#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aj7 s ILE 2 N 0.00 4.99 0.00 0.53 1.01 -1.26 -5.00 121.20 121.47 1aj7 s ILE 2 Ca 0.00 0.70 -0.28 0.00 0.00 0.00 0.00 60.65 61.07 1aj7 s ILE 2 Cb 0.00 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 1aj7 s ILE 2 CO 0.00 -0.11 0.89 -1.10 0.00 0.00 0.00 174.94 174.62 1aj7 s GLN 3 N 2.48 4.54 -0.36 2.79 1.11 -1.26 -4.76 119.66 124.20 1aj7 s GLN 3 Ca 0.22 1.26 -0.08 0.00 0.01 0.00 0.00 55.36 56.77 1aj7 s GLN 3 Cb -0.15 -3.44 0.04 0.00 -1.01 0.00 0.00 33.01 28.45 1aj7 s GLN 3 CO 0.12 0.04 0.16 -1.64 0.01 0.00 0.00 175.29 173.98 1aj7 s MET 4 N 0.73 2.68 -0.42 2.91 -1.94 -1.26 -1.22 119.30 120.78 1aj7 s MET 4 Ca 0.47 -1.19 -0.17 0.00 -1.71 0.00 0.00 55.69 53.09 1aj7 s MET 4 Cb -0.20 -3.60 0.02 0.00 2.01 0.00 0.00 34.83 33.06 1aj7 s MET 4 CO 0.25 -0.72 0.41 0.99 -0.01 0.00 0.00 175.02 175.94 1aj7 s THR 5 N 1.45 5.12 -0.15 2.05 2.01 -0.52 -3.96 115.64 121.65 1aj7 s THR 5 Ca 0.00 -0.39 -0.06 0.00 0.31 0.00 0.00 61.69 61.56 1aj7 s THR 5 Cb -0.20 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.26 1aj7 s THR 5 CO 0.04 -0.39 0.05 -1.58 -0.69 0.00 0.00 174.62 172.05 1aj7 s GLN 6 N 2.05 3.66 -0.01 4.92 0.74 -1.26 -0.63 119.66 129.14 1aj7 s GLN 6 Ca 0.11 -0.34 -0.03 0.00 0.05 0.00 0.00 55.36 55.14 1aj7 s GLN 6 Cb -0.17 -3.09 -0.00 0.00 1.10 0.00 0.00 33.01 30.84 1aj7 s GLN 6 CO 0.13 0.43 0.07 -1.54 -0.55 0.00 0.00 175.29 173.83 1aj7 s SER 7 N -0.10 0.02 0.76 6.67 1.04 -0.58 -4.49 113.70 117.04 1aj7 s SER 7 Ca 0.06 -0.10 -0.08 0.00 0.48 0.00 0.00 55.95 56.31 1aj7 s SER 7 Cb -0.12 0.16 0.10 0.00 0.10 0.00 0.00 66.02 66.26 1aj7 s SER 7 CO 0.01 -0.19 1.09 -2.16 0.98 0.00 0.00 173.24 172.97 1aj7 s PRO 8 N -0.72 1.84 0.19 4.02 0.04 -1.26 -2.17 135.00 136.94 1aj7 s PRO 8 Ca -0.08 -0.34 -0.03 0.00 0.04 0.00 0.00 61.00 60.59 1aj7 s PRO 8 Cb -0.05 -2.11 0.12 0.00 0.04 0.00 0.00 34.50 32.51 1aj7 s PRO 8 CO 0.00 -1.51 1.52 0.77 0.04 0.00 0.00 177.00 177.82 1aj7 h SER 9 N -0.83 0.65 -4.32 6.66 0.02 -1.80 -3.40 113.55 110.54 1aj7 h SER 9 Ca -0.44 -0.33 -0.28 0.00 -0.84 0.00 0.00 61.79 59.90 1aj7 h SER 9 Cb 1.30 -0.19 -0.25 0.00 0.14 0.00 0.00 62.40 63.40 1aj7 h SER 9 CO 0.55 1.04 -0.74 -0.44 -1.14 0.00 0.00 176.83 176.10 1aj7 s SER 10 N -6.90 0.60 -0.03 3.07 0.01 -1.26 -0.77 113.70 108.42 1aj7 s SER 10 Ca -0.08 -0.30 -0.00 0.00 1.31 0.00 0.00 55.95 56.88 1aj7 s SER 10 Cb 0.11 -0.01 0.03 0.00 0.21 0.00 0.00 66.02 66.37 1aj7 s SER 10 CO 0.84 -0.08 0.04 -0.22 0.41 0.00 0.00 173.24 174.24 1aj7 s LEU 11 N -0.79 1.02 -0.15 2.44 2.96 0.14 -4.90 118.68 119.39 1aj7 s LEU 11 Ca -0.04 0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 53.92 1aj7 s LEU 11 Cb -0.06 -0.02 -0.02 0.00 0.50 0.00 0.00 46.19 46.60 1aj7 s LEU 11 CO -0.00 -0.13 -0.09 -0.55 -1.32 0.00 0.00 176.35 174.26 1aj7 s SER 12 N 1.10 4.28 -0.01 3.68 0.15 -1.26 -0.16 113.70 121.48 1aj7 s SER 12 Ca -0.09 -0.29 -0.06 0.00 0.70 0.00 0.00 55.95 56.22 1aj7 s SER 12 Cb -0.13 -1.68 0.00 0.00 -1.71 0.00 0.00 66.02 62.50 1aj7 s SER 12 CO -0.03 0.13 0.12 0.00 1.20 0.00 0.00 173.24 174.66 1aj7 s ALA 13 N 0.57 -0.28 0.58 5.45 0.00 -0.40 -4.96 121.76 122.72 1aj7 s ALA 13 Ca -0.06 -0.01 -0.14 0.00 0.00 0.00 0.00 51.96 51.75 1aj7 s ALA 13 Cb -0.15 0.00 -0.05 0.00 0.00 0.00 0.00 23.12 22.92 1aj7 s ALA 13 CO 0.03 -0.16 1.02 -1.12 0.00 0.00 0.00 175.76 175.54 1aj7 s SER 14 N -0.91 6.21 0.32 0.00 0.01 -1.26 -0.23 113.70 117.85 1aj7 s SER 14 Ca -0.10 1.56 -0.29 0.00 1.31 0.00 0.00 55.95 58.43 1aj7 s SER 14 Cb -0.06 -2.50 -0.10 0.00 0.21 0.00 0.00 66.02 63.57 1aj7 s SER 14 CO 0.01 -0.87 1.41 -0.76 0.41 0.00 0.00 173.24 173.43 1aj7 s LEU 15 N -4.68 4.38 0.00 2.44 1.43 -1.20 -2.29 118.68 118.76 1aj7 s LEU 15 Ca 0.58 2.81 0.00 0.00 -1.03 0.00 0.00 54.13 56.49 1aj7 s LEU 15 Cb -0.12 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.45 1aj7 s LEU 15 CO 0.43 -0.69 0.00 0.61 0.23 0.00 0.00 176.35 176.92 1aj7 n GLY 16 N 1.08 1.67 3.81 -3.19 0.00 0.41 -4.88 105.19 104.09 1aj7 n GLY 16 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1aj7 n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1aj7 s GLU 17 N -0.40 3.82 -0.37 1.61 2.56 -0.97 -4.36 118.70 120.60 1aj7 s GLU 17 Ca 0.00 1.25 -0.17 0.00 0.00 0.00 0.00 54.97 56.05 1aj7 s GLU 17 Cb 0.00 -2.10 0.00 0.00 2.00 0.00 0.00 34.13 34.03 1aj7 s GLU 17 CO 0.00 -0.40 0.45 0.50 -0.56 0.00 0.00 175.26 175.25 1aj7 s ARG 18 N -3.44 3.46 0.22 4.30 3.52 -1.18 -1.12 118.95 124.71 1aj7 s ARG 18 Ca 0.65 -0.40 0.11 0.00 -0.13 0.00 0.00 55.73 55.96 1aj7 s ARG 18 Cb -0.14 -3.85 -0.05 0.00 -1.56 0.00 0.00 34.95 29.35 1aj7 s ARG 18 CO 0.22 -0.67 -0.19 0.14 -0.81 0.00 0.00 175.30 173.99 1aj7 s VAL 19 N 2.23 2.59 0.00 7.11 -7.23 -0.55 -4.98 120.40 119.57 1aj7 s VAL 19 Ca 0.15 -2.08 -0.02 0.00 -1.81 0.00 0.00 61.98 58.22 1aj7 s VAL 19 Cb -0.16 -2.30 -0.01 0.00 0.56 0.00 0.00 36.38 34.48 1aj7 s VAL 19 CO 0.13 -0.22 0.03 -0.44 -0.31 0.00 0.00 175.10 174.29 1aj7 s SER 20 N -3.02 0.07 0.09 4.85 0.01 -1.26 -0.71 113.70 113.74 1aj7 s SER 20 Ca 0.25 -0.18 0.09 0.00 1.31 0.00 0.00 55.95 57.42 1aj7 s SER 20 Cb -0.07 0.11 -0.03 0.00 0.21 0.00 0.00 66.02 66.24 1aj7 s SER 20 CO 0.13 -0.18 -0.23 -0.76 0.41 0.00 0.00 173.24 172.61 1aj7 s LEU 21 N -0.76 2.27 0.09 2.44 1.43 -0.04 -4.88 118.68 119.24 1aj7 s LEU 21 Ca -0.08 -0.67 0.06 0.00 -1.03 0.00 0.00 54.13 52.41 1aj7 s LEU 21 Cb -0.05 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 45.11 1aj7 s LEU 21 CO -0.00 0.13 -0.15 -0.89 0.23 0.00 0.00 176.35 175.67 1aj7 s THR 22 N -1.04 1.23 -0.04 5.49 2.01 -0.92 -0.85 115.64 121.52 1aj7 s THR 22 Ca 0.09 -1.44 0.00 0.00 0.31 0.00 0.00 61.69 60.65 1aj7 s THR 22 Cb -0.10 -1.25 0.03 0.00 0.01 0.00 0.00 72.50 71.19 1aj7 s THR 22 CO 0.04 -0.26 -0.01 0.00 -0.69 0.00 0.00 174.62 173.70 1aj7 s ARG 24 N 1.05 3.34 0.11 0.00 3.52 0.20 -0.57 118.95 126.60 1aj7 s ARG 24 Ca -0.09 -0.65 -0.27 0.00 -0.13 0.00 0.00 55.73 54.59 1aj7 s ARG 24 Cb -0.14 -2.93 -0.06 0.00 -1.56 0.00 0.00 34.95 30.25 1aj7 s ARG 24 CO -0.01 -0.17 0.85 0.00 -0.81 0.00 0.00 175.30 175.16 1aj7 s ALA 25 N 1.37 3.35 -0.60 6.12 0.00 -0.76 -1.44 121.76 129.80 1aj7 s ALA 25 Ca 0.04 0.42 0.26 0.00 0.00 0.00 0.00 51.96 52.68 1aj7 s ALA 25 Cb -0.14 -3.10 0.84 0.00 0.00 0.00 0.00 23.12 20.72 1aj7 s ALA 25 CO -0.04 0.10 1.75 0.66 0.00 0.00 0.00 175.76 178.24 1aj7 h SER 26 N 5.19 0.00 -3.83 0.00 4.64 -1.50 -3.46 113.55 114.59 1aj7 h SER 26 Ca -0.44 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.48 1aj7 h SER 26 Cb 1.21 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.15 1aj7 h SER 26 CO 0.70 0.00 -0.64 -1.10 -0.87 0.00 0.00 176.83 174.92 1aj7 s GLN 27 N -3.20 1.41 -0.11 4.77 1.11 -1.26 -4.95 119.66 117.43 1aj7 s GLN 27 Ca 0.08 -1.73 -0.29 0.00 0.01 0.00 0.00 55.36 53.42 1aj7 s GLN 27 Cb 0.11 -0.62 -0.03 0.00 -1.01 0.00 0.00 33.01 31.45 1aj7 s GLN 27 CO 0.55 -0.14 1.44 -2.00 0.01 0.00 0.00 175.29 175.15 1aj7 s GLU 28 N -3.89 4.21 0.00 2.91 2.56 -1.26 -4.85 118.70 118.38 1aj7 s GLU 28 Ca 0.31 1.91 0.06 0.00 0.00 0.00 0.00 54.97 57.25 1aj7 s GLU 28 Cb 0.06 -3.85 0.13 0.00 2.00 0.00 0.00 34.13 32.47 1aj7 s GLU 28 CO 0.11 -0.76 0.99 0.44 -0.56 0.00 0.00 175.26 175.48 1aj7 n ILE 