#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aj7 s VAL 2 N 0.00 -0.01 0.12 -0.39 0.11 -1.26 -4.34 120.40 114.63 1aj7 s VAL 2 Ca 0.00 0.02 -0.26 0.00 -2.93 0.00 0.00 61.98 58.82 1aj7 s VAL 2 Cb 0.00 -0.78 0.07 0.00 -1.53 0.00 0.00 36.38 34.14 1aj7 s VAL 2 CO 0.00 0.01 0.93 -1.58 -3.33 0.00 0.00 175.10 171.13 1aj7 s GLN 3 N 0.88 1.13 -0.25 1.54 2.00 -0.64 -5.01 119.66 119.32 1aj7 s GLN 3 Ca -0.05 -0.59 -0.04 0.00 -2.00 0.00 0.00 55.36 52.68 1aj7 s GLN 3 Cb -0.05 0.41 0.00 0.00 0.80 0.00 0.00 33.01 34.17 1aj7 s GLN 3 CO -0.07 -0.51 -0.00 -0.51 -0.50 0.00 0.00 175.29 173.69 1aj7 s LEU 4 N -2.84 3.28 -0.27 3.68 1.43 -1.26 -0.96 118.68 121.74 1aj7 s LEU 4 Ca 0.10 -0.58 -0.09 0.00 -1.03 0.00 0.00 54.13 52.54 1aj7 s LEU 4 Cb -0.01 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.40 1aj7 s LEU 4 CO -0.00 -0.10 0.12 -1.58 0.23 0.00 0.00 176.35 175.02 1aj7 s GLN 5 N 1.46 3.68 0.24 1.70 -0.44 0.15 -4.05 119.66 122.40 1aj7 s GLN 5 Ca 0.04 -0.47 -0.01 0.00 -2.50 0.00 0.00 55.36 52.41 1aj7 s GLN 5 Cb -0.16 -3.46 -0.04 0.00 -1.64 0.00 0.00 33.01 27.71 1aj7 s GLN 5 CO -0.01 -0.23 0.44 -0.65 0.50 0.00 0.00 175.29 175.35 1aj7 s GLN 6 N 1.66 3.54 0.93 1.67 -0.21 -1.26 -0.74 119.66 125.25 1aj7 s GLN 6 Ca 0.06 -0.27 -0.11 0.00 0.02 0.00 0.00 55.36 55.07 1aj7 s GLN 6 Cb -0.16 -2.78 0.15 0.00 1.00 0.00 0.00 33.01 31.23 1aj7 s GLN 6 CO 0.06 0.33 1.11 -1.54 -2.12 0.00 0.00 175.29 173.13 1aj7 s SER 7 N -3.27 2.91 0.81 5.90 1.04 -0.68 -4.98 113.70 115.43 1aj7 s SER 7 Ca 0.40 1.88 -0.10 0.00 0.48 0.00 0.00 55.95 58.61 1aj7 s SER 7 Cb -0.11 -2.45 0.08 0.00 0.10 0.00 0.00 66.02 63.65 1aj7 s SER 7 CO 0.30 -3.06 1.10 -0.83 0.98 0.00 0.00 173.24 171.74 1aj7 s GLY 8 N -2.89 1.68 0.61 7.32 0.00 -1.26 -4.68 107.32 108.10 1aj7 s GLY 8 Ca 0.66 0.33 -0.18 0.00 0.00 0.00 0.00 44.72 45.53 1aj7 s GLY 8 CO 0.59 0.70 1.18 0.00 0.00 0.00 0.00 173.10 175.56 1aj7 s ALA 9 N -2.84 2.50 0.18 3.20 0.00 -1.26 -4.79 121.76 118.74 1aj7 s ALA 9 Ca 0.63 0.88 -0.22 0.00 0.00 0.00 0.00 51.96 53.24 1aj7 s ALA 9 Cb -0.19 -3.41 0.06 0.00 0.00 0.00 0.00 23.12 19.58 1aj7 s ALA 9 CO 0.57 -1.20 0.61 -1.83 0.00 0.00 0.00 175.76 173.90 1aj7 s GLU 10 N -3.53 1.35 -0.11 0.00 -1.05 -0.76 -3.33 118.70 111.27 1aj7 s GLU 10 Ca 0.74 -0.56 -0.01 0.00 -0.15 0.00 0.00 54.97 55.00 1aj7 s GLU 10 Cb -0.27 0.59 -0.03 0.00 -0.44 0.00 0.00 34.13 33.98 1aj7 s GLU 10 CO 0.35 -0.59 -0.07 -1.17 0.95 0.00 0.00 175.26 174.73 1aj7 s LEU 11 N -2.78 3.11 0.03 1.83 0.20 -1.26 -1.32 118.68 118.49 1aj7 s LEU 11 Ca 0.03 -0.11 0.02 0.00 0.69 0.00 0.00 54.13 54.76 1aj7 s LEU 11 Cb -0.02 -1.70 -0.02 0.00 -0.43 0.00 0.00 46.19 44.02 1aj7 s LEU 11 CO -0.10 0.26 -0.08 -0.69 -0.29 0.00 0.00 176.35 175.46 1aj7 s VAL 12 N -0.22 0.55 0.47 1.68 1.01 -0.29 -4.97 120.40 118.63 1aj7 s VAL 12 Ca 0.03 -0.80 -0.21 0.00 0.00 0.00 0.00 61.98 60.99 1aj7 s VAL 12 Cb -0.13 -0.56 -0.08 0.00 0.00 0.00 0.00 36.38 35.61 1aj7 s VAL 12 CO 0.03 -0.19 1.09 -0.54 0.00 0.00 0.00 175.10 175.48 1aj7 s LYS 13 N -1.08 3.78 0.36 2.72 1.02 -1.24 -0.89 119.74 124.41 1aj7 s LYS 13 Ca -0.05 1.54 -0.28 0.00 0.02 0.00 0.00 55.97 57.19 1aj7 s LYS 13 Cb -0.07 -2.24 -0.11 0.00 -0.52 0.00 0.00 37.83 34.89 1aj7 s LYS 13 CO 0.00 -0.48 1.41 -2.14 -0.92 0.00 0.00 175.35 173.22 1aj7 s PRO 14 N -2.96 4.19 0.00 -1.68 0.02 -1.26 -2.37 135.00 130.93 1aj7 s PRO 14 Ca 0.66 2.42 0.00 0.00 0.02 0.00 0.00 61.00 64.09 1aj7 s PRO 14 Cb -0.22 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1aj7 s PRO 14 CO 0.26 -0.41 0.00 0.41 -0.33 0.00 0.00 177.00 176.94 1aj7 n GLY 15 N 0.60 3.28 2.72 0.52 0.00 0.12 -4.90 105.19 107.52 1aj7 n GLY 15 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 1aj7 n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aj7 n ALA 16 N -1.19 -0.88 -2.43 4.61 0.00 -1.00 -4.15 120.51 115.47 1aj7 n ALA 16 Ca 0.00 -1.25 -0.23 0.00 0.00 0.00 0.00 53.44 51.96 1aj7 n ALA 16 Cb 0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 19.45 19.33 1aj7 n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1aj7 s SER 17 N -4.33 3.10 0.02 0.00 0.01 -1.26 -1.39 113.70 109.85 1aj7 s SER 17 Ca 0.52 -0.95 -0.11 0.00 1.31 0.00 0.00 55.95 56.72 1aj7 s SER 17 Cb -0.02 -0.22 0.01 0.00 0.21 0.00 0.00 66.02 66.00 1aj7 s SER 17 CO 0.36 -0.01 0.22 0.54 0.41 0.00 0.00 173.24 174.76 1aj7 s VAL 18 N -2.33 0.09 -0.15 3.43 0.11 -0.49 -5.00 120.40 116.06 1aj7 s VAL 18 Ca 0.23 -0.73 -0.01 0.00 -2.93 0.00 0.00 61.98 58.54 1aj7 s VAL 18 Cb -0.05 -0.73 0.04 0.00 -1.53 0.00 0.00 36.38 34.11 1aj7 s VAL 18 CO 0.10 -0.40 -0.05 -0.75 -3.33 0.00 0.00 175.10 170.67 1aj7 s LYS 19 N -1.99 1.40 0.21 1.54 2.20 -1.26 -0.98 119.74 120.86 1aj7 s LYS 19 Ca -0.09 -0.43 -0.04 0.00 -0.36 0.00 0.00 55.97 55.05 1aj7 s LYS 19 Cb -0.04 -1.87 -0.05 0.00 -1.51 0.00 0.00 37.83 34.36 1aj7 s LYS 19 CO -0.01 -0.40 0.45 -0.51 -0.36 0.00 0.00 175.35 174.53 1aj7 s LEU 20 N 1.67 4.18 0.19 5.43 1.02 -0.21 -4.90 118.68 126.07 1aj7 s LEU 20 Ca 0.02 0.60 0.08 0.00 0.02 0.00 0.00 54.13 54.85 1aj7 s LEU 20 Cb -0.15 -3.37 -0.05 0.00 0.02 0.00 0.00 46.19 42.65 1aj7 s LEU 20 CO -0.08 -0.06 -0.15 -0.94 0.02 0.00 0.00 176.35 175.15 1aj7 s SER 21 N -2.86 2.51 -0.24 2.29 1.04 -1.26 -0.80 113.70 114.39 1aj7 s SER 21 Ca 0.42 -0.99 -0.03 0.00 0.48 0.00 0.00 55.95 55.82 1aj7 s SER 21 Cb -0.11 -0.13 0.11 0.00 0.10 0.00 0.00 66.02 65.99 1aj7 s SER 21 CO 0.27 -0.16 0.23 0.00 0.98 0.00 0.00 173.24 174.56 1aj7 s THR 23 N 2.31 5.32 -0.08 0.00 2.01 0.08 -1.39 115.64 123.88 1aj7 s THR 23 Ca 0.08 0.15 -0.12 0.00 0.31 0.00 0.00 61.69 62.11 1aj7 s THR 23 Cb -0.15 -3.41 -0.05 0.00 0.01 0.00 0.00 72.50 68.90 1aj7 s THR 23 CO -0.21 0.47 0.29 0.00 -0.69 0.00 0.00 174.62 174.47 1aj7 s ALA 24 N 0.19 3.73 -0.02 7.40 0.00 -0.70 -0.67 121.76 131.69 1aj7 s ALA 24 Ca 0.08 -0.42 0.07 0.00 0.00 0.00 0.00 51.96 51.69 1aj7 s ALA 24 Cb -0.11 -2.25 -0.02 0.00 0.00 0.00 0.00 23.12 20.74 1aj7 s ALA 24 CO -0.01 0.42 -0.24 -1.54 0.00 0.00 0.00 175.76 174.39 1aj7 s SER 25 N -0.65 2.87 0.00 0.00 1.04 -0.13 -4.81 113.70 112.02 1aj7 s SER 25 Ca 0.19 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.17 1aj7 s SER 25 Cb -0.14 -0.40 0.00 0.00 0.10 0.00 0.00 66.02 65.58 1aj7 s SER 25 CO 0.08 0.29 0.00 0.61 0.98 0.00 0.00 173.24 175.20 1aj7 n GLY 26 N 2.56 1.92 2.14 7.32 0.00 -1.26 -1.61 105.19 116.26 1aj7 n GLY 26 Ca -0.16 -0.63 -0.12 0.00 0.00 0.00 0.00 46.02 45.11 1aj7 n GLY 26 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1aj7 n PHE 27 N 0.00 -2.84 -2.20 1.61 -1.74 -1.26 -5.04 117.46 105.98 1aj7 n PHE 27 Ca 0.00 -1.08 0.00 0.00 -0.56 0.00 0.00 57.45 55.81 1aj7 n PHE 27 Cb 0.00 -0.35 0.00 0.00 1.52 0.00 0.00 39.48 40.65 1aj7 n PHE 27 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 1aj7 n ASN 28 N -2.77 0.00 -0.36 5.98 0.23 -1.26 -4.89 115.26 112.19 1aj7 n ASN 28 Ca 0.09 -0.11 0.32 0.00 -0.53 0.00 0.00 54.58 54.35 1aj7 n ASN 28 Cb 0.33 0.00 0.55 0.00 -2.08 0.00 0.00 39.78 38.58 1aj7 n ASN 28 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1aj7 n ILE 29 N 0.00 -0.27 -0.32 1.53 3.06 -1.26 -2.19 119.36 119.91 1aj7 n ILE 29 Ca 0.00 1.61 0.29 0.00 -2.50 0.00 0.00 62.75 62.15 1aj7 n ILE 29 Cb 0.00 -2.63 0.54 0.00 0.54 0.00 0.00 39.64 38.09 1aj7 n ILE 29 CO 0.00 0.00 0.00 0.07 -2.50 