#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j2t n SER 4 N 0.00 -2.37 -0.88 3.14 2.88 -1.26 -4.92 113.62 110.20 1j2t n SER 4 Ca 0.00 0.87 0.12 0.00 -1.33 0.00 0.00 58.87 58.53 1j2t n SER 4 Cb 0.00 -0.93 0.18 0.00 -0.75 0.00 0.00 64.21 62.71 1j2t n SER 4 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1j2t n VAL 5 N -0.87 0.02 -3.32 2.46 0.24 -1.26 -4.92 118.33 110.69 1j2t n VAL 5 Ca 0.12 -0.47 -0.39 0.00 -2.04 0.00 0.00 64.34 61.57 1j2t n VAL 5 Cb 0.38 1.30 -0.08 0.00 -1.47 0.00 0.00 33.84 33.98 1j2t n VAL 5 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1j2t s PHE 6 N -1.98 3.31 0.29 6.34 0.40 -1.26 0.34 117.98 125.43 1j2t s PHE 6 Ca 0.30 0.61 0.03 0.00 -0.60 0.00 0.00 56.93 57.27 1j2t s PHE 6 Cb 0.20 -2.62 0.66 0.00 0.51 0.00 0.00 43.02 41.77 1j2t s PHE 6 CO 0.31 -0.15 1.78 0.28 0.70 0.00 0.00 175.22 178.14 1j2t h VAL 7 N 5.23 0.75 0.00 -0.44 2.07 -1.28 -0.26 116.25 122.33 1j2t h VAL 7 Ca -0.33 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 1j2t h VAL 7 Cb 1.15 -0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1j2t h VAL 7 CO 0.70 0.14 -0.06 1.23 0.02 0.00 0.00 177.57 179.61 1j2t h GLY 8 N 0.78 0.00 -1.13 2.17 0.00 -1.93 -1.55 103.07 101.41 1j2t h GLY 8 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1j2t h GLY 8 CO -0.36 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.36 1j2t n GLU 9 N -4.07 1.91 -3.99 4.80 1.02 -0.12 -4.91 120.64 115.28 1j2t n GLU 9 Ca -0.03 -1.36 -0.24 0.00 -0.02 0.00 0.00 57.16 55.51 1j2t n GLU 9 Cb 0.14 -1.44 -0.03 0.00 -0.02 0.00 0.00 31.44 30.09 1j2t n GLU 9 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1j2t s LEU 10 N -1.66 4.20 0.63 -4.62 1.43 -0.58 -4.93 118.68 113.14 1j2t s LEU 10 Ca 0.34 0.04 -0.09 0.00 -1.03 0.00 0.00 54.13 53.39 1j2t s LEU 10 Cb 0.19 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.66 1j2t s LEU 10 CO 0.29 -0.00 0.99 0.42 0.23 0.00 0.00 176.35 178.28 1j2t s THR 11 N -1.88 3.85 0.45 5.49 -4.23 -1.26 -4.91 115.64 113.14 1j2t s THR 11 Ca 0.34 0.34 0.14 0.00 -1.18 0.00 0.00 61.69 61.32 1j2t s THR 11 Cb -0.10 -3.56 0.19 0.00 1.34 0.00 0.00 72.50 70.38 1j2t s THR 11 CO 0.28 -0.66 2.00 4.11 -0.54 0.00 0.00 174.62 179.81 1j2t h TRP 12 N -0.36 0.05 -0.38 3.99 5.08 -1.99 -1.56 115.95 120.78 1j2t h TRP 12 Ca -0.45 -0.00 -0.10 0.00 1.08 0.00 0.00 58.89 59.42 1j2t h TRP 12 Cb 1.24 -0.02 -0.01 0.00 -3.00 0.00 0.00 29.16 27.37 1j2t h TRP 12 CO 0.52 0.19 -0.15 0.87 -1.28 0.00 0.00 178.44 178.59 1j2t h LYS 13 N 0.05 0.78 -0.59 0.12 1.79 -1.99 0.77 116.57 117.51 1j2t h LYS 13 Ca 0.01 -0.32 -0.02 0.00 -2.18 0.00 0.00 60.65 58.13 1j2t h LYS 13 Cb 0.27 -0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.86 1j2t h LYS 13 CO 0.02 0.94 0.27 0.93 -1.08 0.00 0.00 179.45 180.53 1j2t h GLU 14 N 0.58 0.85 -0.09 3.15 5.08 -1.80 -1.34 114.58 121.01 1j2t h GLU 14 Ca 0.09 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1j2t h GLU 14 Cb 0.69 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1j2t h GLU 14 CO 0.05 0.70 0.03 -0.92 -1.00 0.00 0.00 179.01 177.87 1j2t h TYR 15 N 0.80 0.15 -0.86 4.33 3.20 -1.20 -2.13 116.97 121.27 1j2t h TYR 15 Ca 0.20 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.14 1j2t h TYR 15 Cb 0.14 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.30 1j2t h TYR 15 CO 0.00 0.29 0.51 1.49 -1.64 0.00 0.00 178.16 178.81 1j2t h GLU 16 N -0.03 0.85 -0.53 1.82 4.81 -0.65 -0.52 114.58 120.33 1j2t h GLU 16 Ca 0.03 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1j2t h GLU 16 Cb 0.21 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1j2t h GLU 16 CO -0.00 0.56 0.12 0.00 -0.73 0.00 0.00 179.01 178.96 1j2t h ALA 17 N 1.45 0.71 -0.62 2.92 0.00 -1.12 0.87 119.26 123.46 1j2t h ALA 17 Ca 0.40 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1j2t h ALA 17 Cb 0.31 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1j2t h ALA 17 CO -0.22 0.41 0.09 0.00 0.00 0.00 0.00 179.25 179.53 1j2t h ARG 18 N 0.76 1.03 -0.26 0.00 2.47 -0.64 -1.95 114.38 115.78 1j2t h ARG 18 Ca 0.17 -0.28 -0.11 0.00 -1.26 0.00 0.00 59.98 58.50 1j2t h ARG 18 Cb 0.35 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 1j2t h ARG 18 CO 0.00 0.97 -0.29 0.28 0.56 0.00 0.00 179.97 181.49 1j2t h VAL 19 N 0.94 1.28 0.00 2.04 2.07 -0.91 -2.87 116.25 118.80 1j2t h VAL 19 Ca 0.19 -1.36 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 1j2t h VAL 19 Cb 0.44 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1j2t h VAL 19 CO 0.01 0.43 -0.10 0.00 0.02 0.00 0.00 177.57 177.93 1j2t h ALA 20 N 1.23 1.27 0.00 1.67 0.00 -0.23 -2.62 119.26 120.58 1j2t h ALA 20 Ca 0.06 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1j2t h ALA 20 Cb 0.74 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1j2t h ALA 20 CO 0.06 0.13 -0.01 0.00 0.00 0.00 0.00 179.25 179.42 1j2t h ALA 21 N 1.90 1.28 0.00 0.00 0.00 -1.13 -3.47 119.26 117.84 1j2t h ALA 21 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1j2t h ALA 21 Cb 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1j2t h ALA 21 CO 0.01 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1j2t n GLY 22 N -1.12 1.93 1.46 0.00 0.00 -0.99 -4.89 105.19 101.58 1j2t n GLY 22 Ca -0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 46.02 45.84 1j2t n GLY 22 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1j2t n ASP 23 N 0.06 2.30 -4.71 1.61 3.85 -1.26 -5.02 116.55 113.38 1j2t n ASP 23 Ca 0.00 -3.17 -0.42 0.00 -0.71 0.00 0.00 54.79 50.49 1j2t n ASP 23 Cb 0.00 -0.43 -0.03 0.00 -1.35 0.00 0.00 41.12 39.32 1j2t n ASP 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1j2t s VAL 25 N 1.47 4.81 0.04 0.00 1.01 -1.26 -4.23 120.40 122.25 1j2t s VAL 25 Ca 0.61 -0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.59 1j2t s VAL 25 Cb -0.31 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1j2t s VAL 25 CO 0.28 0.44 0.02 -0.76 0.00 0.00 0.00 175.10 175.08 1j2t s LEU 26 N 0.55 3.58 -0.03 3.92 1.43 -0.58 -1.54 118.68 126.01 1j2t s LEU 26 Ca 0.04 -0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.13 1j2t s LEU 26 Cb -0.13 -2.17 -0.00 0.00 0.03 0.00 0.00 46.19 43.92 1j2t s LEU 26 CO 0.01 0.23 -0.13 -0.04 0.23 0.00 0.00 176.35 176.65 1j2t s MET 27 N -1.94 1.36 -0.22 1.70 -1.94 0.43 -0.28 119.30 118.41 1j2t s MET 27 Ca 0.23 -0.46 0.01 0.00 -1.71 0.00 0.00 55.69 53.76 1j2t s MET 27 Cb -0.12 -1.22 0.06 0.00 2.01 0.00 0.00 34.83 35.56 1j2t s MET 27 CO 0.15 0.19 -0.06 -1.17 -0.01 0.00 0.00 175.02 174.12 1j2t s LEU 28 N 0.09 2.41 0.17 -0.03 2.96 0.60 -0.08 118.68 124.81 1j2t s LEU 28 Ca -0.03 -1.09 -0.30 0.00 -0.22 0.00 0.00 54.13 52.49 1j2t s LEU 28 Cb -0.10 -1.14 -0.08 0.00 0.50 0.00 0.00 46.19 45.37 1j2t s LEU 28 CO 0.01 -0.22 1.15 -2.84 -1.32 0.00 0.00 176.35 173.13 1j2t s PRO 29 N 1.43 4.53 -0.26 0.98 0.02 -1.26 -1.14 135.00 139.30 1j2t s PRO 29 Ca -0.05 1.80 0.02 0.00 0.02 0.00 0.00 61.00 62.79 1j2t s PRO 29 Cb -0.18 -3.26 0.07 0.00 0.02 0.00 0.00 34.50 31.14 1j2t s PRO 29 CO -0.07 -0.03 -0.05 0.08 -0.33 0.00 0.00 177.00 176.61 1j2t s VAL 30 N -0.06 1.76 0.00 3.83 1.01 -0.18 -1.12 120.40 125.63 1j2t s VAL 30 Ca 0.52 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 61.00 1j2t s VAL 30 Cb -0.31 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1j2t s VAL 30 CO 0.35 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.88 1j2t n GLY 31 N 4.56 4.02 3.59 4.51 0.00 -0.10 -0.69 105.19 121.08 1j2t n GLY 31 Ca -0.10 -1.47 -0.05 0.00 0.00 0.00 0.00 46.02 44.41 1j2t n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j2t s ALA 32 N -2.27 -2.05 -0.33 4.61 0.00 -1.22 -3.26 121.76 117.24 1j2t s ALA 32 Ca 0.00 1.52 -0.06 0.00 0.00 0.00 0.00 51.96 53.43 1j2t s ALA 32 Cb 0.00 -0.05 0.04 0.00 0.00 0.00 0.00 23.12 23.11 1j2t s ALA 32 CO 0.00 -0.61 0.08 -1.17 0.00 0.00 0.00 175.76 174.06 1j2t s LEU 33 N -2.22 4.18 -0.16 0.00 2.96 -1.11 -4.17 118.68 118.16 1j2t s LEU 33 Ca 0.09 -1.10 -0.17 0.00 -0.22 0.00 0.00 54.13 52.74 1j2t s LEU 33 Cb -0.01 -1.85 0.04 0.00 0.50 0.00 0.00 46.19 44.88 1j2t s LEU 33 CO -0.05 -0.30 0.46 -0.70 -1.32 0.00 0.00 176.35 174.44 1j2t s GLU 34 N 1.39 0.57 0.30 1.98 2.12 -0.41 -1.53 118.70 123.12 1j2t s GLU 34 Ca -0.02 0.58 -0.29 0.00 0.36 0.00 0.00 54.97 55.61 1j2t s GLU 34 Cb -0.19 0.27 -0.13 0.00 0.26 0.00 0.00 34.13 34.34 1j2t s GLU 34 CO 0.02 -0.08 1.22 0.00 -0.54 0.00 0.00 175.26 175.88 1j2t n GLN 35 N 2.68 1.83 -2.64 4.30 -0.00 -1.26 -4.35 117.38 117.94 1j2t n GLN 35 Ca -0.14 0.65 -0.13 0.00 -0.00 0.00 0.00 57.00 57.38 1j2t n GLN 35 Cb 0.57 -2.17 0.02 0.00 -0.00 0.00 0.00 30.24 28.66 1j2t n GLN 35 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1j2t n HIS 36 N 0.66 1.57 -4.21 2.61 8.25 -1.26 -4.98 115.22 117.85 1j2t n HIS 36 Ca 0.08 -2.88 0.00 0.00 -0.26 0.00 0.00 57.72 54.66 1j2t n HIS 36 Cb 0.33 