#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h7j s THR 3 N 0.00 3.78 0.19 -0.18 -4.23 -1.26 -4.84 115.64 109.11 3h7j s THR 3 Ca 0.00 0.60 -0.11 0.00 -1.18 0.00 0.00 61.69 61.00 3h7j s THR 3 Cb 0.00 -3.24 0.12 0.00 1.34 0.00 0.00 72.50 70.71 3h7j s THR 3 CO 0.00 -0.73 1.74 0.11 -0.54 0.00 0.00 174.62 175.20 3h7j h LYS 4 N -0.74 0.35 -0.56 3.99 1.79 -1.99 -1.17 116.57 118.24 3h7j h LYS 4 Ca -0.44 -0.02 0.07 0.00 -2.18 0.00 0.00 60.65 58.08 3h7j h LYS 4 Cb 1.22 -0.08 -0.06 0.00 -1.58 0.00 0.00 32.23 31.73 3h7j h LYS 4 CO 0.55 0.23 0.23 1.49 -1.08 0.00 0.00 179.45 180.87 3h7j h GLU 5 N 0.36 0.42 -0.03 3.15 4.81 -1.99 0.24 114.58 121.54 3h7j h GLU 5 Ca 0.27 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 3h7j h GLU 5 Cb 0.31 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 3h7j h GLU 5 CO -0.28 0.28 -0.18 -0.44 -0.73 0.00 0.00 179.01 177.66 3h7j h ASP 6 N 0.43 -0.53 -0.55 1.04 3.45 -1.77 -1.40 116.42 117.09 3h7j h ASP 6 Ca 0.27 0.08 -0.10 0.00 0.43 0.00 0.00 57.03 57.71 3h7j h ASP 6 Cb 0.28 0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 39.25 3h7j h ASP 6 CO -0.25 -0.24 -0.03 0.24 -1.57 0.00 0.00 179.24 177.39 3h7j h MET 7 N -0.27 1.02 -0.57 3.56 2.86 -1.07 -2.69 114.93 117.76 3h7j h MET 7 Ca 0.07 -0.33 -0.11 0.00 -2.06 0.00 0.00 59.70 57.26 3h7j h MET 7 Cb 0.36 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 3h7j h MET 7 CO -0.19 1.02 -0.08 0.37 1.06 0.00 0.00 176.91 179.09 3h7j h GLN 8 N 0.93 1.06 0.00 1.72 -0.00 -0.61 0.17 115.11 118.38 3h7j h GLN 8 Ca 0.16 -0.38 -0.02 0.00 -0.00 0.00 0.00 58.65 58.41 3h7j h GLN 8 Cb 0.58 -0.08 -0.00 0.00 0.00 0.00 0.00 27.48 27.99 3h7j h GLN 8 CO 0.04 1.08 -0.09 0.93 0.00 0.00 0.00 178.83 180.78 3h7j h GLU 9 N 0.95 0.00 0.00 1.69 5.08 -1.21 0.33 114.58 121.43 3h7j h GLU 9 Ca 0.15 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 3h7j h GLU 9 Cb 0.65 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 3h7j h GLU 9 CO 0.04 0.09 -0.84 -0.07 -1.00 0.00 0.00 179.01 177.24 3h7j h LEU 10 N 0.00 0.00 0.00 1.33 3.38 -1.08 -3.36 115.31 115.57 3h7j h LEU 10 Ca -0.00 -0.32 -0.18 0.00 0.09 0.00 0.00 57.88 57.47 3h7j h LEU 10 Cb 0.33 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 3h7j h LEU 10 CO 0.01 1.13 -0.90 1.88 0.09 0.00 0.00 178.44 180.66 3h7j h TYR 11 N -1.00 0.00 -2.03 1.13 0.05 -0.94 -3.39 116.97 110.79 3h7j h TYR 11 Ca -0.18 0.00 -0.52 0.00 0.05 0.00 0.00 58.73 58.08 3h7j h TYR 11 Cb 0.92 0.00 -0.40 0.00 1.01 0.00 0.00 36.73 38.26 3h7j h TYR 11 CO -0.02 0.85 -1.10 1.19 -1.05 0.00 0.00 178.16 178.04 3h7j n PHE 12 N -3.29 0.44 -1.80 4.88 3.72 0.12 -1.04 117.46 120.49 3h7j n PHE 12 Ca -0.00 -3.76 -0.34 0.00 -0.05 0.00 0.00 57.45 53.30 3h7j n PHE 12 Cb 0.88 -0.41 0.05 0.00 -0.94 0.00 0.00 39.48 39.06 3h7j n PHE 12 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3h7j s PRO 13 N -2.07 2.78 0.11 -1.08 0.04 -1.18 -4.50 135.00 129.11 3h7j s PRO 13 Ca 0.39 1.52 -0.31 0.00 0.04 0.00 0.00 61.00 62.63 3h7j s PRO 13 Cb 0.27 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.79 3h7j s PRO 13 CO -0.09 -1.29 1.41 0.99 0.04 0.00 0.00 177.00 178.07 3h7j s THR 14 N -2.14 3.26 0.53 1.26 2.01 -1.26 -4.86 115.64 114.44 3h7j s THR 14 Ca 0.70 0.89 -0.18 0.00 0.31 0.00 0.00 61.69 63.40 3h7j s THR 14 Cb -0.23 -3.57 -0.06 0.00 0.01 0.00 0.00 72.50 68.65 3h7j s THR 14 CO 0.39 0.06 1.06 -2.16 -0.69 0.00 0.00 174.62 173.28 3h7j s PRO 15 N 1.21 3.56 0.02 4.92 0.04 -1.26 -4.81 135.00 138.68 3h7j s PRO 15 Ca 0.65 1.33 0.02 0.00 0.04 0.00 0.00 61.00 63.04 3h7j s PRO 15 Cb -0.37 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 3h7j s PRO 15 CO 0.30 -0.63 0.01 0.15 0.04 0.00 0.00 177.00 176.88 3h7j s LYS 16 N -3.56 2.78 -0.14 4.56 1.02 -0.05 -4.90 119.74 119.44 3h7j s LYS 16 Ca 0.66 -0.64 -0.16 0.00 0.02 0.00 0.00 55.97 55.85 3h7j s LYS 16 Cb -0.17 -2.67 -0.04 0.00 -0.52 0.00 0.00 37.83 34.43 3h7j s LYS 16 CO 0.27 0.61 0.39 -1.17 -0.92 0.00 0.00 175.35 174.53 3h7j s LEU 17 N -1.76 4.26 -0.10 3.17 2.96 -1.26 -0.63 118.68 125.32 3h7j s LEU 17 Ca 0.22 0.67 0.02 0.00 -0.22 0.00 0.00 54.13 54.82 3h7j s LEU 17 Cb -0.12 -2.55 -0.01 0.00 0.50 0.00 0.00 46.19 44.01 3h7j s LEU 17 CO 0.13 0.04 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.40 3h7j s ILE 18 N 0.56 2.68 -0.04 6.68 1.01 0.14 -4.96 121.20 127.27 3h7j s ILE 18 Ca 0.22 -0.81 0.06 0.00 0.00 0.00 0.00 60.65 60.11 3h7j s ILE 18 Cb -0.14 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.25 3h7j s ILE 18 CO 0.07 0.55 -0.21 -0.70 0.00 0.00 0.00 174.94 174.65 3h7j s GLU 19 N 0.07 2.08 0.18 2.79 2.12 -1.26 -0.62 118.70 124.05 3h7j s GLU 19 Ca -0.07 -0.76 0.04 0.00 0.36 0.00 0.00 54.97 54.54 3h7j s GLU 19 Cb -0.15 -1.82 -0.04 0.00 0.26 0.00 0.00 34.13 32.38 3h7j s GLU 19 CO 0.05 0.35 0.22 -1.58 -0.54 0.00 0.00 175.26 173.76 3h7j s TRP 20 N -0.17 3.29 0.28 5.30 0.52 0.00 -5.02 118.94 123.15 3h7j s TRP 20 Ca -0.01 0.01 0.00 0.00 0.02 0.00 0.00 56.10 56.13 3h7j s TRP 20 Cb -0.12 -1.55 0.51 0.00 -1.15 0.00 0.00 33.47 31.15 3h7j s TRP 20 CO 0.02 0.51 1.86 1.49 0.02 0.00 0.00 176.95 180.85 3h7j h GLU 21 N 2.05 1.03 0.00 4.98 4.81 -2.00 -0.56 114.58 124.88 3h7j h GLU 21 Ca -0.49 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 3h7j h GLU 21 Cb 1.21 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.35 3h7j h GLU 21 CO 0.64 0.68 0.00 0.27 -0.73 0.00 0.00 179.01 179.88 3h7j n ASN 22 N -4.56 0.00 0.00 1.04 6.94 -1.26 -4.87 115.26 112.55 3h7j n ASN 22 Ca 0.17 -1.28 0.00 0.00 -0.02 0.00 0.00 54.58 53.45 3h7j n ASN 22 Cb 0.28 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.70 3h7j n ASN 22 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3h7j n GLY 23 N 0.31 0.93 3.73 4.83 0.00 -0.22 -4.88 105.19 109.90 3h7j n GLY 23 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3h7j n GLY 23 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3h7j n VAL 24 N -2.00 1.65 -5.03 1.61 0.31 -1.26 -4.66 118.33 108.94 3h7j n VAL 24 Ca 0.00 -0.41 -0.28 0.00 -0.01 0.00 0.00 64.34 63.64 3h7j n VAL 24 Cb 0.00 -1.80 -0.16 0.00 -0.91 0.00 0.00 33.84 30.97 3h7j n VAL 24 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3h7j s ARG 25 N -1.46 1.72 0.01 5.55 0.52 -0.80 -0.82 118.95 123.67 3h7j s ARG 25 Ca 0.58 -0.78 0.02 0.00 -0.52 0.00 0.00 55.73 55.03 3h7j s ARG 25 Cb -0.53 -1.67 -0.01 0.00 0.52 0.00 0.00 34.95 33.26 3h7j s ARG 25 CO 0.58 0.46 -0.05 -0.65 0.02 0.00 0.00 175.30 175.65 3h7j s GLN 26 N -0.55 0.41 -0.29 3.54 -0.21 0.21 -0.07 119.66 122.70 3h7j s GLN 26 Ca 0.08 -0.40 -0.08 0.00 0.02 0.00 0.00 55.36 54.98 3h7j s GLN 26 Cb -0.08 -0.29 -0.01 0.00 1.00 0.00 0.00 33.01 33.63 3h7j s GLN 26 CO -0.01 0.07 0.12 0.71 -2.12 0.00 0.00 175.29 174.06 3h7j s TYR 27 N -0.65 3.15 -0.13 0.91 2.02 0.66 0.25 117.35 123.56 3h7j s TYR 27 Ca -0.04 -0.58 -0.05 0.00 -0.37 0.00 0.00 57.07 56.03 3h7j s TYR 27 Cb -0.05 -2.30 -0.04 0.00 -0.40 0.00 0.00 41.96 39.17 3h7j s TYR 27 CO -0.00 -0.44 0.04 0.45 -1.57 0.00 0.00 175.55 174.03 3h7j s SER 28 N 1.60 5.53 -0.02 2.29 0.15 0.19 -1.32 113.70 122.12 3h7j s SER 28 Ca 0.05 0.16 0.03 0.00 0.70 0.00 0.00 55.95 56.88 3h7j s SER 28 Cb -0.16 -1.76 -0.00 0.00 -1.71 0.00 0.00 66.02 62.38 3h7j s SER 28 CO 0.05 0.30 -0.09 0.42 1.20 0.00 0.00 173.24 175.11 3h7j s THR 29 N -0.40 0.79 -0.05 6.45 -4.23 -0.19 -0.88 115.64 117.14 3h7j s THR 29 Ca 0.09 -0.39 0.02 0.00 -1.18 0.00 0.00 61.69 60.23 3h7j s THR 29 Cb -0.12 -0.69 0.01 0.00 1.34 0.00 0.00 72.50 73.04 3h7j s THR 29 CO 0.02 0.24 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.55 3h7j