29 N 5.39 0.64 -4.37 -3.70 -5.35 -1.26 -5.02 119.36 105.69 1aj7 n ILE 29 Ca 0.15 -0.82 -0.37 0.00 -0.27 0.00 0.00 62.75 61.44 1aj7 n ILE 29 Cb 0.44 0.73 -0.07 0.00 -1.74 0.00 0.00 39.64 39.00 1aj7 n ILE 29 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1aj7 n SER 30 N 0.19 -1.36 0.00 7.28 7.64 -1.26 -1.03 113.62 125.08 1aj7 n SER 30 Ca 0.06 -1.18 0.00 0.00 1.01 0.00 0.00 58.87 58.76 1aj7 n SER 30 Cb 0.28 -1.99 0.00 0.00 -1.01 0.00 0.00 64.21 61.50 1aj7 n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aj7 n GLY 31 N -1.59 1.49 3.02 0.23 0.00 -1.26 -4.94 105.19 102.14 1aj7 n GLY 31 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1aj7 n GLY 31 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1aj7 n TYR 32 N -2.00 3.91 -3.96 1.61 4.01 -0.20 -2.15 117.16 118.37 1aj7 n TYR 32 Ca 0.00 -2.93 -0.14 0.00 -0.16 0.00 0.00 57.90 54.67 1aj7 n TYR 32 Cb 0.00 -2.57 -0.14 0.00 -0.31 0.00 0.00 39.34 36.32 1aj7 n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1aj7 s LEU 33 N 2.79 1.93 0.18 7.72 0.20 -1.26 -1.63 118.68 128.62 1aj7 s LEU 33 Ca 0.49 -0.03 0.11 0.00 0.69 0.00 0.00 54.13 55.39 1aj7 s LEU 33 Cb 0.10 -0.10 -0.04 0.00 -0.43 0.00 0.00 46.19 45.72 1aj7 s LEU 33 CO -0.03 0.01 -0.23 -0.44 -0.29 0.00 0.00 176.35 175.37 1aj7 s SER 34 N 0.05 3.31 -0.17 3.68 0.01 0.16 -1.07 113.70 119.67 1aj7 s SER 34 Ca -0.00 -0.85 -0.01 0.00 1.31 0.00 0.00 55.95 56.40 1aj7 s SER 34 Cb -0.02 -0.24 -0.01 0.00 0.21 0.00 0.00 66.02 65.97 1aj7 s SER 34 CO -0.00 0.10 -0.12 0.26 0.41 0.00 0.00 173.24 173.89 1aj7 s TRP 35 N -1.66 2.84 0.09 2.43 0.52 -0.10 0.05 118.94 123.11 1aj7 s TRP 35 Ca 0.19 -0.93 0.07 0.00 0.02 0.00 0.00 56.10 55.46 1aj7 s TRP 35 Cb -0.08 -1.94 -0.04 0.00 -1.15 0.00 0.00 33.47 30.27 1aj7 s TRP 35 CO 0.09 -0.43 -0.13 -0.51 0.02 0.00 0.00 176.95 175.99 1aj7 s LEU 36 N 0.88 2.90 -0.10 2.99 1.43 0.87 -0.56 118.68 127.08 1aj7 s LEU 36 Ca -0.03 -0.43 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1aj7 s LEU 36 Cb -0.15 -1.71 0.01 0.00 0.03 0.00 0.00 46.19 44.37 1aj7 s LEU 36 CO -0.00 0.19 -0.18 -1.58 0.23 0.00 0.00 176.35 175.01 1aj7 s GLN 37 N -2.05 2.46 -0.25 1.70 0.74 0.71 -0.93 119.66 122.05 1aj7 s GLN 37 Ca 0.19 -0.66 0.00 0.00 0.05 0.00 0.00 55.36 54.94 1aj7 s GLN 37 Cb -0.11 -1.99 0.04 0.00 1.10 0.00 0.00 33.01 32.05 1aj7 s GLN 37 CO 0.11 0.02 -0.08 -1.14 -0.55 0.00 0.00 175.29 173.65 1aj7 s GLN 38 N 0.73 2.59 0.76 1.67 0.74 0.13 -0.97 119.66 125.31 1aj7 s GLN 38 Ca -0.11 -1.13 -0.12 0.00 0.05 0.00 0.00 55.36 54.05 1aj7 s GLN 38 Cb -0.16 -2.94 0.05 0.00 1.10 0.00 0.00 33.01 31.06 1aj7 s GLN 38 CO 0.02 -0.47 1.12 0.15 -0.55 0.00 0.00 175.29 175.57 1aj7 s LYS 39 N 1.24 2.38 0.44 1.67 1.02 -0.43 -1.20 119.74 124.87 1aj7 s LYS 39 Ca -0.03 0.37 0.24 0.00 0.02 0.00 0.00 55.97 56.57 1aj7 s LYS 39 Cb -0.18 -1.98 1.24 0.00 -0.52 0.00 0.00 37.83 36.40 1aj7 s LYS 39 CO -0.05 -1.35 1.79 -1.35 -0.92 0.00 0.00 175.35 173.46 1aj7 h PRO 40 N -0.88 0.26 0.00 -1.68 0.11 -1.90 -0.22 132.00 127.68 1aj7 h PRO 40 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1aj7 h PRO 40 Cb 1.28 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1aj7 h PRO 40 CO 0.64 0.17 0.00 -0.40 -0.21 0.00 0.00 178.00 178.20 1aj7 n ASP 41 N -4.49 0.00 0.00 -2.05 5.75 -1.26 -4.86 116.55 109.63 1aj7 n ASP 41 Ca 0.25 -1.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.03 1aj7 n ASP 41 Cb 0.97 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 41.06 1aj7 n ASP 41 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1aj7 n GLY 42 N 0.56 0.94 3.68 6.12 0.00 -0.09 -5.03 105.19 111.36 1aj7 n GLY 42 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1aj7 n GLY 42 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aj7 s THR 43 N -2.37 3.40 -0.10 2.61 2.01 -1.25 -4.80 115.64 115.14 1aj7 s THR 43 Ca 0.00 0.71 -0.01 0.00 0.31 0.00 0.00 61.69 62.69 1aj7 s THR 43 Cb 0.00 -3.45 -0.03 0.00 0.01 0.00 0.00 72.50 69.03 1aj7 s THR 43 CO 0.00 -0.03 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.23 1aj7 s ILE 44 N 3.15 3.90 -0.03 1.82 1.01 -1.26 -1.31 121.20 128.48 1aj7 s ILE 44 Ca 0.71 -0.39 -0.05 0.00 0.00 0.00 0.00 60.65 60.92 1aj7 s ILE 44 Cb -0.35 -2.64 0.01 0.00 0.01 0.00 0.00 42.46 39.48 1aj7 s ILE 44 CO 0.30 0.56 0.13 -0.75 0.00 0.00 0.00 174.94 175.18 1aj7 s LYS 45 N -0.41 0.28 -0.09 2.79 2.20 -0.14 -4.96 119.74 119.40 1aj7 s LYS 45 Ca 0.07 -0.05 -0.22 0.00 -0.36 0.00 0.00 55.97 55.41 1aj7 s LYS 45 Cb -0.12 0.12 -0.04 0.00 -1.51 0.00 0.00 37.83 36.28 1aj7 s LYS 45 CO 0.02 -0.05 0.63 0.50 -0.36 0.00 0.00 175.35 176.09 1aj7 s ARG 46 N -0.50 4.40 -0.25 4.03 3.52 -1.26 -0.21 118.95 128.68 1aj7 s ARG 46 Ca -0.06 0.75 0.01 0.00 -0.13 0.00 0.00 55.73 56.30 1aj7 s ARG 46 Cb -0.04 -3.45 -0.16 0.00 -1.56 0.00 0.00 34.95 29.74 1aj7 s ARG 46 CO 0.01 0.08 -0.22 1.28 -0.81 0.00 0.00 175.30 175.63 1aj7 n LEU 47 N 3.81 2.93 -4.03 -0.88 4.77 0.28 -4.78 117.00 119.11 1aj7 n LEU 47 Ca -0.03 -0.11 -0.09 0.00 -0.03 0.00 0.00 56.01 55.75 1aj7 n LEU 47 Cb 0.51 -0.86 -0.11 0.00 -2.33 0.00 0.00 43.42 40.63 1aj7 n LEU 47 CO 0.46 0.90 -0.37 -0.63 -1.33 0.00 0.00 177.39 176.42 1aj7 s ILE 48 N -2.49 0.24 0.18 -0.08 1.01 -1.11 -1.47 121.20 117.48 1aj7 s ILE 48 Ca -0.33 -1.17 -0.06 0.00 0.00 0.00 0.00 60.65 59.09 1aj7 s ILE 48 Cb 0.09 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.89 1aj7 s ILE 48 CO 0.57 -0.60 0.22 -0.72 0.00 0.00 0.00 174.94 174.41 1aj7 s TYR 49 N -2.04 0.69 -1.36 3.97 1.13 -0.39 -0.93 117.35 118.43 1aj7 s TYR 49 Ca -0.09 -1.02 0.00 0.00 -1.41 0.00 0.00 57.07 54.55 1aj7 s TYR 49 Cb -0.06 -0.24 0.00 0.00 -1.10 0.00 0.00 41.96 40.56 1aj7 s TYR 49 CO -0.03 -0.70 0.00 0.00 -2.51 0.00 0.00 175.55 172.32 1aj7 n ALA 50 N -0.23 -0.71 0.00 9.51 0.00 -0.97 -1.17 120.51 126.95 1aj7 n ALA 50 Ca -0.04 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1aj7 n ALA 50 Cb 0.64 -1.78 0.00 0.00 0.00 0.00 0.00 19.45 18.31 1aj7 n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aj7 n ALA 51 N -2.09 0.00 -0.74 0.00 0.00 -0.23 -4.18 120.51 113.26 1aj7 n ALA 51 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1aj7 n ALA 51 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1aj7 n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1aj7 n SER 52 N 1.27 0.48 -4.59 0.00 3.41 -1.17 -3.56 113.62 109.45 1aj7 n SER 52 Ca 0.00 -1.22 -0.40 0.00 -0.26 0.00 0.00 58.87 56.99 1aj7 n SER 52 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1aj7 n SER 52 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1aj7 s THR 53 N -0.22 5.09 0.26 6.66 2.01 -0.31 -4.54 115.64 124.58 1aj7 s THR 53 Ca 0.00 0.61 -0.30 0.00 0.31 0.00 0.00 61.69 62.31 1aj7 s THR 53 Cb 0.00 -3.82 -0.09 0.00 0.01 0.00 0.00 72.50 68.59 1aj7 s THR 53 CO 0.00 0.02 1.05 -0.76 -0.69 0.00 0.00 174.62 174.24 1aj7 s LEU 54 N 2.25 4.58 0.74 4.42 1.02 -1.26 -1.26 118.68 129.16 1aj7 s LEU 54 Ca 0.18 2.16 -0.11 0.00 0.02 0.00 0.00 54.13 56.38 1aj7 s LEU 54 Cb -0.16 -3.62 0.04 0.00 0.02 0.00 0.00 46.19 42.47 1aj7 s LEU 54 CO 0.11 -0.06 1.07 -1.81 0.02 0.00 0.00 176.35 175.68 1aj7 s ASP 55 N -0.90 4.92 0.25 2.29 1.11 -0.54 -4.94 116.67 118.86 1aj7 s ASP 55 Ca 0.44 1.64 -0.31 0.00 0.18 0.00 0.00 52.55 54.50 