00 -0.26 0.00 0.00 58.87 58.29 1h60 n SER 50 Cb 0.19 -0.33 0.03 0.00 -0.26 0.00 0.00 64.21 63.83 1h60 n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1h60 n ALA 51 N -1.33 0.26 -0.32 7.33 0.00 -0.91 -4.86 120.51 120.68 1h60 n ALA 51 Ca 0.11 0.14 0.07 0.00 0.00 0.00 0.00 53.44 53.76 1h60 n ALA 51 Cb 0.22 -2.10 0.23 0.00 0.00 0.00 0.00 19.45 17.80 1h60 n ALA 51 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1h60 h GLY 52 N 1.16 1.47 -5.43 0.00 0.00 -1.21 -3.42 103.07 95.63 1h60 h GLY 52 Ca -0.46 -0.32 -0.07 0.00 0.00 0.00 0.00 47.33 46.48 1h60 h GLY 52 CO 0.54 0.04 -0.19 -2.27 0.00 0.00 0.00 176.54 174.66 1h60 s LEU 53 N -10.30 -0.36 -0.10 3.11 2.96 -1.26 -4.46 118.68 108.27 1h60 s LEU 53 Ca -0.12 1.09 -0.20 0.00 -0.22 0.00 0.00 54.13 54.68 1h60 s LEU 53 Cb 0.22 1.68 -0.04 0.00 0.50 0.00 0.00 46.19 48.55 1h60 s LEU 53 CO 0.79 -0.21 0.57 -0.63 -1.32 0.00 0.00 176.35 175.55 1h60 s ILE 54 N 1.46 5.13 -0.21 6.68 1.01 -0.12 -1.06 121.20 134.08 1h60 s ILE 54 Ca -0.10 1.15 -0.07 0.00 0.00 0.00 0.00 60.65 61.64 1h60 s ILE 54 Cb -0.07 -3.91 -0.03 0.00 0.01 0.00 0.00 42.46 38.46 1h60 s ILE 54 CO -0.15 0.30 0.05 -0.63 0.00 0.00 0.00 174.94 174.51 1h60 s ILE 55 N 0.67 4.37 0.79 2.92 1.01 -0.23 -0.57 121.20 130.16 1h60 s ILE 55 Ca 0.31 -0.17 -0.11 0.00 0.00 0.00 0.00 60.65 60.68 1h60 s ILE 55 Cb -0.16 -3.00 0.06 0.00 0.01 0.00 0.00 42.46 39.38 1h60 s ILE 55 CO 0.13 0.40 1.09 -0.94 0.00 0.00 0.00 174.94 175.63 1h60 s SER 56 N 1.01 4.39 0.52 3.58 1.04 0.13 -3.59 113.70 120.78 1h60 s SER 56 Ca 0.03 1.77 -0.19 0.00 0.48 0.00 0.00 55.95 58.04 1h60 s SER 56 Cb -0.14 -2.47 -0.10 0.00 0.10 0.00 0.00 66.02 63.41 1h60 s SER 56 CO 0.03 -2.10 0.48 -1.84 0.98 0.00 0.00 173.24 170.79 1h60 n GLU 57 N -3.56 0.51 -1.71 4.02 0.28 -1.26 -3.87 120.64 115.05 1h60 n GLU 57 Ca 0.09 0.19 -0.43 0.00 -0.16 0.00 0.00 57.16 56.85 1h60 n GLU 57 Cb 0.53 -1.59 -0.02 0.00 1.43 0.00 0.00 31.44 31.80 1h60 n GLU 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1h60 n ALA 58 N -1.40 1.73 -3.20 -1.84 0.00 -1.26 -4.22 120.51 110.32 1h60 n ALA 58 Ca 0.11 0.38 -0.22 0.00 0.00 0.00 0.00 53.44 53.71 1h60 n ALA 58 Cb 0.45 -2.34 -0.16 0.00 0.00 0.00 0.00 19.45 17.40 1h60 n ALA 58 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1h60 s THR 59 N -0.34 0.95 0.25 0.00 2.01 0.12 -4.40 115.64 114.23 1h60 s THR 59 Ca 0.63 -0.42 -0.30 0.00 0.31 0.00 0.00 61.69 61.91 1h60 s THR 59 Cb -0.57 -0.86 -0.10 0.00 0.01 0.00 0.00 72.50 70.98 1h60 s THR 59 CO 0.53 0.30 1.45 -1.10 -0.69 0.00 0.00 174.62 175.11 1h60 s GLN 60 N 0.38 4.26 0.37 4.92 1.11 -0.04 -1.24 119.66 129.41 1h60 s GLN 60 Ca -0.07 2.32 0.25 0.00 0.01 0.00 0.00 55.36 57.86 1h60 s GLN 60 Cb -0.12 -3.11 0.56 0.00 -1.01 0.00 0.00 33.01 29.33 1h60 s GLN 60 CO 0.02 -0.44 1.68 -0.84 0.01 0.00 0.00 175.29 175.72 1h60 h ILE 61 N 3.55 0.00 -3.14 1.08 3.07 -1.84 -0.79 117.51 119.44 1h60 h ILE 61 Ca -0.46 -0.80 0.04 0.00 1.55 0.00 0.00 64.86 65.20 1h60 h ILE 61 Cb 1.22 1.79 -0.06 0.00 -0.27 0.00 0.00 36.82 39.50 1h60 h ILE 61 CO 0.78 0.00 0.16 -0.94 -1.05 0.00 0.00 178.15 177.10 1h60 s SER 62 N -5.63 -0.23 0.22 2.16 1.04 -1.26 -4.57 113.70 105.43 1h60 s SER 62 Ca 0.08 -0.67 -0.06 0.00 0.48 0.00 0.00 55.95 55.77 1h60 s SER 62 Cb 0.08 0.70 0.18 0.00 0.10 0.00 0.00 66.02 67.07 1h60 s SER 62 CO 0.63 -1.30 1.72 0.00 0.98 0.00 0.00 173.24 175.27 1h60 h ALA 63 N 2.05 0.98 -0.62 5.32 0.00 -1.98 -2.42 119.26 122.59 1h60 h ALA 63 Ca -0.21 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 54.55 1h60 h ALA 63 Cb 1.25 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1h60 h ALA 63 CO 0.26 0.64 0.42 0.37 0.00 0.00 0.00 179.25 180.93 1h60 h GLN 64 N 0.96 0.37 0.00 0.00 4.15 -1.96 -1.83 115.11 116.79 1h60 h GLN 64 Ca 0.19 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.59 1h60 h GLN 64 Cb 0.44 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.05 1h60 h GLN 64 CO 0.01 0.24 0.00 0.00 -1.93 0.00 0.00 178.83 177.16 1h60 h ALA 65 N 1.69 1.00 -2.75 3.38 0.00 -1.77 -3.45 119.26 117.35 1h60 h ALA 65 Ca 0.29 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.67 1h60 h ALA 65 Cb 0.63 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.48 1h60 h ALA 65 CO -0.08 0.00 0.79 0.21 0.00 0.00 0.00 179.25 180.17 1h60 s LYS 66 N -3.56 4.24 0.00 0.00 2.20 -0.69 -1.60 119.74 120.33 1h60 s LYS 66 Ca 0.01 2.36 0.00 0.00 -0.36 0.00 0.00 55.97 57.97 1h60 s LYS 66 Cb 0.09 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.31 1h60 s LYS 66 CO 0.37 -0.47 0.00 0.41 -0.36 0.00 0.00 175.35 175.30 1h60 n GLY 67 N 2.24 0.99 3.08 5.54 0.00 -1.26 -4.74 105.19 111.04 1h60 n GLY 67 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 1h60 n GLY 67 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1h60 s TYR 68 N -0.23 1.58 0.12 1.61 1.51 -1.26 -4.34 117.35 116.34 1h60 s TYR 68 Ca 0.00 -0.51 -0.31 0.00 -1.01 0.00 0.00 57.07 55.24 1h60 s TYR 68 Cb 0.00 -1.10 -0.08 0.00 -0.11 0.00 0.00 41.96 40.67 1h60 s TYR 68 CO 0.00 -0.22 1.39 0.00 -1.11 0.00 0.00 175.55 175.61 1h60 s ALA 69 N 0.31 3.59 0.00 3.71 0.00 0.01 -2.97 121.76 126.41 1h60 s ALA 69 Ca -0.09 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.00 1h60 s ALA 69 Cb -0.13 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1h60 s ALA 69 CO 0.03 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.59 1h60 n GLY 70 N 3.44 0.26 3.73 0.00 0.00 -1.26 -4.82 105.19 106.54 1h60 n GLY 70 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1h60 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h60 s ALA 71 N -2.08 3.27 0.65 4.61 0.00 -1.16 -0.97 121.76 126.07 1h60 s ALA 71 Ca 0.00 0.60 -0.11 0.00 0.00 0.00 0.00 51.96 52.44 1h60 s ALA 71 Cb 0.00 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.83 1h60 s ALA 71 CO 0.00 0.02 1.04 -1.25 0.00 0.00 0.00 175.76 175.57 1h60 s PRO 72 N -0.28 3.31 0.42 0.00 0.04 -1.26 -4.78 135.00 132.44 1h60 s PRO 72 Ca 0.46 0.88 0.07 0.00 0.04 0.00 0.00 61.00 62.45 1h60 s PRO 72 Cb -0.24 -2.04 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 1h60 s PRO 72 CO 0.31 -0.80 0.18 0.20 0.04 0.00 0.00 177.00 176.92 1h60 s GLY 73 N -3.86 2.35 -0.28 0.56 0.00 -0.79 -0.86 107.32 104.43 1h60 s GLY 73 Ca 0.57 -2.09 0.21 0.00 0.00 0.00 0.00 44.72 43.41 1h60 s GLY 73 CO 0.52 -1.92 1.06 -0.10 0.00 0.00 0.00 173.10 172.66 1h60 n LEU 74 N -1.24 1.62 0.00 0.66 7.94 -0.30 -4.75 117.00 120.92 1h60 n LEU 74 Ca -0.01 -3.30 0.00 0.00 -1.11 0.00 0.00 56.01 51.58 1h60 n LEU 74 Cb 0.65 0.44 0.00 0.00 0.53 0.00 0.00 43.42 45.04 1h60 n LEU 74 CO 0.46 1.24 -0.46 0.00 -1.11 0.00 0.00 177.39 177.52 1h60 n HIS 75 N -0.42 0.00 -4.13 1.96 1.44 -1.26 -4.65 115.22 108.16 1h60 n HIS 75 Ca 0.09 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.56 1h60 n HIS 75 Cb 0.81 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.87 1h60 n HIS 75 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 1h60 s SER 76 N -1.86 5.36 0.26 4.39 1.04 -1.26 -4.99 113.70 116.64 1h60 s SER 76 Ca 0.00 -0.26 -0.03 0.00 0.48 0.00 0.00 55.95 56.14 1h60 s SER 76 Cb 0.00 -1.33 0.40 0.00 0.10 0.00 0.00 66.02 65.20 1h60 s SER 76 CO 0.00 0.01 1.88 -0.65 0.98 0.00 0.00 173.24 175.46 1h60 h PRO 77 N 1.93 1.11 -0.77 4.02 0.11 -1.99 -0.33 132.00 136.07 1h60 h PRO 77 Ca -0.48 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 65.54 1h60 h PRO 77 Cb 1.22 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 32.05 1h60 h PRO 77 CO 0.61 0.73 0.39 0.93 -0.21 0.00 0.00 178.00 180.46 1h60 h GLU 78 N 1.14 1.10 -0.25 1.05 3.07 -1.96 -0.60 114.58 118.14 1h60 h GLU 78 Ca 0.43 -0.15 -0.05 0.00 -0.50 0.00 0.00 59.36 59.09 1h60 h GLU 78 Cb 0.18 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 1h60 h GLU 78 CO -0.18 0.84 -0.03 1.96 -1.40 0.00 0.00 179.01 180.21 1h60 h GLN 79 N 1.09 0.46 -0.64 2.33 4.20 -1.70 -2.35 115.11 118.49 1h60 h GLN 79 Ca 0.27 -0.16 0.06 0.00 0.06 0.00 0.00 58.65 58.88 1h60 h GLN 79 Cb 0.09 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.78 1h60 h GLN 79 CO -0.04 0.65 0.35 0.82 -0.67 0.00 0.00 178.83 179.94 1h60 h ILE 80 N 0.21 0.95 -0.23 2.54 2.04 -0.85 -0.40 117.51 121.78 1h60 h ILE 80 Ca 0.07 -0.22 -0.09 0.00 1.00 0.00 0.00 64.86 65.62 1h60 h ILE 80 Cb 0.47 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1h60 h ILE 80 CO 0.02 0.12 -0.25 0.00 0.00 0.00 0.00 178.15 178.04 1h60 h ALA 81 N 1.34 1.15 -0.26 1.87 0.00 -1.01 -1.06 119.26 121.29 1h60 h ALA 81 Ca 0.29 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1h60 h ALA 81 Cb 0.19 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1h60 h ALA 81 CO -0.19 0.54 -0.37 0.00 0.00 0.00 0.00 179.25 179.24 1h60 h ALA 82 N 1.36 0.39 -0.37 0.00 0.00 -0.96 -3.02 119.26 116.65 1h60 h ALA 82 Ca 0.06 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 1h60 h ALA 82 Cb 0.64 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1h60 h ALA 82 CO 0.05 0.46 0.01 -1.49 0.00 0.00 0.00 179.25 178.28 1h60 h TRP 83 N 0.43 0.61 -0.81 0.00 -0.00 -0.85 -1.91 115.95 113.42 1h60 h TRP 83 Ca 0.03 -0.06 0.08 0.00 -0.00 0.00 0.00 58.89 58.93 1h60 h TRP 83 Cb 0.95 -0.17 -0.05 0.00 -0.00 0.00 0.00 29.16 29.89 1h60 h TRP 83 CO 0.08 0.59 0.53 0.87 -0.00 0.00 0.00 178.44 180.51 1h60 h LYS 84 N 0.56 0.82 -0.21 0.49 1.57 -1.08 0.20 116.57 118.92 1h60 h LYS 84 Ca 0.12 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.71 1h60 h LYS 84 Cb 0.35 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1h60 h LYS 84 CO 0.01 0.54 -0.45 0.87 -0.57 0.00 0.00 179.45 179.85 1h60 h LYS 85 N 0.85 0.54 -0.26 3.15 1.57 -1.27 -1.37 116.57 119.78 1h60 h LYS 85 Ca 0.36 -0.30 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1h60 h LYS 85 Cb 0.30 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 1h60 h LYS 85 CO -0.13 0.89 -0.18 0.82 -0.57 0.00 0.00 179.45 180.28 1h60 h ILE 86 N 0.44 1.31 -0.16 1.86 2.04 -0.98 -1.60 117.51 120.42 1h60 h ILE 86 Ca 0.03 -1.30 -0.11 0.00 1.00 0.00 0.00 64.86 64.47 1h60 h ILE 86 Cb 0.96 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 1h60 h ILE 86 CO 0.09 0.41 -0.40 0.71 0.00 0.00 0.00 178.15 178.96 1h60 h THR 87 N 0.29 1.30 -0.62 -0.27 1.35 -1.00 -2.22 112.91 111.75 1h60 h THR 87 Ca 0.05 -1.52 -0.03 0.00 -0.55 0.00 0.00 66.41 64.36 1h60 h THR 87 Cb 0.71 1.62 -0.03 0.00 -1.73 0.00 0.00 68.15 68.72 1h60 h THR 87 CO 0.05 0.46 0.27 0.00 -0.25 0.00 0.00 175.52 176.05 1h60 h ALA 88 N 1.28 1.32 -0.44 6.62 0.00 -1.08 -0.93 119.26 126.02 1h60 h ALA 88 Ca 0.03 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1h60 h ALA 88 Cb 0.83 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1h60 h ALA 88 CO 0.07 0.52 0.10 0.78 0.00 0.00 0.00 179.25 180.72 1h60 h GLY 89 N 0.98 0.76 0.96 0.00 0.00 -0.90 -0.08 103.07 104.79 1h60 h GLY 89 Ca 0.21 -0.48 -0.04 0.00 0.00 0.00 0.00 47.33 47.02 1h60 h GLY 89 CO -0.02 0.45 0.13 -2.08 0.00 0.00 0.00 176.54 175.01 1h60 h VAL 90 N 0.58 1.23 -0.29 4.60 2.07 -1.09 -2.74 116.25 120.62 1h60 h VAL 90 Ca 0.14 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.81 1h60 h VAL 90 Cb 0.32 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1h60 h VAL 90 CO 0.00 0.28 -0.06 0.45 0.02 0.00 0.00 177.57 178.26 1h60 h HIS 91 N 0.63 0.48 0.00 1.57 3.86 -1.00 0.40 115.15 121.10 1h60 h HIS 91 Ca 0.15 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.28 1h60 h HIS 91 Cb 0.30 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.63 1h60 h HIS 91 CO 0.02 0.53 -0.09 0.00 0.86 0.00 0.00 177.93 179.25 1h60 h ALA 92 N 1.50 1.68 -0.59 2.45 0.00 -0.72 0.20 119.26 123.78 1h60 h ALA 92 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1h60 h ALA 92 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1h60 h ALA 92 CO 0.02 0.11 0.00 0.39 0.00 0.00 0.00 179.25 179.77 1h60 n GLU 93 N -4.18 3.28 -1.98 0.00 -0.58 -0.67 -4.93 120.64 111.58 1h60 n GLU 93 Ca -0.03 -2.52 -0.11 0.00 -0.42 0.00 0.00 57.16 54.09 1h60 n GLU 93 Cb 0.17 -1.78 -0.02 0.00 -0.57 0.00 0.00 31.44 29.25 1h60 n GLU 93 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1h60 n ASP 94 N 1.06 -3.78 -4.41 1.62 8.00 0.06 -4.81 116.55 114.30 1h60 n ASP 94 Ca 0.23 0.06 -0.17 0.00 0.71 0.00 0.00 54.79 55.62 1h60 n ASP 94 Cb 0.76 -2.82 0.06 0.00 -0.02 0.00 0.00 41.12 39.11 1h60 n ASP 94 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1h60 n GLY 95 N -1.17 1.75 3.11 0.44 0.00 0.04 -4.98 105.19 104.38 1h60 n GLY 95 Ca -0.13 -2.18 -0.24 0.00 0.00 0.00 0.00 46.02 43.48 1h60 n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h60 s ARG 96 N -4.27 1.41 -0.03 1.61 0.52 -1.26 -4.38 118.95 112.54 1h60 s ARG 96 Ca 0.52 -0.52 -0.01 0.00 -0.52 0.00 0.00 55.73 55.19 1h60 s ARG 96 Cb -0.04 -1.28 0.03 0.00 0.52 0.00 0.00 34.95 34.18 1h60 s ARG 96 CO 0.33 0.25 0.06 -1.50 0.02 0.00 0.00 175.30 174.46 1h60 s ILE 97 N -0.08 -0.05 -0.06 1.52 2.07 -1.26 -0.95 121.20 122.39 1h60 s ILE 97 Ca 0.00 0.18 -0.02 0.00 -1.41 0.00 0.00 60.65 59.40 1h60 s ILE 97 Cb -0.09 -0.12 -0.04 0.00 0.13 0.00 0.00 42.46 42.35 1h60 s ILE 97 CO 0.01 0.07 0.04 0.00 -1.91 0.00 0.00 174.94 173.15 1h60 s ALA 98 N 0.94 3.46 -0.22 1.50 0.00 0.27 -0.36 121.76 127.35 1h60 s ALA 98 Ca -0.08 -0.81 -0.12 0.00 0.00 0.00 0.00 51.96 50.95 1h60 s ALA 98 Cb -0.11 -1.57 -0.05 0.00 0.00 0.00 0.00 23.12 21.40 1h60 s ALA 98 CO -0.03 0.63 0.24 0.54 0.00 0.00 0.00 175.76 177.13 1h60 s VAL 99 N -1.01 5.31 -0.16 0.00 0.11 -0.67 0.18 120.40 124.17 1h60 s VAL 99 Ca 0.17 0.36 -0.24 0.00 -2.93 0.00 0.00 61.98 59.34 1h60 s VAL 99 Cb -0.12 -3.58 -0.02 0.00 -1.53 0.00 0.00 36.38 31.14 1h60 s VAL 99 CO 0.06 0.33 0.75 -1.58 -3.33 0.00 0.00 175.10 171.33 1h60 s GLN 100 N 1.04 4.29 -0.19 1.54 0.74 -1.25 -0.41 119.66 125.43 1h60 s GLN 100 Ca 0.12 0.88 -0.05 0.00 0.05 0.00 0.00 55.36 56.36 1h60 s GLN 100 Cb -0.14 -3.56 -0.02 0.00 1.10 0.00 0.00 33.01 30.39 1h60 s GLN 100 CO 0.05 -0.24 -0.01 -0.51 -0.55 0.00 0.00 175.29 174.02 1h60 s LEU 101 N 1.87 3.22 0.23 3.68 1.43 0.28 0.14 118.68 129.54 1h60 s LEU 101 Ca 0.35 -0.20 0.06 0.00 -1.03 0.00 0.00 54.13 53.31 1h60 s LEU 101 Cb -0.17 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.20 1h60 s LEU 101 CO 0.13 0.08 -0.08 -1.66 0.23 0.00 0.00 176.35 175.05 1h60 s TRP 102 N 0.88 1.71 -0.15 0.29 -2.14 -0.38 -0.75 118.94 118.40 1h60 s TRP 102 Ca 0.00 -0.72 0.01 0.00 2.66 0.00 0.00 56.10 58.06 1h60 s TRP 102 Cb -0.14 -0.91 0.02 0.00 -3.10 0.00 0.00 33.47 29.33 1h60 s TRP 102 CO 0.02 0.21 -0.18 -1.58 -2.66 0.00 0.00 176.95 172.76 1h60 s HIS 103 N -3.13 2.44 -0.63 1.66 2.46 -1.26 -2.60 115.29 114.23 1h60 s HIS 103 Ca 0.25 -1.36 0.26 0.00 0.47 0.00 0.00 55.06 54.68 1h60 s HIS 103 Cb 0.03 -1.73 0.82 0.00 -0.13 0.00 0.00 32.58 31.57 1h60 s HIS 103 CO 0.08 -0.69 1.76 1.79 -2.47 0.00 0.00 174.74 175.21 1h60 h THR 104 N 5.96 0.00 0.00 0.89 1.35 -1.61 0.05 112.91 119.56 1h60 h THR 104 Ca -0.39 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 64.99 1h60 h THR 104 Cb 1.15 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 68.99 1h60 h THR 104 CO 0.57 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.45 1h60 n GLY 105 N 0.98 3.31 0.00 5.82 0.00 -1.26 -1.82 105.19 112.22 1h60 n GLY 105 Ca 0.05 0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.18 1h60 n GLY 105 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1h60 n ARG 106 N 14.00 0.37 -2.94 1.61 1.85 -1.03 -4.03 116.66 126.49 1h60 n ARG 106 Ca 0.00 0.07 -0.44 0.00 -1.00 0.00 0.00 57.85 56.48 1h60 n ARG 106 Cb 0.00 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 29.91 1h60 n ARG 106 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1h60 n ILE 107 N -1.25 4.29 -3.63 8.89 2.08 -0.76 -4.50 119.36 124.48 1h60 n ILE 107 Ca 0.11 -4.76 -0.06 0.00 0.56 0.00 0.00 62.75 58.61 1h60 n ILE 107 Cb 0.17 -2.47 0.02 0.00 -0.75 0.00 0.00 39.64 36.61 1h60 n ILE 107 CO 0.00 0.00 0.00 -0.24 0.56 0.00 0.00 176.55 176.87 1h60 n SER 108 N 5.33 -1.62 -3.84 4.38 2.88 -1.26 -4.49 113.62 115.00 1h60 n SER 108 Ca 0.36 -2.08 -0.12 0.00 -1.33 0.00 0.00 58.87 55.71 1h60 n SER 108 Cb 0.42 2.69 -0.12 0.00 -0.75 0.00 0.00 64.21 66.45 1h60 n SER 108 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 1h60 s HIS 109 N -3.75 -0.11 0.53 0.66 2.46 -1.26 -1.73 115.29 112.08 1h60 s HIS 109 Ca 0.13 0.27 0.19 0.00 0.47 0.00 0.00 55.06 56.12 1h60 s HIS 109 Cb -0.03 0.03 1.32 0.00 -0.13 0.00 0.00 32.58 33.76 1h60 s HIS 109 CO 0.08 -0.11 2.12 0.66 -2.47 0.00 0.00 174.74 175.02 1h60 h SER 110 N 5.65 0.00 0.43 9.88 4.64 -1.88 -2.23 113.55 130.04 1h60 h SER 110 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1h60 h SER 110 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1h60 h SER 110 CO 0.42 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.84 1h60 n SER 111 N -4.48 0.25 -0.15 4.97 3.41 -1.26 -1.66 113.62 114.71 1h60 n SER 111 Ca -0.00 0.57 0.01 0.00 -0.26 0.00 0.00 58.87 59.20 1h60 n SER 111 Cb 0.21 -0.62 0.03 0.00 -0.26 0.00 0.00 64.21 63.57 1h60 n SER 111 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1h60 n ILE 112 N -1.79 0.73 -2.59 -1.33 -5.35 -0.84 -4.87 119.36 103.31 1h60 n ILE 112 Ca 0.02 -0.87 -0.30 0.00 -0.27 0.00 0.00 62.75 61.33 1h60 n ILE 112 Cb 0.14 0.65 -0.02 0.00 -1.74 0.00 0.00 39.64 38.67 1h60 n ILE 112 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1h60 s GLN 113 N -0.79 3.74 0.22 6.28 -1.52 -0.66 -4.89 119.66 122.04 1h60 s GLN 113 Ca 0.05 0.55 -0.32 0.00 -1.95 0.00 0.00 55.36 53.69 1h60 s GLN 113 Cb 0.03 -2.30 -0.13 0.00 -0.22 0.00 0.00 33.01 30.39 1h60 s GLN 113 CO 0.04 -0.18 1.53 -2.30 -0.25 0.00 0.00 175.29 174.12 1h60 n PRO 114 N -1.72 2.25 -0.91 2.91 -0.02 -1.26 -1.13 135.00 135.12 1h60 n PRO 114 Ca 0.03 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1h60 n PRO 114 Cb 0.54 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1h60 n PRO 114 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1h60 n GLY 115 N 2.75 0.54 2.31 -1.23 0.00 -1.26 -2.75 105.19 105.55 1h60 n GLY 115 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 1h60 n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h60 n GLY 116 N -1.89 0.49 4.00 -0.02 0.00 -0.28 -5.02 105.19 102.47 1h60 n GLY 116 Ca 0.00 -0.36 -0.20 0.00 0.00 0.00 0.00 46.02 45.45 1h60 n GLY 116 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h60 s GLN 117 N -4.01 2.38 0.50 1.61 -1.52 -1.11 -4.62 119.66 112.90 1h60 s GLN 117 Ca 0.00 -1.15 -0.23 0.00 -1.95 0.00 0.00 55.36 52.04 1h60 s GLN 117 Cb 0.00 -2.56 -0.06 0.00 -0.22 0.00 0.00 33.01 30.17 1h60 s GLN 117 CO 0.00 -0.79 1.30 0.00 -0.25 0.00 0.00 175.29 175.55 1h60 s ALA 118 N -2.72 2.92 0.98 6.09 0.00 -1.26 -4.35 121.76 123.43 1h60 s ALA 118 Ca 0.60 1.21 -0.12 0.00 0.00 0.00 0.00 51.96 53.64 1h60 s ALA 118 Cb -0.08 -3.50 0.18 0.00 0.00 0.00 0.00 23.12 19.71 1h60 s ALA 118 CO 0.38 -1.10 1.11 -1.25 0.00 0.00 0.00 175.76 174.90 1h60 s PRO 119 N -2.77 0.58 0.25 0.00 0.04 -1.26 -4.70 135.00 127.13 1h60 s PRO 119 Ca 0.67 0.42 0.09 0.00 0.04 0.00 0.00 61.00 62.23 1h60 s PRO 119 Cb -0.37 -1.76 -0.04 0.00 0.04 0.00 0.00 34.50 32.37 1h60 s PRO 119 CO 0.44 -2.61 -0.02 0.14 0.04 0.00 0.00 177.00 174.99 1h60 s VAL 120 N -3.06 3.43 0.25 -0.36 -7.23 -1.26 -0.43 120.40 111.74 1h60 s VAL 120 Ca 0.65 -1.84 -0.11 0.00 -1.81 0.00 0.00 61.98 58.88 1h60 s VAL 120 Cb -0.17 -2.80 0.04 0.00 0.56 0.00 0.00 36.38 34.00 1h60 s VAL 120 CO 0.56 -0.31 0.55 -0.24 -0.31 0.00 0.00 175.10 175.35 1h60 n SER 121 N -0.69 -1.51 0.02 4.85 2.88 -0.70 -2.45 113.62 116.00 1h60 n SER 121 Ca -0.07 -2.02 -0.03 0.00 -1.33 0.00 0.00 58.87 55.41 1h60 n SER 121 Cb 0.58 2.52 0.20 0.00 -0.75 0.00 0.00 64.21 66.76 1h60 n SER 121 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h60 h ALA 122 N 2.00 1.11 -2.45 -1.46 0.00 -1.86 0.45 119.26 117.04 1h60 h ALA 122 Ca -0.22 -0.34 -0.25 0.00 0.00 0.00 0.00 54.91 54.10 1h60 h ALA 122 Cb 0.83 -0.12 -0.15 0.00 0.00 0.00 0.00 17.79 18.35 1h60 h ALA 122 CO 0.28 0.55 -0.63 -1.12 0.00 0.00 0.00 179.25 178.34 1h60 s SER 123 N -6.81 0.54 -1.20 0.00 0.01 -1.25 -4.39 113.70 100.60 1h60 s SER 123 Ca -0.07 -1.31 -0.06 0.00 1.31 0.00 0.00 55.95 55.83 1h60 s SER 123 Cb 0.14 0.28 0.22 0.00 0.21 0.00 0.00 66.02 66.86 1h60 s SER 123 CO 0.79 -0.75 1.90 0.00 0.41 0.00 0.00 173.24 175.59 1h60 n ALA 124 N -0.26 5.82 -3.23 1.44 0.00 -1.26 -4.31 120.51 118.71 1h60 n ALA 124 Ca -0.02 -4.43 -0.29 0.00 0.00 0.00 0.00 53.44 48.70 1h60 n ALA 124 Cb 0.65 -2.64 -0.17 0.00 0.00 0.00 0.00 19.45 17.29 1h60 n ALA 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1h60 s LEU 125 N -2.00 1.94 0.48 0.00 1.43 -1.26 -4.86 118.68 114.41 1h60 s LEU 125 Ca 0.41 -0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 52.82 1h60 s LEU 125 Cb 0.12 -1.20 -0.07 0.00 0.03 0.00 0.00 46.19 45.08 1h60 s LEU 125 CO -0.02 0.13 1.18 0.21 0.23 0.00 0.00 176.35 178.08 1h60 s ASN 126 N 0.37 6.02 0.52 2.29 2.47 -1.26 -4.43 114.94 120.93 1h60 s ASN 126 Ca -0.15 2.34 0.30 0.00 0.42 0.00 0.00 52.86 55.77 1h60 s ASN 126 Cb -0.17 -2.60 1.29 0.00 -1.45 0.00 0.00 41.25 38.32 1h60 s ASN 126 CO 0.06 -1.02 1.97 0.00 -3.72 0.00 0.00 177.10 174.39 1h60 h ALA 127 N 1.89 1.05 -6.08 1.71 0.00 -1.85 -3.47 119.26 112.52 1h60 h ALA 127 Ca -0.50 -0.09 -0.44 0.00 0.00 0.00 0.00 54.91 53.89 1h60 h ALA 127 Cb 1.25 -0.02 0.05 0.00 0.00 0.00 0.00 17.79 19.08 1h60 h ALA 127 CO 0.59 0.12 -0.72 0.09 0.00 0.00 0.00 179.25 179.34 1h60 n ASN 128 N -3.28 -5.64 -0.86 0.00 3.02 -1.26 -4.86 115.26 102.38 1h60 n ASN 128 Ca -0.00 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.89 1h60 n ASN 128 Cb 0.32 -4.47 0.00 0.00 -0.61 0.00 0.00 39.78 35.02 1h60 n ASN 128 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1h60 n THR 129 N -4.86 0.00 -4.90 3.41 5.66 -1.26 -5.01 114.28 107.32 1h60 n THR 129 Ca 0.03 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.72 1h60 n THR 129 Cb 0.54 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.18 