s VAL 30 N 0.03 0.93 -0.16 2.29 1.01 -1.26 -0.90 120.40 122.35 3h7j s VAL 30 Ca -0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.57 3h7j s VAL 30 Cb -0.07 -0.86 0.05 0.00 0.00 0.00 0.00 36.38 35.50 3h7j s VAL 30 CO 0.00 0.30 -0.01 -0.60 0.00 0.00 0.00 175.10 174.80 3h7j s ARG 31 N 0.52 0.94 7.31 2.72 3.52 -0.67 -4.81 118.95 128.48 3h7j s ARG 31 Ca -0.10 -0.35 0.00 0.00 -0.13 0.00 0.00 55.73 55.16 3h7j s ARG 31 Cb -0.13 -1.82 0.00 0.00 -1.56 0.00 0.00 34.95 31.44 3h7j s ARG 31 CO 0.02 -0.49 0.00 0.41 -0.81 0.00 0.00 175.30 174.43 3h7j n GLY 32 N 5.00 3.22 0.49 8.12 0.00 -1.26 -2.27 105.19 118.49 3h7j n GLY 32 Ca -0.10 0.19 0.12 0.00 0.00 0.00 0.00 46.02 46.23 3h7j n GLY 32 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3h7j n ASP 33 N 9.97 1.50 -4.01 1.61 10.43 -1.26 -4.86 116.55 129.93 3h7j n ASP 33 Ca 0.00 -1.61 -0.20 0.00 2.57 0.00 0.00 54.79 55.55 3h7j n ASP 33 Cb 0.00 -0.07 -0.15 0.00 1.84 0.00 0.00 41.12 42.74 3h7j n ASP 33 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 3h7j s THR 34 N -1.87 0.78 0.04 -3.53 2.01 -0.96 -1.99 115.64 110.12 3h7j s THR 34 Ca 0.34 -0.37 0.08 0.00 0.31 0.00 0.00 61.69 62.04 3h7j s THR 34 Cb 0.18 -0.69 -0.02 0.00 0.01 0.00 0.00 72.50 71.98 3h7j s THR 34 CO 0.28 0.24 -0.22 -0.70 -0.69 0.00 0.00 174.62 173.54 3h7j s GLU 35 N 0.10 1.50 -0.12 4.92 2.12 0.71 -1.67 118.70 126.25 3h7j s GLU 35 Ca -0.02 -0.95 0.02 0.00 0.36 0.00 0.00 54.97 54.39 3h7j s GLU 35 Cb -0.07 -1.60 -0.00 0.00 0.26 0.00 0.00 34.13 32.71 3h7j s GLU 35 CO 0.00 0.41 -0.20 0.08 -0.54 0.00 0.00 175.26 175.01 3h7j s VAL 36 N -0.77 2.32 -0.14 3.70 1.01 -0.08 -0.85 120.40 125.60 3h7j s VAL 36 Ca 0.08 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.16 3h7j s VAL 36 Cb -0.09 -1.92 0.02 0.00 0.00 0.00 0.00 36.38 34.38 3h7j s VAL 36 CO 0.02 0.55 -0.16 -0.76 0.00 0.00 0.00 175.10 174.74 3h7j s LEU 37 N 0.49 1.79 -0.22 3.92 1.43 -0.23 -1.02 118.68 124.83 3h7j s LEU 37 Ca -0.14 -0.50 -0.10 0.00 -1.03 0.00 0.00 54.13 52.37 3h7j s LEU 37 Cb -0.17 -1.21 -0.05 0.00 0.03 0.00 0.00 46.19 44.79 3h7j s LEU 37 CO 0.05 -0.02 0.13 -0.32 0.23 0.00 0.00 176.35 176.43 3h7j s MET 38 N 1.26 4.04 -0.03 1.70 -2.45 -0.43 -0.60 119.30 122.79 3h7j s MET 38 Ca 0.00 -0.29 0.07 0.00 -1.25 0.00 0.00 55.69 54.22 3h7j s MET 38 Cb -0.14 -3.45 -0.02 0.00 1.25 0.00 0.00 34.83 32.48 3h7j s MET 38 CO -0.07 0.12 -0.24 -1.12 1.05 0.00 0.00 175.02 174.75 3h7j s SER 39 N 0.87 2.84 -0.24 1.11 0.01 0.73 -0.24 113.70 118.77 3h7j s SER 39 Ca 0.07 -0.45 -0.05 0.00 1.31 0.00 0.00 55.95 56.83 3h7j s SER 39 Cb -0.13 -0.46 -0.01 0.00 0.21 0.00 0.00 66.02 65.63 3h7j s SER 39 CO 0.03 0.27 0.01 -0.31 0.41 0.00 0.00 173.24 173.65 3h7j s TYR 40 N -0.43 3.03 -0.21 2.43 2.02 0.90 -0.59 117.35 124.51 3h7j s TYR 40 Ca 0.05 -0.81 -0.01 0.00 -0.37 0.00 0.00 57.07 55.94 3h7j s TYR 40 Cb -0.10 -2.17 0.02 0.00 -0.40 0.00 0.00 41.96 39.30 3h7j s TYR 40 CO 0.00 -0.50 -0.13 0.08 -1.57 0.00 0.00 175.55 173.43 3h7j s VAL 41 N 1.52 2.53 0.79 0.71 1.01 0.10 -1.90 120.40 125.15 3h7j s VAL 41 Ca 0.05 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.04 3h7j s VAL 41 Cb -0.15 -2.15 0.07 0.00 0.00 0.00 0.00 36.38 34.14 3h7j s VAL 41 CO -0.00 0.42 1.09 -2.84 0.00 0.00 0.00 175.10 173.76 3h7j s PRO 42 N 1.33 2.14 0.53 2.72 0.02 -1.26 -1.16 135.00 139.32 3h7j s PRO 42 Ca 0.04 1.00 -0.19 0.00 0.02 0.00 0.00 61.00 61.86 3h7j s PRO 42 Cb -0.14 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.39 3h7j s PRO 42 CO -0.09 -1.68 0.54 -2.30 -0.33 0.00 0.00 177.00 173.14 3h7j n PRO 43 N -3.52 0.55 -3.92 5.54 -0.02 -1.25 -3.43 135.00 128.94 3h7j n PRO 43 Ca 0.08 0.21 -0.40 0.00 -2.02 0.00 0.00 63.50 61.38 3h7j n PRO 43 Cb 0.54 -1.67 0.03 0.00 -0.02 0.00 0.00 33.50 32.38 3h7j n PRO 43 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3h7j n HIS 44 N -1.48 -1.63 -4.16 6.00 8.25 -0.41 -4.97 115.22 116.81 3h7j n HIS 44 Ca 0.11 0.27 -0.19 0.00 -0.26 0.00 0.00 57.72 57.66 3h7j n HIS 44 Cb 0.46 -2.99 -0.16 0.00 1.12 0.00 0.00 29.99 28.42 3h7j n HIS 44 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3h7j s THR 45 N -3.44 0.49 -0.03 1.59 2.01 -0.54 -4.97 115.64 110.75 3h7j s THR 45 Ca 0.43 -0.15 -0.19 0.00 0.31 0.00 0.00 61.69 62.10 3h7j s THR 45 Cb -0.21 -0.49 -0.05 0.00 0.01 0.00 0.00 72.50 71.76 3h7j s THR 45 CO 0.93 0.19 0.52 0.20 -0.69 0.00 0.00 174.62 175.78 3h7j s ASN 46 N 0.60 6.87 -0.32 3.53 0.01 -1.26 -0.92 114.94 123.44 3h7j s ASN 46 Ca -0.08 1.03 -0.09 0.00 -0.71 0.00 0.00 52.86 53.02 3h7j s ASN 46 Cb -0.11 -2.32 0.01 0.00 0.41 0.00 0.00 41.25 39.24 3h7j s ASN 46 CO -0.00 0.13 0.13 -0.69 -1.51 0.00 0.00 177.10 175.17 3h7j s VAL 47 N -0.21 4.28 0.32 1.60 1.01 0.49 -4.97 120.40 122.92 3h7j s VAL 47 Ca 0.28 -0.70 -0.29 0.00 0.00 0.00 0.00 61.98 61.28 3h7j s VAL 47 Cb -0.17 -3.27 -0.10 0.00 0.00 0.00 0.00 36.38 32.84 3h7j s VAL 47 CO 0.15 -0.03 1.31 -1.61 0.00 0.00 0.00 175.10 174.92 3h7j s GLU 48 N 1.54 4.36 0.47 2.72 2.02 -1.26 -1.41 118.70 127.13 3h7j s GLU 48 Ca 0.03 2.20 -0.24 0.00 0.02 0.00 0.00 54.97 56.98 3h7j s GLU 48 Cb -0.18 -3.08 -0.07 0.00 0.10 0.00 0.00 34.13 30.90 3h7j s GLU 48 CO 0.05 -0.19 1.37 -2.14 0.02 0.00 0.00 175.26 174.37 3h7j s PRO 49 N -1.69 3.60 0.24 0.39 0.02 -1.26 -4.68 135.00 131.62 3h7j s PRO 49 Ca 0.49 2.28 -0.07 0.00 0.02 0.00 0.00 61.00 63.72 3h7j s PRO 49 Cb -0.40 -2.55 -0.02 0.00 0.02 0.00 0.00 34.50 31.55 3h7j s PRO 49 CO 0.52 -0.84 0.34 -3.38 -0.33 0.00 0.00 177.00 173.31 3h7j s HIS 50 N -1.26 0.74 0.13 6.54 -3.43 -0.03 -4.89 115.29 113.09 3h7j s HIS 50 Ca 0.63 -1.03 0.02 0.00 -0.80 0.00 0.00 55.06 53.88 3h7j s HIS 50 Cb -0.41 -0.13 -0.04 0.00 -1.43 0.00 0.00 32.58 30.56 3h7j s HIS 50 CO 0.51 -0.86 -0.03 1.14 -2.00 0.00 0.00 174.74 173.50 3h7j s GLN 51 N -4.01 0.95 0.21 -0.38 1.03 -1.26 -1.30 119.66 114.91 3h7j s GLN 51 Ca 0.30 -1.42 -0.15 0.00 0.04 0.00 0.00 55.36 54.13 3h7j s GLN 51 Cb 0.02 -0.22 0.01 0.00 0.03 0.00 0.00 33.01 32.86 3h7j s GLN 51 CO 0.11 -0.07 0.50 -3.38 -2.54 0.00 0.00 175.29 169.91 3h7j s HIS 52 N -3.65 0.09 0.12 9.60 -3.43 -1.26 -4.90 115.29 111.86 3h7j s HIS 52 Ca 0.17 -0.45 0.23 0.00 -0.80 0.00 0.00 55.06 54.21 3h7j s HIS 52 Cb 0.06 0.30 0.88 0.00 -1.43 0.00 0.00 32.58 32.38 3h7j s HIS 52 CO -0.01 -0.94 1.81 1.57 -2.00 0.00 0.00 174.74 175.16 3h7j h LYS 53 N 2.24 0.00 -6.88 -0.38 2.10 -1.96 0.88 116.57 112.57 3h7j h LYS 53 Ca -0.27 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 57.86 3h7j h LYS 53 Cb 1.25 0.00 0.05 0.00 -0.90 0.00 0.00 32.23 32.64 3h7j h LYS 53 CO 0.37 0.24 0.57 -1.21 -2.00 0.00 0.00 179.45 177.42 3h7j s GLU 54 N -3.62 4.31 0.59 0.07 8.01 -1.26 -4.53 118.70 122.26 3h7j s GLU 54 Ca 0.01 2.04 -0.18 0.00 0.01 0.00 0.00 54.97 56.85 3h7j s GLU 54 Cb 0.10 -2.98 -0.04 0.00 -4.31 0.00 0.00 34.13 26.91 3h7j s GLU 54 CO 0.64 -0.16 1.13 0.54 0.01 0.00 0.00 175.26 177.42 3h7j s VAL 55 N -1.22 3.15 -0.01 2.63 0.11 -0.60 -4.27 120.40 120.19 3h7j s VAL 55 Ca 0.50 0.65 0.03 0.00 -2.93 0.00 0.00 61.98 60.24 3h7j s VAL 55 Cb -0.36 -3.21 -0.01 0.00 -1.53 0.00 0.00 36.38 31.27 3h7j s VAL 55 CO 0.47 -0.22 -0.11 -1.58 -3.33 0.00 0.00 175.10 170.33 3h7j s GLN 56 N -3.57 0.86 -0.08 1.54 0.74 -0.75 -2.00 119.66 116.40 3h7j s GLN 56 Ca 0.71 -0.38 0.04 0.00 0.05 0.00 0.00 55.36 55.78 3h7j s GLN 56 Cb -0.23 -0.83 -0.00 0.00 1.10 0.00 0.00 33.01 33.05 3h7j s GLN 56 CO 0.32 0.23 -0.22 0.42 -0.55 0.00 0.00 175.29 175.49 3h7j s ILE 57 N -0.26 1.90 0.04 -2.34 1.01 -0.38 -0.76 121.20 120.40 3h7j s ILE 57 Ca 0.04 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.77 