1aj7 s ASP 55 Cb -0.30 -2.44 -0.11 0.00 1.07 0.00 0.00 42.92 41.14 1aj7 s ASP 55 CO 0.38 -1.74 1.62 -0.44 1.18 0.00 0.00 175.17 176.17 1aj7 s SER 56 N -3.66 6.41 0.00 0.27 0.01 -1.26 -2.11 113.70 113.36 1aj7 s SER 56 Ca 0.60 2.87 0.00 0.00 1.31 0.00 0.00 55.95 60.73 1aj7 s SER 56 Cb -0.15 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.46 1aj7 s SER 56 CO 0.55 -0.91 0.00 0.61 0.41 0.00 0.00 173.24 173.90 1aj7 n GLY 57 N 2.93 2.03 3.72 3.44 0.00 -1.26 -5.01 105.19 111.03 1aj7 n GLY 57 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1aj7 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aj7 s VAL 58 N -3.12 3.89 0.33 1.61 1.01 -0.89 -4.96 120.40 118.27 1aj7 s VAL 58 Ca 0.00 1.39 -0.28 0.00 0.00 0.00 0.00 61.98 63.08 1aj7 s VAL 58 Cb 0.00 -3.89 -0.12 0.00 0.00 0.00 0.00 36.38 32.37 1aj7 s VAL 58 CO 0.00 0.12 1.31 -2.65 0.00 0.00 0.00 175.10 173.89 1aj7 n PRO 59 N 3.73 2.13 0.30 2.72 -0.02 -1.26 -4.88 135.00 137.72 1aj7 n PRO 59 Ca 0.09 0.75 0.17 0.00 -2.02 0.00 0.00 63.50 62.49 1aj7 n PRO 59 Cb 0.46 -2.34 0.92 0.00 -0.02 0.00 0.00 33.50 32.51 1aj7 n PRO 59 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1aj7 h LYS 60 N 2.83 0.00 0.00 -0.52 2.10 -1.99 -1.96 116.57 117.03 1aj7 h LYS 60 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1aj7 h LYS 60 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 1aj7 h LYS 60 CO 0.65 0.00 0.00 0.07 -2.00 0.00 0.00 179.45 178.17 1aj7 h ARG 61 N 0.00 0.00 -6.10 0.07 0.11 -1.93 -3.42 114.38 103.10 1aj7 h ARG 61 Ca 0.00 0.00 -0.59 0.00 0.10 0.00 0.00 59.98 59.49 1aj7 h ARG 61 Cb 0.26 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.29 1aj7 h ARG 61 CO 0.00 0.00 -0.12 -0.06 0.10 0.00 0.00 179.97 179.89 1aj7 s PHE 62 N -3.72 3.76 -0.08 4.08 0.08 -0.74 -0.89 117.98 120.46 1aj7 s PHE 62 Ca -0.00 1.12 -0.24 0.00 0.12 0.00 0.00 56.93 57.93 1aj7 s PHE 62 Cb 0.10 -2.39 0.05 0.00 -0.57 0.00 0.00 43.02 40.21 1aj7 s PHE 62 CO 0.46 0.60 0.55 -1.54 -0.10 0.00 0.00 175.22 175.19 1aj7 s SER 63 N -1.03 -0.52 0.15 1.36 1.04 -0.33 -4.98 113.70 109.38 1aj7 s SER 63 Ca 0.26 0.65 0.10 0.00 0.48 0.00 0.00 55.95 57.45 1aj7 s SER 63 Cb -0.18 0.63 -0.04 0.00 0.10 0.00 0.00 66.02 66.53 1aj7 s SER 63 CO 0.16 -0.47 -0.24 -0.83 0.98 0.00 0.00 173.24 172.84 1aj7 s GLY 64 N -0.87 1.54 0.15 7.32 0.00 -1.26 -0.04 107.32 114.15 1aj7 s GLY 64 Ca -0.09 -1.48 -0.08 0.00 0.00 0.00 0.00 44.72 43.07 1aj7 s GLY 64 CO 0.06 -1.48 0.24 -1.35 0.00 0.00 0.00 173.10 170.57 1aj7 s SER 65 N -2.27 0.08 0.02 1.64 1.04 -0.45 -4.42 113.70 109.34 1aj7 s SER 65 Ca 0.15 -0.85 0.02 0.00 0.48 0.00 0.00 55.95 55.74 1aj7 s SER 65 Cb -0.09 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.42 1aj7 s SER 65 CO 0.07 -0.84 -0.06 -0.60 0.98 0.00 0.00 173.24 172.78 1aj7 s ARG 66 N -3.95 0.45 -0.37 4.02 3.52 -1.26 -1.42 118.95 119.94 1aj7 s ARG 66 Ca 0.15 -0.46 0.03 0.00 -0.13 0.00 0.00 55.73 55.32 1aj7 s ARG 66 Cb 0.04 -0.31 0.16 0.00 -1.56 0.00 0.00 34.95 33.27 1aj7 s ARG 66 CO -0.02 0.07 0.38 -1.54 -0.81 0.00 0.00 175.30 173.38 1aj7 s SER 67 N -0.86 1.10 1.63 -2.12 1.04 0.01 -5.02 113.70 109.47 1aj7 s SER 67 Ca -0.05 -1.49 0.00 0.00 0.48 0.00 0.00 55.95 54.89 1aj7 s SER 67 Cb -0.06 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1aj7 s SER 67 CO 0.00 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 174.57 1aj7 n GLY 68 N 4.33 2.84 0.38 7.32 0.00 -1.26 -1.62 105.19 117.17 1aj7 n GLY 68 Ca 0.10 -0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.01 1aj7 n GLY 68 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1aj7 n SER 69 N 6.98 1.14 -4.62 1.61 7.64 -1.26 -4.79 113.62 120.32 1aj7 n SER 69 Ca 0.00 -1.53 -0.38 0.00 1.01 0.00 0.00 58.87 57.97 1aj7 n SER 69 Cb 0.00 -0.05 -0.10 0.00 -1.01 0.00 0.00 64.21 63.05 1aj7 n SER 69 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1aj7 s ASP 70 N -1.72 6.13 -0.13 6.43 1.01 -0.64 -1.82 116.67 125.93 1aj7 s ASP 70 Ca 0.34 0.13 0.02 0.00 0.71 0.00 0.00 52.55 53.75 1aj7 s ASP 70 Cb 0.18 -2.14 0.00 0.00 1.01 0.00 0.00 42.92 41.97 1aj7 s ASP 70 CO 0.28 -0.04 -0.20 -0.31 0.21 0.00 0.00 175.17 175.11 1aj7 s TYR 71 N 1.53 2.67 0.12 4.23 1.51 0.26 -0.81 117.35 126.86 1aj7 s TYR 71 Ca 0.10 -1.07 0.09 0.00 -1.01 0.00 0.00 57.07 55.18 1aj7 s TYR 71 Cb -0.15 -1.79 -0.04 0.00 -0.11 0.00 0.00 41.96 39.87 1aj7 s TYR 71 CO 0.08 -0.45 -0.23 -1.12 -1.11 0.00 0.00 175.55 172.72 1aj7 s SER 72 N 0.56 2.84 -0.11 2.29 0.01 -0.51 -0.18 113.70 118.60 1aj7 s SER 72 Ca -0.12 -0.72 0.02 0.00 1.31 0.00 0.00 55.95 56.44 1aj7 s SER 72 Cb -0.17 -0.17 -0.01 0.00 0.21 0.00 0.00 66.02 65.89 1aj7 s SER 72 CO 0.04 0.10 -0.19 -0.22 0.41 0.00 0.00 173.24 173.37 1aj7 s LEU 73 N -2.03 2.38 -0.04 2.44 2.96 -0.03 -1.34 118.68 123.02 1aj7 s LEU 73 Ca 0.10 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.62 1aj7 s LEU 73 Cb -0.10 -1.50 -0.01 0.00 0.50 0.00 0.00 46.19 45.09 1aj7 s LEU 73 CO 0.05 0.18 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.18 1aj7 s THR 74 N 0.25 1.56 -0.25 3.68 2.01 0.94 -0.86 115.64 122.98 1aj7 s THR 74 Ca -0.13 -0.80 0.01 0.00 0.31 0.00 0.00 61.69 61.08 1aj7 s THR 74 Cb -0.16 -1.32 0.04 0.00 0.01 0.00 0.00 72.50 71.06 1aj7 s THR 74 CO 0.07 0.44 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.71 1aj7 s ILE 75 N -0.12 2.44 0.08 1.82 1.01 0.11 -1.19 121.20 125.35 1aj7 s ILE 75 Ca -0.01 -1.32 -0.32 0.00 0.00 0.00 0.00 60.65 59.01 1aj7 s ILE 75 Cb -0.11 -2.31 -0.16 0.00 0.01 0.00 0.00 42.46 39.89 1aj7 s ILE 75 CO 0.02 0.12 1.62 0.28 0.00 0.00 0.00 174.94 176.98 1aj7 h SER 76 N 7.90 -0.83 -3.29 3.58 0.02 -1.30 -1.46 113.55 118.17 1aj7 h SER 76 Ca -0.28 0.05 -0.60 0.00 -0.84 0.00 0.00 61.79 60.12 1aj7 h SER 76 Cb 1.08 0.25 -0.40 0.00 0.14 0.00 0.00 62.40 63.47 1aj7 h SER 76 CO 0.53 -0.51 -0.75 -0.44 -1.14 0.00 0.00 176.83 174.52 1aj7 s SER 77 N -4.50 4.21 0.11 3.07 0.01 -1.25 -3.10 113.70 112.25 1aj7 s SER 77 Ca -0.17 -1.76 -0.34 0.00 1.31 0.00 0.00 55.95 54.99 1aj7 s SER 77 Cb 0.05 -1.06 -0.13 0.00 0.21 0.00 0.00 66.02 65.09 1aj7 s SER 77 CO 0.63 -0.41 1.64 -0.11 0.41 0.00 0.00 173.24 175.40 1aj7 n LEU 78 N 4.70 3.18 -4.55 2.44 7.94 -0.27 -4.62 117.00 125.82 1aj7 n LEU 78 Ca -0.01 1.06 -0.24 0.00 -1.11 0.00 0.00 56.01 55.71 1aj7 n LEU 78 Cb 0.42 -1.42 -0.09 0.00 0.53 0.00 0.00 43.42 42.86 1aj7 n LEU 78 CO 0.14 -0.23 -0.40 -1.61 -1.11 0.00 0.00 177.39 174.18 1aj7 s GLU 79 N 1.59 1.90 0.45 1.96 2.02 -1.26 -0.45 118.70 124.91 1aj7 s GLU 79 Ca 0.82 -1.74 0.12 0.00 0.02 0.00 0.00 54.97 54.18 1aj7 s GLU 79 Cb -0.68 -1.86 1.02 0.00 0.10 0.00 0.00 34.13 32.71 1aj7 s GLU 79 CO 0.41 0.25 2.06 0.77 0.02 0.00 0.00 175.26 178.77 1aj7 h SER 80 N 2.05 0.32 0.56 -0.19 0.02 -1.85 -0.83 113.55 113.63 1aj7 h SER 80 Ca -0.42 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.52 1aj7 h SER 80 Cb 1.25 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.72 1aj7 h SER 80 CO 0.64 0.22 -0.04 -0.33 -1.14 0.00 0.00 176.83 176.18 1aj7 h GLU 81 N 0.37 0.00 0.00 3.45 4.39 -1.78 -2.59 114.58 118.42 1aj7 h GLU 81 Ca 0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.86 1aj7 h GLU 81 Cb 0.