0.00 0.00 176.55 174.12 1aj7 h LYS 30 N 0.00 0.10 -0.26 9.51 2.10 -2.01 0.24 116.57 126.25 1aj7 h LYS 30 Ca 0.74 -0.01 -0.16 0.00 -2.00 0.00 0.00 60.65 59.23 1aj7 h LYS 30 Cb 2.25 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 33.55 1aj7 h LYS 30 CO -0.49 0.07 -0.48 0.38 -2.00 0.00 0.00 179.45 176.93 1aj7 h ASP 31 N 0.10 0.74 -3.80 7.07 2.03 -1.87 -3.50 116.42 117.20 1aj7 h ASP 31 Ca 0.80 -0.37 0.19 0.00 -0.73 0.00 0.00 57.03 56.92 1aj7 h ASP 31 Cb 2.03 -0.21 -0.10 0.00 -0.83 0.00 0.00 39.33 40.22 1aj7 h ASP 31 CO -0.72 1.10 -0.66 0.41 -1.03 0.00 0.00 179.24 178.34 1aj7 n THR 32 N -4.00 -0.46 -2.33 1.15 -1.04 0.83 -4.77 114.28 103.65 1aj7 n THR 32 Ca -0.03 0.49 -0.03 0.00 -2.04 0.00 0.00 64.05 62.44 1aj7 n THR 32 Cb 0.57 -0.74 -0.02 0.00 -1.82 0.00 0.00 70.33 68.32 1aj7 n THR 32 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1aj7 n TYR 33 N -3.26 -4.06 -4.11 -1.42 4.02 -1.19 -3.66 117.16 103.48 1aj7 n TYR 33 Ca -0.05 2.39 -0.34 0.00 -0.01 0.00 0.00 57.90 59.89 1aj7 n TYR 33 Cb 0.36 -3.62 -0.15 0.00 -0.02 0.00 0.00 39.34 35.91 1aj7 n TYR 33 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 176.86 177.26 1aj7 s MET 34 N -0.75 3.20 0.11 -0.72 1.75 -0.04 -2.59 119.30 120.26 1aj7 s MET 34 Ca -0.15 -0.73 0.04 0.00 -1.25 0.00 0.00 55.69 53.60 1aj7 s MET 34 Cb 0.01 -2.77 -0.04 0.00 2.84 0.00 0.00 34.83 34.87 1aj7 s MET 34 CO 0.40 -0.16 0.11 -1.01 -0.65 0.00 0.00 175.02 173.71 1aj7 s HIS 35 N 1.28 3.19 -0.07 4.11 3.76 0.63 -1.05 115.29 127.13 1aj7 s HIS 35 Ca 0.03 0.05 0.05 0.00 -0.15 0.00 0.00 55.06 55.04 1aj7 s HIS 35 Cb -0.14 -1.58 -0.00 0.00 1.11 0.00 0.00 32.58 31.96 1aj7 s HIS 35 CO -0.06 0.52 -0.23 -1.58 -0.85 0.00 0.00 174.74 172.54 1aj7 s TRP 36 N -1.53 2.31 0.03 1.40 0.52 -0.62 -0.32 118.94 120.73 1aj7 s TRP 36 Ca 0.30 -0.78 0.05 0.00 0.02 0.00 0.00 56.10 55.69 1aj7 s TRP 36 Cb -0.11 -1.54 -0.02 0.00 -1.15 0.00 0.00 33.47 30.65 1aj7 s TRP 36 CO 0.23 -0.28 -0.15 0.08 0.02 0.00 0.00 176.95 176.86 1aj7 s VAL 37 N 0.07 1.16 -0.02 4.03 1.01 0.13 -1.23 120.40 125.53 1aj7 s VAL 37 Ca -0.09 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.03 1aj7 s VAL 37 Cb -0.15 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.18 1aj7 s VAL 37 CO 0.05 0.11 -0.12 -0.75 0.00 0.00 0.00 175.10 174.39 1aj7 s LYS 38 N -0.91 2.49 -0.09 2.72 2.20 0.94 -0.20 119.74 126.89 1aj7 s LYS 38 Ca 0.03 -0.72 -0.06 0.00 -0.36 0.00 0.00 55.97 54.86 1aj7 s LYS 38 Cb -0.07 -2.41 0.03 0.00 -1.51 0.00 0.00 37.83 33.87 1aj7 s LYS 38 CO 0.01 0.61 0.21 -1.14 -0.36 0.00 0.00 175.35 174.68 1aj7 s GLN 39 N -1.03 0.20 0.10 4.03 0.74 -0.24 -0.56 119.66 122.89 1aj7 s GLN 39 Ca 0.14 0.39 0.04 0.00 0.05 0.00 0.00 55.36 55.98 1aj7 s GLN 39 Cb -0.11 -0.02 -0.04 0.00 1.10 0.00 0.00 33.01 33.94 1aj7 s GLN 39 CO 0.03 -0.10 -0.11 1.03 -0.55 0.00 0.00 175.29 175.59 1aj7 s ARG 40 N 0.72 0.87 0.28 1.67 0.52 -1.26 -1.48 118.95 120.26 1aj7 s ARG 40 Ca -0.05 -1.16 -0.30 0.00 -0.52 0.00 0.00 55.73 53.70 1aj7 s ARG 40 Cb -0.06 -0.59 -0.13 0.00 0.52 0.00 0.00 34.95 34.69 1aj7 s ARG 40 CO -0.04 0.10 1.41 -2.30 0.02 0.00 0.00 175.30 174.49 1aj7 n PRO 41 N 0.58 2.18 -0.86 3.54 -0.02 -1.26 -1.40 135.00 137.76 1aj7 n PRO 41 Ca -0.16 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1aj7 n PRO 41 Cb 0.57 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1aj7 n PRO 41 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1aj7 n GLU 42 N 1.67 -0.30 -5.21 -0.52 1.02 -1.26 -4.95 120.64 111.09 1aj7 n GLU 42 Ca 0.09 0.07 -0.31 0.00 -0.02 0.00 0.00 57.16 57.00 1aj7 n GLU 42 Cb 0.34 -3.54 -0.16 0.00 -0.02 0.00 0.00 31.44 28.05 1aj7 n GLU 42 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1aj7 s GLN 43 N -0.58 2.44 0.00 3.49 -1.52 -0.49 -5.13 119.66 117.86 1aj7 s GLN 43 Ca 0.00 -0.86 0.00 0.00 -1.95 0.00 0.00 55.36 52.55 1aj7 s GLN 43 Cb 0.00 -2.07 0.00 0.00 -0.22 0.00 0.00 33.01 30.72 1aj7 s GLN 43 CO 0.00 0.36 0.00 0.41 -0.25 0.00 0.00 175.29 175.81 1aj7 n GLY 44 N 2.97 -1.50 3.81 3.09 0.00 -1.26 -4.07 105.19 108.23 1aj7 n GLY 44 Ca -0.17 -1.14 -0.37 0.00 0.00 0.00 0.00 46.02 44.33 1aj7 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aj7 s LEU 45 N 0.00 4.38 -0.13 0.99 1.43 -1.26 -4.24 118.68 119.85 1aj7 s LEU 45 Ca 0.00 0.68 0.02 0.00 -1.03 0.00 0.00 54.13 53.80 1aj7 s LEU 45 Cb 0.00 -2.38 0.01 0.00 0.03 0.00 0.00 46.19 43.86 1aj7 s LEU 45 CO 0.00 0.28 -0.18 -0.70 0.23 0.00 0.00 176.35 175.98 1aj7 s GLU 46 N -0.57 2.58 0.08 1.70 2.12 0.27 -4.97 118.70 119.91 1aj7 s GLU 46 Ca 0.19 -0.69 -0.30 0.00 0.36 0.00 0.00 54.97 54.53 1aj7 s GLU 46 Cb -0.14 -2.16 -0.05 0.00 0.26 0.00 0.00 34.13 32.04 1aj7 s GLU 46 CO 0.08 -0.06 1.09 -0.46 -0.54 0.00 0.00 175.26 175.36 1aj7 s TRP 47 N 0.97 3.58 -0.25 5.30 -0.00 -1.26 -0.04 118.94 127.24 1aj7 s TRP 47 Ca -0.05 1.54 -0.17 0.00 -0.00 0.00 0.00 56.10 57.42 1aj7 s TRP 47 Cb -0.15 -3.26 -0.15 0.00 -0.00 0.00 0.00 33.47 29.91 1aj7 s TRP 47 CO -0.03 -0.59 -0.12 -0.89 -0.00 0.00 0.00 176.95 175.32 1aj7 n ILE 48 N 3.44 1.53 -2.26 5.86 5.41 -0.37 -4.58 119.36 128.39 1aj7 n ILE 48 Ca 0.06 -0.25 0.00 0.00 1.00 0.00 0.00 62.75 63.55 1aj7 n ILE 48 Cb 0.48 -1.93 0.00 0.00 -0.71 0.00 0.00 39.64 37.48 1aj7 n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1aj7 n GLY 49 N 1.35 -1.57 3.27 7.39 0.00 -1.22 -0.77 105.19 113.64 1aj7 n GLY 49 Ca -0.46 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.40 1aj7 n GLY 49 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1aj7 s ARG 50 N -1.37 0.98 0.03 1.61 1.04 0.22 -1.59 118.95 119.88 1aj7 s ARG 50 Ca 0.00 -0.99 0.03 0.00 -1.04 0.00 0.00 55.73 53.73 1aj7 s ARG 50 Cb 0.00 0.37 -0.02 0.00 -2.04 0.00 0.00 34.95 33.27 1aj7 s ARG 50 CO 0.00 -0.34 -0.09 -1.50 -0.04 0.00 0.00 175.30 173.33 1aj7 s ILE 51 N -3.89 0.65 -0.61 4.99 2.07 -0.21 -1.77 121.20 122.43 1aj7 s ILE 51 Ca 0.08 -0.84 -0.13 0.00 -1.41 0.00 0.00 60.65 58.35 1aj7 s ILE 51 Cb 0.04 -0.64 0.15 0.00 0.13 0.00 0.00 42.46 42.14 1aj7 s ILE 51 CO -0.08 -0.16 0.53 -0.62 -1.91 0.00 0.00 174.94 172.70 1aj7 s ASP 52 N -1.11 6.17 0.58 4.50 -1.08 0.58 -0.86 116.67 125.46 1aj7 s ASP 52 Ca -0.04 -2.12 0.28 0.00 -0.52 0.00 0.00 52.55 50.15 1aj7 s ASP 52 Cb -0.07 -2.14 1.50 0.00 -1.46 0.00 0.00 42.92 40.74 1aj7 s ASP 52 CO 0.00 -0.72 1.94 -0.65 0.52 0.00 0.00 175.17 176.27 1aj7 h PRO 52 N 8.38 0.00 -0.24 4.34 0.11 -1.90 0.44 132.00 143.13 1aj7 h PRO 52 Ca -0.15 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.87 1aj7 h PRO 52 Cb 1.07 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1aj7 h PRO 52 CO 0.90 0.00 -0.22 0.00 -0.21 0.00 0.00 178.00 178.47 1aj7 h ALA 53 N 1.55 1.17 0.00 -0.75 0.00 -1.92 -3.36 119.26 115.95 1aj7 h ALA 53 Ca 0.21 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1aj7 h ALA 53 Cb 1.