3h7j s ILE 57 Cb -0.04 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.78 3h7j s ILE 57 CO -0.00 0.53 -0.09 -0.83 0.00 0.00 0.00 174.94 174.54 3h7j s GLY 58 N 0.19 0.56 -0.05 6.18 0.00 -0.98 0.03 107.32 113.24 3h7j s GLY 58 Ca -0.12 -0.72 -0.08 0.00 0.00 0.00 0.00 44.72 43.80 3h7j s GLY 58 CO 0.06 -0.74 0.20 -0.29 0.00 0.00 0.00 173.10 172.34 3h7j s MET 59 N -1.29 0.35 0.02 2.90 0.00 -0.31 -1.12 119.30 119.85 3h7j s MET 59 Ca -0.05 0.07 -0.24 0.00 0.00 0.00 0.00 55.69 55.46 3h7j s MET 59 Cb -0.08 0.16 -0.05 0.00 0.00 0.00 0.00 34.83 34.85 3h7j s MET 59 CO 0.01 -0.07 0.74 0.08 0.00 0.00 0.00 175.02 175.78 3h7j s VAL 60 N -0.42 4.80 -0.18 10.11 1.01 -1.26 -0.74 120.40 133.72 3h7j s VAL 60 Ca -0.05 1.57 -0.03 0.00 0.00 0.00 0.00 61.98 63.46 3h7j s VAL 60 Cb -0.03 -4.09 -0.22 0.00 0.00 0.00 0.00 36.38 32.04 3h7j s VAL 60 CO 0.01 0.35 0.11 0.52 0.00 0.00 0.00 175.10 176.09 3h7j n VAL 61 N 2.96 1.65 -3.78 2.92 0.31 0.90 -0.16 118.33 123.13 3h7j n VAL 61 Ca -0.03 -0.61 -0.13 0.00 -0.01 0.00 0.00 64.34 63.57 3h7j n VAL 61 Cb 0.50 -1.61 -0.12 0.00 -0.91 0.00 0.00 33.84 31.70 3h7j n VAL 61 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3h7j s SER 62 N -6.83 -0.21 0.00 4.52 0.15 -0.45 -4.60 113.70 106.28 3h7j s SER 62 Ca -0.28 0.42 0.00 0.00 0.70 0.00 0.00 55.95 56.79 3h7j s SER 62 Cb 0.08 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 3h7j s SER 62 CO 0.69 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.65 3h7j n GLY 63 N 3.32 -1.44 2.82 9.45 0.00 -1.26 -0.59 105.19 117.49 3h7j n GLY 63 Ca -0.16 -2.08 -0.16 0.00 0.00 0.00 0.00 46.02 43.62 3h7j n GLY 63 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h7j s GLU 64 N 0.00 0.20 -0.03 1.61 2.12 -1.26 -3.22 118.70 118.11 3h7j s GLU 64 Ca 0.00 0.08 0.03 0.00 0.36 0.00 0.00 54.97 55.44 3h7j s GLU 64 Cb 0.00 -0.37 -0.00 0.00 0.26 0.00 0.00 34.13 34.02 3h7j s GLU 64 CO 0.00 -0.11 -0.12 -1.17 -0.54 0.00 0.00 175.26 173.31 3h7j s LEU 65 N 0.85 1.85 -0.63 2.70 2.96 -0.79 -4.59 118.68 121.03 3h7j s LEU 65 Ca -0.08 -0.25 -0.22 0.00 -0.22 0.00 0.00 54.13 53.36 3h7j s LEU 65 Cb -0.11 -0.72 0.07 0.00 0.50 0.00 0.00 46.19 45.93 3h7j s LEU 65 CO -0.02 0.11 0.90 -0.04 -1.32 0.00 0.00 176.35 175.97 3h7j s MET 66 N 0.10 3.11 -0.19 1.98 -1.94 0.19 0.48 119.30 123.03 3h7j s MET 66 Ca -0.03 -0.90 -0.08 0.00 -1.71 0.00 0.00 55.69 52.98 3h7j s MET 66 Cb -0.09 -4.22 -0.04 0.00 2.01 0.00 0.00 34.83 32.49 3h7j s MET 66 CO 0.01 -1.71 0.07 1.41 -0.01 0.00 0.00 175.02 174.79 3h7j s MET 67 N 3.72 4.00 -0.19 2.03 1.75 -0.52 -1.23 119.30 128.85 3h7j s MET 67 Ca 0.20 -0.33 -0.01 0.00 -1.25 0.00 0.00 55.69 54.30 3h7j s MET 67 Cb -0.18 -3.25 0.00 0.00 2.84 0.00 0.00 34.83 34.24 3h7j s MET 67 CO 0.10 0.26 -0.12 0.99 -0.65 0.00 0.00 175.02 175.60 3h7j s THR 68 N 0.41 2.79 -0.12 10.11 2.01 0.32 -1.04 115.64 130.12 3h7j s THR 68 Ca 0.04 -0.70 0.02 0.00 0.31 0.00 0.00 61.69 61.36 3h7j s THR 68 Cb -0.12 -2.22 0.01 0.00 0.01 0.00 0.00 72.50 70.18 3h7j s THR 68 CO 0.00 0.48 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.56 3h7j s VAL 69 N 1.28 1.60 0.00 3.82 1.01 -0.63 -0.89 120.40 126.59 3h7j s VAL 69 Ca 0.03 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.32 3h7j s VAL 69 Cb -0.14 -1.45 0.00 0.00 0.00 0.00 0.00 36.38 34.79 3h7j s VAL 69 CO -0.06 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3h7j n GLY 70 N 4.23 3.29 1.14 4.51 0.00 0.20 -1.31 105.19 117.26 3h7j n GLY 70 Ca -0.19 0.08 0.08 0.00 0.00 0.00 0.00 46.02 45.99 3h7j n GLY 70 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3h7j n ASP 71 N 4.57 3.33 -4.47 1.61 5.68 -1.26 -4.92 116.55 121.08 3h7j n ASP 71 Ca 0.00 -2.16 -0.34 0.00 -0.50 0.00 0.00 54.79 51.80 3h7j n ASP 71 Cb 0.00 -0.43 -0.12 0.00 -1.14 0.00 0.00 41.12 39.42 3h7j n ASP 71 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3h7j s VAL 72 N -1.49 3.81 -0.11 2.12 1.01 -0.42 -5.09 120.40 120.23 3h7j s VAL 72 Ca 0.38 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 61.99 3h7j s VAL 72 Cb 0.22 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 3h7j s VAL 72 CO 0.22 0.49 -0.14 -0.89 0.00 0.00 0.00 175.10 174.78 3h7j s THR 73 N 0.48 2.99 -0.04 3.92 2.01 -1.26 -1.61 115.64 122.13 3h7j s THR 73 Ca -0.04 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.27 3h7j s THR 73 Cb -0.14 -2.23 0.02 0.00 0.01 0.00 0.00 72.50 70.16 3h7j s THR 73 CO 0.03 0.54 -0.04 -0.60 -0.69 0.00 0.00 174.62 173.86 3h7j s ARG 74 N 0.13 0.75 -0.33 4.92 3.52 -0.21 -4.98 118.95 122.76 3h7j s ARG 74 Ca -0.07 -0.08 -0.29 0.00 -0.13 0.00 0.00 55.73 55.16 3h7j s ARG 74 Cb -0.15 -0.79 0.01 0.00 -1.56 0.00 0.00 34.95 32.46 3h7j s ARG 74 CO 0.05 -0.09 1.30 0.21 -0.81 0.00 0.00 175.30 175.95 3h7j s LYS 75 N 0.93 3.86 -0.21 5.12 2.20 -1.26 -1.44 119.74 128.93 3h7j s LYS 75 Ca -0.11 1.14 -0.18 0.00 -0.36 0.00 0.00 55.97 56.46 3h7j s LYS 75 Cb -0.14 -3.90 -0.03 0.00 -1.51 0.00 0.00 37.83 32.25 3h7j s LYS 75 CO -0.00 -1.20 0.51 -1.64 -0.36 0.00 0.00 175.35 172.66 3h7j s MET 76 N 4.28 4.16 0.24 4.03 -1.94 0.18 -4.93 119.30 125.32 3h7j s MET 76 Ca 0.56 0.38 -0.16 0.00 -1.71 0.00 0.00 55.69 54.76 3h7j s MET 76 Cb -0.15 -3.58 -0.08 0.00 2.01 0.00 0.00 34.83 33.02 3h7j s MET 76 CO 0.25 -0.19 0.67 0.99 -0.01 0.00 0.00 175.02 176.72 3h7j s THR 77 N 1.78 4.71 0.11 2.05 2.01 -1.26 -1.88 115.64 123.16 3h7j s THR 77 Ca 0.23 0.97 -0.33 0.00 0.31 0.00 0.00 61.69 62.88 3h7j s THR 77 Cb -0.15 -3.72 -0.12 0.00 0.01 0.00 0.00 72.50 68.51 3h7j s THR 77 CO 0.09 0.05 1.74 0.00 -0.69 0.00 0.00 174.62 175.82 3h7j n ALA 78 N 0.28 1.74 -1.46 7.40 0.00 -1.20 -2.18 120.51 125.09 3h7j n ALA 78 Ca -0.01 0.37 -0.16 0.00 0.00 0.00 0.00 53.44 53.64 3h7j n ALA 78 Cb 0.52 -2.48 -0.07 0.00 0.00 0.00 0.00 19.45 17.42 3h7j n ALA 78 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h7j n LEU 79 N 4.83 -1.09 -0.18 0.00 4.77 0.77 -4.80 117.00 121.29 3h7j n LEU 79 Ca 0.18 0.39 0.03 0.00 -0.03 0.00 0.00 56.01 56.58 3h7j n LEU 79 Cb 0.33 -2.46 0.02 0.00 -2.33 0.00 0.00 43.42 38.97 3h7j n LEU 79 CO 0.66 -0.91 0.29 -0.62 -1.33 0.00 0.00 177.39 175.48 3h7j n GLU 80 N -2.23 0.55 -3.72 3.23 1.02 -0.92 -5.05 120.64 113.51 3h7j n GLU 80 Ca -0.16 -0.70 -0.07 0.00 -0.02 0.00 0.00 57.16 56.21 3h7j n GLU 80 Cb 0.56 -1.05 -0.02 0.00 -0.02 0.00 0.00 31.44 30.91 3h7j n GLU 80 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3h7j s SER 81 N -0.59 -0.31 0.12 1.62 1.04 -1.26 -4.21 113.70 110.11 3h7j s SER 81 Ca 0.06 -0.39 -0.04 0.00 0.48 0.00 0.00 55.95 56.05 3h7j s SER 81 Cb 0.04 0.62 -0.03 0.00 0.10 0.00 0.00 66.02 66.75 3h7j s SER 81 CO 0.08 -1.10 0.12 0.00 0.98 0.00 0.00 173.24 173.32 3h7j s ALA 82 N -3.66 0.43 0.17 5.32 0.00 -1.09 -4.36 121.76 118.57 3h7j s ALA 82 Ca 0.09 -1.16 0.06 0.00 0.00 0.00 0.00 51.96 50.95 3h7j s ALA 82 Cb -0.03 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.75 3h7j s ALA 82 CO 0.01 -0.51 -0.13 1.52 0.00 0.00 0.00 175.76 176.65 3h7j s TYR 83 N -3.98 1.50 -0.21 0.00 -0.85 -0.28 0.67 117.35 114.20 3h7j s TYR 83 Ca 0.17 -0.63 -0.03 0.00 -0.52 0.00 0.00 57.07 56.05 3h7j s TYR 83 Cb 0.06 -0.73 -0.00 0.00 0.38 0.00 0.00 41.96 41.67 3h7j s TYR 83 CO -0.02 0.22 -0.08 0.42 -1.52 0.00 0.00 175.55 174.57 3h7j s ILE 84 N -2.94 3.10 -0.48 -3.49 1.01 0.25 -2.33 121.20 116.33 3h7j s ILE 84 Ca 0.18 -0.59 -0.16 0.00 0.00 0.00 0.00 60.65 60.09 3h7j s ILE 84 Cb -0.00 -2.39 0.07 0.00 0.01 0.00 0.00 42.46 40.14 3h7j s ILE 84 CO 0.04 0.45 0.42 0.00 0.00 0.00 0.00 174.94 175.85 3h7j s ALA 85 N 1.42 3.54 0.91 9.38 0.00 0.06 -4.73 121.76 132.34 