1h60 n THR 129 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1h60 s ARG 130 N -1.36 2.07 0.20 1.09 3.00 -1.26 -1.61 118.95 121.07 1h60 s ARG 130 Ca 0.00 -0.96 0.01 0.00 0.00 0.00 0.00 55.73 54.78 1h60 s ARG 130 Cb 0.00 -2.13 0.01 0.00 0.00 0.00 0.00 34.95 32.84 1h60 s ARG 130 CO 0.00 0.55 0.12 -2.37 0.00 0.00 0.00 175.30 173.60 1h60 n THR 131 N 1.92 0.00 -4.17 0.02 5.66 0.94 -4.89 114.28 113.76 1h60 n THR 131 Ca -0.16 -0.85 -0.32 0.00 -3.05 0.00 0.00 64.05 59.67 1h60 n THR 131 Cb 0.52 -0.20 -0.16 0.00 -1.55 0.00 0.00 70.33 68.94 1h60 n THR 131 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1h60 s SER 132 N -2.18 3.02 0.56 1.09 0.15 -1.26 -1.36 113.70 113.72 1h60 s SER 132 Ca 0.09 -0.61 0.07 0.00 0.70 0.00 0.00 55.95 56.21 1h60 s SER 132 Cb -0.01 -1.41 0.06 0.00 -1.71 0.00 0.00 66.02 62.96 1h60 s SER 132 CO 0.06 -0.00 0.58 -0.76 1.20 0.00 0.00 173.24 174.31 1h60 s LEU 133 N 1.27 2.89 -0.05 3.45 1.43 -0.00 -0.81 118.68 126.86 1h60 s LEU 133 Ca 0.03 -1.06 0.04 0.00 -1.03 0.00 0.00 54.13 52.11 1h60 s LEU 133 Cb -0.13 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.66 1h60 s LEU 133 CO -0.11 -1.21 -0.15 -0.13 0.23 0.00 0.00 176.35 174.98 1h60 s ARG 134 N -4.45 2.52 0.31 1.70 0.52 -1.26 -0.43 118.95 117.85 1h60 s ARG 134 Ca 0.47 -0.72 -0.04 0.00 -0.52 0.00 0.00 55.73 54.92 1h60 s ARG 134 Cb -0.04 -2.36 0.07 0.00 0.52 0.00 0.00 34.95 33.14 1h60 s ARG 134 CO 0.29 0.59 0.42 -0.40 0.02 0.00 0.00 175.30 176.22 1h60 n ASP 135 N 2.39 0.12 0.05 0.23 5.68 0.16 -4.85 116.55 120.32 1h60 n ASP 135 Ca -0.17 -1.20 0.07 0.00 -0.50 0.00 0.00 54.79 52.99 1h60 n ASP 135 Cb 0.52 -0.31 0.31 0.00 -1.14 0.00 0.00 41.12 40.50 1h60 n ASP 135 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1h60 n GLU 136 N -1.86 0.06 -0.23 0.11 0.00 -1.26 -1.08 120.64 116.37 1h60 n GLU 136 Ca 0.05 0.38 0.11 0.00 0.00 0.00 0.00 57.16 57.71 1h60 n GLU 136 Cb 0.19 -1.63 0.23 0.00 0.00 0.00 0.00 31.44 30.23 1h60 n GLU 136 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1h60 n ASN 137 N -1.74 3.50 0.00 -1.84 3.02 -1.26 -4.95 115.26 111.98 1h60 n ASN 137 Ca 0.02 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.60 1h60 n ASN 137 Cb 0.13 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 1h60 n ASN 137 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h60 n GLY 138 N 1.41 0.49 3.83 7.41 0.00 -0.24 -5.04 105.19 113.05 1h60 n GLY 138 Ca 0.20 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 1h60 n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1h60 s ASN 139 N -2.31 6.87 0.29 1.61 0.01 -1.26 -4.71 114.94 115.44 1h60 s ASN 139 Ca 0.00 1.05 -0.29 0.00 -0.71 0.00 0.00 52.86 52.91 1h60 s ASN 139 Cb 0.00 -2.28 -0.10 0.00 0.41 0.00 0.00 41.25 39.28 1h60 s ASN 139 CO 0.00 0.27 1.37 0.00 -1.51 0.00 0.00 177.10 177.23 1h60 s ALA 140 N -1.17 3.56 -0.01 0.60 0.00 -1.26 -0.67 121.76 122.81 1h60 s ALA 140 Ca 0.28 1.29 -0.08 0.00 0.00 0.00 0.00 51.96 53.46 1h60 s ALA 140 Cb -0.17 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 19.44 1h60 s ALA 140 CO 0.16 -0.70 0.16 0.96 0.00 0.00 0.00 175.76 176.34 1h60 s ILE 141 N -0.59 0.07 0.25 0.00 -4.36 0.43 -4.88 121.20 112.11 1h60 s ILE 141 Ca 0.54 -0.57 -0.24 0.00 -0.26 0.00 0.00 60.65 60.12 1h60 s ILE 141 Cb -0.41 -0.43 -0.09 0.00 1.25 0.00 0.00 42.46 42.79 1h60 s ILE 141 CO 0.49 -0.31 0.83 -0.13 0.24 0.00 0.00 174.94 176.05 1h60 s ARG 142 N -1.17 4.48 -0.05 0.37 3.00 -1.26 -0.82 118.95 123.50 1h60 s ARG 142 Ca -0.13 1.14 -0.04 0.00 0.00 0.00 0.00 55.73 56.70 1h60 s ARG 142 Cb -0.06 -2.95 0.01 0.00 0.00 0.00 0.00 34.95 31.95 1h60 s ARG 142 CO 0.02 0.39 0.13 0.54 0.00 0.00 0.00 175.30 176.37 1h60 s VAL 143 N -1.47 0.00 0.40 3.52 0.11 -0.46 -4.88 120.40 117.63 1h60 s VAL 143 Ca 0.44 -0.02 -0.27 0.00 -2.93 0.00 0.00 61.98 59.20 1h60 s VAL 143 Cb -0.19 -0.19 -0.10 0.00 -1.53 0.00 0.00 36.38 34.37 1h60 s VAL 143 CO 0.24 -0.01 1.45 -1.81 -3.33 0.00 0.00 175.10 171.64 1h60 s ASP 144 N 0.03 6.19 0.47 3.54 1.01 -1.26 -0.04 116.67 126.60 1h60 s ASP 144 Ca -0.00 2.98 -0.23 0.00 0.71 0.00 0.00 52.55 56.01 1h60 s ASP 144 Cb -0.01 -2.66 -0.07 0.00 1.01 0.00 0.00 42.92 41.19 1h60 s ASP 144 CO 0.00 -0.97 1.21 0.42 0.21 0.00 0.00 175.17 176.04 1h60 s THR 145 N -1.16 2.86 0.30 -1.27 -4.23 -0.63 -4.78 115.64 106.74 1h60 s THR 145 Ca 0.56 0.66 -0.27 0.00 -1.18 0.00 0.00 61.69 61.46 1h60 s THR 145 Cb -0.45 -3.34 -0.10 0.00 1.34 0.00 0.00 72.50 69.95 1h60 s THR 145 CO 0.60 0.00 0.96 -0.89 -0.54 0.00 0.00 174.62 174.75 1h60 s THR 146 N -1.47 4.11 0.16 3.99 2.01 -0.70 -4.84 115.64 118.89 1h60 s THR 146 Ca 0.64 1.85 -0.32 0.00 0.31 0.00 0.00 61.69 64.18 1h60 s THR 146 Cb -0.32 -4.07 -0.10 0.00 0.01 0.00 0.00 72.50 68.02 1h60 s THR 146 CO 0.38 0.24 1.56 -0.89 -0.69 0.00 0.00 174.62 175.23 1h60 s THR 147 N -1.48 2.66 0.63 -0.82 2.01 -1.26 -4.72 115.64 112.66 1h60 s THR 147 Ca 0.48 0.46 -0.08 0.00 0.31 0.00 0.00 61.69 62.86 1h60 s THR 147 Cb -0.21 -3.30 0.01 0.00 0.01 0.00 0.00 72.50 69.00 1h60 s THR 147 CO 0.27 0.03 0.98 -2.16 -0.69 0.00 0.00 174.62 173.05 1h60 s PRO 148 N 1.19 2.97 -0.04 4.92 0.04 -1.26 -4.52 135.00 138.29 1h60 s PRO 148 Ca 0.70 0.22 -0.14 0.00 0.04 0.00 0.00 61.00 61.82 1h60 s PRO 148 Cb -0.43 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.88 1h60 s PRO 148 CO 0.31 -0.79 0.38 0.50 0.04 0.00 0.00 177.00 177.44 1h60 s ARG 149 N -5.13 3.97 0.09 4.56 3.52 0.43 -4.40 118.95 121.99 1h60 s ARG 149 Ca 0.55 0.34 -0.31 0.00 -0.13 0.00 0.00 55.73 56.18 1h60 s ARG 149 Cb -0.11 -3.27 -0.07 0.00 -1.56 0.00 0.00 34.95 29.95 1h60 s ARG 149 CO 0.48 0.58 1.31 0.00 -0.81 0.00 0.00 175.30 176.87 1h60 s ALA 150 N -0.70 3.51 0.30 6.12 0.00 -1.26 -1.72 121.76 128.00 1h60 s ALA 150 Ca 0.22 1.00 -0.30 0.00 0.00 0.00 0.00 51.96 52.89 1h60 s ALA 150 Cb -0.16 -3.50 -0.12 0.00 0.00 0.00 0.00 23.12 19.34 1h60 s ALA 150 CO 0.11 -0.54 1.45 1.28 0.00 0.00 0.00 175.76 178.06 1h60 n LEU 151 N 3.96 3.80 -4.82 0.00 4.77 0.15 -4.89 117.00 119.97 1h60 n LEU 151 Ca 0.10 1.17 -0.33 0.00 -0.03 0.00 0.00 56.01 56.92 1h60 n LEU 151 Cb 0.44 -1.52 -0.04 0.00 -2.33 0.00 0.00 43.42 39.97 1h60 n LEU 151 CO 0.57 -0.21 0.69 -1.61 -1.33 0.00 0.00 177.39 175.50 1h60 s GLU 152 N -0.99 3.91 0.25 3.23 0.41 -1.26 -4.97 118.70 119.29 1h60 s GLU 152 Ca 0.62 1.16 -0.03 0.00 -0.41 0.00 0.00 54.97 56.31 1h60 s GLU 152 Cb -0.56 -2.12 0.51 0.00 -1.78 0.00 0.00 34.13 30.18 1h60 s GLU 152 CO 0.54 -0.31 1.71 1.25 -0.49 0.00 0.00 175.26 177.95 1h60 h LEU 153 N 1.35 0.20 0.00 1.80 6.46 -2.02 -0.45 115.31 122.64 1h60 h LEU 153 Ca -0.48 0.13 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 1h60 h LEU 153 Cb 1.20 0.13 0.00 0.00 -0.73 0.00 0.00 40.66 41.26 1h60 h LEU 153 CO 0.60 0.03 0.00 -0.90 -0.62 0.00 0.00 178.44 177.55 1h60 n ASP 154 N -5.06 0.00 0.03 1.25 5.68 -1.26 -2.15 116.55 115.04 1h60 n ASP 154 Ca 0.16 -0.92 0.12 0.00 -0.50 0.00 0.00 54.79 53.66 1h60 n ASP 154 Cb 0.48 -0.00 0.28 0.00 -1.14 0.00 0.00 41.12 40.74 1h60 n ASP 154 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1h60 n GLU 155 N -1.00 0.14 -0.08 0.11 1.02 -0.18 -4.41 120.64 116.23 1h60 n GLU 155 Ca 0.22 0.05 -0.13 0.00 -0.02 0.00 0.00 57.16 57.28 1h60 n GLU 155 Cb 0.10 -1.60 -0.05 0.00 -0.02 0.00 0.00 31.44 29.87 1h60 n GLU 155 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1h60 h ILE 156 N 0.00 1.31 -0.94 -3.67 5.03 -1.47 -2.85 117.51 114.93 1h60 h ILE 156 Ca 0.00 -1.41 0.16 0.00 -0.12 0.00 0.00 64.86 63.49 1h60 h ILE 156 Cb 0.62 1.65 -0.08 0.00 -3.03 0.00 0.00 36.82 35.98 1h60 h ILE 156 CO 0.00 0.44 0.60 -0.65 -0.68 0.00 0.00 178.15 177.86 1h60 h PRO 157 N 0.34 0.68 -0.87 2.37 0.11 -1.78 -0.80 132.00 132.04 1h60 h PRO 157 Ca 0.04 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.12 1h60 h PRO 157 Cb 0.81 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 31.72 1h60 h PRO 157 CO 0.06 0.45 0.57 0.78 -0.21 0.00 0.00 178.00 179.66 1h60 h GLY 158 N 0.70 1.23 0.85 -0.55 0.00 -1.76 -0.23 103.07 103.31 1h60 h GLY 158 Ca 0.49 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 47.33 1h60 h GLY 158 CO -0.25 0.45 0.04 -2.22 0.00 0.00 0.00 176.54 174.57 1h60 h ILE 159 N 1.18 1.22 -0.56 2.60 1.08 -1.02 -0.17 117.51 121.84 1h60 h ILE 159 Ca 0.32 -0.72 0.02 0.00 -0.39 0.00 0.00 64.86 64.09 1h60 h ILE 159 Cb -0.13 1.28 -0.03 0.00 -3.07 0.00 0.00 36.82 34.86 1h60 h ILE 159 CO -0.07 0.23 0.35 0.58 -0.69 0.00 0.00 178.15 178.55 1h60 h VAL 160 N 0.16 1.09 -0.56 1.67 2.07 -1.11 -1.89 116.25 117.69 1h60 h VAL 160 Ca 0.07 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 1h60 h VAL 160 Cb 0.30 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 1h60 h VAL 160 CO 0.00 0.13 0.25 -1.13 0.02 0.00 0.00 177.57 176.84 1h60 h ASN 161 N 0.71 0.71 -0.67 0.57 -1.24 -0.76 -0.26 115.58 114.63 1h60 h ASN 161 Ca 0.22 -0.07 -0.01 0.00 0.71 0.00 0.00 56.30 57.14 1h60 h ASN 161 Cb -0.02 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 38.82 1h60 h ASN 161 CO -0.08 0.62 0.36 0.44 -1.29 0.00 0.00 177.43 177.48 1h60 h ASP 162 N 0.79 0.84 -0.57 1.15 3.32 -0.27 0.85 116.42 122.52 1h60 h ASP 162 Ca 0.19 -0.10 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 1h60 h ASP 162 Cb 0.11 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1h60 h ASP 162 CO -0.02 0.70 0.18 -0.26 -1.72 0.00 0.00 179.24 178.11 1h60 h PHE 163 N 0.91 0.92 -0.34 4.55 0.04 -0.70 -0.60 116.94 121.73 1h60 h PHE 163 Ca 0.23 -0.09 0.01 0.00 2.80 0.00 0.00 57.97 60.92 1h60 h PHE 163 Cb 0.05 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 37.91 1h60 h PHE 163 CO -0.00 0.77 0.21 -0.09 -0.60 0.00 0.00 178.31 178.60 1h60 h ARG 164 N 0.80 0.42 -0.55 1.51 2.43 -0.52 -1.52 114.38 116.96 1h60 h ARG 164 Ca 0.18 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.30 1h60 h ARG 164 Cb 0.29 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1h60 h ARG 164 CO -0.01 0.28 0.25 0.37 -1.51 0.00 0.00 179.97 179.35 1h60 h GLN 165 N 0.43 0.80 -0.63 0.20 5.75 -0.76 -0.93 115.11 119.97 1h60 h GLN 165 Ca 0.13 -0.13 -0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1h60 h GLN 165 Cb -0.03 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.35 1h60 h GLN 165 CO -0.04 0.67 0.37 0.00 -2.65 0.00 0.00 178.83 177.19 1h60 h ALA 166 N 1.09 1.47 -0.49 3.38 0.00 -0.85 0.11 119.26 123.96 1h60 h ALA 166 Ca 0.19 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 1h60 h ALA 166 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1h60 h ALA 166 CO -0.02 0.46 -0.16 0.28 0.00 0.00 0.00 179.25 179.81 1h60 h VAL 167 N 0.87 1.27 -0.72 0.00 2.07 -0.73 0.11 116.25 119.13 1h60 h VAL 167 Ca 0.23 -1.31 0.10 0.00 0.82 0.00 0.00 66.70 66.54 1h60 h VAL 167 Cb -0.02 1.09 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1h60 h VAL 167 CO -0.04 0.45 0.35 0.00 0.02 0.00 0.00 177.57 178.36 1h60 h ALA 168 N 0.88 0.99 -0.67 1.67 0.00 -0.50 -1.08 119.26 120.55 1h60 h ALA 168 Ca 