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1aj7 h ALA 53 CO -0.00 0.53 0.00 0.27 0.00 0.00 0.00 179.25 180.05 1aj7 n ASN 54 N -4.14 0.40 0.00 0.00 0.23 -0.83 -5.02 115.26 105.90 1aj7 n ASN 54 Ca -0.00 -1.01 0.00 0.00 -0.53 0.00 0.00 54.58 53.03 1aj7 n ASN 54 Cb 0.38 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 1aj7 n ASN 54 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1aj7 n GLY 55 N -0.01 0.64 3.77 4.83 0.00 0.15 -5.00 105.19 109.57 1aj7 n GLY 55 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1aj7 n GLY 55 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1aj7 s ASN 56 N -2.37 6.61 0.03 1.61 2.47 -1.20 -4.73 114.94 117.35 1aj7 s ASN 56 Ca 0.00 2.81 0.04 0.00 0.42 0.00 0.00 52.86 56.13 1aj7 s ASN 56 Cb 0.00 -2.66 -0.02 0.00 -1.45 0.00 0.00 41.25 37.13 1aj7 s ASN 56 CO 0.00 -0.66 -0.12 0.28 -3.72 0.00 0.00 177.10 172.88 1aj7 s THR 57 N -1.14 0.92 -0.04 -5.21 -1.32 -1.26 -0.30 115.64 107.29 1aj7 s THR 57 Ca 0.50 -0.84 0.02 0.00 -1.21 0.00 0.00 61.69 60.17 1aj7 s THR 57 Cb -0.42 -0.84 0.01 0.00 -1.51 0.00 0.00 72.50 69.74 1aj7 s THR 57 CO 0.56 0.01 -0.08 -0.54 -2.21 0.00 0.00 174.62 172.36 1aj7 s LYS 58 N -0.94 0.99 0.17 7.08 -0.14 -0.73 -5.00 119.74 121.18 1aj7 s LYS 58 Ca 0.01 -0.25 0.09 0.00 -1.36 0.00 0.00 55.97 54.46 1aj7 s LYS 58 Cb -0.07 -0.92 -0.04 0.00 -1.68 0.00 0.00 37.83 35.12 1aj7 s LYS 58 CO 0.01 0.04 -0.19 0.71 -0.76 0.00 0.00 175.35 175.16 1aj7 s TYR 59 N 0.48 1.87 -0.01 3.18 2.02 -1.26 -0.61 117.35 123.01 1aj7 s TYR 59 Ca -0.07 -0.46 -0.30 0.00 -0.37 0.00 0.00 57.07 55.86 1aj7 s TYR 59 Cb -0.11 -0.92 -0.04 0.00 -0.40 0.00 0.00 41.96 40.49 1aj7 s TYR 59 CO 0.01 0.36 1.15 0.34 -1.57 0.00 0.00 175.55 175.84 1aj7 s ASP 60 N -2.73 7.12 0.48 2.29 -1.08 0.05 -4.89 116.67 117.91 1aj7 s ASP 60 Ca 0.17 1.84 0.35 0.00 -0.52 0.00 0.00 52.55 54.39 1aj7 s ASP 60 Cb -0.06 -2.57 1.48 0.00 -1.46 0.00 0.00 42.92 40.32 1aj7 s ASP 60 CO 0.07 -0.48 1.67 -0.65 0.52 0.00 0.00 175.17 176.29 1aj7 h PRO 61 N 7.10 0.09 0.00 4.34 0.11 -1.94 0.16 132.00 141.86 1aj7 h PRO 61 Ca -0.38 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.70 1aj7 h PRO 61 Cb 1.19 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 1aj7 h PRO 61 CO 0.83 0.06 -0.12 0.87 -0.21 0.00 0.00 178.00 179.43 1aj7 h LYS 62 N 0.09 0.00 -0.26 1.05 1.57 -1.95 -2.60 116.57 114.47 1aj7 h LYS 62 Ca 0.77 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.55 1aj7 h LYS 62 Cb 2.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.97 1aj7 h LYS 62 CO -0.23 0.12 0.00 1.19 -0.57 0.00 0.00 179.45 179.96 1aj7 n PHE 63 N -3.46 0.33 0.10 -1.35 3.01 0.56 -4.61 117.46 112.04 1aj7 n PHE 63 Ca -0.01 -0.18 0.20 0.00 1.01 0.00 0.00 57.45 58.47 1aj7 n PHE 63 Cb 0.28 -0.00 0.73 0.00 -0.01 0.00 0.00 39.48 40.47 1aj7 n PHE 63 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 1aj7 h GLN 64 N 4.22 0.00 0.00 -1.08 3.07 -1.38 -0.81 115.11 119.13 1aj7 h GLN 64 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.68 1aj7 h GLN 64 Cb 0.93 0.00 -0.12 0.00 0.08 0.00 0.00 27.48 28.37 1aj7 h GLN 64 CO 0.00 0.00 -0.63 0.41 0.09 0.00 0.00 178.83 178.70 1aj7 n GLY 65 N -1.48 3.61 0.00 0.06 0.00 -1.26 -4.77 105.19 101.35 1aj7 n GLY 65 Ca 0.07 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1aj7 n GLY 65 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1aj7 n LYS 66 N -0.58 0.58 -4.98 1.61 3.00 -0.38 -4.96 118.16 112.46 1aj7 n LYS 66 Ca 0.14 0.00 -0.31 0.00 -0.00 0.00 0.00 58.31 58.14 1aj7 n LYS 66 Cb 0.83 -0.71 -0.15 0.00 0.00 0.00 0.00 35.03 35.01 1aj7 n LYS 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1aj7 s ALA 67 N -1.41 2.32 -0.10 3.14 0.00 -0.80 -2.18 121.76 122.73 1aj7 s ALA 67 Ca 0.00 -1.19 -0.00 0.00 0.00 0.00 0.00 51.96 50.77 1aj7 s ALA 67 Cb 0.00 -0.59 0.02 0.00 0.00 0.00 0.00 23.12 22.56 1aj7 s ALA 67 CO 0.00 0.54 -0.06 0.99 0.00 0.00 0.00 175.76 177.23 1aj7 s THR 68 N -0.76 0.88 -0.15 0.00 2.01 -0.17 -4.83 115.64 112.61 1aj7 s THR 68 Ca 0.12 -0.20 -0.06 0.00 0.31 0.00 0.00 61.69 61.86 1aj7 s THR 68 Cb -0.10 -0.92 -0.04 0.00 0.01 0.00 0.00 72.50 71.45 1aj7 s THR 68 CO 0.02 0.34 0.04 -0.63 -0.69 0.00 0.00 174.62 173.70 1aj7 s ILE 69 N 1.68 4.63 0.22 1.82 1.01 -1.26 -0.83 121.20 128.46 1aj7 s ILE 69 Ca 0.03 -0.10 0.02 0.00 0.00 0.00 0.00 60.65 60.60 1aj7 s ILE 69 Cb -0.13 -3.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.25 1aj7 s ILE 69 CO -0.07 0.51 0.05 0.42 0.00 0.00 0.00 174.94 175.86 1aj7 s THR 70 N -0.06 0.66 -0.01 2.92 -4.23 -0.74 -4.99 115.64 109.19 1aj7 s THR 70 Ca 0.05 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.42 1aj7 s THR 70 Cb -0.12 -2.41 0.02 0.00 1.34 0.00 0.00 72.50 71.33 1aj7 s THR 70 CO 0.01 -0.22 0.30 0.00 -0.54 0.00 0.00 174.62 174.18 1aj7 s ALA 71 N -3.68 -0.76 -0.27 3.99 0.00 -1.26 -0.67 121.76 119.11 1aj7 s ALA 71 Ca 0.31 0.29 -0.01 0.00 0.00 0.00 0.00 51.96 52.55 1aj7 s ALA 71 Cb 0.07 0.10 0.09 0.00 0.00 0.00 0.00 23.12 23.37 1aj7 s ALA 71 CO 0.09 -0.27 0.07 0.34 0.00 0.00 0.00 175.76 176.00 1aj7 s ASP 72 N -1.39 3.70 0.28 0.00 -1.08 0.69 -5.00 116.67 113.88 1aj7 s ASP 72 Ca -0.13 -1.38 -0.03 0.00 -0.52 0.00 0.00 52.55 50.49 1aj7 s ASP 72 Cb -0.05 -0.79 0.38 0.00 -1.46 0.00 0.00 42.92 41.00 1aj7 s ASP 72 CO 0.04 -0.38 1.91 0.71 0.52 0.00 0.00 175.17 177.97 1aj7 h THR 73 N 6.50 1.23 -0.20 1.71 1.35 -1.87 0.81 112.91 122.44 1aj7 h THR 73 Ca -0.15 -0.53 0.05 0.00 -0.55 0.00 0.00 66.41 65.23 1aj7 h THR 73 Cb 1.05 0.14 -0.06 0.00 -1.73 0.00 0.00 68.15 67.55 1aj7 h THR 73 CO 0.43 0.25 -0.15 0.28 -0.25 0.00 0.00 175.52 176.07 1aj7 h SER 74 N 1.09 -0.49 0.08 5.36 0.02 -1.95 -1.82 113.55 115.84 1aj7 h SER 74 Ca 0.28 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 1aj7 h SER 74 Cb -0.01 0.25 0.00 0.00 0.14 0.00 0.00 62.40 62.78 1aj7 h SER 74 CO -0.05 -0.19 -0.11 -1.54 -1.14 0.00 0.00 176.83 173.80 1aj7 n SER 75 N -5.31 1.39 -3.69 3.07 3.41 -1.16 -4.94 113.62 106.38 1aj7 n SER 75 Ca -0.02 -1.28 -0.25 0.00 -0.26 0.00 0.00 58.87 57.06 1aj7 n SER 75 Cb 0.22 0.06 0.06 0.00 -0.26 0.00 0.00 64.21 64.30 1aj7 n SER 75 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1aj7 n ASN 76 N -0.10 -5.21 -4.21 4.04 5.15 0.19 -4.82 115.26 110.29 1aj7 n ASN 76 Ca 0.16 -0.64 -0.24 0.00 -0.60 0.00 0.00 54.58 53.26 1aj7 n ASN 76 Cb 0.36 -4.64 -0.14 0.00 -0.53 0.00 0.00 39.78 34.83 1aj7 n ASN 76 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1aj7 s THR 77 N -3.34 1.51 0.11 -0.44 2.01 -0.65 -1.71 115.64 113.12 1aj7 s THR 77 Ca 0.52 -1.05 0.09 0.00 0.31 0.00 0.00 61.69 61.56 1aj7 s THR 77 Cb -0.24 -1.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.92 1aj7 s THR 77 CO 0.77 0.22 -0.19 0.00 -0.69 0.00 0.00 174.62 174.72 1aj7 s ALA 78 N -0.71 2.62 0.07 7.40 0.00 -0.49 -0.22 121.76 130.43 1aj7 s ALA 78 Ca 0.06 -1.35 0.06 0.00 0.00 0.00 0.00 51.96 50.73 1aj7 s ALA 78 Cb -0.08 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 1aj7 s ALA 78 CO 0.01 0.58 -0.16 0.71 0.00 0.00 0.00 175.76 176.91 1aj7 s TYR 79 N -1.10 1.35 -0.24 0.00 1.51 0.16 -1.05 117.35 117.97 1aj7 s TYR 79 Ca 0.17 -0.42 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1aj7 s TYR 79 Cb -0.10 -0.77 0.06 0.00 -0.11 0.00 0.00 41.96 41.04 1aj7 s TYR 79 CO 0.09 0.08 -0.03 -1.17 -1.11 0.00 0.00 175.55 173.41 1aj7 s LEU 80 N -1.59 2.58 -0.24 -1.29 2.96 0.02 -1.79 118.68 119.33 1aj7 s LEU 80 Ca 0.01 -1.24 -0.12 0.00 -0.22 0.00 0.00 54.13 52.56 1aj7 s LEU 80 Cb -0.09 -1.15 -0.05 0.00 0.50 0.00 0.00 46.19 45.40 1aj7 s LEU 80 CO 0.02 -0.26 0.23 -1.58 -1.32 0.00 0.00 176.35 173.44 1aj7 s GLN 81 N 1.41 4.07 -0.14 1.98 0.74 -0.01 -1.05 119.66 126.65 1aj7 s GLN 81 Ca -0.04 -0.16 -0.01 0.00 0.05 0.00 0.00 55.36 55.20 1aj7 s GLN 81 Cb -0.19 -3.57 -0.01 0.00 1.10 0.00 0.00 33.01 