3h7j s ALA 85 Ca 0.05 -2.07 -0.11 0.00 0.00 0.00 0.00 51.96 49.84 3h7j s ALA 85 Cb -0.14 -3.10 0.14 0.00 0.00 0.00 0.00 23.12 20.02 3h7j s ALA 85 CO -0.05 -1.76 1.12 -2.14 0.00 0.00 0.00 175.76 172.92 3h7j s PRO 86 N 1.76 1.09 0.21 0.00 0.02 -1.26 -1.81 135.00 135.00 3h7j s PRO 86 Ca 0.05 1.32 -0.31 0.00 0.02 0.00 0.00 61.00 62.08 3h7j s PRO 86 Cb -0.24 -1.75 -0.15 0.00 0.02 0.00 0.00 34.50 32.38 3h7j s PRO 86 CO 0.07 -2.51 1.09 -2.30 -0.33 0.00 0.00 177.00 173.03 3h7j n PRO 87 N -4.13 1.16 -0.79 5.54 -0.02 -1.26 -1.74 135.00 133.76 3h7j n PRO 87 Ca 0.10 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3h7j n PRO 87 Cb 0.53 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 3h7j n PRO 87 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3h7j n HIS 88 N 1.08 0.00 -2.84 6.00 8.25 0.31 -4.95 115.22 123.06 3h7j n HIS 88 Ca 0.14 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.18 3h7j n HIS 88 Cb 0.27 -0.79 -0.04 0.00 1.12 0.00 0.00 29.99 30.55 3h7j n HIS 88 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3h7j s VAL 89 N -2.33 4.87 0.37 1.59 1.01 -0.71 -4.76 120.40 120.44 3h7j s VAL 89 Ca 0.00 1.75 -0.26 0.00 0.00 0.00 0.00 61.98 63.47 3h7j s VAL 89 Cb 0.00 -4.19 -0.09 0.00 0.00 0.00 0.00 36.38 32.11 3h7j s VAL 89 CO 0.00 0.06 1.14 -2.16 0.00 0.00 0.00 175.10 174.14 3h7j s PRO 90 N 1.88 4.21 -0.02 2.72 0.04 -1.26 -4.66 135.00 137.90 3h7j s PRO 90 Ca 0.42 1.80 -0.21 0.00 0.04 0.00 0.00 61.00 63.05 3h7j s PRO 90 Cb -0.17 -2.79 0.04 0.00 0.04 0.00 0.00 34.50 31.62 3h7j s PRO 90 CO 0.16 -0.17 0.45 -3.38 0.04 0.00 0.00 177.00 174.09 3h7j s HIS 91 N -1.38 -0.36 0.00 0.56 -3.43 -0.42 -0.62 115.29 109.64 3h7j s HIS 91 Ca 0.54 0.58 0.00 0.00 -0.80 0.00 0.00 55.06 55.38 3h7j s HIS 91 Cb -0.30 0.22 0.00 0.00 -1.43 0.00 0.00 32.58 31.07 3h7j s HIS 91 CO 0.38 -0.48 0.00 0.41 -2.00 0.00 0.00 174.74 173.05 3h7j n GLY 92 N 1.10 2.07 3.49 -1.38 0.00 -0.07 -0.85 105.19 109.56 3h7j n GLY 92 Ca -0.21 -0.77 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 3h7j n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h7j s ALA 93 N -1.00 -1.74 -0.02 4.61 0.00 -0.50 -0.52 121.76 122.59 3h7j s ALA 93 Ca 0.00 0.79 0.02 0.00 0.00 0.00 0.00 51.96 52.78 3h7j s ALA 93 Cb 0.00 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.70 3h7j s ALA 93 CO 0.00 -0.73 -0.08 0.50 0.00 0.00 0.00 175.76 175.44 3h7j s ARG 94 N -3.33 0.81 -0.53 0.00 3.52 -0.37 0.19 118.95 119.23 3h7j s ARG 94 Ca 0.04 -0.28 -0.17 0.00 -0.13 0.00 0.00 55.73 55.19 3h7j s ARG 94 Cb -0.01 -0.77 0.09 0.00 -1.56 0.00 0.00 34.95 32.70 3h7j s ARG 94 CO -0.10 0.13 0.55 1.21 -0.81 0.00 0.00 175.30 176.28 3h7j s ASN 95 N 0.07 6.18 0.00 -2.12 2.47 -0.10 -0.64 114.94 120.81 3h7j s ASN 95 Ca -0.01 -1.39 0.25 0.00 0.42 0.00 0.00 52.86 52.14 3h7j s ASN 95 Cb -0.07 -2.24 0.85 0.00 -1.45 0.00 0.00 41.25 38.34 3h7j s ASN 95 CO 0.00 -0.88 1.62 -0.67 -3.72 0.00 0.00 177.10 173.46 3h7j n ASP 96 N 5.72 1.79 -4.97 -4.21 4.64 -1.26 -1.29 116.55 116.97 3h7j n ASP 96 Ca -0.11 -1.63 -0.19 0.00 -1.38 0.00 0.00 54.79 51.48 3h7j n ASP 96 Cb 0.43 -0.04 0.04 0.00 -1.04 0.00 0.00 41.12 40.50 3h7j n ASP 96 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 3h7j s THR 97 N -1.92 2.65 -2.00 5.18 -4.23 -1.26 -4.70 115.64 109.36 3h7j s THR 97 Ca 0.35 -0.86 0.10 0.00 -1.18 0.00 0.00 61.69 60.10 3h7j s THR 97 Cb 0.20 -2.79 0.29 0.00 1.34 0.00 0.00 72.50 71.54 3h7j s THR 97 CO 0.31 0.00 1.35 0.47 -0.54 0.00 0.00 174.62 176.21 3h7j n ASP 98 N -2.17 0.00 -4.27 3.99 10.43 -1.26 -2.14 116.55 121.13 3h7j n ASP 98 Ca 0.10 -1.60 -0.21 0.00 2.57 0.00 0.00 54.79 55.65 3h7j n ASP 98 Cb 0.60 0.00 -0.12 0.00 1.84 0.00 0.00 41.12 43.44 3h7j n ASP 98 CO 0.00 0.00 0.00 -1.58 -1.07 0.00 0.00 177.20 174.55 3h7j s GLN 99 N -2.00 1.09 0.46 -1.24 0.74 -1.26 -4.81 119.66 112.65 3h7j s GLN 99 Ca 0.15 -1.21 -0.24 0.00 0.05 0.00 0.00 55.36 54.10 3h7j s GLN 99 Cb 0.07 -1.17 -0.08 0.00 1.10 0.00 0.00 33.01 32.93 3h7j s GLN 99 CO 0.12 0.25 1.35 -2.00 -0.55 0.00 0.00 175.29 174.46 3h7j s GLU 100 N -2.29 3.65 -0.13 1.67 2.12 -1.26 -3.91 118.70 118.56 3h7j s GLU 100 Ca 0.08 2.25 -0.04 0.00 0.36 0.00 0.00 54.97 57.61 3h7j s GLU 100 Cb -0.08 -2.58 -0.04 0.00 0.26 0.00 0.00 34.13 31.70 3h7j s GLU 100 CO 0.04 -0.78 0.03 0.08 -0.54 0.00 0.00 175.26 174.09 3h7j s VAL 101 N -1.27 4.55 -0.15 3.70 1.01 -0.31 -4.45 120.40 123.49 3h7j s VAL 101 Ca 0.62 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.44 3h7j s VAL 101 Cb -0.40 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 3h7j s VAL 101 CO 0.50 0.55 -0.06 -0.63 0.00 0.00 0.00 175.10 175.46 3h7j s ILE 102 N -0.37 3.68 0.21 2.22 1.01 0.25 -0.73 121.20 127.47 3h7j s ILE 102 Ca 0.08 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.30 3h7j s ILE 102 Cb -0.12 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.71 3h7j s ILE 102 CO 0.02 0.50 0.07 0.00 0.00 0.00 0.00 174.94 175.53 3h7j s ALA 103 N 0.34 1.45 -0.00 9.38 0.00 0.24 -0.07 121.76 133.10 3h7j s ALA 103 Ca -0.06 -1.72 0.06 0.00 0.00 0.00 0.00 51.96 50.24 3h7j s ALA 103 Cb -0.15 0.92 -0.02 0.00 0.00 0.00 0.00 23.12 23.88 3h7j s ALA 103 CO 0.04 -0.43 -0.19 0.42 0.00 0.00 0.00 175.76 175.59 3h7j s ILE 104 N -3.81 1.49 0.02 0.00 1.09 0.08 -0.20 121.20 119.88 3h7j s ILE 104 Ca 0.32 -0.87 0.03 0.00 -1.10 0.00 0.00 60.65 59.03 3h7j s ILE 104 Cb 0.07 -1.26 -0.01 0.00 -1.06 0.00 0.00 42.46 40.20 3h7j s ILE 104 CO 0.09 0.36 -0.09 -1.81 -0.10 0.00 0.00 174.94 173.40 3h7j s ASP 105 N -0.59 1.06 -0.14 3.58 1.01 0.24 -1.16 116.67 120.66 3h7j s ASP 105 Ca 0.07 -0.31 0.02 0.00 0.71 0.00 0.00 52.55 53.04 3h7j s ASP 105 Cb -0.07 -0.07 0.01 0.00 1.01 0.00 0.00 42.92 43.79 3h7j s ASP 105 CO -0.00 0.01 -0.21 -0.63 0.21 0.00 0.00 175.17 174.54 3h7j s ILE 106 N -0.62 2.15 -0.10 0.77 1.09 0.10 -1.07 121.20 123.53 3h7j s ILE 106 Ca -0.00 -0.96 0.00 0.00 -1.10 0.00 0.00 60.65 58.59 3h7j s ILE 106 Cb -0.06 -1.86 -0.02 0.00 -1.06 0.00 0.00 42.46 39.46 3h7j s ILE 106 CO 0.00 0.55 -0.09 -0.54 -0.10 0.00 0.00 174.94 174.76 3h7j s LYS 107 N 0.74 3.09 -0.02 2.79 1.02 -0.03 -1.25 119.74 126.09 3h7j s LYS 107 Ca -0.09 -0.60 -0.13 0.00 0.02 0.00 0.00 55.97 55.17 3h7j s LYS 107 Cb -0.16 -2.64 0.02 0.00 -0.52 0.00 0.00 37.83 34.53 3h7j s LYS 107 CO -0.00 0.44 0.27 0.50 -0.92 0.00 0.00 175.35 175.64 3h7j s ARG 108 N -0.21 0.60 -0.27 1.68 3.52 -0.85 -0.21 118.95 123.21 3h7j s ARG 108 Ca 0.02 -0.19 -0.01 0.00 -0.13 0.00 0.00 55.73 55.43 3h7j s ARG 108 Cb -0.13 0.26 0.16 0.00 -1.56 0.00 0.00 34.95 33.68 3h7j s ARG 108 CO 0.03 -0.16 0.47 -1.17 -0.81 0.00 0.00 175.30 173.66 3h7j s LEU 109 N -1.21 -0.98 -0.06 -0.88 2.96 -0.84 -1.55 118.68 116.12 3h7j s LEU 109 Ca -0.13 0.34 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 3h7j s LEU 109 Cb -0.05 1.52 0.01 0.00 0.50 0.00 0.00 46.19 48.17 3h7j s LEU 109 CO 0.03 -0.30 -0.12 -0.75 -1.32 0.00 0.00 176.35 173.89 3h7j s LYS 110 N 2.67 1.67 0.41 1.98 2.20 -1.26 -4.81 119.74 122.59 3h7j s LYS 110 Ca 0.15 -0.42 0.13 0.00 -0.36 0.00 0.00 55.97 55.47 3h7j s LYS 110 Cb -0.14 -1.39 0.97 0.00 -1.51 0.00 0.00 37.83 35.76 3h7j s LYS 110 CO -0.20 0.04 1.94 0.00 -0.36 0.00 0.00 175.35 176.76 3h7j h ALA 111 N 6.91 1.99 -0.86 3.13 0.00 -2.01 -2.69 119.26 125.73 3h7j h ALA 111 Ca -0.31 -0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.08 3h7j h ALA 111 Cb 1.19 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 18.62 3h7j h ALA 111 CO 0.48 -0.17 0.66 -0.40 0.00 0.00 0.00 179.25 179.82 3h7j n ASP 112 N -4.49 5.48 -4.20 0.00 3.85 -1.26 -4.92 116.55 111.02 