0.12 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1h60 h ALA 168 Cb 0.72 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1h60 h ALA 168 CO 0.06 -0.05 0.12 -0.91 0.00 0.00 0.00 179.25 178.46 1h60 h ASN 169 N 0.60 1.04 -0.82 0.00 2.35 -0.32 -2.27 115.58 116.16 1h60 h ASN 169 Ca 0.35 -0.24 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1h60 h ASN 169 Cb 0.38 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.44 1h60 h ASN 169 CO -0.27 1.02 0.38 0.00 -1.65 0.00 0.00 177.43 176.91 1h60 h ALA 170 N 1.10 1.13 0.07 -0.83 0.00 -0.18 0.77 119.26 121.32 1h60 h ALA 170 Ca 0.20 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1h60 h ALA 170 Cb 0.42 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1h60 h ALA 170 CO 0.01 0.65 -0.04 -0.09 0.00 0.00 0.00 179.25 179.79 1h60 h ARG 171 N 1.17 -0.10 -0.08 0.00 2.43 -0.95 -2.10 114.38 114.76 1h60 h ARG 171 Ca 0.28 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.44 1h60 h ARG 171 Cb 0.13 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1h60 h ARG 171 CO -0.03 0.00 -0.05 1.49 -1.51 0.00 0.00 179.97 179.87 1h60 h GLU 172 N -0.18 0.11 0.00 0.20 4.81 -1.01 -1.98 114.58 116.54 1h60 h GLU 172 Ca -0.01 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1h60 h GLU 172 Cb 0.15 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1h60 h GLU 172 CO 0.02 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.47 1h60 n ALA 173 N -2.51 2.39 -0.52 2.92 0.00 0.23 -4.88 120.51 118.13 1h60 n ALA 173 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1h60 n ALA 173 Cb 0.17 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1h60 n ALA 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h60 n GLY 174 N 0.99 0.71 3.75 0.00 0.00 -0.75 -3.79 105.19 106.11 1h60 n GLY 174 Ca 0.14 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 1h60 n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1h60 s PHE 175 N -2.00 2.40 -0.04 1.61 0.08 -0.84 -4.91 117.98 114.28 1h60 s PHE 175 Ca 0.00 1.54 0.12 0.00 0.12 0.00 0.00 56.93 58.71 1h60 s PHE 175 Cb 0.00 -3.39 -0.05 0.00 -0.57 0.00 0.00 43.02 39.00 1h60 s PHE 175 CO 0.00 -2.11 1.37 -0.44 -0.10 0.00 0.00 175.22 173.94 1h60 h ASP 176 N 0.53 0.00 -5.13 1.36 3.32 -1.04 -3.44 116.42 112.01 1h60 h ASP 176 Ca -0.49 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 1h60 h ASP 176 Cb 1.28 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.73 1h60 h ASP 176 CO 0.54 0.72 -0.04 -0.76 -1.72 0.00 0.00 179.24 177.98 1h60 s LEU 177 N -6.57 0.25 0.12 1.55 1.43 -1.23 -4.87 118.68 109.38 1h60 s LEU 177 Ca 0.03 -0.58 0.11 0.00 -1.03 0.00 0.00 54.13 52.65 1h60 s LEU 177 Cb 0.09 1.95 -0.04 0.00 0.03 0.00 0.00 46.19 48.22 1h60 s LEU 177 CO 0.78 -1.03 -0.27 -0.69 0.23 0.00 0.00 176.35 175.36 1h60 s VAL 178 N -3.90 2.25 -0.19 -1.59 1.01 -0.09 -1.66 120.40 116.22 1h60 s VAL 178 Ca 0.11 -1.73 0.01 0.00 0.00 0.00 0.00 61.98 60.38 1h60 s VAL 178 Cb -0.00 -1.99 0.03 0.00 0.00 0.00 0.00 36.38 34.42 1h60 s VAL 178 CO -0.01 0.12 -0.16 -0.70 0.00 0.00 0.00 175.10 174.34 1h60 s GLU 179 N -1.99 2.65 0.01 2.72 2.12 0.46 -0.12 118.70 124.55 1h60 s GLU 179 Ca 0.14 -0.91 -0.30 0.00 0.36 0.00 0.00 54.97 54.26 1h60 s GLU 179 Cb -0.10 -2.56 -0.05 0.00 0.26 0.00 0.00 34.13 31.68 1h60 s GLU 179 CO 0.06 -0.31 1.26 -0.51 -0.54 0.00 0.00 175.26 175.21 1h60 s LEU 180 N 1.29 4.33 -0.94 2.70 1.43 -0.35 -0.55 118.68 126.58 1h60 s LEU 180 Ca 0.01 1.99 -0.21 0.00 -1.03 0.00 0.00 54.13 54.90 1h60 s LEU 180 Cb -0.15 -3.57 0.10 0.00 0.03 0.00 0.00 46.19 42.60 1h60 s LEU 180 CO -0.11 -0.58 1.23 -2.28 0.23 0.00 0.00 176.35 174.85 1h60 s HIS 181 N 1.77 2.86 -0.35 0.29 2.46 0.07 -0.80 115.29 121.59 1h60 s HIS 181 Ca 0.59 -1.10 0.08 0.00 0.47 0.00 0.00 55.06 55.10 1h60 s HIS 181 Cb -0.29 -4.44 0.62 0.00 -0.13 0.00 0.00 32.58 28.34 1h60 s HIS 181 CO 0.26 -1.67 1.71 0.45 -2.47 0.00 0.00 174.74 173.01 1h60 n SER 182 N 7.53 3.51 -3.79 9.88 2.88 0.09 -4.55 113.62 129.16 1h60 n SER 182 Ca 0.25 -3.56 -0.24 0.00 -1.33 0.00 0.00 58.87 53.98 1h60 n SER 182 Cb 0.49 -0.73 -0.07 0.00 -0.75 0.00 0.00 64.21 63.16 1h60 n SER 182 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h60 n ALA 183 N -0.92 0.51 -2.35 -1.46 0.00 -1.13 -4.17 120.51 110.99 1h60 n ALA 183 Ca 0.44 -1.93 -0.16 0.00 0.00 0.00 0.00 53.44 51.79 1h60 n ALA 183 Cb 1.35 1.26 -0.01 0.00 0.00 0.00 0.00 19.45 22.05 1h60 n ALA 183 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1h60 n HIS 184 N -0.89 -1.15 -0.61 0.00 8.25 -1.26 -2.51 115.22 117.04 1h60 n HIS 184 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1h60 n HIS 184 Cb 0.57 -3.31 0.00 0.00 1.12 0.00 0.00 29.99 28.37 1h60 n HIS 184 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h60 n GLY 185 N -0.86 0.80 0.04 -1.41 0.00 -1.26 -4.70 105.19 97.80 1h60 n GLY 185 Ca -0.19 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.82 1h60 n GLY 185 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1h60 n TYR 186 N -2.03 -3.79 -0.07 1.61 4.01 -1.05 -4.47 117.16 111.38 1h60 n TYR 186 Ca 0.00 -0.01 -0.09 0.00 -0.16 0.00 0.00 57.90 57.64 1h60 n TYR 186 Cb 0.00 -0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 39.01 1h60 n TYR 186 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1h60 h LEU 187 N 0.00 0.18 -0.75 7.72 5.85 -1.08 0.20 115.31 127.43 1h60 h LEU 187 Ca -0.00 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 1h60 h LEU 187 Cb 0.01 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 1h60 h LEU 187 CO 0.00 0.14 0.45 -0.07 -0.34 0.00 0.00 178.44 178.62 1h60 h LEU 188 N 0.27 0.91 -0.95 2.25 3.38 -1.80 -1.37 115.31 118.00 1h60 h LEU 188 Ca 0.11 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 1h60 h LEU 188 Cb 0.04 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1h60 h LEU 188 CO -0.08 0.71 -0.27 -0.74 0.09 0.00 0.00 178.44 178.15 1h60 h HIS 189 N 1.03 0.51 -0.59 1.13 2.76 -1.54 -1.41 115.15 117.04 1h60 h HIS 189 Ca 0.27 -0.11 0.08 0.00 -2.20 0.00 0.00 60.37 58.41 1h60 h HIS 189 Cb -0.03 -0.12 -0.04 0.00 1.55 0.00 0.00 27.41 28.77 1h60 h HIS 189 CO -0.01 0.68 0.39 1.96 -1.30 0.00 0.00 177.93 179.66 1h60 h GLN 190 N 0.40 0.47 0.07 5.26 4.20 0.45 -0.73 115.11 125.23 1h60 h GLN 190 Ca 0.06 -0.03 -0.27 0.00 0.06 0.00 0.00 58.65 58.47 1h60 h GLN 190 Cb 0.68 -0.11 0.02 0.00 0.30 0.00 0.00 27.48 28.37 1h60 h GLN 190 CO 0.05 0.31 -1.13 0.74 -0.67 0.00 0.00 178.83 178.13 1h60 h PHE 191 N 0.48 0.89 -0.37 2.96 -1.00 -0.77 -3.30 116.94 115.82 1h60 h PHE 191 Ca 0.26 -0.53 -0.06 0.00 2.81 0.00 0.00 57.97 60.45 1h60 h PHE 191 Cb 0.41 -0.08 -0.02 0.00 3.61 0.00 0.00 35.95 39.87 1h60 h PHE 191 CO -0.00 1.37 -0.02 -0.07 -1.61 0.00 0.00 178.31 177.99 1h60 h LEU 192 N 0.28 0.56 -9.28 1.54 3.38 -0.30 -3.43 115.31 108.07 1h60 h LEU 192 Ca -0.15 -0.12 -0.58 0.00 0.09 0.00 0.00 57.88 57.12 1h60 h LEU 192 Cb 1.80 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 42.32 1h60 h LEU 192 CO 0.21 0.65 -0.07 -0.55 0.09 0.00 0.00 178.44 178.77 1h60 s SER 193 N -6.71 6.71 0.57 -0.43 0.15 -0.37 -4.82 113.70 108.80 1h60 s SER 193 Ca -0.08 0.85 0.26 0.00 0.70 0.00 0.00 55.95 57.68 1h60 s SER 193 Cb 0.15 -2.31 1.62 0.00 -1.71 0.00 0.00 66.02 63.77 1h60 s SER 193 CO 0.78 -0.07 2.15 -0.65 1.20 0.00 0.00 173.24 176.65 1h60 h PRO 194 N 6.92 0.00 0.00 5.44 0.11 -1.84 -2.12 132.00 140.51 1h60 h PRO 194 Ca -0.39 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.65 1h60 h PRO 194 Cb 1.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1h60 h PRO 194 CO 0.75 0.00 -0.32 0.66 -0.21 0.00 0.00 178.00 178.89 1h60 h SER 195 N 0.00 0.00 -0.08 -2.05 4.64 -1.92 -3.05 113.55 111.09 1h60 h SER 195 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1h60 h SER 195 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1h60 h SER 195 CO -0.00 0.32 0.00 -1.54 -0.87 0.00 0.00 176.83 174.73 1h60 n SER 196 N -4.05 1.95 -3.89 4.97 3.41 -0.90 -4.91 113.62 110.19 1h60 n SER 196 Ca -0.02 -1.53 -0.30 0.00 -0.26 0.00 0.00 58.87 56.77 1h60 n SER 196 Cb 0.37 -0.05 -0.16 0.00 -0.26 0.00 0.00 64.21 64.12 1h60 n SER 196 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1h60 s ASN 197 N -0.76 3.85 -0.19 4.04 3.84 -0.85 -3.94 114.94 120.93 1h60 s ASN 197 Ca 0.11 -1.30 0.15 0.00 0.21 0.00 0.00 52.86 52.04 1h60 s ASN 197 Cb 0.07 -1.10 0.41 0.00 -0.55 0.00 0.00 41.25 40.09 1h60 s ASN 197 CO 0.10 -0.29 1.29 0.00 -2.79 0.00 0.00 177.10 175.41 1h60 n GLN 198 N 4.71 1.84 -2.01 0.43 6.02 -1.26 -4.66 117.38 122.45 1h60 n GLN 198 Ca -0.08 -2.89 -0.36 0.00 -0.01 0.00 0.00 57.00 53.66 1h60 n GLN 198 Cb 0.44 -1.67 0.03 0.00 1.02 0.00 0.00 30.24 30.06 1h60 n GLN 198 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1h60 s ARG 199 N -3.00 2.98 -0.03 -1.09 0.52 -1.26 -4.95 118.95 112.12 1h60 s ARG 199 Ca 0.38 1.78 0.09 0.00 -0.52 0.00 0.00 55.73 57.45 1h60 s ARG 199 Cb 0.34 -1.94 0.23 0.00 0.52 0.00 0.00 34.95 34.10 1h60 s ARG 199 CO 0.02 -1.18 1.18 0.25 0.02 0.00 0.00 175.30 175.59 1h60 n THR 200 N -1.63 1.24 -2.46 0.02 -2.24 -1.26 -3.84 114.28 104.11 1h60 n THR 200 Ca 0.13 -1.22 0.00 0.00 -2.27 0.00 0.00 64.05 60.70 1h60 n THR 200 Cb 0.50 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 1h60 n THR 200 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1h60 n ASP 201 N -0.11 0.00 0.00 3.42 5.68 -1.26 -4.95 116.55 119.33 1h60 n ASP 201 Ca 0.09 -0.70 0.07 0.00 -0.50 0.00 0.00 54.79 53.76 1h60 n ASP 201 Cb 0.45 0.00 0.44 0.00 -1.14 0.00 0.00 41.12 40.87 1h60 n ASP 201 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1h60 n GLN 202 N -0.70 0.69 -0.26 0.11 0.00 -1.26 -2.52 117.38 113.44 1h60 n GLN 202 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 57.00 57.10 1h60 n GLN 202 Cb 0.00 -1.34 0.24 0.00 0.00 0.00 0.00 30.24 29.14 1h60 n GLN 202 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1h60 n TYR 203 N -0.84 0.67 -4.16 2.61 4.01 -1.26 -4.48 117.16 113.72 1h60 n TYR 203 Ca 0.11 -0.41 -0.10 0.00 -0.16 0.00 0.00 57.90 57.34 1h60 n TYR 203 Cb 0.05 -0.01 -0.10 0.00 -0.31 0.00 0.00 39.34 38.97 1h60 n TYR 203 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1h60 s GLY 204 N -1.11 1.00 0.00 2.72 0.00 -1.05 -4.20 107.32 104.67 1h60 s GLY 204 Ca 0.38 -1.48 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1h60 s GLY 204 CO 0.27 -1.38 0.00 0.61 0.00 0.00 0.00 173.10 172.61 1h60 n GLY 205 N -0.10 0.91 3.65 0.20 0.00 -1.25 -4.67 105.19 103.93 1h60 n GLY 205 Ca -0.06 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 1h60 n GLY 205 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1h60 s SER 206 N -4.00 2.76 0.35 1.61 1.04 -1.26 -4.72 113.70 109.47 1h60 s SER 206 Ca 0.00 2.00 0.03 0.00 0.48 0.00 0.00 55.95 58.46 1h60 s SER 206 Cb 0.00 -2.50 0.63 0.00 0.10 0.00 0.00 66.02 64.25 1h60 s SER 206 CO 0.00 -3.17 1.96 1.62 0.98 0.00 0.00 173.24 174.63 1h60 h VAL 207 N -1.91 1.17 -0.81 5.02 3.04 -1.96 0.96 116.25 121.76 1h60 h VAL 207 Ca -0.47 -0.46 0.01 0.00 -1.01 0.00 0.00 66.70 64.76 1h60 h VAL 207 Cb 1.28 0.50 -0.04 0.00 -2.01 0.00 0.00 31.29 31.02 1h60 h VAL 207 CO 0.45 0.19 0.53 -0.33 -1.01 0.00 0.00 177.57 177.40 1h60 h GLU 208 N 0.72 1.07 -0.23 4.17 3.07 -1.98 -0.18 114.58 121.22 1h60 h GLU 208 Ca 0.18 -0.07 -0.09 0.00 -0.50 0.00 0.00 59.36 58.88 1h60 h GLU 208 Cb 0.06 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 27.73 1h60 h GLU 208 CO -0.03 0.72 -0.20 -0.91 -1.40 0.00 0.00 179.01 177.19 1h60 h ASN 209 N 1.10 0.58 0.20 1.42 4.21 -1.60 -2.33 115.58 119.15 1h60 h ASN 209 Ca 0.29 -0.46 -0.06 0.00 1.21 0.00 0.00 56.30 57.29 1h60 h ASN 209 Cb -0.11 -0.16 -0.01 0.00 -1.12 0.00 0.00 38.32 36.92 1h60 h ASN 209 CO -0.06 0.92 -0.24 0.03 -1.29 0.00 0.00 177.43 176.79 1h60 h ARG 210 N 0.25 0.08 -0.01 0.81 3.08 -0.46 -2.23 114.38 115.90 1h60 h ARG 210 Ca 0.04 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1h60 h ARG 210 Cb 0.74 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.78 1h60 h ARG 210 CO 0.05 0.32 -0.20 0.00 -1.07 0.00 0.00 179.97 179.07 1h60 n ALA 211 N -2.49 2.96 -0.04 0.04 0.00 -0.11 -3.40 120.51 117.47 1h60 n ALA 211 Ca -0.02 -0.40 -0.09 0.00 0.00 0.00 0.00 53.44 52.93 1h60 n ALA 211 Cb 0.32 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.59 1h60 n ALA 211 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1h60 h ARG 212 N 1.39 0.02 0.12 0.00 2.43 -0.82 -1.70 114.38 115.83 1h60 h ARG 212 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1h60 h ARG 212 Cb 0.50 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1h60 h ARG 212 CO 0.00 0.01 -0.10 1.25 -1.51 0.00 0.00 179.97 179.62 1h60 h LEU 213 N 0.02 -0.26 -1.30 3.80 5.85 -1.77 -0.30 115.31 121.35 1h60 h LEU 213 Ca 0.09 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1h60 h LEU 213 Cb 0.14 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1h60 h LEU 213 CO -0.19 -0.16 0.35 1.62 -0.34 0.00 0.00 178.44 179.72 1h60 h VAL 214 N -0.23 1.18 -0.06 1.05 3.04 -1.81 -1.03 116.25 118.39 1h60 h VAL 214 Ca -0.00 -0.42 -0.19 0.00 -1.01 0.00 0.00 66.70 65.08 1h60 h VAL 214 Cb 0.21 0.35 -0.00 0.00 -2.01 0.00 0.00 31.29 29.83 1h60 h VAL 214 CO -0.01 0.19 -0.77 -0.07 -1.01 0.00 0.00 177.57 175.89 1h60 h LEU 215 N 0.84 0.46 -0.91 3.16 3.38 -1.04 0.01 115.31 121.20 1h60 h LEU 215 Ca 0.22 -0.32 0.09 0.00 0.09 0.00 0.00 57.88 57.96 1h60 h LEU 215 Cb -0.00 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.54 1h60 h LEU 215 CO -0.04 1.07 0.56 -0.33 0.09 0.00 0.00 178.44 179.79 1h60 h GLU 216 N 0.25 0.94 -0.12 1.13 5.08 -0.53 -0.32 114.58 121.00 1h60 h GLU 216 Ca -0.04 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1h60 h GLU 216 Cb 1.36 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 1h60 h GLU 216 CO 0.13 0.62 -0.02 0.28 -1.00 0.00 0.00 179.01 179.02 1h60 h VAL 217 N 0.96 1.28 -0.51 3.13 2.07 -0.68 -0.69 116.25 121.82 1h60 h VAL 217 Ca 0.42 -0.92 0.04 0.00 0.82 0.00 0.00 66.70 67.07 1h60 h VAL 217 Cb 0.31 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1h60 h VAL 217 CO -0.22 0.26 0.26 0.58 0.02 0.00 0.00 177.57 178.47 1h60 h VAL 218 N -0.08 0.96 -0.69 2.57 2.07 -0.79 -0.35 116.25 119.95 1h60 h VAL 218 Ca 0.03 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.33 1h60 h VAL 218 Cb 0.42 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.57 1h60 h VAL 218 CO 0.01 0.09 0.24 0.44 0.02 0.00 0.00 177.57 178.37 1h60 h ASP 219 N 0.50 0.98 -0.75 0.57 3.32 -0.90 -0.92 116.42 119.22 1h60 h ASP 219 Ca 0.23 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 1h60 h ASP 219 Cb 0.13 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 1h60 h ASP 219 CO -0.16 0.91 0.28 0.00 -1.72 0.00 0.00 179.24 178.55 1h60 h ALA 220 N 1.11 1.07 0.00 3.45 0.00 -0.57 -1.10 119.26 123.21 1h60 h ALA 220 Ca 0.22 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 1h60 h ALA 220 Cb 0.26 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1h60 h ALA 220 CO -0.01 0.65 -0.88 -0.39 0.00 0.00 0.00 179.25 178.62 1h60 h VAL 221 N 1.11 1.56 -0.50 0.00 -1.51 -0.92 -0.34 116.25 115.65 1h60 h VAL 221 Ca 0.25 -3.09 -0.09 0.00 -1.23 0.00 0.00 66.70 62.54 1h60 h VAL 221 Cb 0.24 2.69 -0.02 0.00 -2.13 0.00 0.00 31.29 32.07 1h60 h VAL 221 CO -0.02 0.86 -0.05 0.00 -1.23 0.00 0.00 177.57 177.13 1h60 h ASN 223 N 0.81 0.57 -0.22 0.00 -0.73 -1.08 -3.09 115.58 111.83 1h60 h ASN 223 Ca 0.14 -0.27 -0.03 0.00 1.87 0.00 0.00 56.30 58.01 1h60 h ASN 223 Cb 0.55 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 38.97 1h60 h ASN 223 CO 0.03 0.95 0.02 -0.08 -0.37 0.00 0.00 177.43 177.98 1h60 h GLU 224 N 0.43 0.38 0.00 6.67 4.57 -0.76 -3.44 114.58 122.43 1h60 h GLU 224 Ca 0.03 -0.11 0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1h60 h GLU 224 Cb 0.96 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.51 1h60 h GLU 224 CO 0.09 0.54 0.00 1.87 -1.18 0.00 0.00 179.01 180.33 1h60 n TRP 225 N -4.69 0.00 -3.66 0.92 -0.00 -0.65 -4.97 117.44 104.39 1h60 n TRP 225 Ca -0.04 0.00 -0.14 0.00 -0.00 0.00 0.00 57.50 57.32 1h60 n TRP 225 Cb 0.21 0.00 -0.08 0.00 -0.00 0.00 0.00 31.31 31.44 1h60 n TRP 225 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1h60 s SER 226 N 0.53 -0.54 0.42 5.87 0.15 -1.17 -4.95 113.70 114.02 1h60 s SER 226 Ca 0.00 0.87 0.12 0.00 0.70 0.00 0.00 55.95 57.64 1h60 s SER 226 Cb 0.00 0.88 0.97 0.00 -1.71 0.00 0.00 66.02 66.16 1h60 s SER 226 CO 0.00 -0.32 1.98 0.00 1.20 0.00 0.00 173.24 176.10 1h60 h ALA 227 N 4.56 1.94 0.00 5.45 0.00 -1.88 -0.28 119.26 129.05 1h60 h ALA 227 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1h60 h ALA 227 Cb 1.17 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1h60 h ALA 227 CO 0.24 -0.07 0.00 -0.40 0.00 0.00 0.00 179.25 179.02 1h60 n ASP 228 N -4.48 0.00 -0.21 0.00 5.75 -1.26 -1.98 116.55 114.37 1h60 n ASP 228 Ca 0.10 -1.14 0.08 0.00 -0.01 0.00 0.00 54.79 53.82 1h60 n ASP 228 Cb 0.33 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.38 1h60 n ASP 228 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1h60 n ARG 229 N -0.76 1.63 -4.09 0.11 5.12 -0.12 -1.34 116.66 117.22 1h60 n ARG 229 Ca 0.09 -0.46 -0.35 0.00 -1.93 0.00 0.00 57.85 55.21 1h60 n ARG 229 Cb 0.04 -1.29 -0.12 0.00 -1.16 0.00 0.00 32.46 29.94 1h60 n ARG 229 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1h60 s ILE 230 N -2.24 4.20 0.33 0.55 -1.09 -0.85 -0.91 121.20 121.19 1h60 s ILE 230 Ca 0.10 -0.23 0.09 0.00 -2.23 0.00 0.00 60.65 58.38 1h60 s ILE 230 Cb 0.13 -2.90 -0.05 0.00 -1.58 0.00 0.00 42.46 38.06 1h60 s ILE 230 CO 0.54 0.44 0.00 -0.83 -1.23 0.00 0.00 174.94 173.85 1h60 s GLY 231 N 0.80 2.03 0.00 6.18 0.00 0.83 -0.61 107.32 116.55 1h60 s GLY 231 Ca 0.01 -1.94 0.00 0.00 0.00 0.00 0.00 44.72 42.80 1h60 s GLY 231 CO 0.02 -1.89 -0.01 -1.50 0.00 0.00 0.00 173.10 169.72 1h60 s ILE 232 N -2.51 0.05 -0.18 0.90 2.07 -0.87 -1.22 121.20 119.45 1h60 s ILE 232 Ca 0.34 -0.11 -0.05 0.00 -1.41 0.00 0.00 60.65 59.42 1h60 s ILE 232 Cb -0.01 -0.07 -0.03 0.00 0.13 0.00 0.00 42.46 42.49 1h60 s ILE 232 CO 0.19 -0.04 -0.01 -0.60 -1.91 0.00 0.00 174.94 172.58 1h60 s ARG 233 N -0.16 3.70 0.19 3.50 3.52 0.02 -0.71 118.95 129.03 1h60 s ARG 233 Ca -0.01 -0.49 0.08 0.00 -0.13 0.00 0.00 55.73 55.18 1h60 s ARG 233 Cb -0.01 -3.02 -0.04 0.00 -1.56 0.00 0.00 34.95 30.31 1h60 s ARG 233 CO -0.00 0.17 -0.16 0.14 -0.81 0.00 0.00 175.30 174.64 1h60 s VAL 234 N 0.58 1.81 -0.42 7.11 -7.23 -0.33 -0.73 120.40 121.19 1h60 s VAL 234 Ca -0.01 -2.11 0.09 0.00 -1.81 0.00 0.00 61.98 58.14 1h60 s VAL 234 Cb -0.14 -1.97 0.28 0.00 0.56 0.00 0.00 36.38 35.10 1h60 s VAL 234 CO 0.02 -0.47 0.61 -1.54 -0.31 0.00 0.00 175.10 173.41 1h60 n SER 235 N -0.13 0.87 -0.65 4.85 3.41 -1.26 -0.97 113.62 119.74 1h60 n SER 235 Ca -0.10 -2.89 0.12 0.00 -0.26 0.00 0.00 58.87 55.74 1h60 n SER 235 Cb 0.59 -0.63 0.37 0.00 -0.26 0.00 0.00 64.21 64.27 1h60 n SER 235 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1h60 n PRO 236 N 1.00 1.87 -4.26 4.33 -0.04 -1.26 -4.74 135.00 131.89 1h60 n PRO 236 Ca 0.23 -1.29 -0.26 0.00 -0.04 0.00 0.00 63.50 62.15 1h60 n PRO 236 Cb 0.55 -1.44 -0.17 0.00 -0.04 0.00 0.00 33.50 32.40 1h60 n PRO 236 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1h60 s ILE 237 N -1.82 1.08 0.00 0.52 -1.09 -1.26 -4.76 121.20 113.87 1h60 s ILE 237 Ca 0.34 -0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.37 1h60 s ILE 237 Cb 0.19 -1.04 0.00 0.00 -1.58 0.00 0.00 42.46 40.03 1h60 s ILE 237 CO 0.29 0.36 0.00 0.61 -1.23 0.00 0.00 174.94 174.97 1h60 n GLY 238 N 4.33 -2.41 3.27 6.18 0.00 -1.26 -4.84 105.19 110.45 1h60 n GLY 238 Ca -0.18 -2.07 -0.32 0.00 0.00 0.00 0.00 46.02 43.45 1h60 n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1h60 s THR 239 N -0.27 2.07 -0.10 2.61 2.01 -1.26 -3.39 115.64 117.30 1h60 s THR 239 Ca 0.00 -1.06 -0.01 0.00 0.31 0.00 0.00 61.69 60.93 1h60 s THR 239 Cb 0.00 -1.75 0.03 0.00 0.01 0.00 0.00 72.50 70.79 1h60 s THR 239 CO 0.00 0.57 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.12 1h60 s PHE 240 N -0.12 0.94 -1.36 4.92 0.40 -0.02 -4.44 117.98 118.30 1h60 s PHE 240 Ca -0.05 -0.42 -0.15 0.00 -0.60 0.00 0.00 56.93 55.72 1h60 s PHE 240 Cb -0.14 -0.95 0.01 0.00 0.51 0.00 0.00 43.02 42.45 1h60 s PHE 240 CO 0.04 -0.42 0.41 1.04 0.70 0.00 0.00 175.22 176.99 1h60 n GLN 241 N 5.08 -1.18 -0.82 0.44 6.02 -1.26 -0.21 117.38 125.45 1h60 n GLN 241 Ca -0.09 0.19 0.00 0.00 -0.01 0.00 0.00 57.00 57.09 1h60 n GLN 241 Cb 0.50 -3.46 0.00 0.00 1.02 0.00 0.00 30.24 28.29 1h60 n GLN 241 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1h60 n ASN 242 N -2.63 -1.12 -4.42 1.08 3.02 -1.26 -4.92 115.26 105.01 1h60 n ASN 242 Ca -0.22 0.00 -0.38 0.00 -0.03 0.00 0.00 54.58 53.95 1h60 n ASN 242 Cb 0.64 -1.40 -0.12 0.00 -0.61 0.00 0.00 39.78 38.29 1h60 n ASN 242 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1h60 s VAL 243 N -2.29 4.43 0.20 2.41 -7.23 0.71 -5.01 120.40 113.62 1h60 s VAL 243 Ca 0.00 -0.48 -0.00 0.00 -1.81 0.00 0.00 61.98 59.69 1h60 s VAL 243 Cb 0.00 -3.26 0.04 0.00 0.56 0.00 0.00 36.38 33.72 1h60 s VAL 243 CO 0.00 0.08 0.27 -0.90 -0.31 0.00 0.00 175.10 174.24 1h60 n ASP 244 N 4.95 0.33 -0.50 4.85 5.68 -1.26 -0.84 116.55 129.77 1h60 n ASP 244 Ca -0.14 -1.29 0.07 0.00 -0.50 0.00 0.00 54.79 52.93 1h60 n ASP 244 Cb 0.49 -0.18 0.19 0.00 -1.14 0.00 0.00 41.12 40.48 1h60 n ASP 244 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1h60 n ASN 245 N -2.99 2.72 0.00 -1.12 3.02 -1.22 -4.71 115.26 110.95 1h60 n ASN 245 Ca 0.04 -3.26 0.00 0.00 -0.03 0.00 0.00 54.58 51.34 1h60 n ASN 245 Cb 0.16 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 38.83 1h60 n ASN 245 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1h60 n GLY 246 N -1.10 -1.22 0.00 7.41 0.00 -1.26 -3.97 105.19 105.05 1h60 n GLY 246 Ca 0.20 -1.61 0.15 0.00 0.00 0.00 0.00 46.02 44.76 1h60 n GLY 246 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h60 n PRO 247 N -1.46 0.78 -2.57 1.61 -0.04 -1.26 -3.43 135.00 128.63 1h60 n PRO 247 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 1h60 n PRO 247 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 1h60 n PRO 247 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1h60 n ASN 248 N -1.10 2.79 -0.23 3.54 4.13 -1.26 -4.93 115.26 118.19 1h60 n ASN 248 Ca 0.20 -3.05 -0.04 0.00 1.68 0.00 0.00 54.58 53.37 1h60 n ASN 248 Cb 0.15 -0.49 0.13 0.00 -1.54 0.00 0.00 39.78 38.03 1h60 n ASN 248 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 1h60 h GLU 249 N 2.76 1.05 -0.06 3.52 4.11 -1.68 -1.26 114.58 123.02 1h60 h GLU 249 Ca 0.06 -0.18 -0.01 0.00 0.07 0.00 0.00 59.36 59.30 1h60 h GLU 249 Cb 1.13 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 1h60 h GLU 249 CO 0.60 0.86 -0.02 1.49 0.07 0.00 0.00 179.01 182.01 1h60 h GLU 250 N 1.03 0.12 -0.70 1.06 4.81 -1.90 -0.09 114.58 118.90 1h60 h GLU 250 Ca 0.24 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.44 1h60 h GLU 250 Cb 0.20 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 1h60 h GLU 250 CO -0.02 0.47 0.45 0.00 -0.73 0.00 0.00 179.01 179.18 1h60 h ALA 251 N 0.65 0.90 -0.55 2.92 0.00 -1.94 -2.00 119.26 119.25 1h60 h ALA 251 Ca 0.01 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1h60 h ALA 251 Cb 0.42 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1h60 h ALA 251 CO 0.01 0.27 0.10 -0.44 0.00 0.00 0.00 179.25 179.18 1h60 h ASP 252 N 0.91 0.81 -0.47 0.00 3.32 -1.19 -1.06 116.42 118.74 1h60 h ASP 252 Ca 0.27 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 1h60 h ASP 252 Cb -0.05 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 1h60 h ASP 252 CO -0.08 0.82 0.17 0.00 -1.72 0.00 0.00 179.24 178.43 1h60 h ALA 253 N 1.28 0.61 -0.24 3.45 0.00 -0.66 -2.01 119.26 121.70 1h60 h ALA 253 Ca 0.17 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1h60 h ALA 253 Cb 0.35 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1h60 h ALA 253 CO 0.01 0.25 -0.34 -0.07 0.00 0.00 0.00 179.25 179.09 1h60 h LEU 254 N 0.62 0.54 0.19 0.00 3.38 -0.95 -0.59 115.31 118.50 1h60 h LEU 254 Ca 0.15 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.92 1h60 h LEU 254 Cb 0.24 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1h60 h LEU 254 CO -0.01 0.85 -0.34 0.22 0.09 0.00 0.00 178.44 179.25 1h60 h TYR 255 N 0.45 -0.92 -0.63 1.13 3.20 -1.08 -0.38 116.97 118.73 1h60 h TYR 255 Ca 0.05 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.00 1h60 h TYR 255 Cb 0.81 0.38 -0.06 0.00 1.54 0.00 0.00 36.73 39.40 1h60 h TYR 255 CO 0.03 -0.46 0.33 1.25 -1.64 0.00 0.00 178.16 177.67 1h60 h LEU 256 N -0.61 0.47 -0.52 2.82 6.46 -1.04 -1.14 115.31 121.74 1h60 h LEU 256 Ca 0.01 0.04 -0.14 0.00 -0.12 0.00 0.00 57.88 57.67 1h60 h LEU 256 Cb 0.61 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.48 1h60 h LEU 256 CO -0.15 0.30 -0.32 0.40 -0.62 0.00 0.00 178.44 178.05 1h60 h ILE 257 N 0.61 1.28 -0.81 4.05 2.04 -0.97 0.63 117.51 124.34 1h60 h ILE 257 Ca 0.29 -1.48 0.03 0.00 1.00 0.00 0.00 64.86 64.69 1h60 h ILE 257 Cb 0.21 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 37.56 1h60 h ILE 257 CO -0.19 0.49 0.52 -0.33 0.00 0.00 0.00 178.15 178.64 1h60 h GLU 258 N 0.71 1.00 -0.50 2.37 5.08 -0.64 -0.00 114.58 122.60 1h60 h GLU 258 Ca 0.07 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 1h60 h GLU 258 Cb 0.88 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1h60 h GLU 258 CO 0.08 0.66 0.10 0.93 -1.00 0.00 0.00 179.01 179.77 1h60 h GLU 259 N 1.03 0.82 -0.93 2.33 4.39 -0.57 -2.45 114.58 119.20 1h60 h GLU 259 Ca 0.32 -0.21 0.01 0.00 0.34 0.00 0.00 59.36 59.81 1h60 h GLU 259 Cb -0.01 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 28.49 1h60 h GLU 259 CO -0.10 0.81 0.60 -0.07 -1.16 0.00 0.00 179.01 179.09 1h60 h LEU 260 N 0.70 1.08 -1.45 1.33 3.38 -0.59 -2.18 115.31 117.58 1h60 h LEU 260 Ca 0.15 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1h60 h LEU 260 Cb 0.38 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1h60 h LEU 260 CO 0.01 0.79 -0.05 0.00 0.09 0.00 0.00 178.44 179.28 1h60 h ALA 261 N 1.40 1.55 -0.07 1.53 0.00 -0.53 -0.66 119.26 122.48 1h60 h ALA 261 Ca 0.34 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1h60 h ALA 261 Cb -0.13 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1h60 h ALA 261 CO -0.07 0.33 0.08 0.87 0.00 0.00 0.00 179.25 180.46 1h60 h LYS 262 N 0.29 0.00 -0.00 0.00 1.57 -1.08 -1.35 116.57 116.00 1h60 h LYS 262 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1h60 h LYS 262 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1h60 h LYS 262 CO 0.01 0.00 -0.31 0.54 -0.57 0.00 0.00 179.45 179.12 1h60 n ARG 263 N -3.74 0.48 -3.36 3.15 3.00 -0.25 -4.96 116.66 110.97 1h60 n ARG 263 Ca -0.01 -0.26 -0.23 0.00 -0.01 0.00 0.00 57.85 57.35 1h60 n ARG 263 Cb 0.18 -1.49 0.06 0.00 0.00 0.00 0.00 32.46 31.21 1h60 n ARG 263 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1h60 n GLY 264 N 1.40 -0.48 3.79 -0.13 0.00 -0.51 -4.84 105.19 104.42 1h60 n GLY 264 Ca 0.10 0.18 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 1h60 n GLY 264 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1h60 s ILE 265 N -3.26 2.43 0.14 -0.61 -4.36 -1.26 -4.36 121.20 109.92 1h60 s ILE 265 Ca 0.47 0.14 -0.11 0.00 -0.26 0.00 0.00 60.65 60.89 1h60 s ILE 265 Cb -0.21 -2.87 -0.03 0.00 1.25 0.00 0.00 42.46 40.60 1h60 s ILE 265 CO 0.59 -0.18 1.49 0.00 0.24 0.00 0.00 174.94 177.08 1h60 h ALA 266 N -1.35 0.58 -2.95 2.27 0.00 -0.21 -3.42 119.26 114.18 1h60 h ALA 266 Ca -0.49 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 53.98 1h60 h ALA 266 Cb 1.31 -0.13 -0.11 0.00 0.00 0.00 0.00 17.79 18.85 1h60 h ALA 266 CO 0.61 0.63 0.16 1.52 0.00 0.00 0.00 179.25 182.16 1h60 s TYR 267 N -4.50 -0.41 -0.19 0.00 -0.85 -1.20 -1.92 117.35 108.28 1h60 s TYR 267 Ca -0.11 0.14 0.01 0.00 -0.52 0.00 0.00 57.07 56.59 1h60 s TYR 267 Cb 0.11 0.52 0.03 0.00 0.38 0.00 0.00 41.96 43.00 1h60 s TYR 267 CO 0.87 -0.89 -0.17 -1.17 -1.52 0.00 0.00 175.55 172.67 1h60 s LEU 268 N -2.79 2.37 -0.33 -3.49 2.96 0.05 -2.06 118.68 115.39 1h60 s LEU 268 Ca 0.03 -0.80 -0.08 0.00 -0.22 0.00 0.00 54.13 53.06 1h60 s LEU 268 Cb -0.01 -1.45 0.02 0.00 0.50 0.00 0.00 46.19 45.25 1h60 s LEU 268 CO -0.09 -0.05 0.13 -2.28 -1.32 0.00 0.00 176.35 172.74 1h60 s HIS 269 N 1.28 3.21 -0.42 5.38 5.65 0.12 -0.68 115.29 129.82 1h60 s HIS 269 Ca 0.02 -1.08 -0.18 0.00 0.25 0.00 0.00 55.06 54.06 1h60 s HIS 269 Cb -0.15 -2.33 0.02 0.00 -1.18 0.00 0.00 32.58 28.95 1h60 s HIS 269 CO -0.11 -0.64 0.48 -1.64 -0.65 0.00 0.00 174.74 172.18 1h60 s MET 270 N 1.49 3.15 -0.48 2.88 1.00 0.45 -1.19 119.30 126.60 1h60 s MET 270 Ca 0.01 -0.67 -0.26 0.00 0.00 0.00 0.00 55.69 54.77 1h60 s MET 270 Cb -0.19 -3.96 0.03 0.00 0.00 0.00 0.00 34.83 30.72 1h60 s MET 270 CO 0.04 -0.88 0.98 0.45 0.00 0.00 0.00 175.02 175.61 1h60 s SER 271 N 1.85 6.51 0.08 3.03 0.15 -0.14 -1.76 113.70 123.41 1h60 s SER 271 Ca 0.14 0.14 0.11 0.00 0.70 0.00 0.00 55.95 57.04 1h60 s SER 271 Cb -0.16 -2.47 -0.17 0.00 -1.71 0.00 0.00 66.02 61.50 1h60 s SER 271 CO 0.15 -1.12 1.03 -0.33 1.20 0.00 0.00 173.24 174.17 1h60 h GLU 272 N 9.15 0.00 -3.89 5.44 5.08 -1.38 -3.40 114.58 125.58 1h60 h GLU 272 Ca -0.24 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.01 1h60 h GLU 272 Cb 1.07 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.17 1h60 h GLU 272 CO 1.06 0.68 -0.49 0.95 -1.00 0.00 0.00 179.01 180.20 1h60 s THR 273 N -2.73 0.16 0.86 1.13 -4.23 -1.26 -4.87 115.64 104.70 1h60 s THR 273 Ca -0.01 -1.29 -0.12 0.00 -1.18 0.00 0.00 61.69 59.09 1h60 s THR 273 Cb 0.09 -1.21 0.11 0.00 1.34 0.00 0.00 72.50 72.82 1h60 s THR 273 CO 0.81 -0.71 1.13 -0.62 -0.54 0.00 0.00 174.62 174.69 1h60 s ASP 274 N -2.59 3.97 0.42 3.99 -1.08 -1.25 -4.90 116.67 115.23 1h60 s ASP 274 Ca 0.02 1.06 0.09 0.00 -0.52 0.00 0.00 52.55 53.20 1h60 s ASP 274 Cb 0.03 -1.69 0.91 0.00 -1.46 0.00 0.00 42.92 40.71 1h60 s ASP 274 CO -0.08 -2.27 2.03 -0.07 0.52 0.00 0.00 175.17 175.30 1h60 h LEU 275 N -1.30 0.32 0.00 -1.34 3.38 -2.02 -3.40 115.31 110.95 1h60 h LEU 275 Ca -0.49 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1h60 h LEU 275 Cb 1.31 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1h60 h LEU 275 CO 0.62 0.30 0.00 0.00 0.09 0.00 0.00 178.44 179.44 1h60 n ALA 276 N -2.49 0.00 -1.45 1.53 0.00 -1.26 -5.01 120.51 111.84 1h60 n ALA 276 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1h60 n ALA 276 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1h60 n ALA 276 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h60 n GLY 277 N 4.58 -0.18 3.51 0.00 0.00 -1.26 -5.03 105.19 106.81 1h60 n GLY 277 Ca 0.00 -1.78 -0.16 0.00 0.00 0.00 0.00 46.02 44.09 1h60 n GLY 277 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h60 s GLY 278 N -2.06 -0.54 0.34 -0.02 0.00 -1.26 -3.95 107.32 99.81 1h60 s GLY 278 Ca 0.00 1.28 -0.28 0.00 0.00 0.00 0.00 44.72 45.72 1h60 s GLY 278 CO 0.00 0.83 1.23 0.54 0.00 0.00 0.00 173.10 175.70 1h60 s LYS 279 N -1.62 4.35 0.57 2.90 1.02 -1.26 -4.95 119.74 120.74 1h60 s LYS 279 Ca -0.08 2.04 -0.19 0.00 0.02 0.00 0.00 55.97 57.77 1h60 s LYS 279 Cb -0.00 -3.01 -0.05 0.00 -0.52 0.00 0.00 37.83 34.25 1h60 s LYS 279 CO 0.05 -0.13 1.15 -1.25 -0.92 0.00 0.00 175.35 174.25 1h60 s PRO 280 N -1.82 3.21 0.37 -1.68 0.04 -1.26 -4.97 135.00 128.89 1h60 s PRO 280 Ca 0.50 1.65 -0.27 0.00 0.04 0.00 0.00 61.00 62.92 1h60 s PRO 280 Cb -0.36 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.11 1h60 s PRO 280 CO 0.47 -0.97 1.24 0.71 0.04 0.00 0.00 177.00 178.49 1h60 s TYR 281 N -1.76 3.02 0.51 0.56 1.51 -1.26 -5.01 117.35 114.92 1h60 s TYR 281 Ca 0.74 1.48 -0.17 0.00 -1.01 0.00 0.00 57.07 58.11 1h60 s TYR 281 Cb -0.25 -3.55 -0.08 0.00 -0.11 0.00 0.00 41.96 37.96 1h60 s TYR 281 CO 0.30 -1.66 0.99 -1.54 -1.11 0.00 0.00 175.55 172.52 1h60 s SER 282 N -0.81 6.61 0.31 2.29 1.04 -1.26 -4.95 113.70 116.94 1h60 s SER 282 Ca 0.54 1.58 0.02 0.00 0.48 0.00 0.00 55.95 58.57 1h60 s SER 282 Cb -0.36 -2.51 0.51 0.00 0.10 0.00 0.00 66.02 63.76 1h60 s SER 282 CO 0.46 -0.59 1.83 -0.33 0.98 0.00 0.00 173.24 175.59 1h60 h GLU 283 N 0.93 0.61 -0.67 4.02 5.08 -1.99 -1.62 114.58 120.93 1h60 h GLU 283 Ca -0.47 -0.14 0.04 0.00 -1.00 0.00 0.00 59.36 57.78 1h60 h GLU 283 Cb 1.19 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.31 1h60 h GLU 283 CO 0.61 0.64 0.41 0.00 -1.00 0.00 0.00 179.01 179.67 1h60 h ALA 284 N 1.42 0.88 -0.36 3.43 0.00 -1.99 -0.31 119.26 122.31 1h60 h ALA 284 Ca 0.12 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1h60 h ALA 284 Cb 0.38 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1h60 h ALA 284 CO 0.01 0.15 0.03 0.35 0.00 0.00 0.00 179.25 179.79 1h60 h PHE 285 N 0.79 0.67 -0.96 0.00 3.57 -1.78 -1.63 116.94 117.60 1h60 h PHE 285 Ca 0.28 -0.11 0.16 0.00 3.53 0.00 0.00 57.97 61.83 1h60 h PHE 285 Cb 0.05 -0.18 -0.09 