30.34 1aj7 s GLN 81 CO -0.08 -0.03 -0.11 -0.51 -0.55 0.00 0.00 175.29 174.02 1aj7 s LEU 82 N 1.31 2.78 0.35 3.68 1.43 -0.15 -1.00 118.68 127.07 1aj7 s LEU 82 Ca 0.10 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 52.96 1aj7 s LEU 82 Cb -0.14 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1aj7 s LEU 82 CO 0.07 0.14 0.20 -0.94 0.23 0.00 0.00 176.35 176.05 1aj7 s SER 83 N 0.51 4.86 -1.37 2.29 1.04 -0.93 -1.40 113.70 118.71 1aj7 s SER 83 Ca -0.08 -0.71 -0.05 0.00 0.48 0.00 0.00 55.95 55.60 1aj7 s SER 83 Cb -0.15 -0.78 0.00 0.00 0.10 0.00 0.00 66.02 65.19 1aj7 s SER 83 CO 0.04 -0.35 0.45 -1.20 0.98 0.00 0.00 173.24 173.16 1aj7 n SER 84 N -1.24 -1.06 -4.64 7.02 7.64 -1.08 -4.84 113.62 115.41 1aj7 n SER 84 Ca -0.02 -1.04 -0.44 0.00 1.01 0.00 0.00 58.87 58.37 1aj7 n SER 84 Cb 0.61 -2.93 -0.02 0.00 -1.01 0.00 0.00 64.21 60.86 1aj7 n SER 84 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1aj7 n LEU 85 N -4.41 2.67 -4.25 -3.43 4.77 -0.49 -4.58 117.00 107.28 1aj7 n LEU 85 Ca -0.27 1.18 -0.14 0.00 -0.03 0.00 0.00 56.01 56.74 1aj7 n LEU 85 Cb 0.67 -1.38 -0.10 0.00 -2.33 0.00 0.00 43.42 40.28 1aj7 n LEU 85 CO 0.75 -0.88 -0.22 0.42 -1.33 0.00 0.00 177.39 176.12 1aj7 s THR 86 N -0.82 0.14 0.59 -5.08 -4.23 -1.26 0.12 115.64 105.10 1aj7 s THR 86 Ca 0.60 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 59.40 1aj7 s THR 86 Cb -0.65 -2.53 0.36 0.00 1.34 0.00 0.00 72.50 71.02 1aj7 s THR 86 CO 0.58 0.00 2.11 0.77 -0.54 0.00 0.00 174.62 177.54 1aj7 h SER 87 N 2.48 0.00 0.62 3.99 4.64 -1.95 -0.10 113.55 123.23 1aj7 h SER 87 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 1aj7 h SER 87 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1aj7 h SER 87 CO 0.52 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.86 1aj7 n GLU 88 N -3.82 0.02 0.00 4.77 -0.58 -1.26 -2.50 120.64 117.27 1aj7 n GLU 88 Ca 0.01 0.17 0.12 0.00 -0.42 0.00 0.00 57.16 57.05 1aj7 n GLU 88 Cb 0.31 -1.50 0.25 0.00 -0.57 0.00 0.00 31.44 29.93 1aj7 n GLU 88 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1aj7 n ASP 89 N -1.48 1.70 -4.62 1.62 8.00 -0.05 -4.84 116.55 116.88 1aj7 n ASP 89 Ca 0.05 -1.35 -0.43 0.00 0.71 0.00 0.00 54.79 53.77 1aj7 n ASP 89 Cb 0.21 0.20 -0.02 0.00 -0.02 0.00 0.00 41.12 41.49 1aj7 n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1aj7 s THR 90 N -2.34 3.84 0.06 -3.53 2.01 -1.04 -4.84 115.64 109.81 1aj7 s THR 90 Ca 0.25 0.91 -0.12 0.00 0.31 0.00 0.00 61.69 63.04 1aj7 s THR 90 Cb 0.19 -3.98 0.04 0.00 0.01 0.00 0.00 72.50 68.77 1aj7 s THR 90 CO 0.47 -0.51 0.58 0.00 -0.69 0.00 0.00 174.62 174.47 1aj7 n ALA 91 N 8.65 -1.55 -2.84 7.40 0.00 -0.65 -4.92 120.51 126.61 1aj7 n ALA 91 Ca 0.18 -0.50 -0.34 0.00 0.00 0.00 0.00 53.44 52.77 1aj7 n ALA 91 Cb 0.47 0.23 -0.11 0.00 0.00 0.00 0.00 19.45 20.04 1aj7 n ALA 91 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1aj7 s VAL 92 N -2.24 4.16 -0.12 0.00 1.01 -0.55 -0.53 120.40 122.13 1aj7 s VAL 92 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1aj7 s VAL 92 Cb -0.01 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 1aj7 s VAL 92 CO 0.02 0.52 -0.12 -0.31 0.00 0.00 0.00 175.10 175.21 1aj7 s TYR 93 N -0.03 2.82 0.04 5.22 1.51 0.31 -1.08 117.35 126.14 1aj7 s TYR 93 Ca 0.03 -0.53 0.07 0.00 -1.01 0.00 0.00 57.07 55.62 1aj7 s TYR 93 Cb -0.13 -1.82 -0.03 0.00 -0.11 0.00 0.00 41.96 39.87 1aj7 s TYR 93 CO 0.02 -0.13 -0.17 0.71 -1.11 0.00 0.00 175.55 174.87 1aj7 s TYR 94 N 0.18 2.58 0.03 2.71 2.02 0.72 -0.72 117.35 124.88 1aj7 s TYR 94 Ca -0.07 -0.24 0.05 0.00 -0.37 0.00 0.00 57.07 56.44 1aj7 s TYR 94 Cb -0.15 -1.46 -0.03 0.00 -0.40 0.00 0.00 41.96 39.91 1aj7 s TYR 94 CO 0.05 0.27 -0.12 0.00 -1.57 0.00 0.00 175.55 174.18 1aj7 s ALA 96 N -1.00 0.19 0.72 0.00 0.00 0.57 -0.84 121.76 121.39 1aj7 s ALA 96 Ca 0.17 -0.50 -0.00 0.00 0.00 0.00 0.00 51.96 51.63 1aj7 s ALA 96 Cb -0.11 0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.11 1aj7 s ALA 96 CO 0.08 -0.10 0.03 -1.13 0.00 0.00 0.00 175.76 174.64 1aj7 n SER 97 N 1.90 0.02 -4.77 0.00 3.41 -0.53 -0.27 113.62 113.38 1aj7 n SER 97 Ca -0.21 -1.02 -0.41 0.00 -0.26 0.00 0.00 58.87 56.97 1aj7 n SER 97 Cb 0.56 -0.02 -0.01 0.00 -0.26 0.00 0.00 64.21 64.48 1aj7 n SER 97 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 1aj7 s TYR 98 N -0.51 2.68 0.00 7.33 5.04 -1.07 -1.85 117.35 128.96 1aj7 s TYR 98 Ca 0.02 1.10 0.00 0.00 -2.44 0.00 0.00 57.07 55.75 1aj7 s TYR 98 Cb -0.00 -4.00 0.00 0.00 0.35 0.00 0.00 41.96 38.31 1aj7 s TYR 98 CO 0.01 -3.02 0.00 0.66 -1.34 0.00 0.00 175.55 171.86 1aj7 n TYR 99 N 0.94 0.00 -2.15 4.97 4.01 -1.26 -3.18 117.16 120.49 1aj7 n TYR 99 Ca 0.03 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.67 1aj7 n TYR 99 Cb 0.39 -0.72 -0.01 0.00 -0.31 0.00 0.00 39.34 38.69 1aj7 n TYR 99 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1aj7 n GLY 100 N -2.00 0.01 0.10 2.72 0.00 -0.77 -4.95 105.19 100.29 1aj7 n GLY 100 Ca 0.00 -0.47 -0.18 0.00 0.00 0.00 0.00 46.02 45.37 1aj7 n GLY 100 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1aj7 h ILE 101 N 0.00 1.62 -2.98 -0.61 2.04 -1.75 -3.45 117.51 112.38 1aj7 h ILE 101 Ca -0.24 -2.47 -0.64 0.00 1.00 0.00 0.00 64.86 62.52 1aj7 h ILE 101 Cb 1.15 3.28 -0.10 0.00 -0.74 0.00 0.00 36.82 40.41 1aj7 h ILE 101 CO 0.28 0.68 -0.50 -0.31 0.00 0.00 0.00 178.15 178.30 1aj7 s TYR 102 N -2.35 3.47 -0.02 1.37 2.02 -1.26 -5.00 117.35 115.59 1aj7 s TYR 102 Ca -0.16 0.39 0.04 0.00 -0.37 0.00 0.00 57.07 56.97 1aj7 s TYR 102 Cb -0.01 -2.03 -0.01 0.00 -0.40 0.00 0.00 41.96 39.52 1aj7 s TYR 102 CO 0.78 0.50 -0.13 -1.58 -1.57 0.00 0.00 175.55 173.55 1aj7 s TRP 103 N -0.36 1.18 0.89 2.71 0.52 -1.26 -1.46 118.94 121.17 1aj7 s TRP 103 Ca 0.11 -0.25 -0.12 0.00 0.02 0.00 0.00 56.10 55.86 1aj7 s TRP 103 Cb -0.12 -0.78 0.12 0.00 -1.15 0.00 0.00 33.47 31.55 1aj7 s TRP 103 CO 0.01 -0.05 1.11 0.20 0.02 0.00 0.00 176.95 178.25 1aj7 s GLY 104 N -0.19 1.59 0.00 0.98 0.00 -0.02 -4.59 107.32 105.09 1aj7 s GLY 104 Ca 0.03 -0.33 0.25 0.00 0.00 0.00 0.00 44.72 44.67 1aj7 s GLY 104 CO -0.00 0.19 1.85 0.61 0.00 0.00 0.00 173.10 175.75 1aj7 n GLN 105 N -3.76 0.30 0.00 2.90 0.00 -1.26 -4.75 117.38 110.81 1aj7 n GLN 105 Ca 0.06 0.05 0.00 0.00 0.00 0.00 0.00 57.00 57.12 1aj7 n GLN 105 Cb 0.57 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.31 1aj7 n GLN 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1aj7 n GLY 106 N 0.91 -0.22 2.97 2.61 0.00 -1.26 -5.03 105.19 105.16 1aj7 n GLY 106 Ca 0.11 -1.53 -0.27 0.00 0.00 0.00 0.00 46.02 44.33 1aj7 n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aj7 s THR 107 N -2.97 1.17 -0.32 2.61 2.01 0.10 -4.90 115.64 113.34 1aj7 s THR 107 Ca 0.00 -0.42 -0.22 0.00 0.31 0.00 0.00 61.69 61.36 1aj7 s THR 107 Cb 0.00 -1.13 -0.00 0.00 0.01 0.00 0.00 72.50 71.38 1aj7 s THR 107 CO 0.00 0.38 0.71 -0.89 -0.69 0.00 0.00 174.62 174.13 1aj7 s THR 108 N 1.33 4.85 -0.23 -0.82 2.01 -1.26 -0.53 115.64 120.99 1aj7 s THR 108 Ca -0.01 0.94 -0.06 0.00 0.31 0.00 0.00 61.69 62.87 1aj7 s THR 108 Cb -0.14 -4.09 -0.02 0.00 0.01 0.00 0.00 72.50 68.26 1aj7 s THR 108 CO -0.05 -0.25 0.03 -0.22 -0.69 0.00 0.00 174.62 173.45 1aj7 s LEU 109 N 2.82 3.30 -0.23 4.42 2.96 0.30 -1.82 118.68 130.42 1aj7 s LEU 109 Ca 0.29 -0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1aj7 s LEU 109 Cb -0.14 -1.86 0.01 0.00 0.50 0.00 0.00 46.19 44.70 1aj7 s LEU 109 CO 0.13 0.00 -0.06 -0.89 -1.32 0.00 0.00 176.35 174.21 1aj7 s THR 110 N 1.38 3.00 -0.22 3.68 2.01 -0.44 -1.63 115.64 123.42 1aj7 s THR 110 Ca 0.05 -0.82 -0.20 0.00 0.31 0.00 0.00 61.69 61.03 1aj7 s THR 110 Cb -0.15 -2.