3h7j n ASP 112 Ca 0.13 -3.50 -0.27 0.00 -0.71 0.00 0.00 54.79 50.44 3h7j n ASP 112 Cb 0.43 -0.89 -0.16 0.00 -1.35 0.00 0.00 41.12 39.15 3h7j n ASP 112 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 3h7j s GLU 113 N -3.08 1.81 -0.30 0.11 2.02 -1.02 -5.10 118.70 113.15 3h7j s GLU 113 Ca 0.53 -0.72 -0.08 0.00 0.02 0.00 0.00 54.97 54.72 3h7j s GLU 113 Cb 0.43 -1.66 0.01 0.00 0.10 0.00 0.00 34.13 33.00 3h7j s GLU 113 CO 0.04 0.37 0.11 0.99 0.02 0.00 0.00 175.26 176.79 3h7j s THR 114 N -0.28 4.17 -1.34 3.63 2.01 -1.26 -4.95 115.64 117.63 3h7j s THR 114 Ca 0.03 -0.62 -0.13 0.00 0.31 0.00 0.00 61.69 61.28 3h7j s THR 114 Cb -0.10 -3.15 0.11 0.00 0.01 0.00 0.00 72.50 69.37 3h7j s THR 114 CO 0.01 0.06 1.91 -1.22 -0.69 0.00 0.00 174.62 174.69 3h7j n TYR 115 N 4.90 3.75 -1.29 4.92 4.02 -1.26 -4.79 117.16 127.42 3h7j n TYR 115 Ca -0.14 -2.95 -0.31 0.00 -0.01 0.00 0.00 57.90 54.49 3h7j n TYR 115 Cb 0.48 -2.31 0.09 0.00 -0.02 0.00 0.00 39.34 37.58 3h7j n TYR 115 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 3h7j s THR 116 N 2.19 3.31 0.17 -0.72 -4.23 -1.26 -4.74 115.64 110.36 3h7j s THR 116 Ca 0.45 0.42 -0.15 0.00 -1.18 0.00 0.00 61.69 61.24 3h7j s THR 116 Cb 0.08 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 71.00 3h7j s THR 116 CO -0.02 -0.55 0.43 -0.94 -0.54 0.00 0.00 174.62 173.00 3h7j s SER 117 N -3.45 -0.17 0.61 3.99 1.04 -1.26 -4.90 113.70 109.57 3h7j s SER 117 Ca 0.61 -0.56 -0.18 0.00 0.48 0.00 0.00 55.95 56.30 3h7j s SER 117 Cb -0.17 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.44 3h7j s SER 117 CO 0.56 -0.97 1.20 -2.84 0.98 0.00 0.00 173.24 172.17 3h7j s PRO 118 N -3.88 2.88 0.09 4.02 0.02 -1.26 -4.84 135.00 132.02 3h7j s PRO 118 Ca 0.10 1.78 -0.18 0.00 0.02 0.00 0.00 61.00 62.72 3h7j s PRO 118 Cb 0.01 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 3h7j s PRO 118 CO -0.04 -1.27 0.94 -1.91 -0.33 0.00 0.00 177.00 174.40 3h7j n GLU 119 N -1.77 -0.25 -0.91 5.54 4.07 -1.26 -0.00 120.64 126.06 3h7j n GLU 119 Ca 0.13 0.93 0.04 0.00 -0.06 0.00 0.00 57.16 58.20 3h7j n GLU 119 Cb 0.50 -1.37 0.37 0.00 -0.06 0.00 0.00 31.44 30.88 3h7j n GLU 119 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 3h7j n ASP 120 N -4.55 5.42 0.00 4.31 8.00 -1.26 -4.95 116.55 123.52 3h7j n ASP 120 Ca 0.01 -2.97 0.00 0.00 0.71 0.00 0.00 54.79 52.54 3h7j n ASP 120 Cb 0.15 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 3h7j n ASP 120 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3h7j n TYR 121 N 0.43 0.00 -3.28 1.24 4.02 0.99 -4.89 117.16 115.68 3h7j n TYR 121 Ca 0.30 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.81 3h7j n TYR 121 Cb 1.22 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 40.48 3h7j n TYR 121 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 3h7j s PHE 122 N -0.02 3.69 -0.21 -0.72 0.40 -1.26 -0.58 117.98 119.27 3h7j s PHE 122 Ca 0.00 1.14 -0.10 0.00 -0.60 0.00 0.00 56.93 57.38 3h7j s PHE 122 Cb 0.00 -2.53 -0.05 0.00 0.51 0.00 0.00 43.02 40.95 3h7j s PHE 122 CO 0.00 0.42 0.12 -0.51 0.70 0.00 0.00 175.22 175.95 3h7j s LEU 123 N -0.39 4.05 0.51 -0.37 1.02 0.21 -4.82 118.68 118.89 3h7j s LEU 123 Ca 0.29 0.13 -0.04 0.00 0.02 0.00 0.00 54.13 54.53 3h7j s LEU 123 Cb -0.18 -2.06 -0.01 0.00 0.02 0.00 0.00 46.19 43.96 3h7j s LEU 123 CO 0.16 0.12 0.79 -1.81 0.02 0.00 0.00 176.35 175.63 3h7j s ASP 124 N 0.71 5.83 0.08 2.29 1.01 -1.26 -2.68 116.67 122.65 3h7j s ASP 124 Ca 0.07 0.61 -0.32 0.00 0.71 0.00 0.00 52.55 53.62 3h7j s ASP 124 Cb -0.13 -1.78 -0.11 0.00 1.01 0.00 0.00 42.92 41.92 3h7j s ASP 124 CO 0.01 -0.82 1.81 -0.38 0.21 0.00 0.00 175.17 176.00 3h7j n ILE 125 N -2.33 0.36 -0.05 0.77 5.41 -1.26 -4.65 119.36 117.61 3h7j n ILE 125 Ca 0.02 -0.06 -0.12 0.00 1.00 0.00 0.00 62.75 63.58 3h7j n ILE 125 Cb 0.57 -1.97 -0.11 0.00 -0.71 0.00 0.00 39.64 37.41 3h7j n ILE 125 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 3h7j h PHE 126 N 8.30 -0.01 -1.97 1.39 3.04 -1.00 -3.49 116.94 123.19 3h7j h PHE 126 Ca -0.47 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.47 3h7j h PHE 126 Cb 1.24 0.00 -0.21 0.00 2.56 0.00 0.00 35.95 39.54 3h7j h PHE 126 CO 0.79 0.80 0.11 0.21 -2.02 0.00 0.00 178.31 178.20 3h7j s LYS 127 N -2.48 0.77 -0.12 1.11 2.47 -1.25 -4.99 119.74 115.26 3h7j s LYS 127 Ca -0.17 1.06 -0.00 0.00 -1.56 0.00 0.00 55.97 55.30 3h7j s LYS 127 Cb -0.02 0.30 -0.02 0.00 -1.46 0.00 0.00 37.83 36.63 3h7j s LYS 127 CO 0.61 -0.12 -0.10 0.99 0.16 0.00 0.00 175.35 176.90 3h7j s THR 128 N 0.83 3.34 0.19 3.43 2.01 -1.26 -0.82 115.64 123.37 3h7j s THR 128 Ca -0.04 -0.57 -0.19 0.00 0.31 0.00 0.00 61.69 61.20 3h7j s THR 128 Cb -0.05 -2.40 0.07 0.00 0.01 0.00 0.00 72.50 70.13 3h7j s THR 128 CO -0.07 0.54 0.91 -2.11 -0.69 0.00 0.00 174.62 173.20 3h7j n ARG 129 N 3.17 0.64 -3.34 4.92 1.85 -0.47 -4.99 116.66 118.44 3h7j n ARG 129 Ca -0.18 -1.41 -0.38 0.00 -1.00 0.00 0.00 57.85 54.88 3h7j n ARG 129 Cb 0.53 1.89 -0.06 0.00 -1.05 0.00 0.00 32.46 33.77 3h7j n ARG 129 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3h7j s ASP 130 N -3.18 6.78 -0.04 2.89 1.11 -1.26 0.52 116.67 123.50 3h7j s ASP 130 Ca 0.20 0.93 -0.20 0.00 0.18 0.00 0.00 52.55 53.66 3h7j s ASP 130 Cb -0.03 -2.29 -0.32 0.00 1.07 0.00 0.00 42.92 41.35 3h7j s ASP 130 CO 0.06 0.12 0.87 0.25 1.18 0.00 0.00 175.17 177.64 3h7j h LEU 131 N 5.91 0.53 -8.87 1.23 5.85 -1.32 -3.47 115.31 115.18 3h7j h LEU 131 Ca -0.45 -0.94 -0.35 0.00 0.84 0.00 0.00 57.88 56.99 3h7j h LEU 131 Cb 1.19 -0.17 -0.14 0.00 0.37 0.00 0.00 40.66 41.91 3h7j h LEU 131 CO 0.70 1.49 -0.62 -0.76 -0.34 0.00 0.00 178.44 178.91 3h7j s LEU 132 N -7.78 1.75 0.06 2.25 1.43 -1.25 -5.04 118.68 110.09 3h7j s LEU 132 Ca -0.14 -1.35 -0.35 0.00 -1.03 0.00 0.00 54.13 51.27 3h7j s LEU 132 Cb 0.02 -0.02 -0.14 0.00 0.03 0.00 0.00 46.19 46.08 3h7j s LEU 132 CO 0.85 -0.69 1.61 -2.65 0.23 0.00 0.00 176.35 175.70 3h7j n PRO 133 N -0.44 1.89 -0.57 1.29 -0.02 -1.26 -0.92 135.00 134.96 3h7j n PRO 133 Ca -0.01 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3h7j n PRO 133 Cb 0.66 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3h7j n PRO 133 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h7j n GLY 134 N 3.52 1.04 3.32 -1.23 0.00 -1.26 -4.96 105.19 105.62 3h7j n GLY 134 Ca 0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.75 3h7j n GLY 134 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3h7j s MET 135 N -0.25 3.49 0.08 1.61 0.00 -0.09 -4.54 119.30 119.61 3h7j s MET 135 Ca 0.00 -2.35 -0.30 0.00 0.00 0.00 0.00 55.69 53.03 3h7j s MET 135 Cb 0.00 -4.40 -0.06 0.00 0.00 0.00 0.00 34.83 30.37 3h7j s MET 135 CO 0.00 -1.29 1.18 -2.00 0.00 0.00 0.00 175.02 172.91 3h7j s GLU 136 N 0.37 4.46 0.13 4.11 2.12 -1.23 -0.82 118.70 127.84 3h7j s GLU 136 Ca 0.16 1.77 0.08 0.00 0.36 0.00 0.00 54.97 57.34 3h7j s GLU 136 Cb -0.13 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 3h7j s GLU 136 CO -0.07 -0.20 -0.20 0.14 -0.54 0.00 0.00 175.26 174.39 3h7j s VAL 137 N 0.82 1.78 -0.03 3.70 -7.23 0.18 -1.35 120.40 118.27 3h7j s VAL 137 Ca 0.57 -1.72 0.04 0.00 -1.81 0.00 0.00 61.98 59.05 3h7j s VAL 137 Cb -0.30 -1.70 -0.00 0.00 0.56 0.00 0.00 36.38 34.94 3h7j s VAL 137 CO 0.30 -0.17 -0.13 -0.89 -0.31 0.00 0.00 175.10 173.90 3h7j s THR 138 N -1.57 1.11 0.17 5.32 2.01 -0.28 -1.37 115.64 121.04 3h7j s THR 138 Ca 0.11 -0.55 0.09 0.00 0.31 0.00 0.00 61.69 61.65 3h7j s THR 138 Cb -0.08 -0.96 -0.04 0.00 0.01 0.00 0.00 72.50 71.43 3h7j s THR 138 CO 0.05 0.33 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.82 3h7j s PHE 139 