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.12 1j2t n HIS 36 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1j2t n GLY 37 N -0.13 -1.82 0.13 -1.41 0.00 -1.25 -3.73 105.19 96.98 1j2t n GLY 37 Ca 0.15 -1.33 0.12 0.00 0.00 0.00 0.00 46.02 44.96 1j2t n GLY 37 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1j2t h HIS 38 N 0.00 0.00 -0.02 1.61 3.86 -1.84 -3.37 115.15 115.40 1j2t h HIS 38 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1j2t h HIS 38 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1j2t h HIS 38 CO 0.00 0.00 -0.10 -2.39 0.86 0.00 0.00 177.93 176.30 1j2t n HIS 39 N -2.52 0.00 -3.99 2.45 1.44 -1.26 -4.86 115.22 106.47 1j2t n HIS 39 Ca 0.04 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.67 1j2t n HIS 39 Cb 0.48 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.49 1j2t n HIS 39 CO 0.00 0.00 0.00 1.41 -2.81 0.00 0.00 176.34 174.94 1j2t s MET 40 N -1.56 0.61 0.93 -1.40 0.00 -1.24 -0.86 119.30 115.79 1j2t s MET 40 Ca 0.18 -0.99 -0.16 0.00 0.00 0.00 0.00 55.69 54.72 1j2t s MET 40 Cb 0.14 0.23 0.22 0.00 0.00 0.00 0.00 34.83 35.41 1j2t s MET 40 CO 0.27 -0.14 1.19 0.00 0.00 0.00 0.00 175.02 176.33 1j2t n MET 42 N -3.73 0.44 -0.40 0.00 0.00 -1.26 -4.28 117.12 107.88 1j2t n MET 42 Ca 0.15 -0.35 0.07 0.00 0.00 0.00 0.00 57.70 57.57 1j2t n MET 42 Cb 0.53 -1.49 0.26 0.00 0.00 0.00 0.00 33.22 32.52 1j2t n MET 42 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 1j2t n ASN 43 N -0.97 3.42 -0.26 7.83 2.04 -1.26 -1.28 115.26 124.78 1j2t n ASN 43 Ca 0.06 -2.23 0.07 0.00 -0.44 0.00 0.00 54.58 52.04 1j2t n ASN 43 Cb 0.38 -0.45 0.20 0.00 -2.53 0.00 0.00 39.78 37.37 1j2t n ASN 43 CO 0.00 0.00 0.00 0.58 -0.44 0.00 0.00 177.26 177.40 1j2t h VAL 44 N 3.08 0.43 0.00 3.53 2.07 -1.83 -0.15 116.25 123.37 1j2t h VAL 44 Ca 0.00 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1j2t h VAL 44 Cb 1.01 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1j2t h VAL 44 CO 0.12 0.04 0.00 0.47 0.02 0.00 0.00 177.57 178.22 1j2t n ASP 45 N -5.22 0.55 -0.11 0.57 9.92 -1.26 -1.26 116.55 119.74 1j2t n ASP 45 Ca 0.16 0.63 -0.23 0.00 -0.53 0.00 0.00 54.79 54.82 1j2t n ASP 45 Cb 0.51 -0.75 -0.11 0.00 -0.64 0.00 0.00 41.12 40.13 1j2t n ASP 45 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1j2t n VAL 46 N -2.10 1.54 -0.16 2.53 0.31 -0.20 -4.01 118.33 116.24 1j2t n VAL 46 Ca 0.02 -0.10 -0.03 0.00 -0.01 0.00 0.00 64.34 64.22 1j2t n VAL 46 Cb 0.22 -2.00 0.07 0.00 -0.91 0.00 0.00 33.84 31.21 1j2t n VAL 46 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1j2t h LEU 47 N -0.96 0.12 0.33 7.52 3.38 -0.81 -2.17 115.31 122.72 1j2t h LEU 47 Ca -0.41 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 1j2t h LEU 47 Cb 1.38 0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.21 1j2t h LEU 47 CO -0.23 0.09 -0.16 -0.07 0.09 0.00 0.00 178.44 178.16 1j2t h LEU 48 N 0.31 -0.38 -1.80 1.67 3.38 -1.42 -1.01 115.31 116.07 1j2t h LEU 48 Ca 0.24 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1j2t h LEU 48 Cb 0.29 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1j2t h LEU 48 CO -0.27 -0.03 -0.12 1.55 0.09 0.00 0.00 178.44 179.66 1j2t h PRO 49 N -0.76 0.00 -0.34 1.13 0.13 -1.75 -1.57 132.00 128.83 1j2t h PRO 49 Ca -0.05 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.96 1j2t h PRO 49 Cb 0.51 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.63 1j2t h PRO 49 CO 0.07 0.12 -0.26 1.15 -0.23 0.00 0.00 178.00 178.86 1j2t h THR 50 N 0.00 1.29 -0.51 1.56 2.02 -1.14 0.96 112.91 117.09 1j2t h THR 50 Ca -0.00 -1.41 -0.09 0.00 0.77 0.00 0.00 66.41 65.68 1j2t h THR 50 Cb 0.23 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 1j2t h THR 50 CO 0.02 0.46 -0.04 0.00 0.37 0.00 0.00 175.52 176.33 1j2t h ALA 51 N 0.76 0.99 -0.21 6.16 0.00 -0.81 0.13 119.26 126.27 1j2t h ALA 51 Ca 0.06 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1j2t h ALA 51 Cb 0.83 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1j2t h ALA 51 CO 0.07 0.61 -0.07 0.28 0.00 0.00 0.00 179.25 180.14 1j2t h VAL 52 N 0.80 1.29 -0.72 0.00 2.07 -1.16 -2.47 116.25 116.07 1j2t h VAL 52 Ca 0.15 -1.09 0.06 0.00 0.82 0.00 0.00 66.70 66.63 1j2t h VAL 52 Cb 0.53 1.58 -0.06 0.00 -1.52 0.00 0.00 31.29 31.83 1j2t h VAL 52 CO 0.03 0.33 0.42 0.00 0.02 0.00 0.00 177.57 178.37 1j2t h LYS 54 N 0.77 0.16 -0.42 0.00 3.64 -0.87 0.90 116.57 120.76 1j2t h LYS 54 Ca 0.32 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.63 1j2t h LYS 54 Cb 0.18 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1j2t h LYS 54 CO -0.18 0.11 0.04 0.00 -2.27 0.00 0.00 179.45 177.15 1j2t h ARG 55 N 0.17 0.71 -0.44 1.90 3.08 -1.17 -1.31 114.38 117.31 1j2t h ARG 55 Ca 0.10 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1j2t h ARG 55 Cb 0.07 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1j2t h ARG 55 CO -0.11 0.76 0.21 0.28 -1.07 0.00 0.00 179.97 180.05 1j2t h VAL 56 N 0.55 1.18 -0.72 2.04 2.07 -0.97 -2.64 116.25 117.75 1j2t h VAL 56 Ca 0.12 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 1j2t h VAL 56 Cb 0.42 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1j2t h VAL 56 CO 0.01 0.19 0.33 0.00 0.02 0.00 0.00 177.57 178.13 1j2t h ALA 57 N 1.06 0.94 -0.92 1.67 0.00 -0.60 -0.53 119.26 120.88 1j2t h ALA 57 Ca 0.15 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1j2t h ALA 57 Cb 0.11 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.56 1j2t h ALA 57 CO -0.02 0.51 0.60 0.93 0.00 0.00 0.00 179.25 181.27 1j2t h GLU 58 N 1.02 1.04 0.02 0.00 5.08 -1.11 0.98 114.58 121.61 1j2t h GLU 58 Ca 0.25 -0.06 -0.23 0.00 -1.00 0.00 0.00 59.36 58.31 1j2t h GLU 58 Cb 0.14 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1j2t h GLU 58 CO -0.03 0.69 -0.99 0.00 -1.00 0.00 0.00 179.01 177.68 1j2t h ARG 59 N 1.07 0.38 -0.02 2.33 3.08 -0.93 -3.36 114.38 116.94 1j2t h ARG 59 Ca 0.39 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1j2t h ARG 59 Cb 0.16 0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.34 1j2t h ARG 59 CO -0.14 1.12 -0.00 0.44 -1.07 0.00 0.00 179.97 180.31 1j2t n ILE 60 N -3.71 0.00 -2.43 2.04 -5.35 -0.30 -4.99 119.36 104.62 1j2t n ILE 60 Ca -0.07 -0.50 -0.04 0.00 -0.27 0.00 0.00 62.75 61.87 1j2t n ILE 60 Cb 0.86 1.28 0.01 0.00 -1.74 0.00 0.00 39.64 40.05 1j2t n ILE 60 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1j2t n GLY 61 N 0.76 0.48 4.01 3.28 0.00 0.29 -5.04 105.19 108.96 1j2t n GLY 61 Ca 0.08 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.31 1j2t n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j2t s ALA 62 N -2.69 4.49 0.10 4.61 0.00 -0.87 -4.72 121.76 122.69 1j2t s ALA 62 Ca 0.06 -1.81 0.10 0.00 0.00 0.00 0.00 51.96 50.31 1j2t s ALA 62 Cb -0.03 -1.63 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 1j2t s ALA 62 CO 0.08 -0.60 -0.26 -0.51 0.00 0.00 0.00 175.76 174.47 1j2t s LEU 63 N -4.55 2.28 -0.16 0.00 1.43 -0.59 -4.67 118.68 112.42 1j2t s LEU 63 Ca 0.58 -0.70 -0.00 0.00 -1.03 0.00 0.00 54.13 52.98 1j2t s LEU 63 Cb -0.08 -1.17 -0.01 0.00 0.03 0.00 0.00 46.19 44.96 1j2t s LEU 63 CO 0.36 0.18 -0.13 -0.69 0.23 0.00 0.00 176.35 176.29 1j2t s VAL 64 N -1.01 2.84 0.57 -1.59 1.01 0.15 -0.42 120.40 121.94 1j2t s VAL 64 Ca 0.12 -0.71 -0.11 0.00 0.00 0.00 0.00 61.98 61.27 1j2t s VAL 64 Cb -0.10 -2.21 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 1j2t s VAL 64 CO 0.05 0.51 0.97 -0.04 0.00 0.00 0.00 175.10 176.59 1j2t s MET 65 N 0.77 3.68 0.21 2.72 -1.94 0.89 -0.72 119.30 124.91 1j2t s MET 65 Ca -0.05 0.71 -0.32 0.00 -1.71 0.00 0.00 55.69 54.31 1j2t s MET 65 Cb -0.15 -2.15 -0.14 0.00 2.01 0.00 0.00 34.83 34.40 1j2t s MET 65 CO 0.01 -0.43 1.47 -2.30 -0.01 0.00 0.00 175.02 173.76 1j2t n PRO 66 N -2.35 2.07 -2.21 2.03 -0.02 -1.26 -4.48 135.00 128.78 1j2t n PRO 66 Ca 0.05 0.74 -0.33 0.00 -2.02 0.00 0.00 63.50 61.94 1j2t n PRO 66 Cb 0.54 -2.44 -0.00 0.00 -0.02 0.00 0.00 33.50 31.58 1j2t n PRO 66 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1j2t s GLY 67 N 0.51 2.32 -0.19 -1.23 0.00 -1.26 -4.73 107.32 102.75 1j2t s GLY 67 Ca 0.72 0.54 -0.29 0.00 0.00 0.00 0.00 44.72 45.68 1j2t s GLY 67 CO 0.45 0.86 1.14 1.08 0.00 0.00 0.00 173.10 176.64 1j2t s LEU 68 N -4.11 4.15 0.14 0.66 1.43 -0.28 -4.91 118.68 115.76 1j2t s LEU 68 Ca 0.66 1.55 0.18 0.00 -1.03 0.00 0.00 54.13 55.49 1j2t s LEU 68 Cb -0.18 -3.54 -0.06 0.00 0.03 0.00 0.00 46.19 42.44 1j2t s LEU 68 CO 0.30 -0.69 1.00 1.56 0.23 0.00 0.00 176.35 178.75 1j2t h GLN 69 N 7.76 0.00 -5.62 1.70 1.08 -1.89 -0.25 115.11 117.88 1j2t h GLN 69 Ca -0.24 0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.33 1j2t h GLN 69 Cb 1.09 0.00 -0.32 0.00 -0.05 0.00 0.00 27.48 28.20 1j2t h GLN 69 CO 0.96 0.26 -0.86 0.71 -0.95 0.00 0.00 178.83 178.95 1j2t s TYR 70 N -3.03 2.14 0.04 2.96 1.51 -1.26 -2.76 117.35 