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.89 1aj7 s THR 110 CO 0.02 0.30 0.60 -0.69 -0.69 0.00 0.00 174.62 174.16 1aj7 s VAL 111 N 1.38 5.03 0.01 3.82 1.01 -1.26 -1.14 120.40 129.26 1aj7 s VAL 111 Ca 0.03 1.09 -0.27 0.00 0.00 0.00 0.00 61.98 62.83 1aj7 s VAL 111 Cb -0.15 -3.91 0.06 0.00 0.00 0.00 0.00 36.38 32.38 1aj7 s VAL 111 CO -0.05 0.09 0.61 -0.55 0.00 0.00 0.00 175.10 175.21 1aj7 s SER 112 N 1.32 -0.57 0.00 3.32 0.15 -0.07 -4.84 113.70 113.01 1aj7 s SER 112 Ca 0.26 0.44 0.26 0.00 0.70 0.00 0.00 55.95 57.62 1aj7 s SER 112 Cb -0.16 0.53 0.71 0.00 -1.71 0.00 0.00 66.02 65.39 1aj7 s SER 112 CO 0.09 -0.69 1.55 -1.20 1.20 0.00 0.00 173.24 174.19 1aj7 n SER 113 N 0.58 1.96 -4.95 5.45 7.64 -1.26 -3.65 113.62 119.38 1aj7 n SER 113 Ca -0.19 -1.61 -0.23 0.00 1.01 0.00 0.00 58.87 57.86 1aj7 n SER 113 Cb 0.59 0.03 0.04 0.00 -1.01 0.00 0.00 64.21 63.86 1aj7 n SER 113 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aj7 s ALA 114 N -2.06 3.64 0.28 -0.43 0.00 -1.26 -5.09 121.76 116.85 1aj7 s ALA 114 Ca 0.33 -1.13 -0.07 0.00 0.00 0.00 0.00 51.96 51.09 1aj7 s ALA 114 Cb 0.20 -2.26 -0.06 0.00 0.00 0.00 0.00 23.12 21.00 1aj7 s ALA 114 CO 0.35 -0.84 0.58 -1.12 0.00 0.00 0.00 175.76 174.73 1aj7 s SER 115 N -4.41 6.51 0.59 0.00 0.01 -1.26 -5.01 113.70 110.14 1aj7 s SER 115 Ca 0.56 0.83 -0.16 0.00 1.31 0.00 0.00 55.95 58.49 1aj7 s SER 115 Cb -0.10 -2.19 -0.04 0.00 0.21 0.00 0.00 66.02 63.90 1aj7 s SER 115 CO 0.40 -0.18 1.06 0.28 0.41 0.00 0.00 173.24 175.22 1aj7 s THR 116 N -2.03 3.73 -0.04 1.44 -1.32 -1.26 -4.84 115.64 111.32 1aj7 s THR 116 Ca 0.46 0.85 -0.01 0.00 -1.21 0.00 0.00 61.69 61.77 1aj7 s THR 116 Cb -0.11 -3.36 0.03 0.00 -1.51 0.00 0.00 72.50 67.55 1aj7 s THR 116 CO 0.27 -0.46 0.04 -0.54 -2.21 0.00 0.00 174.62 171.72 1aj7 s LYS 117 N -3.98 0.08 0.34 7.08 -0.14 0.22 -4.92 119.74 118.42 1aj7 s LYS 117 Ca 0.64 0.28 -0.26 0.00 -1.36 0.00 0.00 55.97 55.27 1aj7 s LYS 117 Cb -0.17 -0.55 -0.09 0.00 -1.68 0.00 0.00 37.83 35.34 1aj7 s LYS 117 CO 0.36 -0.28 1.00 0.20 -0.76 0.00 0.00 175.35 175.87 1aj7 s GLY 118 N 1.86 2.84 0.52 -3.33 0.00 -1.26 -1.64 107.32 106.31 1aj7 s GLY 118 Ca 0.01 0.64 -0.10 0.00 0.00 0.00 0.00 44.72 45.28 1aj7 s GLY 118 CO -0.03 1.11 0.90 2.56 0.00 0.00 0.00 173.10 177.64 1aj7 s PRO 119 N -2.06 3.66 -0.15 2.90 0.04 -1.26 -4.60 135.00 133.54 1aj7 s PRO 119 Ca 0.51 0.56 -0.06 0.00 0.04 0.00 0.00 61.00 62.05 1aj7 s PRO 119 Cb -0.22 -2.24 -0.04 0.00 0.04 0.00 0.00 34.50 32.04 1aj7 s PRO 119 CO 0.28 -0.32 0.07 -1.12 0.04 0.00 0.00 177.00 175.96 1aj7 s SER 120 N -3.81 5.75 -0.24 6.66 0.01 -0.08 -4.92 113.70 117.08 1aj7 s SER 120 Ca 0.52 0.18 -0.04 0.00 1.31 0.00 0.00 55.95 57.93 1aj7 s SER 120 Cb -0.10 -1.90 -0.00 0.00 0.21 0.00 0.00 66.02 64.22 1aj7 s SER 120 CO 0.44 0.26 -0.02 -0.69 0.41 0.00 0.00 173.24 173.64 1aj7 s VAL 121 N -0.16 3.49 0.06 3.43 1.01 -1.26 -1.26 120.40 125.71 1aj7 s VAL 121 Ca 0.08 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.58 1aj7 s VAL 121 Cb -0.12 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1aj7 s VAL 121 CO 0.01 0.35 -0.12 -0.36 0.00 0.00 0.00 175.10 174.98 1aj7 s PHE 122 N 1.48 2.72 0.36 5.22 0.08 -0.20 -4.93 117.98 122.71 1aj7 s PHE 122 Ca 0.05 -0.16 -0.19 0.00 0.12 0.00 0.00 56.93 56.75 1aj7 s PHE 122 Cb -0.15 -1.48 -0.10 0.00 -0.57 0.00 0.00 43.02 40.72 1aj7 s PHE 122 CO -0.02 0.36 0.85 -1.25 -0.10 0.00 0.00 175.22 175.06 1aj7 s PRO 123 N -1.79 4.19 -0.74 0.24 0.04 -1.26 -0.16 135.00 135.52 1aj7 s PRO 123 Ca 0.18 0.96 0.02 0.00 0.04 0.00 0.00 61.00 62.20 1aj7 s PRO 123 Cb -0.11 -2.40 0.18 0.00 0.04 0.00 0.00 34.50 32.22 1aj7 s PRO 123 CO 0.10 0.11 0.56 -0.51 0.04 0.00 0.00 177.00 177.29 1aj7 s LEU 124 N -2.88 5.05 0.31 -3.56 1.43 0.13 -4.81 118.68 114.36 1aj7 s LEU 124 Ca 0.56 -3.65 -0.29 0.00 -1.03 0.00 0.00 54.13 49.72 1aj7 s LEU 124 Cb -0.11 -1.75 -0.12 0.00 0.03 0.00 0.00 46.19 44.24 1aj7 s LEU 124 CO 0.16 -0.15 1.43 0.00 0.23 0.00 0.00 176.35 178.02 1aj7 n ALA 125 N 2.33 1.77 -1.78 4.21 0.00 -1.26 -0.94 120.51 124.83 1aj7 n ALA 125 Ca 0.18 0.37 -0.35 0.00 0.00 0.00 0.00 53.44 53.64 1aj7 n ALA 125 Cb 0.36 -2.34 -0.01 0.00 0.00 0.00 0.00 19.45 17.45 1aj7 n ALA 125 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1aj7 s PRO 126 N -1.22 3.51 -1.32 0.00 0.04 -1.24 -3.73 135.00 131.03 1aj7 s PRO 126 Ca 0.60 1.52 -0.04 0.00 0.04 0.00 0.00 61.00 63.12 1aj7 s PRO 126 Cb -0.55 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 31.97 1aj7 s PRO 126 CO 0.56 -0.70 0.91 0.43 0.04 0.00 0.00 177.00 178.24 1aj7 n SER 127 N -1.19 -2.84 0.00 6.66 7.64 -1.26 -4.55 113.62 118.07 1aj7 n SER 127 Ca 0.11 -0.71 0.00 0.00 1.01 0.00 0.00 58.87 59.28 1aj7 n SER 127 Cb 0.52 -4.49 0.00 0.00 -1.01 0.00 0.00 64.21 59.22 1aj7 n SER 127 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1aj7 n SER 128 N -3.03 0.00 -0.10 6.43 3.41 -1.24 -2.87 113.62 116.21 1aj7 n SER 128 Ca -0.19 0.07 -0.17 0.00 -0.26 0.00 0.00 58.87 58.33 1aj7 n SER 128 Cb 0.63 -0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 64.46 1aj7 n SER 128 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1aj7 n LYS 129 N -1.75 0.49 -3.84 4.33 2.85 -1.26 -4.94 118.16 114.04 1aj7 n LYS 129 Ca 0.00 0.14 -0.10 0.00 -1.05 0.00 0.00 58.31 57.31 1aj7 n LYS 129 Cb 0.00 -1.36 -0.06 0.00 -0.65 0.00 0.00 35.03 32.96 1aj7 n LYS 129 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 1aj7 s SER 130 N -6.24 -0.07 0.54 -5.58 0.01 -1.14 -5.12 113.70 96.11 1aj7 s SER 130 Ca -0.28 -0.65 -0.21 0.00 1.31 0.00 0.00 55.95 56.12 1aj7 s SER 130 Cb 0.08 0.46 -0.05 0.00 0.21 0.00 0.00 66.02 66.73 1aj7 s SER 130 CO 0.44 -0.90 1.23 -0.89 0.41 0.00 0.00 173.24 173.53 1aj7 s THR 131 N -3.90 2.65 0.70 1.44 2.01 -1.26 -4.59 115.64 112.69 1aj7 s THR 131 Ca 0.11 0.45 0.02 0.00 0.31 0.00 0.00 61.69 62.58 1aj7 s THR 131 Cb 0.02 -3.21 0.14 0.00 0.01 0.00 0.00 72.50 69.46 1aj7 s THR 131 CO -0.04 -0.05 0.97 -0.24 -0.69 0.00 0.00 174.62 174.57 1aj7 n SER 132 N -1.12 1.49 -3.79 3.53 2.88 -1.26 -4.97 113.62 110.37 1aj7 n SER 132 Ca 0.11 -2.21 -0.41 0.00 -1.33 0.00 0.00 58.87 55.03 1aj7 n SER 132 Cb 0.48 -0.61 -0.05 0.00 -0.75 0.00 0.00 64.21 63.28 1aj7 n SER 132 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1aj7 n GLY 133 N -2.57 2.57 1.00 0.46 0.00 -1.26 -4.41 105.19 100.97 1aj7 n GLY 133 Ca 0.17 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1aj7 n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1aj7 n GLY 134 N 4.68 2.55 3.90 -0.02 0.00 -1.26 -5.00 105.19 110.04 1aj7 n GLY 134 Ca 0.49 -0.56 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 1aj7 n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1aj7 s THR 135 N 0.00 5.10 0.09 2.61 -4.23 -1.26 -1.45 115.64 116.50 1aj7 s THR 135 Ca 0.00 -0.77 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 1aj7 s THR 135 Cb 0.00 -3.61 -0.03 0.00 1.34 0.00 0.00 72.50 70.19 1aj7 s THR 135 CO 0.00 -0.08 -0.09 