N 0.05 2.56 -0.03 4.92 0.40 0.00 -0.35 117.98 125.54 3h7j s PHE 139 Ca -0.02 -0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.06 3h7j s PHE 139 Cb -0.09 -1.27 0.03 0.00 0.51 0.00 0.00 43.02 42.19 3h7j s PHE 139 CO 0.01 0.49 -0.00 -0.06 0.70 0.00 0.00 175.22 176.36 3h7j s PHE 140 N -1.60 0.34 -0.04 0.36 0.08 -0.29 -0.25 117.98 116.58 3h7j s PHE 140 Ca 0.23 -0.01 0.01 0.00 0.12 0.00 0.00 56.93 57.28 3h7j s PHE 140 Cb -0.09 -0.42 0.02 0.00 -0.57 0.00 0.00 43.02 41.96 3h7j s PHE 140 CO 0.13 -0.13 -0.04 0.08 -0.10 0.00 0.00 175.22 175.16 3h7j s VAL 141 N 1.01 0.50 0.44 -0.44 1.01 -1.26 -0.54 120.40 121.11 3h7j s VAL 141 Ca -0.10 -0.13 0.03 0.00 0.00 0.00 0.00 61.98 61.78 3h7j s VAL 141 Cb -0.14 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 3h7j s VAL 141 CO -0.02 0.20 0.08 -0.70 0.00 0.00 0.00 175.10 174.67 3h7j s GLU 142 N 0.72 2.01 0.35 2.72 2.56 0.54 -5.03 118.70 122.57 3h7j s GLU 142 Ca -0.09 -2.24 0.03 0.00 0.00 0.00 0.00 54.97 52.67 3h7j s GLU 142 Cb -0.12 -0.96 0.63 0.00 2.00 0.00 0.00 34.13 35.68 3h7j s GLU 142 CO 0.00 -0.41 1.96 -0.44 -0.56 0.00 0.00 175.26 175.80 3h7j h ASP 143 N 1.65 0.63 -0.01 -1.70 3.32 -1.96 -3.10 116.42 115.26 3h7j h ASP 143 Ca -0.39 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.61 3h7j h ASP 143 Cb 1.29 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.68 3h7j h ASP 143 CO 0.64 0.54 -0.30 -2.67 -1.72 0.00 0.00 179.24 175.72 3h7j n TRP 144 N -4.38 0.00 -3.71 4.55 4.27 -1.26 -4.43 117.44 112.48 3h7j n TRP 144 Ca 0.04 0.00 -0.13 0.00 -3.89 0.00 0.00 57.50 53.52 3h7j n TRP 144 Cb 0.13 0.00 -0.09 0.00 -1.36 0.00 0.00 31.31 29.98 3h7j n TRP 144 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 3h7j s VAL 145 N -1.68 -0.00 -0.13 -1.67 0.11 -1.17 -4.24 120.40 111.61 3h7j s VAL 145 Ca 0.10 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 3h7j s VAL 145 Cb 0.10 -0.67 0.02 0.00 -1.53 0.00 0.00 36.38 34.30 3h7j s VAL 145 CO 0.35 0.00 -0.11 -0.70 -3.33 0.00 0.00 175.10 171.31 3h7j s GLU 146 N 0.43 1.91 -0.18 1.54 2.12 -0.62 -0.34 118.70 123.57 3h7j s GLU 146 Ca -0.01 -0.41 -0.13 0.00 0.36 0.00 0.00 54.97 54.77 3h7j s GLU 146 Cb -0.04 -1.83 -0.05 0.00 0.26 0.00 0.00 34.13 32.47 3h7j s GLU 146 CO -0.02 -0.23 0.28 0.42 -0.54 0.00 0.00 175.26 175.17 3h7j s ILE 147 N 1.54 5.31 -0.23 -3.70 1.01 0.30 -0.86 121.20 124.56 3h7j s ILE 147 Ca 0.04 0.50 0.01 0.00 0.00 0.00 0.00 60.65 61.19 3h7j s ILE 147 Cb -0.13 -3.62 0.06 0.00 0.01 0.00 0.00 42.46 38.78 3h7j s ILE 147 CO -0.09 0.37 -0.07 -0.32 0.00 0.00 0.00 174.94 174.83 3h7j s MET 148 N 0.67 1.75 0.01 2.79 1.75 0.13 -1.14 119.30 125.26 3h7j s MET 148 Ca 0.15 -0.97 -0.28 0.00 -1.25 0.00 0.00 55.69 53.33 3h7j s MET 148 Cb -0.13 -2.56 -0.04 0.00 2.84 0.00 0.00 34.83 34.94 3h7j s MET 148 CO 0.04 -0.55 0.91 -0.51 -0.65 0.00 0.00 175.02 174.25 3h7j s LEU 149 N 1.38 4.39 -0.05 4.11 1.02 0.52 -1.31 118.68 128.74 3h7j s LEU 149 Ca -0.05 1.58 0.05 0.00 0.02 0.00 0.00 54.13 55.73 3h7j s LEU 149 Cb -0.18 -3.46 -0.01 0.00 0.02 0.00 0.00 46.19 42.56 3h7j s LEU 149 CO -0.07 -0.17 -0.19 0.00 0.02 0.00 0.00 176.35 175.94 3h7j s ALA 150 N 0.69 1.71 -0.22 4.21 0.00 0.28 -1.12 121.76 127.32 3h7j s ALA 150 Ca 0.47 -0.79 -0.07 0.00 0.00 0.00 0.00 51.96 51.57 3h7j s ALA 150 Cb -0.21 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.32 3h7j s ALA 150 CO 0.26 0.31 0.05 0.15 0.00 0.00 0.00 175.76 176.54 3h7j s LYS 151 N -0.01 3.76 -0.24 0.00 1.02 -0.46 -1.64 119.74 122.17 3h7j s LYS 151 Ca -0.04 -0.44 -0.08 0.00 0.02 0.00 0.00 55.97 55.43 3h7j s LYS 151 Cb -0.12 -3.23 -0.03 0.00 -0.52 0.00 0.00 37.83 33.92 3h7j s LYS 151 CO 0.03 0.01 0.08 0.42 -0.92 0.00 0.00 175.35 174.97 3h7j s ILE 152 N 1.06 4.48 0.72 2.17 1.01 -0.08 -3.53 121.20 127.03 3h7j s ILE 152 Ca 0.04 -0.12 -0.14 0.00 0.00 0.00 0.00 60.65 60.42 3h7j s ILE 152 Cb -0.14 -3.08 0.03 0.00 0.01 0.00 0.00 42.46 39.28 3h7j s ILE 152 CO 0.03 0.35 1.16 -2.84 0.00 0.00 0.00 174.94 173.64 3h7j s PRO 153 N 1.39 2.30 1.13 2.79 0.02 -1.26 -0.21 135.00 141.15 3h7j s PRO 153 Ca 0.05 1.58 -0.19 0.00 0.02 0.00 0.00 61.00 62.46 3h7j s PRO 153 Cb -0.15 -1.87 0.28 0.00 0.02 0.00 0.00 34.50 32.78 3h7j s PRO 153 CO 0.04 -1.68 0.99 0.41 -0.33 0.00 0.00 177.00 176.43 3h7j n GLY 154 N -0.03 -2.79 4.08 0.52 0.00 -1.23 -2.17 105.19 103.56 3h7j n GLY 154 Ca 0.12 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.35 3h7j n GLY 154 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3h7j n ASN 155 N -4.74 -1.99 0.00 1.61 4.13 0.62 -3.34 115.26 111.54 3h7j n ASN 155 Ca 0.14 -0.99 0.00 0.00 1.68 0.00 0.00 54.58 55.40 3h7j n ASN 155 Cb 0.54 -2.97 0.00 0.00 -1.54 0.00 0.00 39.78 35.81 3h7j n ASN 155 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3h7j n GLY 156 N -1.72 1.10 3.61 7.41 0.00 0.17 -5.00 105.19 110.76 3h7j n GLY 156 Ca -0.11 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.45 3h7j n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7j n GLY 157 N -1.67 0.06 3.03 -0.02 0.00 -0.92 -4.71 105.19 100.95 3h7j n GLY 157 Ca 0.00 0.42 -0.13 0.00 0.00 0.00 0.00 46.02 46.31 3h7j n GLY 157 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h7j s GLU 158 N -1.02 0.17 -0.44 1.61 2.12 -1.26 -0.74 118.70 119.15 3h7j s GLU 158 Ca 0.64 0.62 -0.23 0.00 0.36 0.00 0.00 54.97 56.37 3h7j s GLU 158 Cb -0.73 -0.09 0.02 0.00 0.26 0.00 0.00 34.13 33.59 3h7j s GLU 158 CO 0.56 -0.22 0.75 1.41 -0.54 0.00 0.00 175.26 177.22 3h7j s MET 159 N 1.78 3.42 0.78 4.30 -2.45 -0.14 -4.99 119.30 122.01 3h7j s MET 159 Ca -0.04 -0.11 -0.15 0.00 -1.25 0.00 0.00 55.69 54.14 3h7j s MET 159 Cb -0.11 -3.92 0.03 0.00 1.25 0.00 0.00 34.83 32.08 3h7j s MET 159 CO -0.08 -1.06 0.92 -2.30 1.05 0.00 0.00 175.02 173.55 3h7j n PRO 160 N 6.59 0.25 -2.28 4.11 -0.02 -1.26 -1.98 135.00 140.40 3h7j n PRO 160 Ca 0.02 0.15 -0.42 0.00 -2.02 0.00 0.00 63.50 61.22 3h7j n PRO 160 Cb 0.48 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.74 3h7j n PRO 160 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3h7j s PHE 161 N -2.02 2.96 0.36 6.00 5.99 -1.26 -4.58 117.98 125.42 3h7j s PHE 161 Ca 0.70 0.93 -0.07 0.00 0.00 0.00 0.00 56.93 58.49 3h7j s PHE 161 Cb -0.31 -3.60 0.02 0.00 0.00 0.00 0.00 43.02 39.14 3h7j s PHE 161 CO 0.54 -2.14 0.60 -3.38 -0.00 0.00 0.00 175.22 170.84 3h7j s HIS 162 N 2.30 0.71 0.06 10.12 -3.43 -0.18 -4.90 115.29 119.97 3h7j s HIS 162 Ca 0.62 -1.12 -0.03 0.00 -0.80 0.00 0.00 55.06 53.73 3h7j s HIS 162 Cb -0.30 0.27 -0.03 0.00 -1.43 0.00 0.00 32.58 31.09 3h7j s HIS 162 CO 0.25 -1.32 0.02 -1.59 -2.00 0.00 0.00 174.74 170.10 3h7j s LYS 163 N -2.72 0.67 0.19 -0.38 -2.85 -1.26 -0.65 119.74 112.73 3h7j s LYS 163 Ca 0.25 -1.17 -0.21 0.00 -1.00 0.00 0.00 55.97 53.84 3h7j s LYS 163 Cb -0.02 0.24 0.05 0.00 -2.06 0.00 0.00 37.83 36.03 3h7j s LYS 163 CO 0.17 -0.15 0.59 -3.38 0.10 0.00 0.00 175.35 172.69 3h7j s HIS 164 N -3.91 -0.32 0.26 1.78 -3.43 -1.26 -4.97 115.29 103.44 3h7j s HIS 164 Ca 0.07 0.02 0.20 0.00 -0.80 0.00 0.00 55.06 54.55 3h7j s HIS 164 Cb 0.07 0.52 0.91 0.00 -1.43 0.00 0.00 32.58 32.66 3h7j s HIS 164 CO -0.10 -0.94 1.85 0.07 -2.00 0.00 0.00 174.74 173.62 3h7j h ARG 165 N 2.08 0.00 -6.64 -0.38 0.11 -1.96 0.16 114.38 107.75 3h7j h ARG 165 Ca -0.29 0.00 -0.52 0.00 0.10 0.00 0.00 59.98 59.27 3h7j h ARG 165 Cb 1.28 0.00 0.06 0.00 1.11 0.00 0.00 29.97 32.42 3h7j h ARG 165 CO 0.35 0.29 1.03 -0.80 0.10 0.00 0.00 179.97 180.95 3h7j s ASN 166 N -6.43 6.38 0.55 0.08 -0.87 -1.26 -4.38 114.94 109.02 3h7j s ASN 166 Ca -0.01 2.86 -0.21 0.00 -1.57 0.00 0.00 52.86 53.93 3h7j s