116.96 1j2t s TYR 70 Ca -0.01 -0.67 0.00 0.00 -1.01 0.00 0.00 57.07 55.39 1j2t s TYR 70 Cb 0.09 -1.42 -0.00 0.00 -0.11 0.00 0.00 41.96 40.51 1j2t s TYR 70 CO 0.79 -0.22 0.01 0.41 -1.11 0.00 0.00 175.55 175.42 1j2t n GLY 71 N 3.12 4.10 3.77 0.71 0.00 -1.20 -4.74 105.19 110.94 1j2t n GLY 71 Ca -0.18 -2.11 -0.32 0.00 0.00 0.00 0.00 46.02 43.41 1j2t n GLY 71 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1j2t s TYR 72 N -1.37 2.62 -0.01 1.61 5.04 -1.26 -0.72 117.35 123.26 1j2t s TYR 72 Ca 0.01 1.55 -0.39 0.00 -2.44 0.00 0.00 57.07 55.80 1j2t s TYR 72 Cb 0.00 -3.13 -0.18 0.00 0.35 0.00 0.00 41.96 39.00 1j2t s TYR 72 CO 0.01 -1.71 1.32 1.63 -1.34 0.00 0.00 175.55 175.46 1j2t n LYS 73 N -2.71 0.76 -1.86 4.97 5.02 -1.24 -4.76 118.16 118.34 1j2t n LYS 73 Ca 0.10 0.27 -0.42 0.00 -2.02 0.00 0.00 58.31 56.25 1j2t n LYS 73 Cb 0.52 -1.87 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 1j2t n LYS 73 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1j2t s SER 74 N 0.80 6.48 -0.04 4.39 0.15 -1.26 -4.90 113.70 119.32 1j2t s SER 74 Ca 0.89 2.82 0.00 0.00 0.70 0.00 0.00 55.95 60.36 1j2t s SER 74 Cb -1.09 -2.62 -0.03 0.00 -1.71 0.00 0.00 66.02 60.57 1j2t s SER 74 CO 0.54 -0.85 -0.00 -1.10 1.20 0.00 0.00 173.24 173.03 1j2t s GLN 75 N -0.15 2.86 0.22 5.44 -1.52 -1.26 -1.99 119.66 123.25 1j2t s GLN 75 Ca 0.64 -0.53 -0.09 0.00 -1.95 0.00 0.00 55.36 53.43 1j2t s GLN 75 Cb -0.46 -2.71 0.34 0.00 -0.22 0.00 0.00 33.01 29.96 1j2t s GLN 75 CO 0.43 0.66 1.67 0.37 -0.25 0.00 0.00 175.29 178.18 1j2t h GLN 76 N 4.74 0.17 0.00 2.91 4.15 -1.91 0.14 115.11 125.30 1j2t h GLN 76 Ca -0.50 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.91 1j2t h GLN 76 Cb 1.18 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.83 1j2t h GLN 76 CO 0.56 0.11 0.00 0.36 -1.93 0.00 0.00 178.83 177.93 1j2t n LYS 77 N -5.23 0.42 0.00 1.69 2.85 -1.26 -2.54 118.16 114.09 1j2t n LYS 77 Ca 0.10 0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.41 1j2t n LYS 77 Cb 0.38 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.26 1j2t n LYS 77 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 1j2t n SER 78 N -1.23 0.04 0.00 -5.58 3.41 -0.63 -4.16 113.62 105.47 1j2t n SER 78 Ca 0.13 -0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1j2t n SER 78 Cb 0.17 0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1j2t n SER 78 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j2t n GLY 79 N 0.23 -0.50 0.99 5.00 0.00 0.39 -4.69 105.19 106.61 1j2t n GLY 79 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1j2t n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j2t n GLY 80 N 0.00 2.65 0.00 -0.02 0.00 -1.05 -4.81 105.19 101.95 1j2t n GLY 80 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1j2t n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j2t n GLY 81 N 0.00 3.68 0.13 -0.02 0.00 -1.23 -4.39 105.19 103.36 1j2t n GLY 81 Ca 0.00 -1.65 0.04 0.00 0.00 0.00 0.00 46.02 44.41 1j2t n GLY 81 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1j2t n ASN 82 N 0.00 0.37 0.02 1.61 2.85 -0.84 -3.42 115.26 115.85 1j2t n ASN 82 Ca 0.00 -1.81 0.13 0.00 -0.11 0.00 0.00 54.58 52.79 1j2t n ASN 82 Cb 0.00 -0.04 0.34 0.00 1.24 0.00 0.00 39.78 41.32 1j2t n ASN 82 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1j2t n HIS 83 N -0.39 0.23 -2.21 1.20 1.44 -1.26 -4.90 115.22 109.32 1j2t n HIS 83 Ca 0.07 0.07 -0.36 0.00 -2.01 0.00 0.00 57.72 55.48 1j2t n HIS 83 Cb 0.08 -0.48 0.00 0.00 0.12 0.00 0.00 29.99 29.72 1j2t n HIS 83 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 1j2t s PHE 84 N -3.05 2.71 0.76 -1.40 0.40 -1.22 -5.01 117.98 111.17 1j2t s PHE 84 Ca 0.11 1.53 -0.12 0.00 -0.60 0.00 0.00 56.93 57.85 1j2t s PHE 84 Cb 0.16 -3.38 0.05 0.00 0.51 0.00 0.00 43.02 40.37 1j2t s PHE 84 CO 0.65 -1.68 1.11 -2.14 0.70 0.00 0.00 175.22 173.86 1j2t s PRO 85 N -3.00 2.25 0.00 0.24 0.02 -1.26 -3.81 135.00 129.44 1j2t s PRO 85 Ca 0.69 1.28 0.00 0.00 0.02 0.00 0.00 61.00 62.99 1j2t s PRO 85 Cb -0.27 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.36 1j2t s PRO 85 CO 0.32 -1.66 0.00 0.41 -0.33 0.00 0.00 177.00 175.74 1j2t n GLY 86 N -0.85 1.78 3.68 0.52 0.00 -1.26 -4.64 105.19 104.42 1j2t n GLY 86 Ca 0.10 -0.18 -0.46 0.00 0.00 0.00 0.00 46.02 45.47 1j2t n GLY 86 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1j2t n THR 87 N 0.00 0.14 -3.71 2.61 -1.04 -1.25 -4.65 114.28 106.38 1j2t n THR 87 Ca 0.00 -0.02 -0.29 0.00 -2.04 0.00 0.00 64.05 61.69 1j2t n THR 87 Cb 0.00 -1.67 -0.15 0.00 -1.82 0.00 0.00 70.33 66.68 1j2t n THR 87 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1j2t s THR 88 N 1.65 0.66 0.09 12.58 2.01 -0.58 -4.97 115.64 127.07 1j2t s THR 88 Ca 0.81 -1.07 0.07 0.00 0.31 0.00 0.00 61.69 61.82 1j2t s THR 88 Cb -0.65 -1.40 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 1j2t s THR 88 CO 0.40 -0.54 -0.13 -0.44 -0.69 0.00 0.00 174.62 173.22 1j2t s SER 89 N 1.75 4.19 0.35 3.53 0.01 -1.26 -4.39 113.70 117.89 1j2t s SER 89 Ca 0.06 -0.42 -0.05 0.00 1.31 0.00 0.00 55.95 56.85 1j2t s SER 89 Cb -0.17 -0.75 -0.05 0.00 0.21 0.00 0.00 66.02 65.26 1j2t s SER 89 CO -0.22 0.20 0.64 -0.76 0.41 0.00 0.00 173.24 173.51 1j2t s LEU 90 N -2.00 3.93 0.65 2.44 1.43 0.11 -4.86 118.68 120.38 1j2t s LEU 90 Ca 0.19 0.80 -0.15 0.00 -1.03 0.00 0.00 54.13 53.95 1j2t s LEU 90 Cb -0.11 -3.66 -0.00 0.00 0.03 0.00 0.00 46.19 42.45 1j2t s LEU 90 CO 0.11 -0.31 1.09 -1.81 0.23 0.00 0.00 176.35 175.66 1j2t s ASP 91 N -3.43 5.24 0.22 2.29 -0.00 -1.26 -3.68 116.67 116.06 1j2t s ASP 91 Ca 0.45 1.92 -0.08 0.00 -0.00 0.00 0.00 52.55 54.84 1j2t s ASP 91 Cb -0.10 -2.54 0.27 0.00 -0.00 0.00 0.00 42.92 40.55 1j2t s ASP 91 CO 0.33 -1.54 1.82 1.23 -0.00 0.00 0.00 175.17 177.02 1j2t h GLY 92 N -0.00 1.08 1.63 0.21 0.00 -1.98 -2.02 103.07 101.99 1j2t h GLY 92 Ca -0.46 -0.30 -0.03 0.00 0.00 0.00 0.00 47.33 46.54 1j2t h GLY 92 CO 0.55 0.18 0.09 0.00 0.00 0.00 0.00 176.54 177.36 1j2t h ALA 93 N 1.37 1.54 -0.13 3.60 0.00 -1.99 -0.34 119.26 123.32 1j2t h ALA 93 Ca 0.33 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1j2t h ALA 93 Cb 0.19 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1j2t h ALA 93 CO -0.18 0.35 -0.07 1.15 0.00 0.00 0.00 179.25 180.50 1j2t h THR 94 N 0.47 1.32 -0.23 0.00 2.02 -1.76 -0.63 112.91 114.10 1j2t h THR 94 Ca 0.11 -1.11 -0.02 0.00 0.77 0.00 0.00 66.41 66.16 1j2t h THR 94 Cb 0.17 1.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 1j2t h THR 94 CO -0.01 0.32 0.05 0.25 0.37 0.00 0.00 175.52 176.51 1j2t h LEU 95 N -0.08 0.36 -0.47 2.58 5.85 -1.19 -1.41 115.31 120.94 1j2t h LEU 95 Ca 0.03 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.55 1j2t h LEU 95 Cb 0.54 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 1j2t h LEU 95 CO 0.02 0.50 0.25 0.74 -0.34 0.00 0.00 178.44 179.61 1j2t h THR 96 N 0.20 0.99 -0.26 1.05 2.02 -1.07 -2.28 112.91 113.56 1j2t h THR 96 Ca 0.07 -0.17 -0.06 0.00 0.77 0.00 0.00 66.41 67.02 1j2t h THR 96 Cb 0.28 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.13 1j2t h THR 96 CO 0.00 0.09 -0.09 1.23 0.37 0.00 0.00 175.52 177.12 1j2t h GLY 97 N 0.50 0.45 0.84 2.16 0.00 -0.96 -0.73 103.07 105.33 1j2t h GLY 97 Ca 0.20 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 1j2t h GLY 97 CO -0.12 0.27 0.04 -0.84 0.00 0.00 0.00 176.54 175.88 1j2t h THR 98 N 0.40 1.18 -0.47 4.70 2.02 -0.76 -0.09 112.91 119.88 1j2t h THR 98 Ca 0.08 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 66.70 1j2t h THR 98 Cb 0.41 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1j2t h THR 98 CO 0.02 0.16 0.28 0.58 0.37 0.00 0.00 175.52 176.93 1j2t h VAL 99 N 0.00 1.15 -0.28 3.16 2.07 -1.18 -1.92 116.25 119.26 1j2t h VAL 99 Ca 0.04 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.22 1j2t h VAL 99 Cb 0.22 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 1j2t h VAL 99 CO -0.00 0.16 0.12 -0.61 0.02 0.00 0.00 177.57 177.26 1j2t h GLN 100 N 0.63 0.26 -0.55 1.57 4.15 -0.98 -1.59 115.11 118.59 1j2t h GLN 100 Ca 0.17 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.55 1j2t h GLN 100 Cb 0.01 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.61 1j2t h GLN 100 CO -0.03 0.17 0.27 -0.44 -1.93 0.00 0.00 178.83 176.87 1j2t h ASP 101 N 0.27 0.72 -0.45 -0.69 3.32 -0.85 -1.54 116.42 117.20 1j2t h ASP 101 Ca 0.12 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1j2t h ASP 101 Cb 0.05 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1j2t h ASP 101 CO -0.09 0.65 0.16 0.40 -1.72 0.00 0.00 179.24 178.63 1j2t h ILE 102 N 0.74 1.21 -0.63 0.35 2.04 -1.11 -1.88 117.51 118.23 1j2t h ILE 102 Ca 0.19 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1j2t h ILE 102 Cb 0.12 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1j2t h ILE 102 CO -0.02 0.25 0.40 0.40 0.00 0.00 