0.00 -0.54 0.00 0.00 174.62 173.91 1aj7 s ALA 136 N -1.73 1.01 0.14 3.99 0.00 -0.11 -4.20 121.76 120.87 1aj7 s ALA 136 Ca 0.34 -1.14 0.10 0.00 0.00 0.00 0.00 51.96 51.26 1aj7 s ALA 136 Cb -0.11 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 1aj7 s ALA 136 CO 0.27 -0.05 -0.22 0.00 0.00 0.00 0.00 175.76 175.75 1aj7 s ALA 137 N -2.40 2.55 0.21 0.00 0.00 -1.26 -0.40 121.76 120.46 1aj7 s ALA 137 Ca 0.04 -1.47 -0.13 0.00 0.00 0.00 0.00 51.96 50.39 1aj7 s ALA 137 Cb -0.03 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.61 1aj7 s ALA 137 CO -0.01 0.53 0.45 -0.48 0.00 0.00 0.00 175.76 176.25 1aj7 s LEU 138 N -2.28 0.40 0.00 0.00 0.05 -0.30 -3.71 118.68 112.83 1aj7 s LEU 138 Ca 0.18 -0.79 0.00 0.00 0.05 0.00 0.00 54.13 53.57 1aj7 s LEU 138 Cb -0.10 1.75 0.00 0.00 -2.05 0.00 0.00 46.19 45.79 1aj7 s LEU 138 CO 0.09 -1.06 0.00 0.61 -0.55 0.00 0.00 176.35 175.44 1aj7 n GLY 139 N -0.33 -1.10 2.97 -3.48 0.00 -0.12 -0.12 105.19 103.02 1aj7 n GLY 139 Ca -0.05 -0.81 -0.16 0.00 0.00 0.00 0.00 46.02 45.00 1aj7 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aj7 s LEU 141 N -0.26 4.30 -0.50 0.00 2.96 0.77 -1.58 118.68 124.38 1aj7 s LEU 141 Ca 0.01 -0.68 -0.15 0.00 -0.22 0.00 0.00 54.13 53.09 1aj7 s LEU 141 Cb -0.03 -2.01 0.10 0.00 0.50 0.00 0.00 46.19 44.75 1aj7 s LEU 141 CO -0.00 -0.26 0.43 -0.69 -1.32 0.00 0.00 176.35 174.51 1aj7 s VAL 142 N 1.59 5.12 0.09 1.68 1.01 0.36 -1.03 120.40 129.22 1aj7 s VAL 142 Ca 0.04 -1.29 0.08 0.00 0.00 0.00 0.00 61.98 60.80 1aj7 s VAL 142 Cb -0.18 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 1aj7 s VAL 142 CO 0.06 -0.70 -0.16 -0.75 0.00 0.00 0.00 175.10 173.55 1aj7 s LYS 143 N 1.60 1.97 -0.88 2.72 2.20 -0.39 -0.72 119.74 126.24 1aj7 s LYS 143 Ca 0.04 -1.07 -0.03 0.00 -0.36 0.00 0.00 55.97 54.55 1aj7 s LYS 143 Cb -0.27 -2.20 -0.03 0.00 -1.51 0.00 0.00 37.83 33.83 1aj7 s LYS 143 CO 0.05 0.51 0.80 -0.25 -0.36 0.00 0.00 175.35 176.09 1aj7 n ASP 144 N 1.00 -7.28 -4.23 1.43 8.00 -0.47 -0.90 116.55 114.10 1aj7 n ASP 144 Ca -0.15 -0.36 -0.14 0.00 0.71 0.00 0.00 54.79 54.85 1aj7 n ASP 144 Cb 0.52 -5.25 -0.10 0.00 -0.02 0.00 0.00 41.12 36.27 1aj7 n ASP 144 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1aj7 s TYR 145 N -3.17 1.21 -0.26 1.24 1.13 -0.91 -3.99 117.35 112.60 1aj7 s TYR 145 Ca 0.21 -0.74 -0.18 0.00 -1.41 0.00 0.00 57.07 54.95 1aj7 s TYR 145 Cb -0.03 -0.63 0.07 0.00 -1.10 0.00 0.00 41.96 40.28 1aj7 s TYR 145 CO 0.75 0.05 0.65 0.12 -2.51 0.00 0.00 175.55 174.61 1aj7 s PHE 146 N -3.10 -0.90 0.00 -3.49 5.36 -0.65 -0.68 117.98 114.52 1aj7 s PHE 146 Ca 0.14 1.92 0.00 0.00 -0.96 0.00 0.00 56.93 58.03 1aj7 s PHE 146 Cb 0.01 0.46 0.00 0.00 -0.34 0.00 0.00 43.02 43.15 1aj7 s PHE 146 CO 0.00 -0.44 0.00 -0.35 -1.46 0.00 0.00 175.22 172.97 1aj7 n PRO 147 N 3.72 2.95 -2.75 10.12 -0.04 -1.26 -0.61 135.00 147.13 1aj7 n PRO 147 Ca -0.18 0.00 -0.26 0.00 -0.04 0.00 0.00 63.50 63.02 1aj7 n PRO 147 Cb 0.57 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.04 1aj7 n PRO 147 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1aj7 s GLU 148 N 2.43 3.29 0.28 0.54 2.02 -1.26 -4.82 118.70 121.19 1aj7 s GLU 148 Ca 0.00 -0.06 0.03 0.00 0.02 0.00 0.00 54.97 54.96 1aj7 s GLU 148 Cb 0.00 -2.43 0.03 0.00 0.10 0.00 0.00 34.13 31.83 1aj7 s GLU 148 CO 0.00 -0.29 0.25 -0.35 0.02 0.00 0.00 175.26 174.90 1aj7 n PRO 149 N -2.24 1.01 -4.31 0.39 -0.04 -1.26 -4.88 135.00 123.68 1aj7 n PRO 149 Ca 0.01 -1.70 -0.18 0.00 -0.04 0.00 0.00 63.50 61.59 1aj7 n PRO 149 Cb 0.56 0.11 -0.14 0.00 -0.04 0.00 0.00 33.50 34.00 1aj7 n PRO 149 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1aj7 s VAL 150 N -1.25 0.70 -0.18 0.52 0.11 -1.26 -4.55 120.40 114.49 1aj7 s VAL 150 Ca 0.19 -0.49 -0.09 0.00 -2.93 0.00 0.00 61.98 58.67 1aj7 s VAL 150 Cb -0.02 -0.61 -0.05 0.00 -1.53 0.00 0.00 36.38 34.18 1aj7 s VAL 150 CO 0.12 0.12 0.11 -0.89 -3.33 0.00 0.00 175.10 171.23 1aj7 s THR 151 N -0.37 5.24 -0.12 5.04 2.01 0.38 -4.95 115.64 122.87 1aj7 s THR 151 Ca 0.02 0.13 -0.00 0.00 0.31 0.00 0.00 61.69 62.14 1aj7 s THR 151 Cb -0.04 -3.36 0.03 0.00 0.01 0.00 0.00 72.50 69.13 1aj7 s THR 151 CO -0.00 0.48 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.64 1aj7 s VAL 152 N 0.08 1.12 0.40 3.82 1.01 -1.26 -0.77 120.40 124.80 1aj7 s VAL 152 Ca 0.08 -0.36 0.08 0.00 0.00 0.00 0.00 61.98 61.78 1aj7 s VAL 152 Cb -0.11 -1.13 -0.06 0.00 0.00 0.00 0.00 36.38 35.07 1aj7 s VAL 152 CO -0.00 0.37 0.07 -0.44 0.00 0.00 0.00 175.10 175.10 1aj7 s SER 153 N 1.67 4.12 -0.06 3.32 0.01 0.30 -4.93 113.70 118.13 1aj7 s SER 153 Ca 0.05 -1.20 0.01 0.00 1.31 0.00 0.00 55.95 56.13 1aj7 s SER 153 Cb -0.13 -0.45 0.02 0.00 0.21 0.00 0.00 66.02 65.67 1aj7 s SER 153 CO -0.09 -0.44 -0.08 0.26 0.41 0.00 0.00 173.24 173.30 1aj7 s TRP 154 N -2.64 1.13 -1.51 2.43 0.52 -1.26 -0.15 118.94 117.47 1aj7 s TRP 154 Ca 0.37 -0.40 -0.10 0.00 0.02 0.00 0.00 56.10 55.99 1aj7 s TRP 154 Cb 0.06 -0.90 0.07 0.00 -1.15 0.00 0.00 33.47 31.55 1aj7 s TRP 154 CO 0.20 -0.26 0.79 0.09 0.02 0.00 0.00 176.95 177.80 1aj7 n ASN 155 N 4.01 -3.04 -3.05 2.95 3.02 0.25 -1.25 115.26 118.15 1aj7 n ASN 155 Ca -0.23 -0.88 -0.21 0.00 -0.03 0.00 0.00 54.58 53.24 1aj7 n ASN 155 Cb 0.51 -3.52 0.01 0.00 -0.61 0.00 0.00 39.78 36.17 1aj7 n ASN 155 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1aj7 n SER 156 N -2.86 -4.46 0.00 6.41 7.64 -1.26 -1.16 113.62 117.92 1aj7 n SER 156 Ca -0.07 -0.23 0.00 0.00 1.01 0.00 0.00 58.87 59.58 1aj7 n SER 156 Cb 0.57 -3.68 0.00 0.00 -1.01 0.00 0.00 64.21 60.09 1aj7 n SER 156 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1aj7 n GLY 157 N -1.18 1.92 0.23 0.23 0.00 -0.38 -4.93 105.19 101.08 1aj7 n GLY 157 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.03 1aj7 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aj7 h ALA 158 N 0.00 1.30 -3.13 4.61 0.00 -1.05 -3.41 119.26 117.59 1aj7 h ALA 158 Ca 0.00 -0.21 -0.67 0.00 0.00 0.00 0.00 54.91 54.03 1aj7 h ALA 158 Cb 0.00 -0.04 -0.31 0.00 0.00 0.00 0.00 17.79 17.45 1aj7 h ALA 158 CO 0.00 0.29 -0.75 -1.17 0.00 0.00 0.00 179.25 177.61 1aj7 s LEU 159 N -7.60 2.93 0.00 0.00 2.96 -0.96 -4.90 118.68 111.11 1aj7 s LEU 159 Ca -0.02 -0.66 0.00 0.00 -0.22 0.00 0.00 54.13 53.22 1aj7 s LEU 159 Cb 0.13 -1.67 0.00 0.00 0.50 0.00 0.00 46.19 45.16 1aj7 s LEU 159 CO 0.65 -0.07 0.00 0.35 -1.32 0.00 0.00 176.35 175.96 1aj7 n THR 160 N 4.71 0.00 -2.02 3.68 -2.24 -1.26 -4.08 114.28 113.06 1aj7 n THR 160 Ca -0.18 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 1aj7 n THR 160 Cb 0.49 -0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.65 1aj7 n THR 160 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1aj7 s SER 161 N -0.94 6.68 -1.01 3.42 0.15 -1.26 -2.98 113.70 117.75 1aj7 s SER 161 Ca 0.00 2.53 0.00 0.00 0.70 0.00 0.00 55.95 59.18 1aj7 s SER 161 Cb 0.00 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 1aj7 s SER 161 CO 0.00 -0.75 0.00 0.61 1.20 0.00 0.00 173.24 174.30 1aj7 n GLY 162 N 3.46 1.09 3.81 9.45 0.00 -1.26 -4.76 105.19 116.99 1aj7 n GLY 162 Ca 0.12 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 1aj7 n GLY 162 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aj7 s VAL 163 N -2.27 4.81 -0.17 1.61 1.01 -1.16 -3.31 120.40 120.92 1aj7 s VAL 163 Ca 