0.00 2.79 0.00 0.00 35.95 38.53 1h60 h PHE 285 CO -0.05 0.70 0.61 0.00 -2.23 0.00 0.00 178.31 177.34 1h60 h ARG 286 N 0.45 0.76 -0.61 1.11 3.08 -0.80 0.33 114.38 118.70 1h60 h ARG 286 Ca 0.11 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 1h60 h ARG 286 Cb 0.42 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1h60 h ARG 286 CO 0.01 0.50 0.08 1.96 -1.07 0.00 0.00 179.97 181.46 1h60 h GLN 287 N 0.78 1.00 -0.28 0.04 1.08 -0.41 0.43 115.11 117.76 1h60 h GLN 287 Ca 0.51 -0.26 -0.12 0.00 -1.45 0.00 0.00 58.65 57.32 1h60 h GLN 287 Cb 0.75 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 28.05 1h60 h GLN 287 CO -0.28 0.93 -0.34 0.87 -0.95 0.00 0.00 178.83 179.07 1h60 h LYS 288 N 0.94 0.60 -0.05 1.46 1.57 -0.25 -1.85 116.57 118.99 1h60 h LYS 288 Ca 0.19 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 1h60 h LYS 288 Cb 0.43 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1h60 h LYS 288 CO 0.01 0.86 -0.02 0.28 -0.57 0.00 0.00 179.45 180.01 1h60 h VAL 289 N 0.51 1.32 -0.96 0.50 2.07 -0.77 -3.16 116.25 115.76 1h60 h VAL 289 Ca 0.06 -1.01 0.08 0.00 0.82 0.00 0.00 66.70 66.65 1h60 h VAL 289 Cb 0.83 1.89 -0.07 0.00 -1.52 0.00 0.00 31.29 32.42 1h60 h VAL 289 CO 0.07 0.28 0.62 -0.09 0.02 0.00 0.00 177.57 178.47 1h60 h ARG 290 N -0.27 1.02 0.00 1.57 9.65 -0.67 -0.83 114.38 124.85 1h60 h ARG 290 Ca 0.01 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1h60 h ARG 290 Cb 0.45 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 28.80 1h60 h ARG 290 CO 0.01 0.68 0.00 -0.85 2.80 0.00 0.00 179.97 182.60 1h60 n GLU 291 N -4.53 0.24 0.00 0.20 0.28 -0.72 -3.19 120.64 112.93 1h60 n GLU 291 Ca 0.16 0.04 0.09 0.00 -0.16 0.00 0.00 57.16 57.29 1h60 n GLU 291 Cb 0.25 -1.50 -0.05 0.00 1.43 0.00 0.00 31.44 31.57 1h60 n GLU 291 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1h60 n ARG 292 N -1.36 1.43 -4.42 3.44 1.74 -0.33 -4.95 116.66 112.21 1h60 n ARG 292 Ca 0.10 -0.43 -0.24 0.00 -0.77 0.00 0.00 57.85 56.52 1h60 n ARG 292 Cb 0.24 -1.33 -0.17 0.00 -1.02 0.00 0.00 32.46 30.19 1h60 n ARG 292 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1h60 s PHE 293 N -2.36 1.28 -0.67 -1.55 5.36 -1.13 -4.54 117.98 114.37 1h60 s PHE 293 Ca 0.11 -0.47 0.15 0.00 -0.96 0.00 0.00 56.93 55.75 1h60 s PHE 293 Cb 0.14 -0.98 0.50 0.00 -0.34 0.00 0.00 43.02 42.34 1h60 s PHE 293 CO 0.59 -0.28 1.42 0.72 -1.46 0.00 0.00 175.22 176.21 1h60 n HIS 294 N 3.98 0.93 -3.03 10.12 8.25 -1.26 -4.88 115.22 129.33 1h60 n HIS 294 Ca -0.22 -0.68 0.00 0.00 -0.26 0.00 0.00 57.72 56.56 1h60 n HIS 294 Cb 0.51 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1h60 n HIS 294 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1h60 n GLY 295 N 0.27 3.70 3.76 -1.41 0.00 -1.26 -5.09 105.19 105.15 1h60 n GLY 295 Ca 0.19 -2.11 -0.41 0.00 0.00 0.00 0.00 46.02 43.69 1h60 n GLY 295 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h60 s VAL 296 N 0.70 3.27 -0.15 1.61 1.01 -0.81 -4.88 120.40 121.15 1h60 s VAL 296 Ca 0.00 1.22 -0.01 0.00 0.00 0.00 0.00 61.98 63.19 1h60 s VAL 296 Cb 0.00 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1h60 s VAL 296 CO 0.00 0.27 -0.10 -0.63 0.00 0.00 0.00 175.10 174.64 1h60 s ILE 297 N -0.90 3.24 -0.17 2.22 1.01 -1.26 -0.77 121.20 124.58 1h60 s ILE 297 Ca 0.48 -0.58 -0.03 0.00 0.00 0.00 0.00 60.65 60.52 1h60 s ILE 297 Cb -0.35 -2.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.71 1h60 s ILE 297 CO 0.43 0.50 -0.06 -0.63 0.00 0.00 0.00 174.94 175.19 1h60 s ILE 298 N 0.59 3.59 -0.02 2.92 1.01 0.14 -0.84 121.20 128.59 1h60 s ILE 298 Ca -0.06 -0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 1h60 s ILE 298 Cb -0.15 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.69 1h60 s ILE 298 CO 0.03 0.48 0.32 -0.83 0.00 0.00 0.00 174.94 174.93 1h60 s GLY 299 N 0.65 2.34 0.02 6.18 0.00 -0.41 -0.41 107.32 115.68 1h60 s GLY 299 Ca -0.03 -0.41 -0.14 0.00 0.00 0.00 0.00 44.72 44.14 1h60 s GLY 299 CO 0.02 -0.12 0.29 0.00 0.00 0.00 0.00 173.10 173.30 1h60 s ALA 300 N -1.14 -0.70 0.00 3.20 0.00 -0.72 -1.15 121.76 121.25 1h60 s ALA 300 Ca 0.23 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.32 1h60 s ALA 300 Cb -0.15 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.18 1h60 s ALA 300 CO 0.12 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1h60 n GLY 301 N 0.92 1.61 3.69 0.00 0.00 -1.26 -1.00 105.19 109.15 1h60 n GLY 301 Ca -0.20 -0.47 -0.28 0.00 0.00 0.00 0.00 46.02 45.07 1h60 n GLY 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h60 n ALA 302 N 0.00 -1.22 -1.77 4.61 0.00 -1.26 -4.79 120.51 116.09 1h60 n ALA 302 Ca 0.00 0.23 -0.39 0.00 0.00 0.00 0.00 53.44 53.28 1h60 n ALA 302 Cb 0.00 -4.37 -0.05 0.00 0.00 0.00 0.00 19.45 15.03 1h60 n ALA 302 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1h60 s TYR 303 N -3.24 3.63 0.37 0.00 1.51 -1.26 -5.06 117.35 113.31 1h60 s TYR 303 Ca 0.58 1.76 -0.00 0.00 -1.01 0.00 0.00 57.07 58.40 1h60 s TYR 303 Cb -0.28 -3.11 -0.03 0.00 -0.11 0.00 0.00 41.96 38.43 1h60 s TYR 303 CO 0.72 -0.18 0.59 0.95 -1.11 0.00 0.00 175.55 176.51 1h60 s THR 304 N -1.36 4.97 0.32 -0.71 -4.23 -1.26 -5.01 115.64 108.36 1h60 s THR 304 Ca 0.48 -0.39 0.05 0.00 -1.18 0.00 0.00 61.69 60.64 1h60 s THR 304 Cb -0.26 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.06 1h60 s THR 304 CO 0.33 -0.57 1.88 0.00 -0.54 0.00 0.00 174.62 175.71 1h60 h ALA 305 N 0.65 1.66 -0.54 3.99 0.00 -1.99 -0.98 119.26 122.05 1h60 h ALA 305 Ca -0.49 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.36 1h60 h ALA 305 Cb 1.22 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1h60 h ALA 305 CO 0.61 0.14 0.09 0.93 0.00 0.00 0.00 179.25 181.01 1h60 h GLU 306 N 0.87 0.89 -0.36 0.00 3.07 -1.99 0.17 114.58 117.23 1h60 h GLU 306 Ca 0.44 -0.24 -0.06 0.00 -0.50 0.00 0.00 59.36 59.00 1h60 h GLU 306 Cb 0.49 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.28 1h60 h GLU 306 CO -0.20 0.87 0.01 -0.22 -1.40 0.00 0.00 179.01 178.07 1h60 h LYS 307 N 0.78 0.63 -0.53 2.33 3.64 -1.84 0.12 116.57 121.71 1h60 h LYS 307 Ca 0.16 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1h60 h LYS 307 Cb 0.41 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.14 1h60 h LYS 307 CO 0.01 0.74 0.29 0.00 -2.27 0.00 0.00 179.45 178.21 1h60 h ALA 308 N 0.87 0.68 -0.68 5.00 0.00 -0.98 -0.80 119.26 123.35 1h60 h ALA 308 Ca 0.10 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1h60 h ALA 308 Cb 0.44 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1h60 h ALA 308 CO 0.02 0.20 0.14 0.93 0.00 0.00 0.00 179.25 180.54 1h60 h GLU 309 N 0.71 1.11 -0.12 0.00 4.39 -0.74 -0.37 114.58 119.55 1h60 h GLU 309 Ca 0.19 -0.28 0.04 0.00 0.34 0.00 0.00 59.36 59.65 1h60 h GLU 309 Cb 0.05 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.52 1h60 h GLU 309 CO -0.03 1.00 -0.16 0.22 -1.16 0.00 0.00 179.01 178.88 1h60 h ASP 310 N 1.04 -0.49 0.43 1.42 3.58 -0.25 0.21 116.42 122.37 1h60 h ASP 310 Ca 0.21 0.09 -0.24 0.00 0.42 0.00 0.00 57.03 57.51 1h60 h ASP 310 Cb 0.40 0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.68 1h60 h ASP 310 CO 0.01 -0.20 -1.04 -0.07 -2.88 0.00 0.00 179.24 175.05 1h60 h LEU 311 N -0.20 0.50 -0.66 2.28 3.38 -1.09 -1.40 115.31 118.13 1h60 h LEU 311 Ca 0.09 -0.44 -0.08 0.00 0.09 0.00 0.00 57.88 57.54 1h60 h LEU 311 Cb 0.33 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1h60 h LEU 311 CO -0.24 1.27 0.12 0.40 0.09 0.00 0.00 178.44 180.07 1h60 h ILE 312 N 0.18 1.26 0.00 1.22 2.04 -1.04 -2.07 117.51 119.10 1h60 h ILE 312 Ca -0.10 -1.02 -0.05 0.00 1.00 0.00 0.00 64.86 64.70 1h60 h ILE 312 Cb 1.71 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1h60 h ILE 312 CO 0.18 0.38 -0.21 1.23 0.00 0.00 0.00 178.15 179.72 1h60 h GLY 313 N 1.00 0.00 1.94 5.37 0.00 -0.74 -1.24 103.07 109.41 1h60 h GLY 313 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1h60 h GLY 313 CO 0.01 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.83 1h60 n LYS 314 N -3.99 0.06 -1.34 4.80 5.02 -0.55 -4.91 118.16 117.25 1h60 n LYS 314 Ca -0.02 0.04 -0.07 0.00 -2.02 0.00 0.00 58.31 56.24 1h60 n LYS 314 Cb 0.29 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.78 1h60 n LYS 314 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1h60 n GLY 315 N 1.21 0.83 0.08 0.72 0.00 -0.47 -4.94 105.19 102.63 1h60 n GLY 315 Ca 0.07 -0.69 -0.06 0.00 0.00 0.00 0.00 46.02 45.34 1h60 n GLY 315 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1h60 h LEU 316 N 0.00 0.00 -8.17 0.99 3.38 -1.60 -3.48 115.31 106.44 1h60 h LEU 316 Ca -0.16 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.69 1h60 h LEU 316 Cb 0.57 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.18 1h60 h LEU 316 CO 0.22 0.90 -0.50 0.27 0.09 0.00 0.00 178.44 179.43 1h60 s ILE 317 N -2.71 0.12 -0.09 1.22 -4.36 -1.22 -4.74 121.20 109.42 1h60 s ILE 317 Ca -0.01 -1.59 0.12 0.00 -0.26 0.00 0.00 60.65 58.91 1h60 s ILE 317 Cb 0.09 -1.76 -0.18 0.00 1.25 0.00 0.00 42.46 41.86 1h60 s ILE 317 CO 0.81 -0.54 0.14 0.47 0.24 0.00 0.00 174.94 176.06 1h60 n ASP 318 N -0.09 1.79 -3.91 4.36 8.00 -0.02 -4.20 116.55 122.48 1h60 n ASP 318 Ca -0.09 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.31 1h60 n ASP 318 Cb 0.63 1.11 -0.06 0.00 -0.02 0.00 0.00 41.12 42.78 1h60 n ASP 318 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h60 s ALA 319 N -2.54 -0.32 -0.02 2.24 0.00 -1.03 -4.87 121.76 115.22 1h60 s ALA 319 Ca -0.06 -0.71 0.05 0.00 0.00 0.00 0.00 51.96 51.24 1h60 s ALA 319 Cb 0.06 0.93 -0.01 0.00 0.00 0.00 0.00 23.12 24.09 1h60 s ALA 319 CO 0.55 -0.75 -0.17 0.54 0.00 0.00 0.00 175.76 175.93 1h60 s VAL 320 N -3.96 1.34 -0.24 0.00 0.11 -0.69 -1.29 120.40 115.67 1h60 s VAL 320 Ca 0.17 -0.70 -0.08 0.00 -2.93 0.00 0.00 61.98 58.43 1h60 s VAL 320 Cb 0.01 -1.13 -0.04 0.00 -1.53 0.00 0.00 36.38 33.69 1h60 s VAL 320 CO 0.02 0.38 0.10 0.00 -3.33 0.00 0.00 175.10 172.28 1h60 s ALA 321 N -0.23 3.33 -0.11 1.54 0.00 -0.30 -1.23 121.76 124.76 1h60 s ALA 321 Ca 0.03 -1.02 -0.11 0.00 0.00 0.00 0.00 51.96 50.85 1h60 s ALA 321 Cb -0.08 -2.15 -0.05 0.00 0.00 0.00 0.00 23.12 20.84 1h60 s ALA 321 CO 0.00 -0.33 0.25 -0.06 0.00 0.00 0.00 175.76 175.62 1h60 s PHE 322 N 1.33 3.57 0.00 0.00 0.08 -0.48 -4.38 117.98 118.11 1h60 s PHE 322 Ca 0.06 0.65 0.00 0.00 0.12 0.00 0.00 56.93 57.76 1h60 s PHE 322 Cb -0.15 -2.17 0.00 0.00 -0.57 0.00 0.00 43.02 40.13 1h60 s PHE 322 CO 0.05 0.52 0.00 0.41 -0.10 0.00 0.00 175.22 176.10 1h60 n GLY 323 N 2.52 -0.26 0.29 4.36 0.00 -1.26 -1.11 105.19 109.73 1h60 n GLY 323 Ca -0.16 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.88 1h60 n GLY 323 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1h60 h ARG 324 N 0.00 0.54 -0.11 1.61 3.08 -1.97 0.16 114.38 117.69 1h60 h ARG 324 Ca 0.00 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 59.99 1h60 h ARG 324 Cb 0.00 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1h60 h ARG 324 