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1aj7 h GLU 81 CO -0.04 0.04 0.00 -0.25 -1.16 0.00 0.00 179.01 177.60 1aj7 n ASP 82 N -3.22 0.00 -4.61 1.42 8.00 -0.32 -4.76 116.55 113.07 1aj7 n ASP 82 Ca -0.01 -0.73 -0.43 0.00 0.71 0.00 0.00 54.79 54.33 1aj7 n ASP 82 Cb 0.22 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.24 1aj7 n ASP 82 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1aj7 s PHE 83 N -2.11 1.63 0.01 1.24 5.36 -0.98 -4.86 117.98 118.27 1aj7 s PHE 83 Ca 0.39 0.50 -0.28 0.00 -0.96 0.00 0.00 56.93 56.58 1aj7 s PHE 83 Cb 0.19 -4.05 0.10 0.00 -0.34 0.00 0.00 43.02 38.92 1aj7 s PHE 83 CO 0.34 -3.50 1.25 0.00 -1.46 0.00 0.00 175.22 171.86 1aj7 s ALA 84 N 6.82 -2.32 -0.20 11.12 0.00 -1.23 -4.58 121.76 131.37 1aj7 s ALA 84 Ca 0.85 0.08 -0.06 0.00 0.00 0.00 0.00 51.96 52.83 1aj7 s ALA 84 Cb -0.28 0.80 -0.03 0.00 0.00 0.00 0.00 23.12 23.62 1aj7 s ALA 84 CO 0.34 -1.13 0.03 0.34 0.00 0.00 0.00 175.76 175.34 1aj7 s ASP 85 N -3.64 5.15 -0.12 0.00 -1.08 -0.34 -1.17 116.67 115.47 1aj7 s ASP 85 Ca 0.26 -0.10 -0.03 0.00 -0.52 0.00 0.00 52.55 52.17 1aj7 s ASP 85 Cb -0.00 -1.88 -0.03 0.00 -1.46 0.00 0.00 42.92 39.54 1aj7 s ASP 85 CO -0.00 0.10 -0.01 -0.31 0.52 0.00 0.00 175.17 175.46 1aj7 s TYR 86 N 0.80 3.10 -0.04 -5.34 1.51 -0.62 -0.69 117.35 116.06 1aj7 s TYR 86 Ca 0.02 -0.04 0.04 0.00 -1.01 0.00 0.00 57.07 56.08 1aj7 s TYR 86 Cb -0.14 -1.89 -0.00 0.00 -0.11 0.00 0.00 41.96 39.82 1aj7 s TYR 86 CO 0.02 0.21 -0.16 0.71 -1.11 0.00 0.00 175.55 175.22 1aj7 s TYR 87 N -0.21 1.63 0.20 2.71 1.51 -0.10 -1.04 117.35 122.04 1aj7 s TYR 87 Ca 0.05 -0.46 -0.08 0.00 -1.01 0.00 0.00 57.07 55.57 1aj7 s TYR 87 Cb -0.13 -1.10 -0.07 0.00 -0.11 0.00 0.00 41.96 40.56 1aj7 s TYR 87 CO 0.02 -0.15 0.49 0.00 -1.11 0.00 0.00 175.55 174.80 1aj7 s LEU 89 N -2.73 1.27 -0.22 0.00 2.96 0.11 -1.18 118.68 118.88 1aj7 s LEU 89 Ca 0.45 -0.18 -0.17 0.00 -0.22 0.00 0.00 54.13 54.01 1aj7 s LEU 89 Cb -0.12 -0.57 -0.03 0.00 0.50 0.00 0.00 46.19 45.97 1aj7 s LEU 89 CO 0.22 -0.07 0.46 -1.58 -1.32 0.00 0.00 176.35 174.07 1aj7 s GLN 90 N 1.11 4.14 -0.16 1.98 -0.44 -0.34 -0.66 119.66 125.29 1aj7 s GLN 90 Ca -0.08 0.28 0.16 0.00 -2.50 0.00 0.00 55.36 53.22 1aj7 s GLN 90 Cb -0.14 -3.58 0.44 0.00 -1.64 0.00 0.00 33.01 28.08 1aj7 s GLN 90 CO -0.01 -0.17 1.19 2.48 0.50 0.00 0.00 175.29 179.29 1aj7 n TYR 91 N 4.89 0.45 0.05 1.67 0.18 -0.64 -3.37 117.16 120.39 1aj7 n TYR 91 Ca -0.06 -1.34 -0.15 0.00 1.88 0.00 0.00 57.90 58.22 1aj7 n TYR 91 Cb 0.51 -0.23 -0.14 0.00 -0.38 0.00 0.00 39.34 39.10 1aj7 n TYR 91 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1aj7 h ALA 92 N 1.28 0.35 -2.82 -3.48 0.00 -1.84 -3.49 119.26 109.26 1aj7 h ALA 92 Ca -0.03 -1.16 -0.14 0.00 0.00 0.00 0.00 54.91 53.58 1aj7 h ALA 92 Cb 1.36 0.30 -0.10 0.00 0.00 0.00 0.00 17.79 19.35 1aj7 h ALA 92 CO 0.14 1.22 -0.22 -1.54 0.00 0.00 0.00 179.25 178.85 1aj7 s SER 93 N -6.85 0.21 -0.05 0.00 1.04 -1.26 -5.12 113.70 101.67 1aj7 s SER 93 Ca -0.09 -1.16 -0.03 0.00 0.48 0.00 0.00 55.95 55.16 1aj7 s SER 93 Cb 0.07 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 1aj7 s SER 93 CO 0.84 -1.14 0.13 -0.31 0.98 0.00 0.00 173.24 173.75 1aj7 s TYR 94 N -3.77 3.47 0.56 5.02 2.02 -1.26 -3.76 117.35 119.63 1aj7 s TYR 94 Ca 0.27 0.36 -0.15 0.00 -0.37 0.00 0.00 57.07 57.18 1aj7 s TYR 94 Cb 0.01 -1.84 -0.06 0.00 -0.40 0.00 0.00 41.96 39.67 1aj7 s TYR 94 CO 0.12 0.64 1.02 -1.25 -1.57 0.00 0.00 175.55 174.51 1aj7 s PRO 95 N -1.54 3.68 0.29 -1.71 0.04 -1.26 -4.86 135.00 129.64 1aj7 s PRO 95 Ca 0.21 1.01 -0.29 0.00 0.04 0.00 0.00 61.00 61.97 1aj7 s PRO 95 Cb -0.12 -2.09 -0.10 0.00 0.04 0.00 0.00 34.50 32.22 1aj7 s PRO 95 CO 0.12 -0.50 1.37 1.03 0.04 0.00 0.00 177.00 179.06 1aj7 s ARG 96 N -4.23 4.31 0.04 4.56 1.81 -1.25 -4.72 118.95 119.47 1aj7 s ARG 96 Ca 0.60 2.26 0.05 0.00 -1.72 0.00 0.00 55.73 56.92 1aj7 s ARG 96 Cb -0.12 -3.09 -0.02 0.00 -0.45 0.00 0.00 34.95 31.27 1aj7 s ARG 96 CO 0.36 -0.30 -0.15 0.95 -0.68 0.00 0.00 175.30 175.48 1aj7 s THR 97 N -0.61 1.21 0.18 0.02 -4.23 -1.22 -5.01 115.64 105.98 1aj7 s THR 97 Ca 0.54 -1.01 0.06 0.00 -1.18 0.00 0.00 61.69 60.10 1aj7 s THR 97 Cb -0.41 -1.08 -0.04 0.00 1.34 0.00 0.00 72.50 72.31 1aj7 s THR 97 CO 0.49 0.06 0.06 -0.36 -0.54 0.00 0.00 174.62 174.32 1aj7 s PHE 98 N -0.81 2.97 0.71 3.99 0.40 -1.26 -1.20 117.98 122.78 1aj7 s PHE 98 Ca 0.03 -0.09 -0.10 0.00 -0.60 0.00 0.00 56.93 56.17 1aj7 s PHE 98 Cb -0.08 -1.43 0.04 0.00 0.51 0.00 0.00 43.02 42.06 1aj7 s PHE 98 CO 0.01 0.52 1.07 0.20 0.70 0.00 0.00 175.22 177.72 1aj7 s GLY 99 N -3.06 1.62 0.57 4.36 0.00 -0.33 -4.46 107.32 106.02 1aj7 s GLY 99 Ca 0.29 -0.57 0.32 0.00 0.00 0.00 0.00 44.72 44.76 1aj7 s GLY 99 CO 0.21 -0.18 2.16 -1.33 0.00 0.00 0.00 173.10 173.95 1aj7 h GLY 100 N -0.65 0.00 0.00 0.20 0.00 -1.86 -3.43 103.07 97.33 1aj7 h GLY 100 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1aj7 h GLY 100 CO 0.63 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.78 1aj7 n GLY 101 N -0.79 1.75 3.00 4.60 0.00 -1.26 -5.03 105.19 107.47 1aj7 n GLY 101 Ca -0.02 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.01 1aj7 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aj7 s THR 102 N -2.08 1.59 -0.36 2.61 2.01 -0.21 -4.53 115.64 114.67 1aj7 s THR 102 Ca 0.00 -0.81 -0.28 0.00 0.31 0.00 0.00 61.69 60.91 1aj7 s THR 102 Cb 0.00 -1.59 0.02 0.00 0.01 0.00 0.00 72.50 70.94 1aj7 s THR 102 CO 0.00 0.31 1.02 -0.54 -0.69 0.00 0.00 174.62 174.72 1aj7 s LYS 103 N 1.45 3.93 -0.35 4.92 1.02 0.05 -1.58 119.74 129.17 1aj7 s LYS 103 Ca 0.02 0.80 -0.16 0.00 0.02 0.00 0.00 55.97 56.65 1aj7 s LYS 103 Cb -0.14 -3.79 -0.01 0.00 -0.52 0.00 0.00 37.83 33.37 1aj7 s LYS 103 CO -0.09 -0.98 0.42 0.08 -0.92 0.00 0.00 175.35 173.85 1aj7 s VAL 104 N 3.68 5.11 0.08 3.17 1.01 -0.31 -0.69 120.40 132.45 1aj7 s VAL 104 Ca 0.43 0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.53 1aj7 s VAL 104 Cb -0.11 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 1aj7 s VAL 104 CO 0.19 -0.17 0.12 -1.61 0.00 0.00 0.00 175.10 173.62 1aj7 s GLU 105 N 2.16 3.02 -0.12 2.72 2.02 0.78 -3.51 118.70 125.77 1aj7 s GLU 105 Ca 0.14 -0.64 0.01 0.00 0.02 0.00 0.00 54.97 54.50 1aj7 s GLU 105 Cb -0.16 -2.80 -0.01 0.00 0.10 0.00 0.00 34.13 31.25 1aj7 s GLU 105 CO 0.12 0.57 -0.14 0.42 0.02 0.00 0.00 175.26 176.25 1aj7 s ILE 106 N -1.44 2.94 -0.08 -1.63 1.01 -1.26 -1.28 121.20 119.46 1aj7 s ILE 106 Ca 0.31 -0.71 -0.14 0.00 0.00 0.00 0.00 60.65 60.11 1aj7 s ILE 106 Cb -0.12 -2.21 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 1aj7 s ILE 106 CO 0.24 0.53 0.34 -0.54 0.00 0.00 0.00 174.94 175.51 1aj7 s LYS 107 N 0.25 4.00 0.14 2.79 1.02 0.68 -4.89 119.74 123.73 1aj7 s LYS 107 Ca -0.10 0.23 0.01 0.00 0.02 0.00 0.00 55.97 56.13 1aj7 s LYS 107 Cb -0.16 -3.31 -0.00 0.00 -0.52 0.00 0.00 37.83 33.85 1aj7 s LYS 107 CO 0.06 0.50 0.16 2.89 -0.92 0.00 0.00 175.35 178.04 1aj7 n ARG 108 N 2.61 0.24 -2.34 1.68 1.85 -1.26 -3.24 116.66 116.19 1aj7 n ARG 108 Ca -0.13 -1.18 -0.32 0.00 -1.00 0.00 0.00 57.85 55.21 1aj7 n ARG 108 Cb 0.52 1.07 -0.02 0.00 -1.05 0.00 0.00 32.46 32.98 1aj7 n ARG 108 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 1aj7 s THR 109 N -2.56 4.28 0.22 8.89 -4.23 -1.26 -4.98 115.64 116.00 1aj7 s THR 109 Ca 0.13 1.13 -0.31 0.00 -1.18 