0.00 178.15 179.17 1j2t h ILE 103 N 0.58 1.17 -0.43 -0.67 2.04 -1.07 -0.50 117.51 118.63 1j2t h ILE 103 Ca 0.15 -0.35 0.08 0.00 1.00 0.00 0.00 64.86 65.74 1j2t h ILE 103 Cb 0.23 0.28 -0.07 0.00 -0.74 0.00 0.00 36.82 36.51 1j2t h ILE 103 CO -0.01 0.17 -0.04 -0.09 0.00 0.00 0.00 178.15 178.19 1j2t h ARG 104 N 0.85 0.07 -0.42 2.37 2.43 -1.03 -0.79 114.38 117.86 1j2t h ARG 104 Ca 0.23 -0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.31 1j2t h ARG 104 Cb -0.06 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1j2t h ARG 104 CO -0.05 0.05 -0.05 0.93 -1.51 0.00 0.00 179.97 179.34 1j2t h GLU 105 N 0.07 0.78 -0.90 0.20 4.39 -0.74 -1.45 114.58 116.92 1j2t h GLU 105 Ca 0.21 -0.27 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 1j2t h GLU 105 Cb 0.32 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.87 1j2t h GLU 105 CO -0.39 0.88 0.52 -0.07 -1.16 0.00 0.00 179.01 178.79 1j2t h LEU 106 N 0.60 1.11 -0.88 1.33 3.38 -0.80 -1.55 115.31 118.49 1j2t h LEU 106 Ca 0.11 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1j2t h LEU 106 Cb 0.56 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1j2t h LEU 106 CO 0.03 0.87 0.12 0.00 0.09 0.00 0.00 178.44 179.55 1j2t h ALA 107 N 1.32 1.08 -0.83 1.53 0.00 -0.89 -1.68 119.26 119.79 1j2t h ALA 107 Ca 0.32 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1j2t h ALA 107 Cb -0.01 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.49 1j2t h ALA 107 CO -0.06 0.60 0.54 -0.09 0.00 0.00 0.00 179.25 180.24 1j2t h ARG 108 N 0.90 1.03 0.00 0.00 2.43 -0.34 -0.64 114.38 117.76 1j2t h ARG 108 Ca 0.19 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1j2t h ARG 108 Cb 0.36 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.68 1j2t h ARG 108 CO 0.00 0.68 -0.01 0.45 -1.51 0.00 0.00 179.97 179.58 1j2t h HIS 109 N 1.06 0.00 0.00 2.20 3.86 -0.66 -3.45 115.15 118.15 1j2t h HIS 109 Ca 0.33 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.54 1j2t h HIS 109 Cb -0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.45 1j2t h HIS 109 CO -0.02 0.01 0.00 0.41 0.86 0.00 0.00 177.93 179.19 1j2t n GLY 110 N -0.88 0.57 3.76 2.45 0.00 -0.25 -4.98 105.19 105.87 1j2t n GLY 110 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1j2t n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j2t s ALA 111 N -2.00 2.75 0.00 4.61 0.00 -0.70 -4.94 121.76 121.48 1j2t s ALA 111 Ca 0.00 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.02 1j2t s ALA 111 Cb 0.00 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1j2t s ALA 111 CO 0.00 -1.05 0.29 0.54 0.00 0.00 0.00 175.76 175.54 1j2t n ARG 112 N -1.11 0.00 -3.74 0.00 5.12 -1.26 -4.20 116.66 111.47 1j2t n ARG 112 Ca 0.11 -0.29 -0.23 0.00 -1.93 0.00 0.00 57.85 55.50 1j2t n ARG 112 Cb 0.48 -0.50 -0.17 0.00 -1.16 0.00 0.00 32.46 31.10 1j2t n ARG 112 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1j2t s ARG 113 N -0.00 0.46 -0.02 5.56 0.52 -1.26 -0.97 118.95 123.24 1j2t s ARG 113 Ca 0.00 0.07 0.01 0.00 -0.52 0.00 0.00 55.73 55.30 1j2t s ARG 113 Cb 0.00 -1.10 0.01 0.00 0.52 0.00 0.00 34.95 34.38 1j2t s ARG 113 CO 0.00 -0.38 -0.04 -1.17 0.02 0.00 0.00 175.30 173.73 1j2t s LEU 114 N 2.00 1.66 -0.22 2.53 2.96 -0.77 -1.53 118.68 125.32 1j2t s LEU 114 Ca 0.04 -0.09 -0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1j2t s LEU 114 Cb -0.13 -0.31 -0.01 0.00 0.50 0.00 0.00 46.19 46.24 1j2t s LEU 114 CO -0.05 0.00 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.25 1j2t s VAL 115 N 0.37 3.42 -0.36 1.68 1.01 0.61 -1.00 120.40 126.13 1j2t s VAL 115 Ca -0.04 -0.48 -0.14 0.00 0.00 0.00 0.00 61.98 61.32 1j2t s VAL 115 Cb -0.08 -2.56 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1j2t s VAL 115 CO -0.00 0.42 0.29 -0.76 0.00 0.00 0.00 175.10 175.05 1j2t s LEU 116 N 1.48 4.62 -0.43 3.92 1.43 0.29 -0.29 118.68 129.70 1j2t s LEU 116 Ca 0.06 -0.47 -0.09 0.00 -1.03 0.00 0.00 54.13 52.59 1j2t s LEU 116 Cb -0.14 -2.21 0.09 0.00 0.03 0.00 0.00 46.19 43.96 1j2t s LEU 116 CO -0.03 -0.32 0.29 -0.32 0.23 0.00 0.00 176.35 176.20 1j2t s MET 117 N 1.82 2.57 0.24 1.70 1.75 -0.29 -1.58 119.30 125.51 1j2t s MET 117 Ca 0.08 -1.54 -0.30 0.00 -1.25 0.00 0.00 55.69 52.67 1j2t s MET 117 Cb -0.17 -3.83 -0.09 0.00 2.84 0.00 0.00 34.83 33.58 1j2t s MET 117 CO 0.11 -1.02 0.98 1.21 -0.65 0.00 0.00 175.02 175.65 1j2t s ASN 118 N 2.28 7.55 0.00 1.11 2.47 0.26 -1.01 114.94 127.60 1j2t s ASN 118 Ca 0.04 2.02 0.00 0.00 0.42 0.00 0.00 52.86 55.34 1j2t s ASN 118 Cb -0.24 -2.61 0.00 0.00 -1.45 0.00 0.00 41.25 36.95 1j2t s ASN 118 CO 0.01 0.07 0.33 0.61 -3.72 0.00 0.00 177.10 174.41 1j2t n GLY 119 N 1.47 -0.66 2.93 1.21 0.00 0.14 -3.14 105.19 107.14 1j2t n GLY 119 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1j2t n GLY 119 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1j2t s HIS 120 N -0.27 2.06 0.30 1.61 5.65 -1.25 -4.66 115.29 118.72 1j2t s HIS 120 Ca 0.00 -1.38 0.03 0.00 0.25 0.00 0.00 55.06 53.96 1j2t s HIS 120 Cb 0.00 -1.47 0.76 0.00 -1.18 0.00 0.00 32.58 30.69 1j2t s HIS 120 CO 0.00 -0.69 1.62 -0.92 -0.65 0.00 0.00 174.74 174.10 1j2t h TYR 121 N 8.04 0.25 0.00 3.88 3.20 -1.94 -1.01 116.97 129.39 1j2t h TYR 121 Ca -0.24 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.69 1j2t h TYR 121 Cb 1.10 0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.41 1j2t h TYR 121 CO 0.47 -0.30 0.00 0.39 -1.64 0.00 0.00 178.16 177.08 1j2t n GLU 122 N -5.31 0.11 0.17 1.82 4.71 -1.26 -3.65 120.64 117.23 1j2t n GLU 122 Ca 0.23 0.34 0.04 0.00 -0.01 0.00 0.00 57.16 57.76 1j2t n GLU 122 Cb 0.74 -1.70 0.27 0.00 -1.01 0.00 0.00 31.44 29.74 1j2t n GLU 122 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 1j2t h ASN 123 N 0.00 0.00 -0.53 1.62 2.35 -1.51 -3.40 115.58 114.11 1j2t h ASN 123 Ca 0.00 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.84 1j2t h ASN 123 Cb 0.32 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.59 1j2t h ASN 123 CO 0.00 0.43 -0.34 0.28 -1.65 0.00 0.00 177.43 176.15 1j2t h SER 124 N 0.00 -1.17 0.60 5.81 0.02 -1.77 -1.13 113.55 115.91 1j2t h SER 124 Ca -0.00 0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 1j2t h SER 124 Cb 1.00 0.56 -0.01 0.00 0.14 0.00 0.00 62.40 64.09 1j2t h SER 124 CO 0.06 -0.31 -0.32 0.24 -1.14 0.00 0.00 176.83 175.35 1j2t h MET 125 N -0.20 0.00 0.01 3.45 2.86 -1.90 -0.71 114.93 118.44 1j2t h MET 125 Ca 0.21 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.63 1j2t h MET 125 Cb 0.55 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.20 1j2t h MET 125 CO -0.63 0.32 -0.93 0.74 1.06 0.00 0.00 176.91 177.47 1j2t h PHE 126 N 0.00 0.42 -0.36 -0.22 -1.00 -1.53 -1.63 116.94 112.63 1j2t h PHE 126 Ca -0.00 -0.24 -0.01 0.00 2.81 0.00 0.00 57.97 60.52 1j2t h PHE 126 Cb 0.71 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.21 1j2t h PHE 126 CO 0.00 1.06 0.17 0.82 -1.61 0.00 0.00 178.31 178.75 1j2t h ILE 127 N 0.15 1.17 -0.58 -0.55 2.04 -0.92 -1.61 117.51 117.22 1j2t h ILE 127 Ca -0.06 -0.49 0.06 0.00 1.00 0.00 0.00 64.86 65.36 1j2t h ILE 127 Cb 1.57 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 38.43 1j2t h ILE 127 CO 0.15 0.18 0.30 0.58 0.00 0.00 0.00 178.15 179.36 1j2t h VAL 128 N 0.44 0.93 -0.59 1.67 2.07 -0.99 -0.90 116.25 118.88 1j2t h VAL 128 Ca 0.12 -0.19 -0.10 0.00 0.82 0.00 0.00 66.70 67.35 1j2t h VAL 128 Cb 0.13 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.21 1j2t h VAL 128 CO -0.01 0.10 -0.01 -0.08 0.02 0.00 0.00 177.57 177.58 1j2t h GLU 129 N 0.56 1.05 -0.53 1.57 4.57 -1.19 -0.89 114.58 119.71 1j2t h GLU 129 Ca 0.27 -0.34 0.05 0.00 -1.18 0.00 0.00 59.36 58.15 1j2t h GLU 129 Cb 0.19 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 28.64 1j2t h GLU 129 CO -0.19 1.04 0.26 0.78 -1.18 0.00 0.00 179.01 179.72 1j2t h GLY 130 N 0.94 0.75 0.99 1.92 0.00 -0.73 -0.16 103.07 106.78 1j2t h GLY 130 Ca 0.16 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1j2t h GLY 130 CO 0.03 0.10 0.09 -2.22 0.00 0.00 0.00 176.54 174.55 1j2t h ILE 131 N 0.51 1.05 -0.54 2.60 2.04 -0.87 -1.71 117.51 120.60 1j2t h ILE 131 Ca 0.24 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 66.00 1j2t h ILE 131 Cb 0.16 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1j2t h ILE 131 CO -0.17 0.05 0.35 -0.78 0.00 0.00 0.00 178.15 177.59 1j2t h ASP 132 N 0.18 0.62 -0.31 1.72 1.82 -0.67 0.35 116.42 120.14 1j2t h ASP 132 Ca 0.05 -0.02 -0.09 0.00 -0.39 0.00 0.00 57.03 56.58 1j2t h ASP 132 Cb -0.01 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 39.83 1j2t h ASP 132 CO -0.01 0.46 -0.10 -0.07 -1.61 0.00 0.00 179.24 177.90 1j2t h LEU 133 N 0.72 0.71 -0.36 2.28 3.38 -0.96 -0.75 115.31 120.33 1j2t h LEU 133 Ca 0.20 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 1j2t h LEU 133 Cb -0.07 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1j2t