ASN 166 Cb 0.12 -2.59 -0.05 0.00 -0.02 0.00 0.00 41.25 38.71 3h7j s ASN 166 CO 0.66 -0.98 1.27 -0.70 -2.57 0.00 0.00 177.10 174.79 3h7j s GLU 167 N 1.42 3.15 -0.14 -0.60 2.12 0.86 -4.52 118.70 120.98 3h7j s GLU 167 Ca 0.76 2.02 -0.05 0.00 0.36 0.00 0.00 54.97 58.05 3h7j s GLU 167 Cb -0.49 -2.15 0.07 0.00 0.26 0.00 0.00 34.13 31.81 3h7j s GLU 167 CO 0.33 -1.12 0.30 -1.14 -0.54 0.00 0.00 175.26 173.09 3h7j s GLN 168 N -3.03 0.20 0.10 4.30 0.74 -0.14 -1.35 119.66 120.48 3h7j s GLN 168 Ca 0.73 0.79 0.06 0.00 0.05 0.00 0.00 55.36 56.99 3h7j s GLN 168 Cb -0.35 0.04 -0.03 0.00 1.10 0.00 0.00 33.01 33.76 3h7j s GLN 168 CO 0.40 -0.26 -0.15 0.96 -0.55 0.00 0.00 175.29 175.70 3h7j s ILE 169 N 2.31 1.28 0.32 -2.34 -4.36 -0.37 0.14 121.20 118.19 3h7j s ILE 169 Ca -0.01 -1.54 -0.17 0.00 -0.26 0.00 0.00 60.65 58.67 3h7j s ILE 169 Cb -0.12 -1.35 0.03 0.00 1.25 0.00 0.00 42.46 42.27 3h7j s ILE 169 CO -0.10 -0.30 0.72 -0.83 0.24 0.00 0.00 174.94 174.67 3h7j s GLY 170 N -2.11 0.22 -0.13 6.27 0.00 -0.15 0.96 107.32 112.38 3h7j s GLY 170 Ca 0.04 -0.60 -0.09 0.00 0.00 0.00 0.00 44.72 44.08 3h7j s GLY 170 CO 0.03 -0.27 0.33 -1.50 0.00 0.00 0.00 173.10 171.69 3h7j s ILE 171 N -3.21 -0.02 0.10 0.90 2.07 0.16 -0.41 121.20 120.80 3h7j s ILE 171 Ca 0.15 0.07 -0.30 0.00 -1.41 0.00 0.00 60.65 59.15 3h7j s ILE 171 Cb -0.05 -0.49 -0.06 0.00 0.13 0.00 0.00 42.46 41.99 3h7j s ILE 171 CO 0.10 0.03 1.18 0.00 -1.91 0.00 0.00 174.94 174.34 3h7j n ILE 173 N 3.42 1.14 0.00 0.00 -5.35 0.40 -0.38 119.36 118.59 3h7j n ILE 173 Ca 0.07 -1.37 0.00 0.00 -0.27 0.00 0.00 62.75 61.18 3h7j n ILE 173 Cb 0.46 0.06 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 3h7j n ILE 173 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h7j n GLY 174 N -0.87 1.22 7.00 3.28 0.00 -1.11 -4.81 105.19 109.90 3h7j n GLY 174 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.13 3h7j n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h7j n GLY 175 N -0.00 1.41 3.57 -0.02 0.00 -1.26 -1.82 105.19 107.06 3h7j n GLY 175 Ca 0.00 -0.67 -0.07 0.00 0.00 0.00 0.00 46.02 45.28 3h7j n GLY 175 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h7j s GLY 176 N -0.84 -0.41 0.05 -0.02 0.00 -1.26 -4.09 107.32 100.74 3h7j s GLY 176 Ca 0.00 0.77 -0.28 0.00 0.00 0.00 0.00 44.72 45.21 3h7j s GLY 176 CO 0.00 0.24 1.17 -2.52 0.00 0.00 0.00 173.10 172.00 3h7j s TYR 177 N -3.16 -0.07 -0.17 1.90 1.13 -1.19 -4.73 117.35 111.06 3h7j s TYR 177 Ca 0.07 -0.11 -0.13 0.00 -1.41 0.00 0.00 57.07 55.48 3h7j s TYR 177 Cb -0.01 0.58 -0.05 0.00 -1.10 0.00 0.00 41.96 41.39 3h7j s TYR 177 CO -0.06 -0.48 0.27 -0.51 -2.51 0.00 0.00 175.55 172.27 3h7j s ASP 178 N -3.00 6.39 -0.05 -0.18 1.11 -0.24 -0.17 116.67 120.53 3h7j s ASP 178 Ca 0.14 0.45 0.06 0.00 0.18 0.00 0.00 52.55 53.39 3h7j s ASP 178 Cb 0.03 -2.17 -0.01 0.00 1.07 0.00 0.00 42.92 41.83 3h7j s ASP 178 CO -0.02 0.10 -0.24 -0.32 1.18 0.00 0.00 175.17 175.87 3h7j s MET 179 N 0.54 2.33 -0.09 8.23 -2.45 -0.04 -1.66 119.30 126.16 3h7j s MET 179 Ca 0.15 -0.87 0.03 0.00 -1.25 0.00 0.00 55.69 53.75 3h7j s MET 179 Cb -0.13 -2.05 0.00 0.00 1.25 0.00 0.00 34.83 33.91 3h7j s MET 179 CO 0.03 0.41 -0.21 0.99 1.05 0.00 0.00 175.02 177.29 3h7j s THR 180 N -0.26 1.83 -0.11 10.11 2.01 -0.24 -0.61 115.64 128.36 3h7j s THR 180 Ca -0.00 -0.88 0.03 0.00 0.31 0.00 0.00 61.69 61.15 3h7j s THR 180 Cb -0.12 -1.59 0.01 0.00 0.01 0.00 0.00 72.50 70.80 3h7j s THR 180 CO 0.02 0.51 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.56 3h7j s VAL 181 N 0.46 1.88 0.00 3.82 1.01 -0.56 -1.87 120.40 125.14 3h7j s VAL 181 Ca -0.17 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 60.92 3h7j s VAL 181 Cb -0.17 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.55 3h7j s VAL 181 CO 0.07 0.52 0.00 -0.62 0.00 0.00 0.00 175.10 175.07 3h7j n GLU 182 N 3.88 0.00 -0.52 2.72 -0.58 0.93 -1.17 120.64 125.90 3h7j n GLU 182 Ca -0.20 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.60 3h7j n GLU 182 Cb 0.52 0.00 0.26 0.00 -0.57 0.00 0.00 31.44 31.65 3h7j n GLU 182 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h7j n GLY 183 N 0.00 2.21 2.98 0.62 0.00 -1.26 -4.88 105.19 104.86 3h7j n GLY 183 Ca 0.00 -0.60 -0.28 0.00 0.00 0.00 0.00 46.02 45.14 3h7j n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h7j s THR 185 N 1.47 3.81 0.04 0.00 2.01 -1.26 -1.49 115.64 120.23 3h7j s THR 185 Ca 0.03 -0.42 0.04 0.00 0.31 0.00 0.00 61.69 61.64 3h7j s THR 185 Cb -0.13 -2.59 -0.02 0.00 0.01 0.00 0.00 72.50 69.76 3h7j s THR 185 CO -0.08 0.57 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.62 3h7j s VAL 186 N -0.50 0.89 -0.54 3.82 1.01 0.21 -4.97 120.40 120.33 3h7j s VAL 186 Ca 0.08 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.81 3h7j s VAL 186 Cb -0.12 -0.85 0.04 0.00 0.00 0.00 0.00 36.38 35.45 3h7j s VAL 186 CO 0.02 -0.13 0.96 -1.61 0.00 0.00 0.00 175.10 174.34 3h7j s GLU 187 N -1.26 3.37 0.29 2.72 2.02 -1.26 -0.86 118.70 123.73 3h7j s GLU 187 Ca -0.02 -0.16 -0.29 0.00 0.02 0.00 0.00 54.97 54.52 3h7j s GLU 187 Cb -0.08 -4.03 -0.10 0.00 0.10 0.00 0.00 34.13 30.02 3h7j s GLU 187 CO 0.01 -1.46 1.24 -1.64 0.02 0.00 0.00 175.26 173.43 3h7j s MET 188 N 3.99 4.45 0.37 1.61 -1.94 0.76 -4.91 119.30 123.64 3h7j s MET 188 Ca 0.32 2.06 0.05 0.00 -1.71 0.00 0.00 55.69 56.41 3h7j s MET 188 Cb -0.12 -3.13 -0.06 0.00 2.01 0.00 0.00 34.83 33.53 3h7j s MET 188 CO 0.21 -0.07 0.05 0.15 -0.01 0.00 0.00 175.02 175.34 3h7j s LYS 189 N -1.41 1.82 -0.07 2.03 1.02 -1.26 -3.16 119.74 118.71 3h7j s LYS 189 Ca 0.49 -2.04 -0.37 0.00 0.02 0.00 0.00 55.97 54.06 3h7j s LYS 189 Cb -0.37 -1.13 -0.15 0.00 -0.52 0.00 0.00 37.83 35.66 3h7j s LYS 189 CO 0.47 -0.19 1.60 0.34 -0.92 0.00 0.00 175.35 176.65 3h7j n PHE 190 N -0.84 1.92 -0.01 3.18 7.35 -1.26 -1.26 117.46 126.53 3h7j n PHE 190 Ca -0.05 0.47 0.00 0.00 -0.76 0.00 0.00 57.45 57.11 3h7j n PHE 190 Cb 0.67 -2.45 0.00 0.00 0.35 0.00 0.00 39.48 38.04 3h7j n PHE 190 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3h7j n GLY 191 N 3.53 0.73 3.72 7.13 0.00 0.49 -5.00 105.19 115.78 3h7j n GLY 191 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 3h7j n GLY 191 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h7j s THR 192 N -2.26 4.07 -0.02 2.61 2.01 -0.39 -4.78 115.64 116.88 3h7j s THR 192 Ca 0.00 1.59 0.02 0.00 0.31 0.00 0.00 61.69 63.60 3h7j s THR 192 Cb 0.00 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 3h7j s THR 192 CO 0.00 0.18 -0.03 0.00 -0.69 0.00 0.00 174.62 174.08 3h7j s ALA 193 N 0.56 3.17 0.12 7.40 0.00 -1.26 -1.33 121.76 130.42 3h7j s ALA 193 Ca 0.54 -0.95 0.08 0.00 0.00 0.00 0.00 51.96 51.64 3h7j s ALA 193 Cb -0.28 -1.28 -0.04 0.00 0.00 0.00 0.00 23.12 21.52 3h7j s ALA 193 CO 0.31 0.62 -0.20 1.52 0.00 0.00 0.00 175.76 178.01 3h7j s TYR 194 N -1.01 1.82 -0.16 0.00 -0.85 0.46 -4.34 117.35 113.26 3h7j s TYR 194 Ca 0.17 -0.43 -0.02 0.00 -0.52 0.00 0.00 57.07 56.27 3h7j s TYR 194 Cb -0.11 -0.97 0.05 0.00 0.38 0.00 0.00 41.96 41.31 3h7j s TYR 194 CO 0.08 0.25 0.01 -0.06 -1.52 0.00 0.00 175.55 174.31 3h7j s PHE 195 N -1.41 1.07 -0.28 -3.49 0.08 -0.21 -0.98 117.98 112.76 3h7j s PHE 195 Ca 0.09 -0.75 -0.05 0.00 0.12 0.00 0.00 56.93 56.34 3h7j s PHE 195 Cb -0.09 -1.03 0.02 0.00 -0.57 0.00 0.00 43.02 41.35 3h7j s PHE 195 CO 0.05 -0.55 0.03 0.00 -0.10 0.00 0.00 175.22 174.65 3h7j s GLU 197 N 1.43 0.81 0.22 0.00 0.41 -1.26 -0.97 118.70 119.35 3h7j s GLU 197 Ca 0.02 0.91 -0.32 0.00 -0.41 0.00 0.00 54.97 55.16 3h7j s GLU 197 Cb -0.17 -1.75 -0.14 0.00 -1.78 0.00 0.00 34.13 30.29 3h7j s GLU 