CO 0.00 0.45 0.08 -0.44 -1.07 0.00 0.00 179.97 178.99 1h60 h ASP 325 N 0.54 0.09 0.67 7.04 3.32 -1.98 -2.04 116.42 124.06 1h60 h ASP 325 Ca 0.13 -0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.97 1h60 h ASP 325 Cb 0.12 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1h60 h ASP 325 CO -0.01 0.07 -0.93 1.88 -1.72 0.00 0.00 179.24 178.52 1h60 h TYR 326 N 0.11 0.25 -0.37 4.55 0.05 -0.93 -1.34 116.97 119.29 1h60 h TYR 326 Ca 0.04 -0.15 0.06 0.00 0.05 0.00 0.00 58.73 58.74 1h60 h TYR 326 Cb 0.04 -0.02 -0.06 0.00 1.01 0.00 0.00 36.73 37.70 1h60 h TYR 326 CO -0.00 1.00 0.02 0.82 -1.05 0.00 0.00 178.16 178.95 1h60 h ILE 327 N 0.08 0.74 -0.00 -2.88 2.04 -0.57 -3.14 117.51 113.78 1h60 h ILE 327 Ca -0.05 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1h60 h ILE 327 Cb 1.59 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.28 1h60 h ILE 327 CO 0.14 0.02 -0.39 0.00 0.00 0.00 0.00 178.15 177.93 1h60 n ALA 328 N -2.50 3.27 -3.46 1.87 0.00 -0.87 -4.70 120.51 114.11 1h60 n ALA 328 Ca 0.02 -0.29 -0.26 0.00 0.00 0.00 0.00 53.44 52.91 1h60 n ALA 328 Cb 0.19 -1.20 -0.12 0.00 0.00 0.00 0.00 19.45 18.32 1h60 n ALA 328 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1h60 s ASN 329 N -3.00 2.70 0.31 0.00 0.01 -0.51 -4.42 114.94 110.04 1h60 s ASN 329 Ca 0.12 -1.70 0.00 0.00 -0.71 0.00 0.00 52.86 50.57 1h60 s ASN 329 Cb 0.18 -0.14 0.51 0.00 0.41 0.00 0.00 41.25 42.21 1h60 s ASN 329 CO 0.66 -0.34 1.92 1.55 -1.51 0.00 0.00 177.10 179.37 1h60 h PRO 330 N 7.53 0.84 -1.44 -0.60 0.13 -1.82 -1.34 132.00 135.30 1h60 h PRO 330 Ca -0.03 -0.11 -0.62 0.00 -0.87 0.00 0.00 66.00 64.37 1h60 h PRO 330 Cb 1.00 -0.16 -0.25 0.00 0.13 0.00 0.00 31.00 31.73 1h60 h PRO 330 CO 0.31 0.65 0.80 -0.40 -0.23 0.00 0.00 178.00 179.13 1h60 n ASP 331 N -4.36 7.34 -0.26 1.44 5.75 -1.26 -4.30 116.55 120.90 1h60 n ASP 331 Ca 0.05 -3.62 0.13 0.00 -0.01 0.00 0.00 54.79 51.34 1h60 n ASP 331 Cb 0.13 -1.04 0.40 0.00 -1.03 0.00 0.00 41.12 39.58 1h60 n ASP 331 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1h60 h LEU 332 N 2.54 0.61 0.13 -2.12 5.85 -1.58 -1.31 115.31 119.43 1h60 h LEU 332 Ca 0.52 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.29 1h60 h LEU 332 Cb 0.62 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 1h60 h LEU 332 CO 1.35 0.30 -0.13 0.58 -0.34 0.00 0.00 178.44 180.19 1h60 h VAL 333 N 0.64 0.70 -0.93 1.05 2.07 -1.87 0.63 116.25 118.54 1h60 h VAL 333 Ca 0.45 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.97 1h60 h VAL 333 Cb 0.79 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 31.21 1h60 h VAL 333 CO -0.20 0.00 0.59 0.00 0.02 0.00 0.00 177.57 177.98 1h60 h ALA 334 N 0.56 1.19 -0.52 1.67 0.00 -1.72 0.01 119.26 120.45 1h60 h ALA 334 Ca 0.01 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1h60 h ALA 334 Cb 0.28 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1h60 h ALA 334 CO -0.04 0.62 0.14 0.00 0.00 0.00 0.00 179.25 179.96 1h60 h ARG 335 N 1.28 0.82 -0.12 0.00 3.08 -0.79 -1.24 114.38 117.42 1h60 h ARG 335 Ca 0.34 -0.19 -0.10 0.00 0.07 0.00 0.00 59.98 60.10 1h60 h ARG 335 Cb -0.10 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 1h60 h ARG 335 CO -0.07 0.78 -0.36 -0.07 -1.07 0.00 0.00 179.97 179.18 1h60 h LEU 336 N 0.72 0.25 -0.40 3.04 3.38 -0.46 0.17 115.31 122.01 1h60 h LEU 336 Ca 0.16 -0.09 -0.18 0.00 0.09 0.00 0.00 57.88 57.87 1h60 h LEU 336 Cb 0.32 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1h60 h LEU 336 CO -0.00 0.59 -0.57 -0.61 0.09 0.00 0.00 178.44 177.94 1h60 h GLN 337 N 0.21 0.70 -0.01 1.13 4.15 -0.73 -3.05 115.11 117.51 1h60 h GLN 337 Ca 0.02 -0.46 0.00 0.00 0.77 0.00 0.00 58.65 58.99 1h60 h GLN 337 Cb 0.74 0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.49 1h60 h GLN 337 CO 0.06 1.08 -0.20 1.63 -1.93 0.00 0.00 178.83 179.46 1h60 n LYS 338 N -3.97 1.17 -3.68 1.69 5.02 -0.49 -4.79 118.16 113.11 1h60 n LYS 338 Ca -0.04 -0.75 -0.25 0.00 -2.02 0.00 0.00 58.31 55.25 1h60 n LYS 338 Cb 0.63 -1.48 0.06 0.00 -0.02 0.00 0.00 35.03 34.21 1h60 n LYS 338 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1h60 n LYS 339 N -0.26 -6.84 -2.37 1.97 4.76 0.40 -4.99 118.16 110.84 1h60 n LYS 339 Ca 0.14 0.75 -0.29 0.00 -2.87 0.00 0.00 58.31 56.03 1h60 n LYS 339 Cb 0.38 -5.71 -0.00 0.00 -1.84 0.00 0.00 35.03 27.86 1h60 n LYS 339 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1h60 s ALA 340 N -3.35 3.26 0.88 7.82 0.00 -0.04 -5.03 121.76 125.30 1h60 s ALA 340 Ca 0.49 -0.26 -0.11 0.00 0.00 0.00 0.00 51.96 52.08 1h60 s ALA 340 Cb -0.23 -2.82 0.12 0.00 0.00 0.00 0.00 23.12 20.19 1h60 s ALA 340 CO 0.77 -0.42 1.10 -1.21 0.00 0.00 0.00 175.76 176.00 1h60 s GLU 341 N -4.73 1.33 0.10 0.00 2.02 -1.26 -4.78 118.70 111.38 1h60 s GLU 341 Ca 0.52 1.12 0.03 0.00 0.02 0.00 0.00 54.97 56.65 1h60 s GLU 341 Cb -0.11 -1.79 -0.04 0.00 0.10 0.00 0.00 34.13 32.29 1h60 s GLU 341 CO 0.45 -2.28 0.15 -0.51 0.02 0.00 0.00 175.26 173.10 1h60 s LEU 342 N -6.31 4.02 0.43 1.80 1.43 -1.26 -4.99 118.68 113.80 1h60 s LEU 342 Ca 0.64 0.07 -0.25 0.00 -1.03 0.00 0.00 54.13 53.55 1h60 s LEU 342 Cb -0.20 -2.65 -0.08 0.00 0.03 0.00 0.00 46.19 43.29 1h60 s LEU 342 CO 0.58 0.14 1.37 0.20 0.23 0.00 0.00 176.35 178.86 1h60 s ASN 343 N -2.67 6.04 0.39 2.29 0.01 -1.26 -4.98 114.94 114.75 1h60 s ASN 343 Ca 0.32 2.79 -0.26 0.00 -0.71 0.00 0.00 52.86 54.99 1h60 s ASN 343 Cb -0.12 -2.65 -0.09 0.00 0.41 0.00 0.00 41.25 38.81 1h60 s ASN 343 CO 0.25 -1.05 1.28 -2.16 -1.51 0.00 0.00 177.10 173.91 1h60 s PRO 344 N -2.38 4.06 0.36 -0.60 0.04 -1.26 -4.87 135.00 130.35 1h60 s PRO 344 Ca 0.60 2.11 -0.25 0.00 0.04 0.00 0.00 61.00 63.49 1h60 s PRO 344 Cb -0.41 -2.81 -0.09 0.00 0.04 0.00 0.00 34.50 31.23 1h60 s PRO 344 CO 0.52 -0.40 1.03 -0.65 0.04 0.00 0.00 177.00 177.54 1h60 s GLN 345 N -2.15 4.33 -0.69 4.56 -0.21 -1.26 -4.96 119.66 119.28 1h60 s GLN 345 Ca 0.55 1.49 0.05 0.00 0.02 0.00 0.00 55.36 57.48 1h60 s GLN 345 Cb -0.37 -2.68 0.18 0.00 1.00 0.00 0.00 33.01 31.14 1h60 s GLN 345 CO 0.48 0.01 0.53 0.54 -2.12 0.00 0.00 175.29 174.73 1h60 n ARG 346 N 0.24 1.89 0.21 2.91 1.74 -1.26 -4.98 116.66 117.42 1h60 n ARG 346 Ca 0.03 -4.49 0.16 0.00 -0.77 0.00 0.00 57.85 52.79 1h60 n ARG 346 Cb 0.49 -2.27 0.81 0.00 -1.02 0.00 0.00 32.46 30.47 1h60 n ARG 346 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 1h60 h PRO 347 N 5.22 0.00 0.00 5.56 0.11 -1.99 -2.00 132.00 138.91 1h60 h PRO 347 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1h60 h PRO 347 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1h60 h PRO 347 CO 0.73 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.57 1h60 h GLU 348 N 0.00 0.00 -0.26 1.05 9.09 -1.99 -1.52 114.58 120.95 1h60 h GLU 348 Ca 0.08 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.48 1h60 h GLU 348 Cb 0.41 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.51 1h60 h GLU 348 CO -0.00 0.00 0.00 -1.13 0.05 0.00 0.00 179.01 177.93 1h60 n SER 349 N -2.57 3.86 -0.25 3.06 3.41 -0.75 -4.56 113.62 115.82 1h60 n SER 349 Ca -0.01 -3.04 -0.08 0.00 -0.26 0.00 0.00 58.87 55.49 1h60 n SER 349 Cb 0.14 -0.55 0.05 0.00 -0.26 0.00 0.00 64.21 63.59 1h60 n SER 349 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1h60 h PHE 350 N 1.79 1.19 -3.32 7.33 0.04 -1.37 -3.44 116.94 119.16 1h60 h PHE 350 Ca 0.01 -0.16 -0.66 0.00 2.80 0.00 0.00 57.97 59.96 1h60 h PHE 350 Cb 1.46 -0.33 -0.28 0.00 2.20 0.00 0.00 35.95 39.00 1h60 h PHE 350 CO 0.51 0.98 -0.78 0.71 -0.60 0.00 0.00 178.31 179.14 1h60 s TYR 351 N -5.25 2.79 0.06 -0.55 2.02 -1.26 -4.47 117.35 110.69 1h60 s TYR 351 Ca -0.12 -0.71 0.00 0.00 -0.37 0.00 0.00 57.07 55.87 1h60 s TYR 351 Cb 0.15 -1.84 0.00 0.00 -0.40 0.00 0.00 41.96 39.87 1h60 s TYR 351 CO 0.85 -0.25 0.00 0.41 -1.57 0.00 0.00 175.55 174.99 1h60 n GLY 352 N 3.57 -2.08 3.56 0.71 0.00 0.08 -4.77 105.19 106.26 1h60 n GLY 352 Ca -0.18 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1h60 n GLY 352 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h60 n GLY 353 N -1.31 -0.64 0.00 -0.02 0.00 -1.26 -4.88 105.19 97.09 1h60 n GLY 353 Ca 0.00 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.50 1h60 n GLY 353 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h60 n GLY 354 N 0.00 4.82 0.19 -0.02 0.00 -1.26 -4.87 105.19 104.05 1h60 n GLY 354 Ca 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 46.02 45.27 1h60 n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h60 h ALA 355 N 1.00 1.31 -2.48 4.61 0.00 -1.99 -3.39 119.26 118.33 1h60 h ALA 355 Ca 0.00 -0.36 -0.53 0.00 0.00 0.00 0.00 54.91 54.01 1h60 h ALA 355 Cb 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.74 1h60 h ALA 355 CO 0.00 0.51 0.94 -2.00 0.00 0.00 0.00 179.25 178.70 1h60 s GLU 356 N -4.16 4.22 -0.01 0.00 2.12 -1.26 -0.61 118.70 119.00 1h60 s GLU 356 Ca -0.03 2.28 0.00 0.00 0.36 0.00 0.00 54.97 57.58 1h60 s GLU 356 Cb 0.14 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 31.04 1h60 s GLU 356 CO 0.74 -0.67 0.00 0.41 -0.54 0.00 0.00 175.26 175.19 1h60 n GLY 357 N 3.88 0.45 1.37 -1.50 0.00 -1.26 -4.84 105.19 103.29 1h60 n GLY 357 Ca 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1h60 n GLY 357 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1h60 n TYR 358 N -2.90 -0.67 -0.07 1.61 9.36 0.22 -4.72 117.16 120.00 1h60 n TYR 358 Ca -0.00 0.12 0.06 0.00 3.32 0.00 0.00 57.90 61.39 1h60 n TYR 358 Cb 0.05 0.20 0.14 0.00 -0.63 0.00 0.00 39.34 39.10 1h60 n TYR 358 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 1h60 n THR 359 N -3.23 0.83 -0.23 2.97 -2.24 -0.44 -4.57 114.28 107.37 1h60 n THR 359 Ca 0.00 -0.92 0.24 0.00 -2.27 0.00 0.00 64.05 61.10 1h60 n THR 359 Cb 0.00 0.62 0.61 0.00 -2.10 0.00 0.00 70.33 69.46 1h60 n THR 359 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1h60 h ASP 360 N 2.07 0.23 -3.63 3.42 3.58 -1.90 -3.46 116.42 116.73 1h60 h ASP 360 Ca 0.00 0.03 -0.63 0.00 0.42 0.00 0.00 57.03 56.85 1h60 h ASP 360 Cb 0.69 -0.01 -0.14 0.00 1.72 0.00 0.00 39.33 41.59 1h60 h ASP 360 CO 0.00 0.08 -0.10 -0.31 -2.88 0.00 0.00 179.24 176.03 1h60 s TYR 361 N -5.23 3.23 0.64 0.28 2.02 -1.26 -4.93 117.35 112.10 1h60 s TYR 361 Ca -0.07 0.42 -0.14 0.00 -0.37 0.00 0.00 57.07 56.91 1h60 s TYR 361 Cb 0.22 -2.74 -0.02 0.00 -0.40 0.00 0.00 41.96 39.03 1h60 s TYR 361 CO 0.78 -0.35 1.06 -1.25 -1.57 0.00 0.00 175.55 174.23 1h60 s PRO 362 N 2.26 3.12 0.58 -1.71 0.04 -1.26 -4.62 135.00 133.40 1h60 s PRO 362 Ca 0.18 1.13 -0.06 0.00 0.04 0.00 0.00 61.00 62.29 1h60 s PRO 362 Cb -0.16 -2.01 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 1h60 s PRO 362 CO 0.11 -0.97 0.90 -1.12 0.04 0.00 0.00 177.00 175.96 1h60 s SER 363 N -3.12 5.73 0.00 6.66 0.01 -1.26 -4.61 113.70 117.11 1h60 s SER 363 Ca 0.62 0.81 0.00 0.00 1.31 0.00 0.00 55.95 58.69 1h60 s SER 363 Cb -0.16 -1.85 0.00 0.00 0.21 0.00 0.00 66.02 64.22 1h60 s SER 363 CO 0.44 -0.99 0.44 0.18 0.41 0.00 0.00 173.24 173.72