0.00 1.15 -0.03 0.00 0.00 0.00 0.00 61.98 63.10 1aj7 s VAL 163 Cb 0.00 -3.87 0.05 0.00 0.00 0.00 0.00 36.38 32.57 1aj7 s VAL 163 CO 0.00 0.55 0.03 -1.00 0.00 0.00 0.00 175.10 174.68 1aj7 s HIS 164 N -1.01 0.89 -0.39 5.22 3.76 0.04 -4.99 115.29 118.81 1aj7 s HIS 164 Ca 0.28 -0.69 -0.10 0.00 -0.15 0.00 0.00 55.06 54.41 1aj7 s HIS 164 Cb -0.19 -0.96 0.05 0.00 1.11 0.00 0.00 32.58 32.60 1aj7 s HIS 164 CO 0.18 -0.55 0.22 0.99 -0.85 0.00 0.00 174.74 174.73 1aj7 s THR 165 N 1.90 4.35 0.59 1.30 2.01 -1.26 -0.57 115.64 123.96 1aj7 s THR 165 Ca 0.00 -1.14 -0.17 0.00 0.31 0.00 0.00 61.69 60.70 1aj7 s THR 165 Cb -0.16 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 1aj7 s THR 165 CO -0.08 -0.36 1.10 -0.36 -0.69 0.00 0.00 174.62 174.23 1aj7 s PHE 166 N 1.48 2.76 0.45 4.92 0.08 -0.25 -4.99 117.98 122.42 1aj7 s PHE 166 Ca 0.02 1.54 -0.25 0.00 0.12 0.00 0.00 56.93 58.36 1aj7 s PHE 166 Cb -0.21 -3.16 -0.08 0.00 -0.57 0.00 0.00 43.02 39.00 1aj7 s PHE 166 CO 0.04 -1.44 1.36 -2.14 -0.10 0.00 0.00 175.22 172.95 1aj7 s PRO 167 N -3.76 3.71 0.48 0.24 0.02 -1.26 -4.49 135.00 129.93 1aj7 s PRO 167 Ca 0.68 2.27 -0.22 0.00 0.02 0.00 0.00 61.00 63.75 1aj7 s PRO 167 Cb -0.20 -2.62 -0.07 0.00 0.02 0.00 0.00 34.50 31.63 1aj7 s PRO 167 CO 0.34 -0.75 1.15 0.00 -0.33 0.00 0.00 177.00 177.41 1aj7 s ALA 168 N -1.25 2.92 0.02 -1.55 0.00 -1.26 -4.83 121.76 115.81 1aj7 s ALA 168 Ca 0.61 0.89 0.03 0.00 0.00 0.00 0.00 51.96 53.50 1aj7 s ALA 168 Cb -0.41 -3.37 -0.04 0.00 0.00 0.00 0.00 23.12 19.31 1aj7 s ALA 168 CO 0.52 -0.65 -0.04 0.14 0.00 0.00 0.00 175.76 175.72 1aj7 s VAL 169 N -1.61 3.81 -0.28 0.00 -7.23 0.15 -4.90 120.40 110.34 1aj7 s VAL 169 Ca 0.65 -0.80 -0.17 0.00 -1.81 0.00 0.00 61.98 59.86 1aj7 s VAL 169 Cb -0.27 -2.70 -0.03 0.00 0.56 0.00 0.00 36.38 33.94 1aj7 s VAL 169 CO 0.32 0.33 0.46 -0.22 -0.31 0.00 0.00 175.10 175.67 1aj7 s LEU 170 N -1.65 4.11 0.60 1.32 2.96 -1.26 -1.51 118.68 123.25 1aj7 s LEU 170 Ca 0.19 0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 54.33 1aj7 s LEU 170 Cb -0.11 -2.55 -0.00 0.00 0.50 0.00 0.00 46.19 44.03 1aj7 s LEU 170 CO 0.10 -0.29 0.94 -1.10 -1.32 0.00 0.00 176.35 174.68 1aj7 s GLN 171 N 2.23 3.10 0.62 1.98 -0.21 0.15 -4.95 119.66 122.57 1aj7 s GLN 171 Ca 0.18 0.22 0.32 0.00 0.02 0.00 0.00 55.36 56.10 1aj7 s GLN 171 Cb -0.16 -2.21 1.74 0.00 1.00 0.00 0.00 33.01 33.38 1aj7 s GLN 171 CO 0.10 -0.67 1.97 0.77 -2.12 0.00 0.00 175.29 175.35 1aj7 h SER 172 N -0.22 0.00 0.99 5.90 0.02 -1.98 0.15 113.55 118.41 1aj7 h SER 172 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1aj7 h SER 172 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 1aj7 h SER 172 CO 0.62 0.00 -0.10 -1.54 -1.14 0.00 0.00 176.83 174.66 1aj7 n SER 173 N -2.83 0.23 0.00 3.07 3.41 -1.26 -4.89 113.62 111.35 1aj7 n SER 173 Ca -0.02 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 1aj7 n SER 173 Cb 0.27 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 1aj7 n SER 173 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1aj7 n GLY 174 N 1.46 0.73 3.88 5.00 0.00 0.04 -5.06 105.19 111.25 1aj7 n GLY 174 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1aj7 n GLY 174 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aj7 s LEU 175 N 0.00 4.19 0.44 0.99 1.02 -1.25 -4.87 118.68 119.19 1aj7 s LEU 175 Ca 0.00 0.18 -0.00 0.00 0.02 0.00 0.00 54.13 54.32 1aj7 s LEU 175 Cb 0.00 -2.81 -0.01 0.00 0.02 0.00 0.00 46.19 43.38 1aj7 s LEU 175 CO 0.00 0.16 0.66 -0.31 0.02 0.00 0.00 176.35 176.89 1aj7 s TYR 176 N -1.49 3.32 -0.22 0.29 2.02 0.14 -0.67 117.35 120.74 1aj7 s TYR 176 Ca 0.33 0.34 -0.19 0.00 -0.37 0.00 0.00 57.07 57.18 1aj7 s TYR 176 Cb -0.13 -2.23 0.06 0.00 -0.40 0.00 0.00 41.96 39.26 1aj7 s TYR 176 CO 0.26 -0.26 0.58 0.45 -1.57 0.00 0.00 175.55 175.02 1aj7 s SER 177 N -4.17 -0.64 0.24 2.29 0.15 -0.57 -1.37 113.70 109.64 1aj7 s SER 177 Ca 0.46 1.19 -0.10 0.00 0.70 0.00 0.00 55.95 58.21 1aj7 s SER 177 Cb -0.10 1.18 -0.01 0.00 -1.71 0.00 0.00 66.02 65.38 1aj7 s SER 177 CO 0.38 -0.21 0.40 -1.48 1.20 0.00 0.00 173.24 173.53 1aj7 s LEU 178 N 0.54 0.54 0.04 3.45 0.05 0.10 -0.67 118.68 122.72 1aj7 s LEU 178 Ca -0.02 -1.06 0.02 0.00 0.05 0.00 0.00 54.13 53.12 1aj7 s LEU 178 Cb -0.05 1.43 -0.02 0.00 -2.05 0.00 0.00 46.19 45.50 1aj7 s LEU 178 CO -0.03 -1.08 -0.07 -0.94 -0.55 0.00 0.00 176.35 173.69 1aj7 s SER 179 N -3.06 0.73 -0.08 1.48 1.04 -1.26 -0.49 113.70 112.06 1aj7 s SER 179 Ca 0.27 -0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.21 1aj7 s SER 179 Cb 0.01 0.04 0.01 0.00 0.10 0.00 0.00 66.02 66.18 1aj7 s SER 179 CO 0.10 -0.20 -0.15 -0.55 0.98 0.00 0.00 173.24 173.42 1aj7 s SER 180 N -1.46 2.17 0.15 7.02 0.15 -0.61 -1.09 113.70 120.02 1aj7 s SER 180 Ca -0.10 -0.37 0.06 0.00 0.70 0.00 0.00 55.95 56.23 1aj7 s SER 180 Cb -0.09 -0.99 -0.04 0.00 -1.71 0.00 0.00 66.02 63.18 1aj7 s SER 180 CO 0.00 0.05 -0.13 0.68 1.20 0.00 0.00 173.24 175.05 1aj7 s VAL 181 N 0.67 1.37 0.01 4.45 -7.23 0.27 -0.73 120.40 119.21 1aj7 s VAL 181 Ca -0.14 -1.99 -0.00 0.00 -1.81 0.00 0.00 61.98 58.03 1aj7 s VAL 181 Cb -0.16 -1.80 -0.01 0.00 0.56 0.00 0.00 36.38 34.97 1aj7 s VAL 181 CO 0.04 -0.60 -0.00 -0.69 -0.31 0.00 0.00 175.10 173.53 1aj7 s VAL 182 N -2.86 0.04 -0.16 1.32 1.01 0.83 -0.78 120.40 119.80 1aj7 s VAL 182 Ca 0.16 -0.32 -0.04 0.00 0.00 0.00 0.00 61.98 61.78 1aj7 s VAL 182 Cb -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.24 1aj7 s VAL 182 CO 0.03 -0.17 -0.02 -0.89 0.00 0.00 0.00 175.10 174.05 1aj7 s THR 183 N -0.51 4.02 0.25 3.92 2.01 -1.21 -1.15 115.64 122.98 1aj7 s THR 183 Ca -0.06 -0.31 0.01 0.00 0.31 0.00 0.00 61.69 61.65 1aj7 s THR 183 Cb -0.03 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.66 1aj7 s THR 183 CO -0.00 0.49 0.13 0.68 -0.69 0.00 0.00 174.62 175.23 1aj7 s VAL 184 N 0.39 0.27 0.31 3.82 -7.23 0.46 -4.84 120.40 113.59 1aj7 s VAL 184 Ca -0.03 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 57.85 1aj7 s VAL 184 Cb -0.14 -2.55 -0.10 0.00 0.56 0.00 0.00 36.38 34.15 1aj7 s VAL 184 CO 0.02 0.00 1.30 -2.84 -0.31 0.00 0.00 175.10 173.27 1aj7 s PRO 185 N -3.99 4.38 0.32 4.82 0.02 -1.26 -0.94 135.00 138.35 1aj7 s PRO 185 Ca 0.38 2.17 0.17 0.00 0.02 0.00 0.00 61.00 63.74 1aj7 s PRO 185 Cb 0.06 -3.10 0.26 0.00 0.02 0.00 0.00 34.50 31.75 1aj7 s PRO 185 CO 0.15 -0.18 1.54 0.66 -0.33 0.00 0.00 177.00 178.84 1aj7 h SER 186 N 3.74 0.00 0.33 2.53 4.64 -1.54 -3.28 113.55 119.96 1aj7 h SER 186 Ca -0.48 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.79 1aj7 h SER 186 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 1aj7 h SER 186 CO 0.68 0.44 -0.22 0.77 -0.87 0.00 0.00 176.83 177.63 1aj7 h SER 187 N 0.00 0.00 -0.55 4.97 4.64 -1.91 -3.03 113.55 117.67 1aj7 h SER 187 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1aj7 h SER 187 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1aj7 h SER 187 CO 0.06 0.22 0.00 -1.54 -0.87 0.00 0.00 176.83 174.69 1aj7 n SER 188 N -3.99 4.85 0.30 4.97 3.41 -1.24 -4.54 113.62 117.38 1aj7 n SER 188 Ca -0.02 -2.66 0.18 0.00 -0.26 0.00 0.00 58.87 56.11 1aj7 n SER 188 Cb 0.29 -0.59 1.01 0.00 -0.26 0.00 0.00 64.21 64.67 1aj7 n SER 188 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1aj7 h LEU 189 N 3.61 0.00 -0.33 1.04 3.38 -1.68 -0.26 115.31 121.06 1aj7 h LEU 189 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1aj7 h LEU 189 Cb 1.