h LEU 133 CO -0.04 0.84 -0.17 0.00 0.09 0.00 0.00 178.44 179.16 1j2t h ALA 134 N 1.23 0.50 -0.24 1.53 0.00 -0.87 -2.41 119.26 119.01 1j2t h ALA 134 Ca 0.12 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1j2t h ALA 134 Cb 0.56 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1j2t h ALA 134 CO 0.03 0.43 -0.25 -0.07 0.00 0.00 0.00 179.25 179.40 1j2t h LEU 135 N 0.54 0.45 -0.47 0.00 3.38 -0.73 -1.41 115.31 117.07 1j2t h LEU 135 Ca 0.08 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1j2t h LEU 135 Cb 0.72 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1j2t h LEU 135 CO 0.05 0.69 0.31 -0.09 0.09 0.00 0.00 178.44 179.49 1j2t h ARG 136 N 0.40 0.61 -0.50 1.13 2.43 -1.02 -1.07 114.38 116.35 1j2t h ARG 136 Ca 0.06 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.08 1j2t h ARG 136 Cb 0.65 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1j2t h ARG 136 CO 0.05 0.40 -0.13 0.93 -1.51 0.00 0.00 179.97 179.71 1j2t h GLU 137 N 0.63 0.95 -0.67 0.20 5.08 -1.00 -2.03 114.58 117.73 1j2t h GLU 137 Ca 0.17 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1j2t h GLU 137 Cb -0.07 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.09 1j2t h GLU 137 CO -0.04 1.02 0.42 -0.07 -1.00 0.00 0.00 179.01 179.34 1j2t h LEU 138 N 0.84 0.80 -1.52 1.33 3.38 -1.04 -2.11 115.31 116.99 1j2t h LEU 138 Ca 0.13 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1j2t h LEU 138 Cb 0.68 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1j2t h LEU 138 CO 0.05 0.60 0.06 -0.09 0.09 0.00 0.00 178.44 179.15 1j2t h ARG 139 N 0.92 0.37 -0.51 1.13 2.43 -0.90 0.11 114.38 117.92 1j2t h ARG 139 Ca 0.24 -0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.44 1j2t h ARG 139 Cb -0.06 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 1j2t h ARG 139 CO -0.05 0.35 0.34 1.88 -1.51 0.00 0.00 179.97 180.99 1j2t h TYR 140 N 0.37 0.40 -0.59 2.20 0.05 -0.66 -1.20 116.97 117.52 1j2t h TYR 140 Ca 0.09 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.88 1j2t h TYR 140 Cb 0.15 -0.13 0.00 0.00 1.01 0.00 0.00 36.73 37.76 1j2t h TYR 140 CO 0.00 0.20 0.00 0.00 -1.05 0.00 0.00 178.16 177.32 1j2t n ALA 141 N -2.52 2.59 -0.94 3.88 0.00 -0.12 -4.92 120.51 118.48 1j2t n ALA 141 Ca 0.07 -1.15 0.00 0.00 0.00 0.00 0.00 53.44 52.37 1j2t n ALA 141 Cb 0.30 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1j2t n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1j2t n GLY 142 N 1.33 0.52 3.59 0.00 0.00 -0.45 -5.01 105.19 105.16 1j2t n GLY 142 Ca 0.21 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1j2t n GLY 142 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1j2t s ILE 143 N -2.00 5.06 0.00 -0.61 1.01 -0.33 -4.89 121.20 119.43 1j2t s ILE 143 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 60.65 61.24 1j2t s ILE 143 Cb 0.00 -3.87 0.00 0.00 0.01 0.00 0.00 42.46 38.60 1j2t s ILE 143 CO 0.00 -0.05 0.41 0.00 0.00 0.00 0.00 174.94 175.30 1j2t n GLN 144 N 5.61 -0.37 -0.49 2.79 6.02 -1.26 -3.01 117.38 126.67 1j2t n GLN 144 Ca -0.05 -0.45 0.08 0.00 -0.01 0.00 0.00 57.00 56.57 1j2t n GLN 144 Cb 0.49 -0.85 0.30 0.00 1.02 0.00 0.00 30.24 31.20 1j2t n GLN 144 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1j2t n ASP 145 N -0.04 4.22 -4.68 1.08 3.85 -1.26 -4.90 116.55 114.82 1j2t n ASP 145 Ca 0.00 -2.49 -0.41 0.00 -0.71 0.00 0.00 54.79 51.18 1j2t n ASP 145 Cb 0.10 -0.50 -0.05 0.00 -1.35 0.00 0.00 41.12 39.33 1j2t n ASP 145 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 1j2t s PHE 146 N -1.91 3.44 -0.04 2.11 2.19 -1.26 -4.83 117.98 117.68 1j2t s PHE 146 Ca 0.43 1.18 0.06 0.00 0.33 0.00 0.00 56.93 58.94 1j2t s PHE 146 Cb 0.29 -2.92 -0.01 0.00 -1.31 0.00 0.00 43.02 39.07 1j2t s PHE 146 CO 0.19 -0.16 -0.22 0.21 1.83 0.00 0.00 175.22 177.07 1j2t s LYS 147 N 1.81 2.06 -0.05 10.12 2.20 -0.14 -5.02 119.74 130.72 1j2t s LYS 147 Ca 0.36 -0.79 0.06 0.00 -0.36 0.00 0.00 55.97 55.23 1j2t s LYS 147 Cb -0.17 -1.85 -0.01 0.00 -1.51 0.00 0.00 37.83 34.29 1j2t s LYS 147 CO 0.13 0.40 -0.23 0.08 -0.36 0.00 0.00 175.35 175.37 1j2t s VAL 148 N -0.28 1.86 -0.16 4.02 1.01 -1.26 -1.85 120.40 123.75 1j2t s VAL 148 Ca 0.02 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 61.01 1j2t s VAL 148 Cb -0.11 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 1j2t s VAL 148 CO 0.01 0.52 -0.10 -0.69 0.00 0.00 0.00 175.10 174.84 1j2t s VAL 149 N -0.19 3.15 -0.05 2.92 1.01 -0.17 -4.99 120.40 122.06 1j2t s VAL 149 Ca -0.01 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.42 1j2t s VAL 149 Cb -0.12 -2.36 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 1j2t s VAL 149 CO 0.02 0.50 -0.23 0.54 0.00 0.00 0.00 175.10 175.93 1j2t s VAL 150 N 0.71 1.90 0.07 2.92 0.11 -1.26 -0.55 120.40 124.30 1j2t s VAL 150 Ca -0.05 -0.99 -0.19 0.00 -2.93 0.00 0.00 61.98 57.82 1j2t s VAL 150 Cb -0.15 -1.61 0.04 0.00 -1.53 0.00 0.00 36.38 33.13 1j2t s VAL 150 CO 0.02 0.53 0.44 -1.48 -3.33 0.00 0.00 175.10 171.29 1j2t s LEU 151 N -0.16 0.24 -0.19 2.54 0.05 -0.62 -4.98 118.68 115.57 1j2t s LEU 151 Ca -0.02 -0.03 -0.07 0.00 0.05 0.00 0.00 54.13 54.05 1j2t s LEU 151 Cb -0.13 1.90 -0.04 0.00 -2.05 0.00 0.00 46.19 45.87 1j2t s LEU 151 CO 0.03 -0.73 0.06 -0.44 -0.55 0.00 0.00 176.35 174.71 1j2t s SER 152 N -2.21 5.51 0.45 1.48 0.01 -1.26 -0.57 113.70 117.10 1j2t s SER 152 Ca -0.03 0.02 0.11 0.00 1.31 0.00 0.00 55.95 57.36 1j2t s SER 152 Cb -0.00 -1.95 1.00 0.00 0.21 0.00 0.00 66.02 65.28 1j2t s SER 152 CO -0.05 0.14 2.07 0.10 0.41 0.00 0.00 173.24 175.91 1j2t h TYR 153 N 6.95 0.28 0.00 2.43 -0.00 -1.91 -2.18 116.97 122.54 1j2t h TYR 153 Ca -0.36 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.35 1j2t h TYR 153 Cb 1.17 -0.09 -0.00 0.00 0.00 0.00 0.00 36.73 37.81 1j2t h TYR 153 CO 0.58 0.21 -0.07 0.11 -0.00 0.00 0.00 178.16 178.99 1j2t h TRP 154 N 0.29 0.00 0.00 0.10 0.09 -1.95 -2.71 115.95 111.77 1j2t h TRP 154 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.06 1j2t h TRP 154 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.27 1j2t h TRP 154 CO 0.00 0.07 0.00 -0.44 0.09 0.00 0.00 178.44 178.16 1j2t h ASP 155 N 0.00 0.00 0.66 0.11 3.32 -1.82 -1.59 116.42 117.10 1j2t h ASP 155 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1j2t h ASP 155 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 1j2t h ASP 155 CO 0.01 0.00 -0.08 0.49 -1.72 0.00 0.00 179.24 177.94 1j2t n PHE 156 N -2.61 0.00 -2.98 4.55 3.01 -1.02 -4.50 117.46 113.91 1j2t n PHE 156 Ca -0.00 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 58.02 1j2t n PHE 156 Cb 0.16 -0.33 -0.03 0.00 -0.01 0.00 0.00 39.48 39.26 1j2t n PHE 156 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1j2t s VAL 157 N -2.74 4.74 0.00 -4.37 1.01 -0.60 -4.71 120.40 113.73 1j2t s VAL 157 Ca 0.22 -1.31 0.00 0.00 0.00 0.00 0.00 61.98 60.89 1j2t s VAL 157 Cb 0.19 -4.68 0.00 0.00 0.00 0.00 0.00 36.38 31.89 1j2t s VAL 157 CO 0.51 -1.39 0.00 0.29 0.00 0.00 0.00 175.10 174.52 1j2t n LYS 158 N 6.52 0.58 -1.68 2.72 5.02 -1.26 -4.96 118.16 125.09 1j2t n LYS 158 Ca 0.11 0.00 -0.48 0.00 -2.02 0.00 0.00 58.31 55.93 1j2t n LYS 158 Cb 0.47 -0.96 -0.05 0.00 -0.02 0.00 0.00 35.03 34.47 1j2t n LYS 158 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1j2t n ASP 159 N -1.41 3.48 -0.25 4.39 2.03 -1.26 -4.86 116.55 118.67 1j2t n ASP 159 Ca 0.00 0.98 0.05 0.00 0.52 0.00 0.00 54.79 56.34 1j2t n ASP 159 Cb 0.02 -1.39 0.29 0.00 -0.72 0.00 0.00 41.12 39.33 1j2t n ASP 159 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1j2t h PRO 160 N 9.08 0.87 -0.82 -0.67 0.11 -1.98 0.16 132.00 138.76 1j2t h PRO 160 Ca -0.48 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.56 1j2t h PRO 160 Cb 1.27 -0.20 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 1j2t h PRO 160 CO 0.94 0.58 0.46 0.00 -0.21 0.00 0.00 178.00 179.78 1j2t h ALA 161 N 1.55 1.26 0.02 -0.75 0.00 -2.00 0.35 119.26 119.70 1j2t h ALA 161 Ca 0.36 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.98 1j2t h ALA 161 Cb 0.25 -0.33 0.02 0.00 0.00 0.00 0.00 17.79 17.72 1j2t h ALA 161 CO -0.13 0.61 -0.70 0.28 0.00 0.00 0.00 179.25 179.30 1j2t h VAL 162 N 1.15 1.41 -0.82 0.00 2.07 -1.47 -3.22 116.25 115.37 1j2t h VAL 162 Ca 0.29 -2.16 0.05 0.00 0.82 0.00 0.00 66.70 65.70 1j2t h VAL 162 Cb 0.01 2.65 -0.06 0.00 -1.52 0.00 0.00 31.29 32.37 1j2t h VAL 162 CO -0.05 0.63 0.51 0.40 0.02 0.00 0.00 177.57 179.08 1j2t h ILE 163 N -0.06 1.06 -0.45 4.57 1.08 -0.48 -2.44 117.51 120.79 1j2t h ILE 163 Ca -0.09 -0.33 -0.03 0.00 -0.39 0.00 0.00 64.86 64.02 1j2t h ILE 163 Cb 1.42 0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 35.17 1j2t h ILE 163 CO 0.14 0.17 0.16 -0.61 -0.69 0.00 0.00 178.15 177.32 1j2t h GLN 164 N 0.95 0.65 -0.14 2.37 5.75 -1.01 0.12 115.11 123.80 1j2t h GLN 164 Ca 0.35 