0.00 0.00 61.69 61.46 1aj7 s THR 109 Cb 0.00 -3.60 -0.11 0.00 1.34 0.00 0.00 72.50 70.13 1aj7 s THR 109 CO 0.09 -0.59 1.56 0.54 -0.54 0.00 0.00 174.62 175.69 1aj7 s VAL 110 N -2.51 2.42 -0.06 2.29 0.11 -1.26 -4.75 120.40 116.64 1aj7 s VAL 110 Ca 0.61 0.33 0.02 0.00 -2.93 0.00 0.00 61.98 60.00 1aj7 s VAL 110 Cb -0.12 -3.21 0.02 0.00 -1.53 0.00 0.00 36.38 31.54 1aj7 s VAL 110 CO 0.31 0.04 -0.10 0.00 -3.33 0.00 0.00 175.10 172.02 1aj7 s ALA 111 N 0.57 1.05 0.25 1.54 0.00 -0.14 -4.93 121.76 120.10 1aj7 s ALA 111 Ca 0.66 -0.28 -0.30 0.00 0.00 0.00 0.00 51.96 52.04 1aj7 s ALA 111 Cb -0.45 -0.51 -0.09 0.00 0.00 0.00 0.00 23.12 22.07 1aj7 s ALA 111 CO 0.38 0.08 1.02 0.00 0.00 0.00 0.00 175.76 177.24 1aj7 s ALA 112 N 0.73 3.37 0.47 0.00 0.00 -1.26 -1.72 121.76 123.35 1aj7 s ALA 112 Ca -0.13 0.75 -0.20 0.00 0.00 0.00 0.00 51.96 52.38 1aj7 s ALA 112 Cb -0.15 -3.27 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 1aj7 s ALA 112 CO 0.03 0.02 1.01 -1.25 0.00 0.00 0.00 175.76 175.56 1aj7 s PRO 113 N -1.24 3.94 -0.32 0.00 0.04 -1.26 -4.64 135.00 131.51 1aj7 s PRO 113 Ca 0.43 1.26 -0.12 0.00 0.04 0.00 0.00 61.00 62.61 1aj7 s PRO 113 Cb -0.29 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 1aj7 s PRO 113 CO 0.36 -0.30 0.23 -1.54 0.04 0.00 0.00 177.00 175.79 1aj7 s SER 114 N -2.10 6.06 -0.05 6.66 1.04 -0.69 -4.86 113.70 119.77 1aj7 s SER 114 Ca 0.65 -0.26 -0.12 0.00 0.48 0.00 0.00 55.95 56.70 1aj7 s SER 114 Cb -0.14 -2.14 -0.05 0.00 0.10 0.00 0.00 66.02 63.80 1aj7 s SER 114 CO 0.18 -0.18 0.30 -0.69 0.98 0.00 0.00 173.24 173.84 1aj7 s VAL 115 N 1.76 5.22 0.02 5.02 1.01 -1.26 -0.86 120.40 131.31 1aj7 s VAL 115 Ca 0.07 0.59 0.01 0.00 0.00 0.00 0.00 61.98 62.65 1aj7 s VAL 115 Cb -0.17 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 1aj7 s VAL 115 CO 0.11 0.59 -0.05 -0.36 0.00 0.00 0.00 175.10 175.39 1aj7 s PHE 116 N -1.05 0.44 -0.04 5.22 0.08 -0.26 -4.99 117.98 117.38 1aj7 s PHE 116 Ca 0.20 -0.35 0.04 0.00 0.12 0.00 0.00 56.93 56.94 1aj7 s PHE 116 Cb -0.15 -0.28 -0.00 0.00 -0.57 0.00 0.00 43.02 42.02 1aj7 s PHE 116 CO 0.10 -0.08 -0.15 -1.50 -0.10 0.00 0.00 175.22 173.48 1aj7 s ILE 117 N -0.94 1.29 -0.09 0.64 2.07 -1.26 -0.30 121.20 122.61 1aj7 s ILE 117 Ca -0.07 -0.63 0.03 0.00 -1.41 0.00 0.00 60.65 58.57 1aj7 s ILE 117 Cb -0.07 -1.12 -0.01 0.00 0.13 0.00 0.00 42.46 41.39 1aj7 s ILE 117 CO -0.00 0.38 -0.20 -0.36 -1.91 0.00 0.00 174.94 172.85 1aj7 s PHE 118 N 0.14 2.62 0.69 3.50 0.08 0.11 -5.00 117.98 120.12 1aj7 s PHE 118 Ca -0.05 -0.74 -0.11 0.00 0.12 0.00 0.00 56.93 56.15 1aj7 s PHE 118 Cb -0.11 -1.71 0.01 0.00 -0.57 0.00 0.00 43.02 40.63 1aj7 s PHE 118 CO 0.02 -0.24 1.08 -2.14 -0.10 0.00 0.00 175.22 173.84 1aj7 s PRO 119 N 0.09 2.93 0.48 0.24 0.02 -1.26 -1.85 135.00 135.66 1aj7 s PRO 119 Ca -0.09 0.45 -0.22 0.00 0.02 0.00 0.00 61.00 61.16 1aj7 s PRO 119 Cb -0.15 -2.05 -0.07 0.00 0.02 0.00 0.00 34.50 32.25 1aj7 s PRO 119 CO 0.06 -0.97 1.19 -2.14 -0.33 0.00 0.00 177.00 174.81 1aj7 s PRO 120 N -5.32 3.64 0.56 5.54 0.02 -1.24 -4.79 135.00 133.41 1aj7 s PRO 120 Ca 0.58 1.82 -0.16 0.00 0.02 0.00 0.00 61.00 63.25 1aj7 s PRO 120 Cb -0.11 -2.35 -0.05 0.00 0.02 0.00 0.00 34.50 32.01 1aj7 s PRO 120 CO 0.51 -0.66 1.04 -1.54 -0.33 0.00 0.00 177.00 176.02 1aj7 s SER 121 N -1.34 6.04 0.29 2.53 1.04 -1.26 -4.93 113.70 116.07 1aj7 s SER 121 Ca 0.65 1.78 -0.01 0.00 0.48 0.00 0.00 55.95 58.85 1aj7 s SER 121 Cb -0.30 -2.53 0.44 0.00 0.10 0.00 0.00 66.02 63.73 1aj7 s SER 121 CO 0.36 -0.99 1.87 0.44 0.98 0.00 0.00 173.24 175.90 1aj7 h ASP 122 N 0.68 0.79 0.20 7.02 3.32 -2.00 -2.18 116.42 124.26 1aj7 h ASP 122 Ca -0.47 -0.11 -0.07 0.00 0.02 0.00 0.00 57.03 56.40 1aj7 h ASP 122 Cb 1.21 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1aj7 h ASP 122 CO 0.58 0.72 -0.28 1.05 -1.72 0.00 0.00 179.24 179.59 1aj7 h GLU 123 N 0.85 0.15 -0.27 3.56 4.11 -2.00 -2.33 114.58 118.65 1aj7 h GLU 123 Ca 0.20 -0.05 -0.19 0.00 0.07 0.00 0.00 59.36 59.40 1aj7 h GLU 123 Cb 0.18 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1aj7 h GLU 123 CO -0.02 0.42 -0.56 0.37 0.07 0.00 0.00 179.01 179.29 1aj7 h GLN 124 N 0.13 0.86 -0.82 1.06 4.15 -1.76 -2.99 115.11 115.74 1aj7 h GLN 124 Ca 0.02 -0.56 0.11 0.00 0.77 0.00 0.00 58.65 58.99 1aj7 h GLN 124 Cb 0.58 0.07 -0.06 0.00 0.21 0.00 0.00 27.48 28.28 1aj7 h GLN 124 CO 0.04 1.19 0.53 -0.07 -1.93 0.00 0.00 178.83 178.60 1aj7 h LEU 125 N 0.64 0.65 -2.03 -2.39 3.38 -0.91 0.55 115.31 115.19 1aj7 h LEU 125 Ca 0.01 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1aj7 h LEU 125 Cb 1.18 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 1aj7 h LEU 125 CO 0.12 0.37 -0.07 0.11 0.09 0.00 0.00 178.44 179.07 1aj7 h LYS 126 N 0.71 0.00 -0.00 1.13 1.57 -1.28 -1.30 116.57 117.40 1aj7 h LYS 126 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 1aj7 h LYS 126 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1aj7 h LYS 126 CO -0.15 0.07 -0.01 0.43 -0.57 0.00 0.00 179.45 179.21 1aj7 n SER 127 N -4.13 0.17 0.00 0.86 7.64 0.18 -4.91 113.62 113.43 1aj7 n SER 127 Ca -0.03 -0.75 0.00 0.00 1.01 0.00 0.00 58.87 59.11 1aj7 n SER 127 Cb 0.15 -0.09 0.00 0.00 -1.01 0.00 0.00 64.21 63.26 1aj7 n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aj7 n GLY 128 N 1.13 0.75 3.37 0.23 0.00 -0.49 -5.05 105.19 105.13 1aj7 n GLY 128 Ca 0.20 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.02 1aj7 n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1aj7 s THR 129 N -2.69 1.80 -0.10 2.61 -4.23 -1.24 -1.07 115.64 110.72 1aj7 s THR 129 Ca 0.00 -2.22 -0.04 0.00 -1.18 0.00 0.00 61.69 58.25 1aj7 s THR 129 Cb 0.00 -2.14 0.05 0.00 1.34 0.00 0.00 72.50 71.75 1aj7 s THR 129 CO 0.00 -0.53 0.19 0.00 -0.54 0.00 0.00 174.62 173.74 1aj7 s ALA 130 N -2.93 -0.25 -0.26 3.99 0.00 0.33 -3.43 121.76 119.21 1aj7 s ALA 130 Ca 0.24 0.63 -0.04 0.00 0.00 0.00 0.00 51.96 52.80 1aj7 s ALA 130 Cb -0.00 -0.88 0.02 0.00 0.00 0.00 0.00 23.12 22.25 1aj7 s ALA 130 CO 0.09 -0.61 -0.01 -1.12 0.00 0.00 0.00 175.76 174.11 1aj7 s SER 131 N 2.33 4.61 -0.18 0.00 0.01 -1.26 -0.54 113.70 118.66 1aj7 s SER 131 Ca 0.03 -0.78 -0.14 0.00 1.31 0.00 0.00 55.95 56.37 1aj7 s SER 131 Cb -0.12 -1.75 -0.04 0.00 0.21 0.00 0.00 66.02 64.32 1aj7 s SER 131 CO -0.07 -0.14 0.30 -0.69 0.41 0.00 0.00 173.24 173.06 1aj7 s VAL 132 N 1.40 5.29 -0.09 3.43 1.01 0.33 -3.67 120.40 128.10 1aj7 s VAL 132 Ca 0.01 0.55 0.02 0.00 0.00 0.00 0.00 61.98 62.56 1aj7 s VAL 132 Cb -0.17 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.55 1aj7 s VAL 132 CO -0.02 0.35 -0.13 -0.69 0.00 0.00 0.00 175.10 174.62 1aj7 s VAL 133 N 0.73 3.14 -0.14 2.92 1.01 -0.77 -0.28 120.40 127.01 1aj7 s VAL 133 Ca 0.16 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.50 1aj7 s VAL 133 Cb -0.13 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 33.97 1aj7 s VAL 133 CO 0.05 0.56 -0.20 0.00 0.00 0.00 0.00 175.10 175.51 1aj7 s LEU 135 N 0.69 2.91 -0.36 0.00 2.96 0.59 -0.96 118.68 124.51 1aj7 s LEU 135 Ca -0.09 -0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 53.50 1aj7 s LEU 135 Cb -0.16 -1.68 0.07 0.00 0.50 0.00 0.00 46.19 44.92 1aj7 s LEU 135 CO 0.01 0.14 0.13 -0.76 -1.32 0.00 0.00 176.35 174.55 1aj7 s LEU 136 N 