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.33 1aj7 h LEU 189 CO 0.30 0.00 -0.52 0.61 0.09 0.00 0.00 178.44 178.92 1aj7 n GLY 190 N -1.24 -0.77 0.03 0.83 0.00 -1.26 -4.44 105.19 98.34 1aj7 n GLY 190 Ca -0.02 -0.47 -0.02 0.00 0.00 0.00 0.00 46.02 45.51 1aj7 n GLY 190 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1aj7 n THR 191 N -0.97 0.35 -3.81 2.61 -2.24 -0.24 -5.04 114.28 104.94 1aj7 n THR 191 Ca 0.08 -0.26 -0.28 0.00 -2.27 0.00 0.00 64.05 61.32 1aj7 n THR 191 Cb 0.36 -0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.04 1aj7 n THR 191 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1aj7 s GLN 192 N -2.26 3.49 -0.12 -0.78 -1.52 -0.45 -5.10 119.66 112.91 1aj7 s GLN 192 Ca -0.03 -0.40 0.01 0.00 -1.95 0.00 0.00 55.36 52.98 1aj7 s GLN 192 Cb 0.03 -2.92 -0.01 0.00 -0.22 0.00 0.00 33.01 29.89 1aj7 s GLN 192 CO 0.29 0.49 -0.16 0.99 -0.25 0.00 0.00 175.29 176.65 1aj7 s THR 193 N -1.73 2.77 -0.15 -0.19 2.01 -1.26 -4.87 115.64 112.22 1aj7 s THR 193 Ca 0.37 -0.76 0.01 0.00 0.31 0.00 0.00 61.69 61.61 1aj7 s THR 193 Cb -0.12 -2.14 0.02 0.00 0.01 0.00 0.00 72.50 70.27 1aj7 s THR 193 CO 0.28 0.53 -0.15 -0.31 -0.69 0.00 0.00 174.62 174.28 1aj7 s TYR 194 N 0.36 2.26 -0.05 4.92 2.02 -1.26 -4.95 117.35 120.65 1aj7 s TYR 194 Ca -0.13 -1.27 0.01 0.00 -0.37 0.00 0.00 57.07 55.31 1aj7 s TYR 194 Cb -0.16 -1.64 0.02 0.00 -0.40 0.00 0.00 41.96 39.77 1aj7 s TYR 194 CO 0.06 -0.68 -0.07 0.96 -1.57 0.00 0.00 175.55 174.25 1aj7 s ILE 195 N 1.43 0.73 0.01 2.71 -4.36 -1.26 -0.53 121.20 119.92 1aj7 s ILE 195 Ca 0.04 -0.23 -0.15 0.00 -0.26 0.00 0.00 60.65 60.05 1aj7 s ILE 195 Cb -0.13 -0.72 -0.06 0.00 1.25 0.00 0.00 42.46 42.81 1aj7 s ILE 195 CO -0.11 0.27 0.41 0.00 0.24 0.00 0.00 174.94 175.76 1aj7 s ASN 197 N -1.11 5.31 -0.10 0.00 0.02 0.79 -1.50 114.94 118.35 1aj7 s ASN 197 Ca 0.24 -1.36 -0.04 0.00 -1.02 0.00 0.00 52.86 50.68 1aj7 s ASN 197 Cb -0.17 -1.86 -0.04 0.00 0.02 0.00 0.00 41.25 39.20 1aj7 s ASN 197 CO 0.14 -0.39 0.06 -0.69 0.02 0.00 0.00 177.10 176.24 1aj7 s VAL 198 N 1.35 4.86 -0.11 1.60 1.01 0.13 -0.54 120.40 128.70 1aj7 s VAL 198 Ca 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.90 1aj7 s VAL 198 Cb -0.21 -3.08 0.05 0.00 0.00 0.00 0.00 36.38 33.15 1aj7 s VAL 198 CO 0.01 0.61 0.22 0.21 0.00 0.00 0.00 175.10 176.15 1aj7 s ASN 199 N -0.95 0.28 -0.46 3.32 3.84 0.05 -0.52 114.94 120.50 1aj7 s ASN 199 Ca 0.14 0.48 0.03 0.00 0.21 0.00 0.00 52.86 53.72 1aj7 s ASN 199 Cb -0.12 0.47 0.12 0.00 -0.55 0.00 0.00 41.25 41.18 1aj7 s ASN 199 CO 0.03 -0.22 0.20 -2.28 -2.79 0.00 0.00 177.10 172.05 1aj7 s HIS 200 N 2.01 3.42 0.21 0.43 5.65 0.93 -0.47 115.29 127.47 1aj7 s HIS 200 Ca -0.02 -3.05 -0.10 0.00 0.25 0.00 0.00 55.06 52.15 1aj7 s HIS 200 Cb -0.12 -2.91 0.26 0.00 -1.18 0.00 0.00 32.58 28.63 1aj7 s HIS 200 CO -0.08 -0.83 1.77 0.87 -0.65 0.00 0.00 174.74 175.82 1aj7 h LYS 201 N 6.99 0.49 -0.55 2.88 1.79 -1.80 -1.85 116.57 124.52 1aj7 h LYS 201 Ca -0.06 -0.03 0.16 0.00 -2.18 0.00 0.00 60.65 58.54 1aj7 h LYS 201 Cb 0.95 -0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.47 1aj7 h LYS 201 CO 0.63 0.32 0.51 -1.35 -1.08 0.00 0.00 179.45 178.48 1aj7 h PRO 202 N 0.50 0.00 -0.10 3.15 0.11 -1.87 -0.49 132.00 133.30 1aj7 h PRO 202 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 1aj7 h PRO 202 Cb 0.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1aj7 h PRO 202 CO -0.25 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.41 1aj7 n SER 203 N -3.88 2.03 -3.14 -2.05 3.41 -1.08 -4.81 113.62 104.11 1aj7 n SER 203 Ca 0.11 -1.70 -0.23 0.00 -0.26 0.00 0.00 58.87 56.78 1aj7 n SER 203 Cb 0.72 -0.06 0.03 0.00 -0.26 0.00 0.00 64.21 64.64 1aj7 n SER 203 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1aj7 n ASN 204 N 0.06 -5.75 -4.66 4.04 3.02 -0.19 -4.88 115.26 106.90 1aj7 n ASN 204 Ca 0.04 -0.33 -0.37 0.00 -0.03 0.00 0.00 54.58 53.89 1aj7 n ASN 204 Cb 0.25 -4.65 -0.09 0.00 -0.61 0.00 0.00 39.78 34.68 1aj7 n ASN 204 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1aj7 s THR 205 N -3.16 5.29 -0.09 3.41 2.01 -0.75 -4.98 115.64 117.37 1aj7 s THR 205 Ca 0.35 0.40 -0.01 0.00 0.31 0.00 0.00 61.69 62.74 1aj7 s THR 205 Cb -0.16 -3.60 0.03 0.00 0.01 0.00 0.00 72.50 68.78 1aj7 s THR 205 CO 0.43 0.30 -0.03 -0.75 -0.69 0.00 0.00 174.62 173.88 1aj7 s LYS 206 N 1.21 0.96 0.02 4.92 2.20 -1.26 -0.05 119.74 127.74 1aj7 s LYS 206 Ca 0.12 -0.05 0.04 0.00 -0.36 0.00 0.00 55.97 55.73 1aj7 s LYS 206 Cb -0.14 -1.25 -0.02 0.00 -1.51 0.00 0.00 37.83 34.92 1aj7 s LYS 206 CO 0.06 -0.30 -0.13 0.08 -0.36 0.00 0.00 175.35 174.70 1aj7 s VAL 207 N 1.87 0.98 -0.17 4.02 1.01 0.32 -5.01 120.40 123.42 1aj7 s VAL 207 Ca 0.05 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.25 1aj7 s VAL 207 Cb -0.13 -0.87 0.04 0.00 0.00 0.00 0.00 36.38 35.42 1aj7 s VAL 207 CO -0.06 0.09 -0.09 -1.81 0.00 0.00 0.00 175.10 173.23 1aj7 s ASP 208 N -0.78 2.99 -0.16 3.32 1.01 -1.26 0.20 116.67 122.00 1aj7 s ASP 208 Ca 0.02 -0.70 0.01 0.00 0.71 0.00 0.00 52.55 52.59 1aj7 s ASP 208 Cb -0.06 -1.09 0.01 0.00 1.01 0.00 0.00 42.92 42.79 1aj7 s ASP 208 CO 0.00 -0.14 -0.18 -0.75 0.21 0.00 0.00 175.17 174.31 1aj7 s LYS 209 N 1.52 3.11 -0.09 8.23 2.47 -0.56 -4.96 119.74 129.45 1aj7 s LYS 209 Ca 0.01 -0.80 -0.29 0.00 -1.56 0.00 0.00 55.97 53.34 1aj7 s LYS 209 Cb -0.15 -2.57 -0.02 0.00 -1.46 0.00 0.00 37.83 33.64 1aj7 s LYS 209 CO -0.08 -0.05 0.96 0.21 0.16 0.00 0.00 175.35 176.54 1aj7 s LYS 210 N 0.95 4.43 -0.32 4.03 2.20 -1.26 -0.81 119.74 128.96 1aj7 s LYS 210 Ca -0.03 1.31 -0.07 0.00 -0.36 0.00 0.00 55.97 56.81 1aj7 s LYS 210 Cb -0.15 -3.53 0.02 0.00 -1.51 0.00 0.00 37.83 32.67 1aj7 s LYS 210 CO -0.04 -0.25 0.11 0.08 -0.36 0.00 0.00 175.35 174.90 1aj7 s VAL 211 N 1.78 4.04 0.13 4.02 1.01 0.30 -4.95 120.40 126.73 1aj7 s VAL 211 Ca 0.47 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.62 1aj7 s VAL 211 Cb -0.18 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1aj7 s VAL 211 CO 0.19 -0.06 -0.04 -1.83 0.00 0.00 0.00 175.10 173.36 1aj7 s GLU 212 N 1.48 0.93 0.18 2.72 -1.05 -1.26 -4.33 118.70 117.37 1aj7 s GLU 212 Ca 0.01 -1.41 -0.31 0.00 -0.15 0.00 0.00 54.97 53.12 1aj7 s GLU 212 Cb -0.18 -0.22 -0.09 0.00 -0.44 0.00 0.00 34.13 33.20 1aj7 s GLU 212 CO 0.03 -0.06 1.47 -2.14 0.95 0.00 0.00 175.26 175.51 1aj7 s PRO 213 N -3.87 4.27 0.26 -4.83 0.02 -1.26 -4.55 135.00 125.03 1aj7 s PRO 213 Ca 0.16 2.25 -0.18 0.00 0.02 0.00 0.00 61.00 63.25 1aj7 s PRO 213 Cb 0.06 -3.16 -0.09 0.00 0.02 0.00 0.00 34.50 31.33 1aj7 s PRO 213 CO -0.02 -0.48 0.74 -1.59 -0.33 0.00 0.00 177.00 175.32 1aj7 s LYS 214 N 0.57 4.19 0.44 5.54 -2.85 -1.26 -5.05 119.74 121.31 1aj7 s LYS 214 Ca 0.64 0.82 -0.22 0.00 -1.00 0.00 0.00 55.97 56.22 1aj7 s LYS 214 Cb -0.41 -2.74 -0.09 0.00 -2.06 0.00 0.00 37.83 32.53 1aj7 s LYS 214 CO 0.35 0.32 1.03 -1.12 0.10 0.00 0.00 175.35 176.03 1aj7 s SER 215 N -1.84 6.64 0.00 0.03 0.01 -1.26 -5.10 113.70 112.18 1aj7 s SER 215 Ca 0.47 1.93 0.00 0.00 1.31 0.00 0.00 55.95 59.66 1aj7 s SER 215 Cb -0.15 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.51 1aj7 s SER 215 CO 0.20 -0.57 0.00 0.00 0.41 0.00 0.00 173.24 173.28