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.75 1j2t h GLN 164 Cb 0.13 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.55 1j2t h GLN 164 CO -0.16 0.56 0.06 1.96 -2.65 0.00 0.00 178.83 178.60 1j2t h GLN 165 N 0.64 0.21 -0.24 1.69 4.20 -1.45 -2.90 115.11 117.26 1j2t h GLN 165 Ca 0.15 -0.04 -0.19 0.00 0.06 0.00 0.00 58.65 58.64 1j2t h GLN 165 Cb 0.17 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1j2t h GLN 165 CO -0.01 0.29 -0.59 -0.07 -0.67 0.00 0.00 178.83 177.78 1j2t h LEU 166 N 0.08 0.90 -6.39 1.46 3.38 -1.25 -3.38 115.31 110.11 1j2t h LEU 166 Ca 0.05 -0.50 -0.59 0.00 0.09 0.00 0.00 57.88 56.93 1j2t h LEU 166 Cb 0.16 -0.26 -0.40 0.00 0.09 0.00 0.00 40.66 40.24 1j2t h LEU 166 CO -0.00 1.29 -0.81 -1.22 0.09 0.00 0.00 178.44 177.78 1j2t n TYR 167 N -3.98 1.48 0.04 1.13 4.02 0.41 -4.96 117.16 115.29 1j2t n TYR 167 Ca -0.05 -3.85 0.09 0.00 -0.01 0.00 0.00 57.90 54.08 1j2t n TYR 167 Cb 0.65 -0.34 0.52 0.00 -0.02 0.00 0.00 39.34 40.15 1j2t n TYR 167 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1j2t h PRO 168 N 4.73 0.32 -0.26 -0.72 0.11 -1.70 -1.12 132.00 133.36 1j2t h PRO 168 Ca 0.17 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1j2t h PRO 168 Cb 0.80 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1j2t h PRO 168 CO 0.61 0.21 0.00 0.39 -0.21 0.00 0.00 178.00 179.00 1j2t n GLU 169 N -4.48 1.87 0.00 1.05 1.02 -1.26 -4.99 120.64 113.85 1j2t n GLU 169 Ca 0.04 -1.33 0.00 0.00 -0.02 0.00 0.00 57.16 55.85 1j2t n GLU 169 Cb 0.20 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 1j2t n GLU 169 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j2t n GLY 170 N 1.17 3.59 3.66 0.62 0.00 -0.42 -5.01 105.19 108.81 1j2t n GLY 170 Ca 0.16 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 1j2t n GLY 170 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1j2t s PHE 171 N -1.29 2.96 -2.44 1.61 5.36 -1.26 -4.84 117.98 118.07 1j2t s PHE 171 Ca 0.00 1.09 0.21 0.00 -0.96 0.00 0.00 56.93 57.28 1j2t s PHE 171 Cb 0.00 -3.46 0.30 0.00 -0.34 0.00 0.00 43.02 39.51 1j2t s PHE 171 CO 0.00 -1.50 1.28 1.28 -1.46 0.00 0.00 175.22 174.82 1j2t n LEU 172 N 6.33 3.10 0.00 6.12 7.99 -1.26 -5.07 117.00 134.21 1j2t n LEU 172 Ca 0.13 -1.29 0.00 0.00 -0.01 0.00 0.00 56.01 54.84 1j2t n LEU 172 Cb 0.45 -0.13 0.00 0.00 -0.11 0.00 0.00 43.42 43.63 1j2t n LEU 172 CO 0.55 0.62 0.00 0.61 -1.51 0.00 0.00 177.39 177.66 1j2t n GLY 173 N 1.30 3.40 0.26 -0.72 0.00 -1.26 -4.72 105.19 103.44 1j2t n GLY 173 Ca 0.16 -1.75 0.15 0.00 0.00 0.00 0.00 46.02 44.57 1j2t n GLY 173 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1j2t h TRP 174 N 0.00 0.00 -0.17 1.61 -0.00 -1.97 -2.97 115.95 112.45 1j2t h TRP 174 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 58.89 58.83 1j2t h TRP 174 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.16 1j2t h TRP 174 CO 0.00 0.04 -0.13 0.38 -0.00 0.00 0.00 178.44 178.73 1j2t h ASP 175 N 0.00 0.41 0.70 -3.49 -0.00 -1.90 -3.00 116.42 109.14 1j2t h ASP 175 Ca -0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 57.03 56.57 1j2t h ASP 175 Cb 0.66 -0.11 0.00 0.00 -0.00 0.00 0.00 39.33 39.88 1j2t h ASP 175 CO 0.01 0.78 0.00 -0.38 -0.00 0.00 0.00 179.24 179.64 1j2t n ILE 176 N -4.55 0.81 -2.58 4.15 5.41 -1.16 -3.93 119.36 117.51 1j2t n ILE 176 Ca -0.06 0.18 -0.43 0.00 1.00 0.00 0.00 62.75 63.44 1j2t n ILE 176 Cb 0.35 -0.98 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 1j2t n ILE 176 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1j2t n GLU 177 N -1.82 3.20 -3.83 0.38 0.00 -1.13 -3.54 120.64 113.90 1j2t n GLU 177 Ca 0.03 -3.30 -0.29 0.00 0.00 0.00 0.00 57.16 53.60 1j2t n GLU 177 Cb 0.23 -3.46 -0.16 0.00 0.00 0.00 0.00 31.44 28.05 1j2t n GLU 177 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1j2t s HIS 178 N 3.98 1.70 -0.48 4.31 5.65 -1.25 -4.76 115.29 124.43 1j2t s HIS 178 Ca 0.53 -1.33 0.00 0.00 0.25 0.00 0.00 55.06 54.51 1j2t s HIS 178 Cb 0.04 -1.33 0.00 0.00 -1.18 0.00 0.00 32.58 30.11 1j2t s HIS 178 CO 0.07 -0.70 0.00 0.41 -0.65 0.00 0.00 174.74 173.87 1j2t n GLY 179 N 4.86 0.72 0.00 1.59 0.00 -1.26 -2.00 105.19 109.10 1j2t n GLY 179 Ca -0.10 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1j2t n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1j2t n GLY 180 N -2.07 1.51 0.33 -0.02 0.00 -1.25 -4.34 105.19 99.34 1j2t n GLY 180 Ca -0.05 -1.79 -0.06 0.00 0.00 0.00 0.00 46.02 44.13 1j2t n GLY 180 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1j2t h VAL 181 N 0.00 1.25 0.66 1.61 2.07 -1.83 -2.26 116.25 117.75 1j2t h VAL 181 Ca 0.00 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.73 1j2t h VAL 181 Cb 0.00 0.32 0.01 0.00 -1.52 0.00 0.00 31.29 30.10 1j2t h VAL 181 CO 0.00 0.31 -0.32 0.15 0.02 0.00 0.00 177.57 177.74 1j2t h PHE 182 N 1.10 -0.82 -0.71 1.57 3.04 -1.94 -0.76 116.94 118.42 1j2t h PHE 182 Ca 0.26 -0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.15 1j2t h PHE 182 Cb 0.18 0.27 -0.03 0.00 2.56 0.00 0.00 35.95 38.92 1j2t h PHE 182 CO 0.02 -0.51 0.27 0.93 -2.02 0.00 0.00 178.31 176.99 1j2t h GLU 183 N -1.03 1.06 -0.43 1.11 5.08 -1.93 -2.44 114.58 116.00 1j2t h GLU 183 Ca -0.09 -0.19 -0.13 0.00 -1.00 0.00 0.00 59.36 57.95 1j2t h GLU 183 Cb 0.68 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1j2t h GLU 183 CO 0.15 0.88 -0.22 1.15 -1.00 0.00 0.00 179.01 179.96 1j2t h THR 184 N 1.04 1.27 -0.17 1.13 2.02 -1.45 -0.31 112.91 116.45 1j2t h THR 184 Ca 0.24 -1.37 -0.00 0.00 0.77 0.00 0.00 66.41 66.04 1j2t h THR 184 Cb 0.22 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1j2t h THR 184 CO -0.02 0.47 0.10 0.28 0.37 0.00 0.00 175.52 176.72 1j2t h SER 185 N 0.74 0.20 -0.87 4.18 0.02 -1.02 0.43 113.55 117.23 1j2t h SER 185 Ca 0.10 -0.05 0.06 0.00 -0.84 0.00 0.00 61.79 61.05 1j2t h SER 185 Cb 0.79 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.22 1j2t h SER 185 CO 0.07 0.19 0.54 -0.07 -1.14 0.00 0.00 176.83 176.42 1j2t h LEU 186 N 0.19 0.86 -0.90 5.07 3.38 -1.27 -1.25 115.31 121.39 1j2t h LEU 186 Ca 0.06 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 1j2t h LEU 186 Cb 0.03 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1j2t h LEU 186 CO -0.01 0.55 -0.12 0.24 0.09 0.00 0.00 178.44 179.20 1j2t h MET 187 N 1.00 0.68 -0.50 1.13 2.86 -0.51 -0.98 114.93 118.61 1j2t h MET 187 Ca 0.38 -0.22 -0.07 0.00 -2.06 0.00 0.00 59.70 57.73 1j2t h MET 187 Cb 0.15 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1j2t h MET 187 CO -0.17 0.78 0.04 -0.07 1.06 0.00 0.00 176.91 178.55 1j2t h LEU 188 N 0.62 0.78 -0.18 1.22 3.38 0.18 0.23 115.31 121.53 1j2t h LEU 188 Ca 0.11 -0.17 -0.14 0.00 0.09 0.00 0.00 57.88 57.77 1j2t h LEU 188 Cb 0.56 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1j2t h LEU 188 CO 0.04 0.82 -0.42 0.00 0.09 0.00 0.00 178.44 178.97 1j2t h ALA 189 N 1.27 0.29 0.09 1.53 0.00 -0.99 -3.31 119.26 118.14 1j2t h ALA 189 Ca 0.16 -0.46 -0.36 0.00 0.00 0.00 0.00 54.91 54.24 1j2t h ALA 189 Cb 0.41 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1j2t h ALA 189 CO 0.01 0.40 -2.03 1.28 0.00 0.00 0.00 179.25 178.92 1j2t n LEU 190 N -4.25 2.61 -3.17 0.00 4.77 -0.40 -4.73 117.00 111.83 1j2t n LEU 190 Ca -0.06 0.17 -0.20 0.00 -0.03 0.00 0.00 56.01 55.89 1j2t n LEU 190 Cb 0.55 -1.07 -0.04 0.00 -2.33 0.00 0.00 43.42 40.53 1j2t n LEU 190 CO 0.46 0.81 -0.23 -1.22 -1.33 0.00 0.00 177.39 175.88 1j2t n TYR 191 N -3.55 -0.15 -0.16 -1.77 4.01 0.77 -4.98 117.16 111.33 1j2t n TYR 191 Ca -0.35 -3.65 0.19 0.00 -0.16 0.00 0.00 57.90 53.93 1j2t n TYR 191 Cb 1.00 -0.31 0.56 0.00 -0.31 0.00 0.00 39.34 40.29 1j2t n TYR 191 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1j2t h PRO 192 N 3.36 0.28 0.00 -0.72 0.13 -1.59 -0.50 132.00 132.96 1j2t h PRO 192 Ca 0.08 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1j2t h PRO 192 Cb 0.94 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1j2t h PRO 192 CO 0.47 0.19 0.00 -0.44 -0.23 0.00 0.00 178.00 177.99 1j2t h ASP 193 N 0.29 0.00 -0.39 1.44 3.45 -1.92 -2.30 116.42 116.98 1j2t h ASP 193 Ca 0.38 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.84 1j2t h ASP 193 Cb 1.06 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.83 1j2t h ASP 193 CO -0.10 0.00 0.00 0.18 -1.57 0.00 0.00 179.24 177.75 1j2t n LEU 194 N -2.87 2.83 -4.04 1.55 4.77 -0.20 -4.86 117.00 114.18 1j2t n LEU 194 Ca -0.01 -1.29 -0.21 0.00 -0.03 0.00 0.00 56.01 54.48 1j2t n LEU 194 Cb 0.18 -0.26 -0.15 0.00 -2.33 0.00 0.00 43.42 40.87 1j2t n LEU 194 CO 0.22 0.64 -0.45 -0.69 -1.33 0.00 0.00 177.39 175.78 1j2t s VAL 195 N -1.48 0.87 -0.40 4.08 1.01 -0.87 -3.05 120.40 120.55 1j2t s VAL 195 Ca 0.37 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.92 1j2t s VAL 195 Cb 0.20 -0.75 0.12 0.00 0.00 0.00 0.00 36.38 35.96 1j2t s VAL 195 CO 0.28 0.26 0.19 -0.62 0.00 0.00 