0.53 4.64 -0.15 -0.68 1.02 0.01 -1.10 118.68 122.94 1aj7 s LEU 136 Ca -0.06 -1.55 -0.07 0.00 0.02 0.00 0.00 54.13 52.46 1aj7 s LEU 136 Cb -0.15 -1.82 -0.04 0.00 0.02 0.00 0.00 46.19 44.20 1aj7 s LEU 136 CO 0.03 -0.41 0.09 0.21 0.02 0.00 0.00 176.35 176.29 1aj7 s ASN 137 N 1.61 5.93 -0.87 2.29 2.47 -0.04 -0.52 114.94 125.80 1aj7 s ASN 137 Ca 0.01 0.24 -0.05 0.00 0.42 0.00 0.00 52.86 53.49 1aj7 s ASN 137 Cb -0.21 -1.95 0.00 0.00 -1.45 0.00 0.00 41.25 37.64 1aj7 s ASN 137 CO -0.01 0.28 0.67 0.59 -3.72 0.00 0.00 177.10 174.91 1aj7 n ASN 138 N 2.83 -5.83 -4.55 -4.21 3.02 -1.07 -1.70 115.26 103.75 1aj7 n ASN 138 Ca -0.18 -0.71 -0.26 0.00 -0.03 0.00 0.00 54.58 53.40 1aj7 n ASN 138 Cb 0.53 -3.10 -0.11 0.00 -0.61 0.00 0.00 39.78 36.49 1aj7 n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1aj7 s PHE 139 N -3.10 2.36 -0.27 3.10 -0.12 0.22 -4.54 117.98 115.64 1aj7 s PHE 139 Ca 0.11 -0.60 -0.23 0.00 -0.05 0.00 0.00 56.93 56.16 1aj7 s PHE 139 Cb -0.04 -1.47 0.07 0.00 -0.63 0.00 0.00 43.02 40.95 1aj7 s PHE 139 CO 0.85 0.48 0.71 -0.47 -0.05 0.00 0.00 175.22 176.73 1aj7 s TYR 140 N -2.73 -0.85 0.71 3.49 5.04 -0.70 -0.56 117.35 121.76 1aj7 s TYR 140 Ca 0.33 1.97 -0.12 0.00 -2.44 0.00 0.00 57.07 56.81 1aj7 s TYR 140 Cb 0.05 0.35 0.17 0.00 0.35 0.00 0.00 41.96 42.89 1aj7 s TYR 140 CO 0.16 -0.41 0.73 -0.35 -1.34 0.00 0.00 175.55 174.34 1aj7 n PRO 141 N 3.07 -1.81 0.17 4.97 -0.04 -1.26 -0.97 135.00 139.13 1aj7 n PRO 141 Ca -0.15 -1.15 0.04 0.00 -0.04 0.00 0.00 63.50 62.19 1aj7 n PRO 141 Cb 0.56 -0.96 0.43 0.00 -0.04 0.00 0.00 33.50 33.49 1aj7 n PRO 141 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1aj7 h ARG 142 N 0.00 0.11 -6.57 0.54 2.43 -1.99 -3.44 114.38 105.47 1aj7 h ARG 142 Ca -0.26 -0.03 -0.52 0.00 -0.81 0.00 0.00 59.98 58.36 1aj7 h ARG 142 Cb 0.77 -0.02 0.05 0.00 -0.42 0.00 0.00 29.97 30.34 1aj7 h ARG 142 CO 0.17 0.30 1.04 -1.21 -1.51 0.00 0.00 179.97 178.77 1aj7 s GLU 143 N -4.62 4.15 -0.12 0.20 8.01 -1.26 -4.98 118.70 120.07 1aj7 s GLU 143 Ca -0.04 2.55 -0.30 0.00 0.01 0.00 0.00 54.97 57.19 1aj7 s GLU 143 Cb 0.15 -3.36 0.09 0.00 -4.31 0.00 0.00 34.13 26.70 1aj7 s GLU 143 CO 0.72 -0.78 0.79 0.00 0.01 0.00 0.00 175.26 176.01 1aj7 s ALA 144 N 2.00 -1.83 -0.10 5.21 0.00 -1.26 -4.68 121.76 121.10 1aj7 s ALA 144 Ca 0.77 1.51 0.04 0.00 0.00 0.00 0.00 51.96 54.27 1aj7 s ALA 144 Cb -0.47 -0.41 0.00 0.00 0.00 0.00 0.00 23.12 22.24 1aj7 s ALA 144 CO 0.34 -0.34 -0.23 0.21 0.00 0.00 0.00 175.76 175.74 1aj7 s LYS 145 N -0.91 2.88 -0.10 0.00 2.20 -0.06 -4.99 119.74 118.77 1aj7 s LYS 145 Ca -0.06 -0.82 0.02 0.00 -0.36 0.00 0.00 55.97 54.75 1aj7 s LYS 145 Cb -0.01 -2.19 0.01 0.00 -1.51 0.00 0.00 37.83 34.13 1aj7 s LYS 145 CO 0.06 0.16 -0.17 0.54 -0.36 0.00 0.00 175.35 175.58 1aj7 s VAL 146 N 0.38 1.54 -0.08 4.02 0.11 -1.26 -0.37 120.40 124.74 1aj7 s VAL 146 Ca -0.18 -0.69 0.04 0.00 -2.93 0.00 0.00 61.98 58.21 1aj7 s VAL 146 Cb -0.18 -1.38 0.00 0.00 -1.53 0.00 0.00 36.38 33.29 1aj7 s VAL 146 CO 0.08 0.45 -0.20 -1.10 -3.33 0.00 0.00 175.10 171.00 1aj7 s GLN 147 N 0.74 2.48 0.03 1.54 -0.21 0.17 -4.97 119.66 119.45 1aj7 s GLN 147 Ca -0.12 -0.70 -0.19 0.00 0.02 0.00 0.00 55.36 54.37 1aj7 s GLN 147 Cb -0.16 -1.94 -0.06 0.00 1.00 0.00 0.00 33.01 31.85 1aj7 s GLN 147 CO 0.02 0.14 0.55 -1.58 -2.12 0.00 0.00 175.29 172.31 1aj7 s TRP 148 N 0.41 3.75 -0.08 0.91 0.52 -1.26 -0.68 118.94 122.51 1aj7 s TRP 148 Ca -0.16 1.20 -0.01 0.00 0.02 0.00 0.00 56.10 57.15 1aj7 s TRP 148 Cb -0.17 -2.51 0.03 0.00 -1.15 0.00 0.00 33.47 29.67 1aj7 s TRP 148 CO 0.07 0.51 -0.01 0.15 0.02 0.00 0.00 176.95 177.68 1aj7 s LYS 149 N -0.76 0.75 -0.28 4.98 1.02 -0.50 -0.36 119.74 124.61 1aj7 s LYS 149 Ca 0.29 0.03 -0.06 0.00 0.02 0.00 0.00 55.97 56.25 1aj7 s LYS 149 Cb -0.19 -1.12 0.01 0.00 -0.52 0.00 0.00 37.83 36.01 1aj7 s LYS 149 CO 0.17 -0.31 0.05 0.08 -0.92 0.00 0.00 175.35 174.42 1aj7 s VAL 150 N 1.93 3.80 -1.42 3.17 1.01 0.03 -0.78 120.40 128.13 1aj7 s VAL 150 Ca 0.05 -0.69 -0.10 0.00 0.00 0.00 0.00 61.98 61.24 1aj7 s VAL 150 Cb -0.12 -2.93 0.03 0.00 0.00 0.00 0.00 36.38 33.36 1aj7 s VAL 150 CO -0.06 0.14 1.08 0.47 0.00 0.00 0.00 175.10 176.73 1aj7 n ASP 151 N 4.84 -5.94 0.00 3.32 8.00 0.42 -0.78 116.55 126.40 1aj7 n ASP 151 Ca -0.15 -0.58 0.00 0.00 0.71 0.00 0.00 54.79 54.77 1aj7 n ASP 151 Cb 0.48 -4.70 0.00 0.00 -0.02 0.00 0.00 41.12 36.89 1aj7 n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1aj7 n ASN 152 N -2.92 0.00 -4.66 -2.24 2.85 -1.26 -4.98 115.26 102.04 1aj7 n ASN 152 Ca 0.01 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.07 1aj7 n ASN 152 Cb 0.55 -0.58 -0.05 0.00 1.24 0.00 0.00 39.78 40.95 1aj7 n ASN 152 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1aj7 s ALA 153 N -2.57 3.54 0.31 5.20 0.00 0.04 -4.96 121.76 123.31 1aj7 s ALA 153 Ca 0.00 -0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.60 1aj7 s ALA 153 Cb 0.00 -3.17 -0.11 0.00 0.00 0.00 0.00 23.12 19.84 1aj7 s ALA 153 CO 0.00 -0.65 1.58 -1.17 0.00 0.00 0.00 175.76 175.52 1aj7 s LEU 154 N 2.15 4.34 0.08 0.00 2.96 -1.26 -0.79 118.68 126.15 1aj7 s LEU 154 Ca 0.35 2.99 0.02 0.00 -0.22 0.00 0.00 54.13 57.27 1aj7 s LEU 154 Cb -0.16 -3.64 -0.04 0.00 0.50 0.00 0.00 46.19 42.85 1aj7 s LEU 154 CO 0.11 -0.92 0.14 -1.10 -1.32 0.00 0.00 176.35 173.27 1aj7 s GLN 155 N -0.83 3.15 -0.24 1.98 -1.52 0.52 -4.88 119.66 117.83 1aj7 s GLN 155 Ca 0.61 -0.58 -0.21 0.00 -1.95 0.00 0.00 55.36 53.23 1aj7 s GLN 155 Cb -0.48 -2.87 0.06 0.00 -0.22 0.00 0.00 33.01 29.50 1aj7 s GLN 155 CO 0.51 0.58 0.63 -1.54 -0.25 0.00 0.00 175.29 175.22 1aj7 s SER 156 N -2.49 -0.67 0.00 5.90 1.04 -1.26 -4.60 113.70 111.62 1aj7 s SER 156 Ca 0.32 1.27 0.00 0.00 0.48 0.00 0.00 55.95 58.02 1aj7 s SER 156 Cb -0.12 1.28 0.00 0.00 0.10 0.00 0.00 66.02 67.28 1aj7 s SER 156 CO 0.25 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.86 1aj7 n GLY 157 N 2.83 0.94 0.21 7.32 0.00 -1.26 -4.90 105.19 110.33 1aj7 n GLY 157 Ca -0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.96 1aj7 n GLY 157 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1aj7 n ASN 158 N 0.00 1.90 -4.18 1.61 4.13 -1.26 -5.07 115.26 112.39 1aj7 n ASN 158 Ca 0.00 -2.97 -0.12 0.00 1.68 0.00 0.00 54.58 53.16 1aj7 n ASN 158 Cb 0.00 -0.40 -0.10 0.00 -1.54 0.00 0.00 39.78 37.74 1aj7 n ASN 158 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1aj7 s SER 159 N -2.60 1.32 -0.04 6.41 1.04 -1.26 -1.08 113.70 117.49 1aj7 s SER 159 Ca 0.28 -0.93 -0.03 0.00 0.48 0.00 0.00 55.95 55.74 1aj7 s SER 159 Cb 0.25 0.05 0.02 0.00 0.10 0.00 0.00 66.02 66.44 1aj7 s SER 159 CO 0.01 -0.38 0.11 -1.10 0.98 0.00 0.00 173.24 172.86 1aj7 s GLN 160 N -3.43 0.10 0.23 4.02 -0.21 -0.61 -4.98 119.66 114.78 1aj7 s GLN 160 Ca 0.10 0.20 0.09 0.00 0.02 0.00 0.00 55.36 55.77 1aj7 s GLN 160 Cb 0.02 -0.02 -0.05 0.00 1.00 0.00 0.00 33.01 33.96 1aj7 s GLN 160 CO -0.02 -0.06 -0.17 -1.83 -2.12 0.00 0.00 175.29 171.09 1aj7 s GLU 161 N 0.40 1.44 -0.11 2.91 -1.05 -1.26 -0.63 118.70 120.40 1aj7 s GLU 161 Ca -0.03 -1.63 -0.09 0.00 -0.15 0.00 0.00 54.97 53.07 1aj7 s GLU 161 Cb -0.04 -1.36 0.03 0.00 -0.44 0.00 0.00 34.13 32.32 1aj7 s GLU 161 CO -0.02 0.24 0.29 0.45 0.95 0.00 0.00 175.26 177.18 1aj7 