197 CO -0.00 -2.57 1.33 -2.30 -0.49 0.00 0.00 175.26 171.23 3h7j n PRO 198 N -4.12 1.77 -1.16 0.39 -0.02 -1.26 -1.90 135.00 128.70 3h7j n PRO 198 Ca 0.07 0.63 -0.06 0.00 -2.02 0.00 0.00 63.50 62.12 3h7j n PRO 198 Cb 0.55 -2.24 -0.02 0.00 -0.02 0.00 0.00 33.50 31.77 3h7j n PRO 198 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3h7j n ARG 199 N 1.91 -0.73 -3.05 -0.52 1.74 0.55 -4.98 116.66 111.58 3h7j n ARG 199 Ca 0.12 0.59 -0.40 0.00 -0.77 0.00 0.00 57.85 57.39 3h7j n ARG 199 Cb 0.30 -4.39 -0.05 0.00 -1.02 0.00 0.00 32.46 27.29 3h7j n ARG 199 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3h7j s GLU 200 N -2.05 4.24 0.48 5.56 2.02 -0.80 -4.82 118.70 123.34 3h7j s GLU 200 Ca 0.00 0.73 -0.24 0.00 0.02 0.00 0.00 54.97 55.48 3h7j s GLU 200 Cb 0.00 -3.57 -0.07 0.00 0.10 0.00 0.00 34.13 30.59 3h7j s GLU 200 CO 0.00 -0.26 1.39 -0.51 0.02 0.00 0.00 175.26 175.90 3h7j s ASP 201 N 1.17 5.71 0.10 -0.19 -0.00 -1.26 -4.67 116.67 117.54 3h7j s ASP 201 Ca 0.32 2.84 -0.25 0.00 -0.00 0.00 0.00 52.55 55.45 3h7j s ASP 201 Cb -0.16 -2.65 0.08 0.00 -0.00 0.00 0.00 42.92 40.19 3h7j s ASP 201 CO 0.11 -1.28 0.75 -1.38 -0.00 0.00 0.00 175.17 173.37 3h7j s HIS 202 N -1.25 -0.41 -0.03 4.23 -3.43 0.18 -0.05 115.29 114.54 3h7j s HIS 202 Ca 0.64 0.20 -0.26 0.00 -0.80 0.00 0.00 55.06 54.84 3h7j s HIS 202 Cb -0.42 0.57 0.09 0.00 -1.43 0.00 0.00 32.58 31.38 3h7j s HIS 202 CO 0.52 -0.75 1.18 0.41 -2.00 0.00 0.00 174.74 174.10 3h7j n GLY 203 N -0.34 0.24 3.52 -1.38 0.00 -0.78 -1.00 105.19 105.44 3h7j n GLY 203 Ca -0.12 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.73 3h7j n GLY 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h7j s ALA 204 N -1.92 -1.54 -0.02 4.61 0.00 -0.84 -1.08 121.76 120.97 3h7j s ALA 204 Ca 0.28 1.64 0.00 0.00 0.00 0.00 0.00 51.96 53.88 3h7j s ALA 204 Cb -0.01 -0.85 0.03 0.00 0.00 0.00 0.00 23.12 22.29 3h7j s ALA 204 CO -0.01 -0.30 0.02 -1.50 0.00 0.00 0.00 175.76 173.97 3h7j s ILE 205 N 0.07 0.01 -0.55 0.00 2.07 -0.67 -0.96 121.20 121.16 3h7j s ILE 205 Ca -0.02 0.19 -0.17 0.00 -1.41 0.00 0.00 60.65 59.24 3h7j s ILE 205 Cb -0.04 -0.14 0.12 0.00 0.13 0.00 0.00 42.46 42.54 3h7j s ILE 205 CO 0.02 0.11 0.55 0.21 -1.91 0.00 0.00 174.94 173.92 3h7j s ASN 206 N 1.09 6.19 0.00 4.50 3.84 0.09 -1.08 114.94 129.56 3h7j s ASN 206 Ca -0.09 -1.70 0.16 0.00 0.21 0.00 0.00 52.86 51.44 3h7j s ASN 206 Cb -0.13 -2.23 0.45 0.00 -0.55 0.00 0.00 41.25 38.79 3h7j s ASN 206 CO -0.03 -0.92 1.37 -2.11 -2.79 0.00 0.00 177.10 172.62 3h7j n ARG 207 N 5.52 2.15 -1.76 0.43 1.85 -1.26 0.42 116.66 124.01 3h7j n ARG 207 Ca -0.13 -1.78 -0.29 0.00 -1.00 0.00 0.00 57.85 54.65 3h7j n ARG 207 Cb 0.41 -1.39 0.13 0.00 -1.05 0.00 0.00 32.46 30.55 3h7j n ARG 207 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3h7j s SER 208 N -1.03 3.79 0.17 2.89 1.04 -1.26 -4.48 113.70 114.81 3h7j s SER 208 Ca 0.33 0.73 -0.05 0.00 0.48 0.00 0.00 55.95 57.44 3h7j s SER 208 Cb 0.17 -1.15 0.06 0.00 0.10 0.00 0.00 66.02 65.20 3h7j s SER 208 CO 0.23 -2.35 1.47 1.05 0.98 0.00 0.00 173.24 174.62 3h7j h GLU 209 N -1.37 0.61 -6.20 4.02 -0.00 -1.93 1.81 114.58 111.53 3h7j h GLU 209 Ca -0.47 -0.40 -0.51 0.00 -0.00 0.00 0.00 59.36 57.98 3h7j h GLU 209 Cb 1.31 0.05 -0.05 0.00 -0.00 0.00 0.00 28.75 30.07 3h7j h GLU 209 CO 0.58 1.02 -0.51 0.15 -0.00 0.00 0.00 179.01 180.25 3h7j s LYS 210 N -3.96 2.84 0.68 1.06 1.02 -1.26 -4.54 119.74 115.57 3h7j s LYS 210 Ca -0.08 -1.14 -0.15 0.00 0.02 0.00 0.00 55.97 54.63 3h7j s LYS 210 Cb 0.11 -2.52 0.01 0.00 -0.52 0.00 0.00 37.83 34.91 3h7j s LYS 210 CO 0.85 0.32 1.13 -1.83 -0.92 0.00 0.00 175.35 174.91 3h7j s GLU 211 N -3.87 2.63 0.20 1.68 -1.05 -1.26 -3.56 118.70 113.47 3h7j s GLU 211 Ca 0.35 1.47 0.08 0.00 -0.15 0.00 0.00 54.97 56.72 3h7j s GLU 211 Cb -0.07 -1.92 -0.05 0.00 -0.44 0.00 0.00 34.13 31.65 3h7j s GLU 211 CO 0.25 -1.39 -0.16 -1.54 0.95 0.00 0.00 175.26 173.36 3h7j s SER 212 N -2.47 2.72 -0.01 0.83 1.04 0.70 -4.42 113.70 112.10 3h7j s SER 212 Ca 0.68 -0.96 0.06 0.00 0.48 0.00 0.00 55.95 56.21 3h7j s SER 212 Cb -0.22 -0.16 -0.02 0.00 0.10 0.00 0.00 66.02 65.72 3h7j s SER 212 CO 0.42 -0.10 -0.19 -0.54 0.98 0.00 0.00 173.24 173.82 3h7j s LYS 213 N -3.32 1.47 0.04 4.02 1.02 -0.76 -0.90 119.74 121.32 3h7j s LYS 213 Ca 0.21 -0.69 -0.06 0.00 0.02 0.00 0.00 55.97 55.45 3h7j s LYS 213 Cb -0.03 -1.44 -0.01 0.00 -0.52 0.00 0.00 37.83 35.83 3h7j s LYS 213 CO 0.08 0.39 0.12 -1.54 -0.92 0.00 0.00 175.35 173.48 3h7j s SER 214 N -0.51 0.14 -0.21 2.83 1.04 -0.65 -0.45 113.70 115.89 3h7j s SER 214 Ca 0.07 -0.49 -0.06 0.00 0.48 0.00 0.00 55.95 55.95 3h7j s SER 214 Cb -0.07 0.24 -0.03 0.00 0.10 0.00 0.00 66.02 66.26 3h7j s SER 214 CO -0.00 -0.51 0.03 -0.63 0.98 0.00 0.00 173.24 173.10 3h7j s ILE 215 N -2.55 4.23 -0.08 -1.02 1.01 -0.32 -0.55 121.20 121.93 3h7j s ILE 215 Ca -0.05 -0.22 0.03 0.00 0.00 0.00 0.00 60.65 60.41 3h7j s ILE 215 Cb -0.01 -2.93 0.01 0.00 0.01 0.00 0.00 42.46 39.54 3h7j s ILE 215 CO -0.04 0.41 -0.17 0.20 0.00 0.00 0.00 174.94 175.35 3h7j s ASN 216 N 0.99 2.30 -0.14 3.58 0.01 -0.43 -0.66 114.94 120.59 3h7j s ASN 216 Ca 0.03 -0.40 0.02 0.00 -0.71 0.00 0.00 52.86 51.80 3h7j s ASN 216 Cb -0.14 -1.06 0.01 0.00 0.41 0.00 0.00 41.25 40.47 3h7j s ASN 216 CO 0.02 0.07 -0.21 -0.63 -1.51 0.00 0.00 177.10 174.85 3h7j s ILE 217 N 0.60 1.98 -0.22 0.60 1.01 0.27 0.18 121.20 125.62 3h7j s ILE 217 Ca -0.15 -0.93 -0.09 0.00 0.00 0.00 0.00 60.65 59.49 3h7j s ILE 217 Cb -0.16 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 3h7j s ILE 217 CO 0.05 0.53 0.10 -0.36 0.00 0.00 0.00 174.94 175.27 3h7j s PHE 218 N 0.88 3.24 -0.19 3.97 0.08 -0.04 -1.24 117.98 124.69 3h7j s PHE 218 Ca -0.06 0.04 0.01 0.00 0.12 0.00 0.00 56.93 57.04 3h7j s PHE 218 Cb -0.15 -2.19 0.03 0.00 -0.57 0.00 0.00 43.02 40.14 3h7j s PHE 218 CO -0.03 0.02 -0.15 -0.06 -0.10 0.00 0.00 175.22 174.90 3h7j s PHE 219 N 0.90 2.59 0.71 0.36 0.40 -0.45 -1.59 117.98 120.89 3h7j s PHE 219 Ca 0.05 -1.60 -0.11 0.00 -0.60 0.00 0.00 56.93 54.67 3h7j s PHE 219 Cb -0.13 -1.77 0.16 0.00 0.51 0.00 0.00 43.02 41.79 3h7j s PHE 219 CO 0.03 -0.76 0.97 -0.35 0.70 0.00 0.00 175.22 175.80 3h7j n PRO 220 N 4.65 -0.86 -1.61 0.24 -0.04 -1.26 -0.09 135.00 136.03 3h7j n PRO 220 Ca -0.18 -1.60 -0.38 0.00 -0.04 0.00 0.00 63.50 61.30 3h7j n PRO 220 Cb 0.48 -0.97 0.04 0.00 -0.04 0.00 0.00 33.50 33.02 3h7j n PRO 220 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3h7j n PRO 221 N -3.03 1.00 -0.04 0.54 -0.02 -1.25 -4.80 135.00 127.40 3h7j n PRO 221 Ca 0.12 0.38 -0.08 0.00 -2.02 0.00 0.00 63.50 61.91 3h7j n PRO 221 Cb 0.44 -2.15 -0.04 0.00 -0.02 0.00 0.00 33.50 31.73 3h7j n PRO 221 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3h7j n ARG 222 N -0.75 0.21 -0.04 -0.52 0.63 -1.26 -4.88 116.66 110.05 3h7j n ARG 222 Ca 0.13 0.07 -0.22 0.00 -0.92 0.00 0.00 57.85 56.91 3h7j n ARG 222 Cb 0.46 -1.00 -0.13 0.00 0.45 0.00 0.00 32.46 32.24 3h7j n ARG 222 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3h7j n TYR 223 N -3.09 1.13 -3.74 -0.14 4.01 -1.26 -4.71 117.16 109.35 3h7j n TYR 223 Ca -0.17 0.31 -0.35 0.00 -0.16 0.00 0.00 57.90 57.54 3h7j n TYR 223 Cb 0.65 -1.14 -0.09 0.00 -0.31 0.00 0.00 39.34 38.45 3h7j n TYR 223 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 3h7j s ASN 224 N -6.98 5.31 0.00 7.72 0.01 -1.26 -5.28 114.94 114.46 3h7j s ASN 224 Ca -0.25 -3.26 0.24 0.00 -0.71 0.00 0.00 52.86 48.88 3h7j s ASN 224 Cb 0.07 -1.82 0.29 0.00 0.41 0.00 0.00 41.25 40.20 3h7j s ASN 224 CO 0.70 -0.26 1.32 0.54 -1.51 0.00 0.00 177.10 177.88