0.00 175.10 175.20 1j2t s ASP 196 N -0.05 3.88 0.57 3.32 -1.08 -0.04 -4.95 116.67 118.33 1j2t s ASP 196 Ca 0.01 -2.36 0.27 0.00 -0.52 0.00 0.00 52.55 49.95 1j2t s ASP 196 Cb -0.06 -1.08 1.55 0.00 -1.46 0.00 0.00 42.92 41.87 1j2t s ASP 196 CO 0.00 -0.31 2.05 0.25 0.52 0.00 0.00 175.17 177.68 1j2t h LEU 197 N 7.14 0.00 -0.63 -1.34 5.85 -1.96 -0.74 115.31 123.63 1j2t h LEU 197 Ca -0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1j2t h LEU 197 Cb 0.96 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.99 1j2t h LEU 197 CO 0.49 0.00 0.00 0.47 -0.34 0.00 0.00 178.44 179.06 1j2t n ASP 198 N -3.95 0.54 -0.43 1.25 8.00 -1.26 -2.03 116.55 118.67 1j2t n ASP 198 Ca 0.04 0.64 0.12 0.00 0.71 0.00 0.00 54.79 56.31 1j2t n ASP 198 Cb 0.42 -0.75 0.21 0.00 -0.02 0.00 0.00 41.12 40.98 1j2t n ASP 198 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1j2t n ARG 199 N -2.11 1.19 -1.70 -1.24 1.74 -0.28 -4.93 116.66 109.32 1j2t n ARG 199 Ca 0.02 -0.86 -0.42 0.00 -0.77 0.00 0.00 57.85 55.82 1j2t n ARG 199 Cb 0.20 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 1j2t n ARG 199 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1j2t n VAL 200 N -0.15 0.23 -3.11 1.55 0.31 -0.86 -4.38 118.33 111.91 1j2t n VAL 200 Ca 0.12 -0.04 -0.42 0.00 -0.01 0.00 0.00 64.34 63.99 1j2t n VAL 200 Cb 0.42 -2.09 -0.07 0.00 -0.91 0.00 0.00 33.84 31.19 1j2t n VAL 200 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1j2t s VAL 201 N 2.13 4.87 -0.63 2.52 1.01 -1.26 -5.01 120.40 124.03 1j2t s VAL 201 Ca 0.79 0.46 -0.27 0.00 0.00 0.00 0.00 61.98 62.96 1j2t s VAL 201 Cb -0.48 -4.11 0.04 0.00 0.00 0.00 0.00 36.38 31.82 1j2t s VAL 201 CO 0.35 -0.39 1.15 -0.62 0.00 0.00 0.00 175.10 175.59 1j2t s ASP 202 N 1.85 6.31 0.22 3.32 2.15 -1.26 -4.80 116.67 124.47 1j2t s ASP 202 Ca 0.24 -0.26 0.10 0.00 0.43 0.00 0.00 52.55 53.05 1j2t s ASP 202 Cb -0.14 -2.52 -0.05 0.00 -0.30 0.00 0.00 42.92 39.91 1j2t s ASP 202 CO 0.16 -1.55 -0.18 -1.38 -0.17 0.00 0.00 175.17 172.06 1j2t s HIS 203 N 4.94 1.97 0.40 -5.34 -3.43 -1.26 -5.08 115.29 107.50 1j2t s HIS 203 Ca 0.36 -0.45 -0.26 0.00 -0.80 0.00 0.00 55.06 53.91 1j2t s HIS 203 Cb -0.09 -0.90 -0.08 0.00 -1.43 0.00 0.00 32.58 30.07 1j2t s HIS 203 CO 0.19 0.49 1.22 -1.25 -2.00 0.00 0.00 174.74 173.40 1j2t s PRO 204 N -3.39 4.02 0.20 -0.38 0.04 -1.26 -4.09 135.00 130.14 1j2t s PRO 204 Ca 0.24 1.97 -0.32 0.00 0.04 0.00 0.00 61.00 62.93 1j2t s PRO 204 Cb -0.04 -2.72 -0.14 0.00 0.04 0.00 0.00 34.50 31.65 1j2t s PRO 204 CO 0.10 -0.39 1.37 -2.30 0.04 0.00 0.00 177.00 175.82 1j2t n PRO 205 N 0.11 1.78 -1.67 0.56 -0.02 -1.26 -4.87 135.00 129.62 1j2t n PRO 205 Ca 0.04 0.63 -0.41 0.00 -2.02 0.00 0.00 63.50 61.74 1j2t n PRO 205 Cb 0.45 -2.27 0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1j2t n PRO 205 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j2t n ALA 206 N 2.08 0.89 -2.46 3.55 0.00 -0.37 -5.01 120.51 119.18 1j2t n ALA 206 Ca 0.14 0.26 -0.26 0.00 0.00 0.00 0.00 53.44 53.58 1j2t n ALA 206 Cb 0.28 -2.20 -0.14 0.00 0.00 0.00 0.00 19.45 17.39 1j2t n ALA 206 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1j2t s THR 207 N -1.21 1.74 0.04 0.00 -4.23 -1.26 -5.04 115.64 105.67 1j2t s THR 207 Ca 0.61 -1.22 0.03 0.00 -1.18 0.00 0.00 61.69 59.93 1j2t s THR 207 Cb -0.53 -1.51 -0.02 0.00 1.34 0.00 0.00 72.50 71.78 1j2t s THR 207 CO 0.58 0.23 -0.09 -0.36 -0.54 0.00 0.00 174.62 174.45 1j2t s PHE 208 N -0.80 0.74 1.18 3.99 0.40 -1.26 -5.04 117.98 117.19 1j2t s PHE 208 Ca 0.08 -0.40 -0.15 0.00 -0.60 0.00 0.00 56.93 55.86 1j2t s PHE 208 Cb -0.09 -0.44 0.28 0.00 0.51 0.00 0.00 43.02 43.28 1j2t s PHE 208 CO 0.02 -0.04 1.03 -1.25 0.70 0.00 0.00 175.22 175.68 1j2t s PRO 209 N -1.26 -1.02 -0.03 0.24 0.04 -1.26 -4.88 135.00 126.84 1j2t s PRO 209 Ca -0.06 0.51 0.01 0.00 0.04 0.00 0.00 61.00 61.50 1j2t s PRO 209 Cb -0.08 -1.57 0.05 0.00 0.04 0.00 0.00 34.50 32.94 1j2t s PRO 209 CO 0.01 -3.70 0.90 -0.35 0.04 0.00 0.00 177.00 173.89 1j2t n PRO 210 N -4.86 1.16 -3.99 0.56 -0.05 -1.26 -4.81 135.00 121.75 1j2t n PRO 210 Ca 0.06 -0.22 -0.09 0.00 -0.05 0.00 0.00 63.50 63.19 1j2t n PRO 210 Cb 0.57 -1.25 -0.06 0.00 -0.05 0.00 0.00 33.50 32.71 1j2t n PRO 210 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 175.50 176.97 1j2t s TYR 211 N -0.55 0.40 0.12 0.54 -0.85 -1.26 -5.18 117.35 110.58 1j2t s TYR 211 Ca 0.04 -0.75 0.11 0.00 -0.52 0.00 0.00 57.07 55.95 1j2t s TYR 211 Cb 0.03 0.10 -0.04 0.00 0.38 0.00 0.00 41.96 42.43 1j2t s TYR 211 CO 0.01 -0.91 -0.26 -0.51 -1.52 0.00 0.00 175.55 172.36 1j2t s ASP 212 N -3.01 3.40 -0.03 -0.18 1.11 -1.26 -5.10 116.67 111.60 1j2t s ASP 212 Ca 0.22 -0.71 0.06 0.00 0.18 0.00 0.00 52.55 52.30 1j2t s ASP 212 Cb 0.01 -0.27 -0.01 0.00 1.07 0.00 0.00 42.92 43.71 1j2t s ASP 212 CO 0.07 0.18 -0.22 -0.69 1.18 0.00 0.00 175.17 175.70 1j2t s VAL 213 N -1.06 1.73 -0.01 -1.27 1.01 -1.26 -5.13 120.40 114.41 1j2t s VAL 213 Ca 0.14 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.23 1j2t s VAL 213 Cb -0.10 -1.45 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 1j2t s VAL 213 CO 0.06 0.49 -0.07 -0.36 0.00 0.00 0.00 175.10 175.22 1j2t s PHE 214 N -0.33 0.64 0.69 5.22 0.08 -1.26 -3.71 117.98 119.31 1j2t s PHE 214 Ca 0.04 -0.12 -0.17 0.00 0.12 0.00 0.00 56.93 56.80 1j2t s PHE 214 Cb -0.10 -0.42 0.02 0.00 -0.57 0.00 0.00 43.02 41.94 1j2t s PHE 214 CO 0.01 -0.02 1.26 -2.14 -0.10 0.00 0.00 175.22 174.23 1j2t s PRO 215 N -0.10 2.30 0.30 0.24 0.02 -1.26 -5.07 135.00 131.42 1j2t s PRO 215 Ca 0.02 1.95 -0.30 0.00 0.02 0.00 0.00 61.00 62.69 1j2t s PRO 215 Cb -0.03 -1.83 -0.11 0.00 0.02 0.00 0.00 34.50 32.55 1j2t s PRO 215 CO -0.00 -1.76 1.55 0.54 -0.33 0.00 0.00 177.00 176.99 1j2t s VAL 216 N -1.64 2.16 -0.44 3.83 0.11 -1.24 -4.96 120.40 118.22 1j2t s VAL 216 Ca 0.79 0.14 -0.17 0.00 -2.93 0.00 0.00 61.98 59.81 1j2t s VAL 216 Cb -0.34 -3.09 0.03 0.00 -1.53 0.00 0.00 36.38 31.45 1j2t s VAL 216 CO 0.43 0.02 0.44 -0.62 -3.33 0.00 0.00 175.10 172.04 1j2t s ASP 217 N 0.34 6.18 0.54 3.54 3.68 -1.26 -4.97 116.67 124.72 1j2t s ASP 217 Ca 0.61 -0.83 0.24 0.00 2.13 0.00 0.00 52.55 54.69 1j2t s ASP 217 Cb -0.47 -2.22 1.42 0.00 -1.45 0.00 0.00 42.92 40.21 1j2t s ASP 217 CO 0.50 -0.61 2.04 -0.65 0.13 0.00 0.00 175.17 176.58 1j2t h PRO 218 N 8.75 0.00 0.00 4.34 0.11 -1.96 -2.04 132.00 141.20 1j2t h PRO 218 Ca -0.27 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.84 1j2t h PRO 218 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1j2t h PRO 218 CO 0.82 0.00 -0.00 0.00 -0.21 0.00 0.00 178.00 178.61 1j2t h ALA 219 N 1.79 1.24 -0.01 -0.75 0.00 -2.00 -2.37 119.26 117.16 1j2t h ALA 219 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1j2t h ALA 219 Cb 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1j2t h ALA 219 CO -0.00 0.00 -0.06 0.54 0.00 0.00 0.00 179.25 179.73 1j2t n ARG 220 N -3.44 1.25 -4.33 0.00 1.74 -0.77 -4.75 116.66 106.37 1j2t n ARG 220 Ca -0.03 -0.61 -0.35 0.00 -0.77 0.00 0.00 57.85 56.10 1j2t n ARG 220 Cb 0.08 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 29.94 1j2t n ARG 220 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1j2t s THR 221 N -2.17 4.33 0.25 0.55 2.01 -0.89 -4.88 115.64 114.84 1j2t s THR 221 Ca 0.36 -0.23 -0.31 0.00 0.31 0.00 0.00 61.69 61.82 1j2t s THR 221 Cb 0.21 -2.85 -0.14 0.00 0.01 0.00 0.00 72.50 69.73 1j2t s THR 221 CO 0.40 0.57 1.31 -2.65 -0.69 0.00 0.00 174.62 173.56 1j2t n PRO 222 N 2.50 1.84 -0.34 4.92 -0.02 -1.26 -4.86 135.00 137.78 1j2t n PRO 222 Ca -0.18 0.65 0.06 0.00 -2.02 0.00 0.00 63.50 62.02 1j2t n PRO 222 Cb 0.53 -2.25 0.15 0.00 -0.02 0.00 0.00 33.50 31.91 1j2t n PRO 222 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1j2t n ALA 223 N 1.44 0.25 0.33 3.55 0.00 -1.26 -0.82 120.51 124.00 1j2t n ALA 223 Ca 0.11 1.03 0.14 0.00 0.00 0.00 0.00 53.44 54.72 1j2t n ALA 223 Cb 0.31 -0.63 0.63 0.00 0.00 0.00 0.00 19.45 19.76 1j2t n ALA 223 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1j2t h PRO 224 N 0.00 0.00 0.00 0.00 0.13 -1.97 -3.46 132.00 126.70 1j2t h PRO 224 Ca 0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.59 1j2t h PRO 224 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1j2t h PRO 224 CO -0.96 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 177.22 1j2t n GLY 225 N -0.21 0.51 3.84 1.56 0.00 0.00 -3.77 105.19 107.12 1j2t n GLY 225 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 1j2t n GLY 225 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j2t s THR 226 N -2.14 4.56 -0.62 2.61 -4.23 -1.26 -4.38 115.64 110.18 1j2t s THR 226 Ca 0.00 1.15 0.21 0.00 -1.18 0.00 0.00 61.69 61.88 1j2t s THR 226 Cb 0.00 -3.66 -0.27 0.00 1.34 0.00 0.00 72.50 69.91 1j2t s THR 226 CO 0.00 -0.46 0.75 0.18 -0.54 0.00 0.00 174.62 174.55 1j2t n LEU 227 N -1.02 0.61 -3.66 4.79 