s SER 162 N -3.31 -0.31 0.00 0.83 0.15 -0.21 -4.99 113.70 105.87 1aj7 s SER 162 Ca 0.24 0.59 0.06 0.00 0.70 0.00 0.00 55.95 57.54 1aj7 s SER 162 Cb -0.03 0.57 -0.03 0.00 -1.71 0.00 0.00 66.02 64.83 1aj7 s SER 162 CO 0.09 -0.11 -0.19 0.54 1.20 0.00 0.00 173.24 174.77 1aj7 s VAL 163 N 0.34 2.68 0.94 4.45 0.11 -1.26 -1.25 120.40 126.41 1aj7 s VAL 163 Ca -0.02 -1.05 -0.15 0.00 -2.93 0.00 0.00 61.98 57.83 1aj7 s VAL 163 Cb -0.03 -2.07 0.18 0.00 -1.53 0.00 0.00 36.38 32.94 1aj7 s VAL 163 CO -0.01 0.46 1.30 0.42 -3.33 0.00 0.00 175.10 173.93 1aj7 s THR 164 N -0.80 2.01 0.81 5.04 -4.23 -0.63 -5.00 115.64 112.84 1aj7 s THR 164 Ca 0.13 -0.02 -0.07 0.00 -1.18 0.00 0.00 61.69 60.55 1aj7 s THR 164 Cb -0.10 -2.98 0.15 0.00 1.34 0.00 0.00 72.50 70.90 1aj7 s THR 164 CO 0.02 0.00 1.12 -1.61 -0.54 0.00 0.00 174.62 173.62 1aj7 s GLU 165 N -5.83 1.29 0.37 3.99 2.02 -1.26 -4.70 118.70 114.58 1aj7 s GLU 165 Ca 0.72 -0.81 -0.28 0.00 0.02 0.00 0.00 54.97 54.63 1aj7 s GLU 165 Cb -0.05 -2.14 -0.10 0.00 0.10 0.00 0.00 34.13 31.95 1aj7 s GLU 165 CO 0.52 -1.82 1.35 -0.65 0.02 0.00 0.00 175.26 174.68 1aj7 s GLN 166 N -5.44 4.16 0.21 1.61 -0.21 -1.26 -4.66 119.66 114.07 1aj7 s GLN 166 Ca 0.69 2.28 -0.30 0.00 0.02 0.00 0.00 55.36 58.05 1aj7 s GLN 166 Cb -0.05 -2.94 -0.09 0.00 1.00 0.00 0.00 33.01 30.94 1aj7 s GLN 166 CO 0.48 -0.38 1.24 0.34 -2.12 0.00 0.00 175.29 174.85 1aj7 s ASP 167 N -0.49 7.01 0.60 5.90 2.15 0.28 -4.89 116.67 127.23 1aj7 s ASP 167 Ca 0.53 2.33 0.37 0.00 0.43 0.00 0.00 52.55 56.20 1aj7 s ASP 167 Cb -0.41 -2.61 1.89 0.00 -0.30 0.00 0.00 42.92 41.49 1aj7 s ASP 167 CO 0.54 -0.42 2.20 0.28 -0.17 0.00 0.00 175.17 177.60 1aj7 h SER 168 N 5.02 0.00 0.00 -0.34 0.02 -1.91 0.25 113.55 116.59 1aj7 h SER 168 Ca -0.45 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.25 1aj7 h SER 168 Cb 1.21 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.72 1aj7 h SER 168 CO 0.74 0.03 -1.36 0.29 -1.14 0.00 0.00 176.83 175.39 1aj7 n LYS 169 N -3.29 0.57 0.00 3.45 4.76 -1.26 -2.37 118.16 120.02 1aj7 n LYS 169 Ca -0.02 0.56 0.00 0.00 -2.87 0.00 0.00 58.31 55.98 1aj7 n LYS 169 Cb 0.17 -1.73 0.00 0.00 -1.84 0.00 0.00 35.03 31.63 1aj7 n LYS 169 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1aj7 n ASP 170 N -4.42 1.39 -1.39 4.39 5.68 -1.23 -4.75 116.55 116.23 1aj7 n ASP 170 Ca -0.34 -1.46 -0.16 0.00 -0.50 0.00 0.00 54.79 52.33 1aj7 n ASP 170 Cb 0.70 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.63 1aj7 n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1aj7 n SER 171 N -0.23 -4.86 -4.97 -1.12 7.64 0.08 -4.93 113.62 105.21 1aj7 n SER 171 Ca 0.00 0.27 -0.19 0.00 1.01 0.00 0.00 58.87 59.96 1aj7 n SER 171 Cb 0.14 -3.83 0.04 0.00 -1.01 0.00 0.00 64.21 59.55 1aj7 n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1aj7 s THR 172 N -2.65 2.67 0.35 0.44 -4.23 -1.26 -4.52 115.64 106.44 1aj7 s THR 172 Ca 0.00 -0.87 0.09 0.00 -1.18 0.00 0.00 61.69 59.73 1aj7 s THR 172 Cb 0.00 -2.80 -0.06 0.00 1.34 0.00 0.00 72.50 70.98 1aj7 s THR 172 CO 0.00 0.00 0.01 -0.31 -0.54 0.00 0.00 174.62 173.78 1aj7 s TYR 173 N -2.59 2.54 -0.00 3.99 2.02 0.28 -0.55 117.35 123.03 1aj7 s TYR 173 Ca 0.58 -0.46 -0.02 0.00 -0.37 0.00 0.00 57.07 56.80 1aj7 s TYR 173 Cb -0.09 -1.52 -0.00 0.00 -0.40 0.00 0.00 41.96 39.95 1aj7 s TYR 173 CO 0.37 0.47 0.03 -1.12 -1.57 0.00 0.00 175.55 173.73 1aj7 s SER 174 N -3.72 0.07 0.00 2.29 0.01 -1.26 -0.61 113.70 110.49 1aj7 s SER 174 Ca 0.35 -0.16 0.06 0.00 1.31 0.00 0.00 55.95 57.50 1aj7 s SER 174 Cb 0.01 0.11 -0.02 0.00 0.21 0.00 0.00 66.02 66.33 1aj7 s SER 174 CO 0.19 -0.17 -0.17 -0.22 0.41 0.00 0.00 173.24 173.28 1aj7 s LEU 175 N -0.71 2.08 -0.08 2.44 2.96 0.32 -1.61 118.68 124.08 1aj7 s LEU 175 Ca -0.08 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.50 1aj7 s LEU 175 Cb -0.05 -0.86 0.00 0.00 0.50 0.00 0.00 46.19 45.78 1aj7 s LEU 175 CO -0.00 0.18 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.47 1aj7 s SER 176 N -0.65 2.51 -0.08 3.68 0.15 -0.38 -0.81 113.70 118.13 1aj7 s SER 176 Ca 0.06 -0.44 0.03 0.00 0.70 0.00 0.00 55.95 56.30 1aj7 s SER 176 Cb -0.07 -1.10 0.01 0.00 -1.71 0.00 0.00 66.02 63.15 1aj7 s SER 176 CO 0.00 0.12 -0.18 -0.55 1.20 0.00 0.00 173.24 173.83 1aj7 s SER 177 N 0.42 2.37 -0.15 5.45 0.15 -0.13 -1.04 113.70 120.77 1aj7 s SER 177 Ca -0.15 -0.41 0.02 0.00 0.70 0.00 0.00 55.95 56.10 1aj7 s SER 177 Cb -0.16 -1.05 0.01 0.00 -1.71 0.00 0.00 66.02 63.10 1aj7 s SER 177 CO 0.06 0.10 -0.21 -0.89 1.20 0.00 0.00 173.24 173.50 1aj7 s THR 178 N 0.47 2.14 -0.36 6.45 2.01 0.19 -0.19 115.64 126.36 1aj7 s THR 178 Ca -0.16 -0.95 -0.12 0.00 0.31 0.00 0.00 61.69 60.78 1aj7 s THR 178 Cb -0.16 -1.87 0.01 0.00 0.01 0.00 0.00 72.50 70.49 1aj7 s THR 178 CO 0.06 0.54 0.23 -0.22 -0.69 0.00 0.00 174.62 174.54 1aj7 s LEU 179 N 0.87 4.63 -0.22 4.42 2.96 0.61 -1.57 118.68 130.38 1aj7 s LEU 179 Ca -0.05 -0.71 -0.07 0.00 -0.22 0.00 0.00 54.13 53.07 1aj7 s LEU 179 Cb -0.15 -2.08 -0.03 0.00 0.50 0.00 0.00 46.19 44.42 1aj7 s LEU 179 CO -0.03 -0.32 0.07 -0.89 -1.32 0.00 0.00 176.35 173.87 1aj7 s THR 180 N 1.65 4.55 0.27 3.68 2.01 -0.24 -0.52 115.64 127.04 1aj7 s THR 180 Ca 0.04 -0.10 0.03 0.00 0.31 0.00 0.00 61.69 61.98 1aj7 s THR 180 Cb -0.18 -3.10 -0.06 0.00 0.01 0.00 0.00 72.50 69.17 1aj7 s THR 180 CO 0.08 0.38 0.03 -0.76 -0.69 0.00 0.00 174.62 173.67 1aj7 s LEU 181 N 1.13 2.10 0.46 4.42 1.43 0.30 -4.85 118.68 123.67 1aj7 s LEU 181 Ca 0.04 -1.30 -0.14 0.00 -1.03 0.00 0.00 54.13 51.70 1aj7 s LEU 181 Cb -0.14 -0.27 -0.07 0.00 0.03 0.00 0.00 46.19 45.73 1aj7 s LEU 181 CO 0.03 -0.58 0.89 -0.94 0.23 0.00 0.00 176.35 175.98 1aj7 s SER 182 N -3.38 6.59 0.23 2.29 1.04 -1.26 -0.51 113.70 118.70 1aj7 s SER 182 Ca 0.33 1.38 -0.06 0.00 0.48 0.00 0.00 55.95 58.08 1aj7 s SER 182 Cb 0.07 -2.43 0.40 0.00 0.10 0.00 0.00 66.02 64.17 1aj7 s SER 182 CO 0.12 -0.49 1.73 0.50 0.98 0.00 0.00 173.24 176.08 1aj7 h LYS 183 N 1.11 0.42 -0.49 4.02 3.64 -1.35 -0.60 116.57 123.32 1aj7 h LYS 183 Ca -0.47 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1aj7 h LYS 183 Cb 1.19 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 1aj7 h LYS 183 CO 0.63 0.28 0.32 0.00 -2.27 0.00 0.00 179.45 178.40 1aj7 h ALA 184 N 1.51 0.62 -0.49 5.00 0.00 -1.93 -0.41 119.26 123.55 1aj7 h ALA 184 Ca 0.38 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 1aj7 h ALA 184 Cb 0.55 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1aj7 h ALA 184 CO -0.38 0.06 -0.05 0.22 0.00 0.00 0.00 179.25 179.10 1aj7 h ASP 185 N 0.65 0.85 -0.06 0.00 3.58 -1.76 -2.48 116.42 117.20 1aj7 h ASP 185 Ca 0.18 -0.24 -0.00 0.00 0.42 0.00 0.00 57.03 57.39 1aj7 h ASP 185 Cb -0.07 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.75 1aj7 h ASP 185 CO -0.04 0.94 0.03 0.22 -2.88 0.00 0.00 179.24 177.51 1aj7 h TYR 186 N 0.79 0.08 0.00 0.28 3.20 -0.64 -2.42 116.97 118.27 1aj7 h TYR 186 Ca 0.14 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.01 1aj7 h TYR 186 Cb 0.55 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.79 1aj7 h TYR 186 CO 0.03 0.14 0.00 0.39 -1.64 0.00 0.00 178.16 177.08 1aj7 n GLU 187 N -5.00 0.09 0.15 1.82 -0.58 -0.21 -2.40 120.64 114.51 1aj7 n GLU 187 Ca -0.06 0.42 0.13 0.00 -0.42 0.00 0.00 57.16 57.23 1aj7 n GLU 187 Cb 0.07 -1.71 0.36 0.00 -0.57 0.00 0.00 31.44 29.60 1aj7 n GLU 187 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1aj7 h LYS 188 N 0.00 0.00 -5.84 3.49 1.57 -0.97 -3.46 116.57 111.36 1aj7 h LYS 188 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 1aj7 h LYS 188 Cb 0.20 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.37 1aj7 h LYS 188 CO 0.00 0.00 -0.73 -1.01 -0.57 0.00 0.00 179.45 177.14 1aj7 s HIS 189 N -3.19 2.05 -0.16 -1.35 3.76 -1.01 -5.09 115.29 110.31 1aj7 s HIS 189 Ca 0.08 -0.49 -0.14 0.00 -0.15 0.00 0.00 55.06 54.36 1aj7 s HIS 189 Cb 0.10 -0.99 -0.06 0.00 1.11 0.00 0.00 32.58 32.73 1aj7 s HIS 189 CO 0.59 0.51 -0.30 1.17 -0.85 0.00 0.00 174.74 175.87 1aj7 n LYS 190 N -0.56 0.46 -3.45 1.40 3.00 -1.26 -4.80 118.16 112.95 1aj7 n LYS 190 Ca -0.06 0.19 -0.38 0.00 -0.00 0.00 0.00 58.31 58.06 1aj7 n LYS 190 Cb 0.61 -1.30 -0.07 0.00 0.00 0.00 0.00 35.03 34.27 1aj7 n LYS 190 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1aj7 s VAL 191 N -2.69 5.24 -0.18 3.15 1.01 -1.26 -1.88 120.40 123.78 1aj7 s VAL 191 Ca -0.26 0.63 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1aj7 s VAL 191 Cb 0.05 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.76 1aj7 s VAL 191 CO 0.37 0.30 -0.17 -0.31 0.00 0.00 0.00 175.10 175.29 1aj7 s TYR 192 N 1.04 2.79 0.12 5.22 1.51 -0.53 -0.44 117.35 127.06 1aj7 s TYR 192 Ca 0.18 -1.43 0.05 0.00 -1.01 0.00 0.00 57.07 54.86 1aj7 s TYR 192 Cb -0.14 -1.93 -0.04 0.00 -0.11 0.00 0.00 41.96 39.74 1aj7 s TYR 192 CO 0.07 -0.70 -0.12 0.00 -1.11 0.00 0.00 175.55 173.68 1aj7 s ALA 193 N 1.21 1.36 -0.15 3.71 0.00 0.04 -1.33 121.76 126.59 1aj7 s ALA 193 Ca 0.02 -1.29 -0.00 0.00 0.00 0.00 0.00 51.96 50.69 1aj7 s ALA 193 Cb -0.14 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 22.99 1aj7 s ALA 193 CO -0.09 0.02 -0.10 0.00 0.00 0.00 0.00 175.76 175.60 1aj7 s GLU 195 N 1.57 3.78 -0.08 0.00 2.12 0.15 -1.40 118.70 124.85 1aj7 s GLU 195 Ca 0.03 -0.42 0.02 0.00 0.36 0.00 0.00 54.97 54.96 1aj7 s GLU 195 Cb -0.14 -3.32 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 1aj7 s GLU 195 CO -0.09 -0.04 -0.13 0.08 -0.54 0.00 0.00 175.26 174.54 1aj7 s VAL 196 N 1.24 3.18 -0.10 3.70 1.01 0.52 -0.65 120.40 129.29 1aj7 s VAL 196 Ca 0.05 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.39 1aj7 s VAL 196 Cb -0.14 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 33.96 1aj7 s VAL 196 CO 0.04 0.57 -0.16 -0.89 0.00 0.00 0.00 175.10 174.66 1aj7 s THR 197 N -0.42 1.54 -0.14 3.92 2.01 0.50 -1.20 115.64 121.85 1aj7 s THR 197 Ca 0.05 -0.69 -0.25 0.00 0.31 0.00 0.00 61.69 61.12 1aj7 s THR 197 Cb -0.12 -1.39 0.06 0.00 0.01 0.00 0.00 72.50 71.06 1aj7 s THR 197 CO 0.02 0.45 0.62 -2.28 -0.69 0.00 0.00 174.62 172.74 1aj7 s HIS 198 N 0.81 -0.63 0.46 4.92 2.46 -1.26 -0.88 115.29 121.17 1aj7 s HIS 198 Ca -0.10 1.33 0.26 0.00 0.47 0.00 0.00 55.06 57.01 1aj7 s HIS 198 Cb -0.16 0.29 1.30 0.00 -0.13 0.00 0.00 32.58 33.88 1aj7 s HIS 198 CO 0.01 -0.45 1.79 0.37 -2.47 0.00 0.00 174.74 173.99 1aj7 h GLN 199 N 4.16 0.21 0.00 2.88 4.15 -1.92 0.11 115.11 124.70 1aj7 h GLN 199 Ca -0.28 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.13 1aj7 h GLN 199 Cb 1.16 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.80 1aj7 h GLN 199 CO 0.25 0.14 0.00 0.41 -1.93 0.00 0.00 178.83 177.70 1aj7 n GLY 200 N -1.60 -0.63 3.34 2.39 0.00 -1.26 -4.69 105.19 102.74 1aj7 n GLY 200 Ca 0.25 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1aj7 n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aj7 s LEU 201 N -1.98 2.27 0.26 0.99 1.43 0.36 -4.45 118.68 117.56 1aj7 s LEU 201 Ca 0.30 -0.41 0.12 0.00 -1.03 0.00 0.00 54.13 53.10 1aj7 s LEU 201 Cb 0.14 -1.42 0.29 0.00 0.03 0.00 0.00 46.19 45.22 1aj7 s LEU 201 CO 0.23 0.29 1.56 0.77 0.23 0.00 0.00 176.35 179.43 1aj7 h SER 202 N 5.74 0.00 -5.10 2.29 4.64 -1.83 -3.45 113.55 115.84 1aj7 h SER 202 Ca -0.39 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.84 1aj7 h SER 202 Cb 1.15 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.09 1aj7 h SER 202 CO 0.48 0.64 -0.32 -0.94 -0.87 0.00 0.00 176.83 175.82 1aj7 s SER 203 N -6.71 -0.00 0.32 4.97 1.04 -1.26 -5.14 113.70 106.92 1aj7 s SER 203 Ca -0.00 -0.41 -0.29 0.00 0.48 0.00 0.00 55.95 55.73 1aj7 s SER 203 Cb 0.11 0.34 -0.13 0.00 0.10 0.00 0.00 66.02 66.45 1aj7 s SER 203 CO 0.76 -0.65 1.31 -2.65 0.98 0.00 0.00 173.24 172.98 1aj7 n PRO 204 N 0.33 2.09 -3.89 4.02 -0.02 -1.26 -4.92 135.00 131.35 1aj7 n PRO 204 Ca -0.17 0.74 -0.35 0.00 -2.02 0.00 0.00 63.50 61.69 1aj7 n PRO 204 Cb 0.61 -2.33 -0.11 0.00 -0.02 0.00 0.00 33.50 31.65 1aj7 n PRO 204 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1aj7 s VAL 205 N -0.87 4.76 -0.12 -1.45 1.01 -0.34 -4.90 120.40 118.48 1aj7 s VAL 205 Ca 0.58 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.53 1aj7 s VAL 205 Cb -0.59 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1aj7 s VAL 205 CO 0.59 0.40 -0.15 -0.89 0.00 0.00 0.00 175.10 175.06 1aj7 s THR 206 N 0.85 2.90 -0.03 3.92 2.01 -1.26 -0.36 115.64 123.67 1aj7 s THR 206 Ca 0.04 -0.72 0.07 0.00 0.31 0.00 0.00 61.69 61.39 1aj7 s THR 206 Cb -0.13 -2.20 -0.01 0.00 0.01 0.00 0.00 72.50 70.16 1aj7 s THR 206 CO 0.02 0.53 -0.23 -0.54 -0.69 0.00 0.00 174.62 173.71 1aj7 s LYS 207 N 0.33 2.07 0.25 4.92 -0.14 -0.49 -4.97 119.74 121.72 1aj7 s LYS 207 Ca -0.12 -0.83 -0.13 0.00 -1.36 0.00 0.00 55.97 53.53 1aj7 s LYS 207 Cb -0.16 -1.90 -0.00 0.00 -1.68 0.00 0.00 37.83 34.09 1aj7 s LYS 207 CO 0.06 0.44 0.50 -1.54 -0.76 0.00 0.00 175.35 174.05 1aj7 s SER 208 N -0.38 -0.07 0.07 2.83 1.04 -1.26 -0.31 113.70 115.62 1aj7 s SER 208 Ca 0.04 -0.93 -0.09 0.00 0.48 0.00 0.00 55.95 55.45 1aj7 s SER 208 Cb -0.11 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.62 1aj7 s SER 208 CO 0.01 -1.17 0.20 0.72 0.98 0.00 0.00 173.24 173.98 1aj7 s PHE 209 N -3.95 0.10 -0.18 5.02 -0.12 -0.44 -5.00 117.98 113.40 1aj7 s PHE 209 Ca 0.22 -0.43 -0.01 0.00 -0.05 0.00 0.00 56.93 56.66 1aj7 s PHE 209 Cb -0.01 -0.04 0.00 0.00 -0.63 0.00 0.00 43.02 42.34 1aj7 s PHE 209 CO 0.09 -0.50 -0.14 -0.80 -0.05 0.00 0.00 175.22 173.83 1aj7 s ASN 210 N -2.52 3.70 -0.77 1.98 -0.87 -1.26 -1.46 114.94 113.74 1aj7 s ASN 210 Ca 0.00 -0.49 -0.25 0.00 -1.57 0.00 0.00 52.86 50.55 1aj7 s ASN 210 Cb 0.02 -1.59 -0.05 0.00 -0.02 0.00 0.00 41.25 39.61 1aj7 s ASN 210 CO -0.08 0.04 2.00 0.00 -2.57 0.00 0.00 177.10 176.49 1aj7 s ARG 211 N 1.09 2.45 0.19 -0.60 1.70 -0.79 -4.94 118.95 118.06 1aj7 s ARG 211 Ca 0.00 0.18 0.04 0.00 -0.47 0.00 0.00 55.73 55.48 1aj7 s ARG 211 Cb -0.14 -4.79 -0.03 0.00 -0.57 0.00 0.00 34.95 29.41 1aj7 s ARG 211 CO -0.04 -3.28 0.30 0.20 -1.08 0.00 0.00 175.30 171.40 1aj7 s GLY 212 N 8.61 1.49 0.12 3.88 0.00 -1.26 -4.98 107.32 115.18 1aj7 s GLY 212 Ca 0.73 -1.15 -0.30 0.00 0.00 0.00 0.00 44.72 44.00 1aj7 s GLY 212 CO 0.08 -1.16 1.22 -0.54 0.00 0.00 0.00 173.10 172.71 1aj7 s GLU 213 N -3.56 4.44 0.00 2.90 8.01 -1.26 -5.26 118.70 123.97 1aj7 s GLU 213 Ca 0.34 1.85 0.00 0.00 0.01 0.00 0.00 54.97 57.17 1aj7 s GLU 213 Cb -0.10 -3.29 0.00 0.00 -4.31 0.00 0.00 34.13 26.43 1aj7 s GLU 213 CO 0.28 -0.21 0.40 0.00 0.01 0.00 0.00 175.26 175.74