4.77 -0.85 -4.35 117.00 117.29 1j2t n LEU 227 Ca 0.05 -0.29 -0.15 0.00 -0.03 0.00 0.00 56.01 55.60 1j2t n LEU 227 Cb 0.54 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 1j2t n LEU 227 CO 0.43 0.15 0.20 -0.94 -1.33 0.00 0.00 177.39 175.89 1j2t s SER 228 N -3.61 -0.38 0.18 -1.43 1.04 -1.23 -1.24 113.70 107.03 1j2t s SER 228 Ca 0.02 0.31 -0.30 0.00 0.48 0.00 0.00 55.95 56.46 1j2t s SER 228 Cb 0.15 0.41 -0.08 0.00 0.10 0.00 0.00 66.02 66.60 1j2t s SER 228 CO 0.88 -0.54 1.20 -0.55 0.98 0.00 0.00 173.24 175.21 1j2t s SER 229 N -1.37 7.09 -0.21 7.02 0.15 -1.26 -3.76 113.70 121.35 1j2t s SER 229 Ca -0.11 2.23 0.15 0.00 0.70 0.00 0.00 55.95 58.91 1j2t s SER 229 Cb -0.03 -2.61 0.81 0.00 -1.71 0.00 0.00 66.02 62.49 1j2t s SER 229 CO 0.05 -0.37 1.73 0.00 1.20 0.00 0.00 173.24 175.86 1j2t n ALA 230 N 2.55 3.75 -0.25 5.45 0.00 -1.26 -3.82 120.51 126.92 1j2t n ALA 230 Ca 0.04 -1.86 0.05 0.00 0.00 0.00 0.00 53.44 51.68 1j2t n ALA 230 Cb 0.45 -1.11 0.17 0.00 0.00 0.00 0.00 19.45 18.96 1j2t n ALA 230 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1j2t h LYS 231 N 4.05 0.16 -0.39 0.00 3.64 -1.93 0.73 116.57 122.84 1j2t h LYS 231 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1j2t h LYS 231 Cb 1.89 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.67 1j2t h LYS 231 CO 0.45 0.11 0.00 0.25 -2.27 0.00 0.00 179.45 177.98 1j2t n THR 232 N -5.27 0.52 -1.90 1.00 -2.24 -1.26 -4.92 114.28 100.21 1j2t n THR 232 Ca 0.14 -0.44 -0.37 0.00 -2.27 0.00 0.00 64.05 61.11 1j2t n THR 232 Cb 0.47 0.12 0.04 0.00 -2.10 0.00 0.00 70.33 68.86 1j2t n THR 232 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1j2t s ALA 233 N -1.61 2.56 0.03 6.98 0.00 0.25 -5.03 121.76 124.94 1j2t s ALA 233 Ca 0.21 1.13 -0.18 0.00 0.00 0.00 0.00 51.96 53.11 1j2t s ALA 233 Cb 0.12 -3.50 0.04 0.00 0.00 0.00 0.00 23.12 19.77 1j2t s ALA 233 CO 0.13 -1.31 0.41 -1.54 0.00 0.00 0.00 175.76 173.45 1j2t s SER 234 N -1.41 -0.29 0.31 0.00 1.04 -1.26 -4.94 113.70 107.16 1j2t s SER 234 Ca 0.78 0.04 0.02 0.00 0.48 0.00 0.00 55.95 57.26 1j2t s SER 234 Cb -0.34 0.41 0.58 0.00 0.10 0.00 0.00 66.02 66.77 1j2t s SER 234 CO 0.37 -0.63 1.92 -0.09 0.98 0.00 0.00 173.24 175.79 1j2t h ARG 235 N 3.12 0.94 -0.16 4.02 2.43 -1.87 -1.76 114.38 121.10 1j2t h ARG 235 Ca -0.31 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1j2t h ARG 235 Cb 1.20 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.53 1j2t h ARG 235 CO 0.43 0.62 0.09 0.93 -1.51 0.00 0.00 179.97 180.53 1j2t h GLU 236 N 0.96 0.22 -0.83 0.20 3.07 -1.95 -1.34 114.58 114.92 1j2t h GLU 236 Ca 0.38 -0.03 0.02 0.00 -0.50 0.00 0.00 59.36 59.24 1j2t h GLU 236 Cb 0.24 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.06 1j2t h GLU 236 CO -0.14 0.23 0.55 0.87 -1.40 0.00 0.00 179.01 179.11 1j2t h LYS 237 N 0.16 1.04 -0.55 2.33 1.57 -1.83 -2.17 116.57 117.12 1j2t h LYS 237 Ca 0.06 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1j2t h LYS 237 Cb 0.07 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.12 1j2t h LYS 237 CO -0.01 0.69 0.33 0.78 -0.57 0.00 0.00 179.45 180.67 1j2t h GLY 238 N 1.07 0.80 1.61 3.86 0.00 -0.65 0.03 103.07 109.79 1j2t h GLY 238 Ca 0.32 -0.34 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 1j2t h GLY 238 CO -0.08 0.33 -0.13 0.83 0.00 0.00 0.00 176.54 177.49 1j2t h GLU 239 N 0.74 0.48 0.05 4.80 4.39 -0.86 -0.11 114.58 124.06 1j2t h GLU 239 Ca 0.20 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 1j2t h GLU 239 Cb -0.01 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 1j2t h GLU 239 CO -0.04 0.60 -0.02 1.25 -1.16 0.00 0.00 179.01 179.64 1j2t h LEU 240 N 0.44 -0.05 -0.21 1.33 5.85 -0.88 -2.20 115.31 119.59 1j2t h LEU 240 Ca 0.08 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.58 1j2t h LEU 240 Cb 0.49 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1j2t h LEU 240 CO 0.03 0.24 -0.00 0.40 -0.34 0.00 0.00 178.44 178.76 1j2t h ILE 241 N -0.34 0.85 -0.47 4.05 2.04 -0.79 -2.26 117.51 120.58 1j2t h ILE 241 Ca -0.01 -0.02 0.07 0.00 1.00 0.00 0.00 64.86 65.90 1j2t h ILE 241 Cb 0.31 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.11 1j2t h ILE 241 CO 0.01 0.01 0.14 0.25 0.00 0.00 0.00 178.15 178.56 1j2t h LEU 242 N 0.06 0.11 -0.63 1.44 5.85 -0.98 -0.08 115.31 121.08 1j2t h LEU 242 Ca 0.10 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.76 1j2t h LEU 242 Cb 0.13 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1j2t h LEU 242 CO -0.17 0.09 -0.23 -0.08 -0.34 0.00 0.00 178.44 177.71 1j2t h GLU 243 N 0.30 0.83 -0.27 1.25 4.57 -1.13 -0.58 114.58 119.54 1j2t h GLU 243 Ca 0.23 -0.35 -0.05 0.00 -1.18 0.00 0.00 59.36 58.01 1j2t h GLU 243 Cb 0.26 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 1j2t h GLU 243 CO -0.26 0.98 -0.02 0.28 -1.18 0.00 0.00 179.01 178.81 1j2t h VAL 244 N 0.72 1.26 0.29 0.32 2.07 -0.88 -0.88 116.25 119.15 1j2t h VAL 244 Ca 0.10 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.63 1j2t h VAL 244 Cb 0.76 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 1j2t h VAL 244 CO 0.06 0.31 -0.14 0.00 0.02 0.00 0.00 177.57 177.82 1j2t h VAL 246 N -0.53 0.85 -0.22 0.00 2.07 -1.13 0.97 116.25 118.25 1j2t h VAL 246 Ca -0.04 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1j2t h VAL 246 Cb 0.39 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1j2t h VAL 246 CO 0.07 0.02 0.11 -0.61 0.02 0.00 0.00 177.57 177.18 1j2t h GLN 247 N 0.09 0.32 -0.45 1.57 5.75 -1.16 -1.01 115.11 120.22 1j2t h GLN 247 Ca 0.11 -0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.52 1j2t h GLN 247 Cb 0.13 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 1j2t h GLN 247 CO -0.18 0.31 0.09 0.78 -2.65 0.00 0.00 178.83 177.19 1j2t h GLY 248 N 0.24 0.79 1.04 2.39 0.00 -0.88 -1.51 103.07 105.13 1j2t h GLY 248 Ca 0.08 -0.51 -0.11 0.00 0.00 0.00 0.00 47.33 46.79 1j2t h GLY 248 CO -0.01 0.47 -0.19 -2.22 0.00 0.00 0.00 176.54 174.59 1j2t h ILE 249 N 0.60 1.28 -0.79 2.60 2.04 -0.79 -1.40 117.51 121.04 1j2t h ILE 249 Ca 0.14 -1.33 0.00 0.00 1.00 0.00 0.00 64.86 64.67 1j2t h ILE 249 Cb 0.35 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 1j2t h ILE 249 CO 0.00 0.45 0.50 0.00 0.00 0.00 0.00 178.15 179.10 1j2t h ALA 250 N 0.83 1.01 -0.44 1.87 0.00 -1.04 -0.84 119.26 120.65 1j2t h ALA 250 Ca 0.09 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1j2t h ALA 250 Cb 0.75 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1j2t h ALA 250 CO 0.06 0.45 0.12 -0.44 0.00 0.00 0.00 179.25 179.43 1j2t h ASP 251 N 1.08 0.65 -0.58 0.00 3.32 -1.11 -1.45 116.42 118.32 1j2t h ASP 251 Ca 0.29 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 1j2t h ASP 251 Cb -0.08 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1j2t h ASP 251 CO -0.06 0.70 0.35 0.00 -1.72 0.00 0.00 179.24 178.51 1j2t h ALA 252 N 0.97 0.74 -0.53 3.45 0.00 -0.90 -1.18 119.26 121.81 1j2t h ALA 252 Ca 0.14 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1j2t h ALA 252 Cb 0.30 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1j2t h ALA 252 CO -0.00 0.22 -0.02 0.82 0.00 0.00 0.00 179.25 180.26 1j2t h ILE 253 N 0.78 1.26 -0.50 0.00 2.04 -1.02 -0.38 117.51 119.69 1j2t h ILE 253 Ca 0.21 -1.11 -0.03 0.00 1.00 0.00 0.00 64.86 64.92 1j2t h ILE 253 Cb -0.02 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1j2t h ILE 253 CO -0.04 0.40 0.17 0.03 0.00 0.00 0.00 178.15 178.71 1j2t h ARG 254 N 0.84 0.74 -0.19 2.37 3.08 -0.91 0.41 114.38 120.73 1j2t h ARG 254 Ca 0.15 -0.12 -0.12 0.00 0.07 0.00 0.00 59.98 59.96 1j2t h ARG 254 Cb 0.53 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1j2t h ARG 254 CO 0.03 0.63 -0.36 1.49 -1.07 0.00 0.00 179.97 180.69 1j2t h GLU 255 N 0.73 0.57 0.04 0.04 4.81 -0.58 -3.09 114.58 117.09 1j2t h GLU 255 Ca 0.17 -0.37 -0.23 0.00 -0.13 0.00 0.00 59.36 58.81 1j2t h GLU 255 Cb 0.19 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 1j2t h GLU 255 CO -0.01 0.98 -1.06 0.93 -0.73 0.00 0.00 179.01 179.11 1j2t h GLU 256 N 0.24 0.08 -2.32 1.92 4.39 -0.87 -3.38 114.58 114.64 1j2t h GLU 256 Ca 0.01 -0.13 -0.60 0.00 0.34 0.00 0.00 59.36 58.98 1j2t h GLU 256 Cb 0.96 0.05 -0.41 0.00 -0.10 0.00 0.00 28.75 29.24 1j2t h GLU 256 CO 0.08 1.06 -0.70 1.19 -1.16 0.00 0.00 179.01 179.48 1j2t n PHE 257 N -3.41 2.61 -2.05 4.33 3.72 0.14 -5.08 117.46 117.72 1j2t n PHE 257 Ca -0.02 -4.03 -0.38 0.00 -0.05 0.00 0.00 57.45 52.96 1j2t n PHE 257 Cb 0.96 -0.49 0.01 0.00 -0.94 0.00 0.00 39.48 39.02 1j2t n PHE 257 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1j2t s PRO 258 N -1.94 3.62 0.00 -1.08 0.05 -1.17 -4.62 135.00 129.85 1j2t s PRO 258 Ca 0.36 2.02 0.00 0.00 0.05 0.00 0.00 61.00 63.43 1j2t s PRO 258 Cb 0.11 -2.45 0.00 0.00 0.05 0.00 0.00 34.50 32.22 1j2t s PRO 258 CO -0.07 -0.74 0.29 -2.30 0.05 0.00 0.00 177.00 174.23