#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2df7 n PRO 13 N 0.00 -0.06 -0.08 5.55 -0.02 -1.26 -0.48 135.00 138.65 2df7 n PRO 13 Ca 0.00 0.71 -0.07 0.00 -2.02 0.00 0.00 63.50 62.12 2df7 n PRO 13 Cb 0.00 -1.06 -0.00 0.00 -0.02 0.00 0.00 33.50 32.42 2df7 n PRO 13 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2df7 h PHE 14 N 0.00 0.06 -0.68 6.00 3.57 -1.93 0.16 116.94 124.12 2df7 h PHE 14 Ca 0.20 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.72 2df7 h PHE 14 Cb 0.31 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 2df7 h PHE 14 CO -0.37 -0.00 0.43 0.82 -2.23 0.00 0.00 178.31 176.96 2df7 h ILE 15 N 0.14 1.18 -0.55 1.41 1.08 -1.14 0.16 117.51 119.79 2df7 h ILE 15 Ca 0.14 -0.36 -0.06 0.00 -0.39 0.00 0.00 64.86 64.19 2df7 h ILE 15 Cb 0.16 0.20 -0.02 0.00 -3.07 0.00 0.00 36.82 34.08 2df7 h ILE 15 CO -0.20 0.18 0.11 -0.09 -0.69 0.00 0.00 178.15 177.47 2df7 h ARG 16 N 0.93 0.90 -0.26 2.37 2.43 -0.96 -1.50 114.38 118.29 2df7 h ARG 16 Ca 0.25 -0.23 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 2df7 h ARG 16 Cb -0.08 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 2df7 h ARG 16 CO -0.05 0.85 -0.12 1.03 -1.51 0.00 0.00 179.97 180.18 2df7 h SER 17 N 0.79 0.55 0.14 -3.80 0.87 -0.05 0.81 113.55 112.87 2df7 h SER 17 Ca 0.17 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 2df7 h SER 17 Cb 0.37 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 2df7 h SER 17 CO 0.01 0.83 -0.14 0.25 -0.53 0.00 0.00 176.83 177.25 2df7 h LEU 18 N 0.27 -0.37 0.00 2.23 5.85 -0.56 -1.01 115.31 121.72 2df7 h LEU 18 Ca 0.06 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 2df7 h LEU 18 Cb 0.62 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.77 2df7 h LEU 18 CO 0.04 -0.21 -0.33 -0.07 -0.34 0.00 0.00 178.44 177.52 2df7 h LEU 19 N -0.31 0.00 -6.01 2.25 3.38 -1.31 -3.38 115.31 109.93 2df7 h LEU 19 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.42 2df7 h LEU 19 Cb 0.29 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.65 2df7 h LEU 19 CO -0.04 0.15 -1.04 0.23 0.09 0.00 0.00 178.44 177.83 2df7 n MET 20 N -3.06 1.03 -0.29 1.13 2.81 0.28 -4.98 117.12 114.04 2df7 n MET 20 Ca 0.02 -3.46 0.31 0.00 -1.81 0.00 0.00 57.70 52.75 2df7 n MET 20 Cb 0.60 -1.43 0.68 0.00 -0.71 0.00 0.00 33.22 32.35 2df7 n MET 20 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 2df7 h PRO 21 N 3.87 0.11 0.00 0.03 0.11 -1.35 -0.02 132.00 134.75 2df7 h PRO 21 Ca 0.09 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.20 2df7 h PRO 21 Cb 0.85 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2df7 h PRO 21 CO 0.52 0.07 0.00 0.25 -0.21 0.00 0.00 178.00 178.63 2df7 n THR 22 N -4.32 1.10 1.62 -1.15 -2.24 -1.26 -1.80 114.28 106.23 2df7 n THR 22 Ca 0.24 0.36 0.15 0.00 -2.27 0.00 0.00 64.05 62.53 2df7 n THR 22 Cb 1.09 -1.25 0.72 0.00 -2.10 0.00 0.00 70.33 68.79 2df7 n THR 22 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2df7 n THR 23 N -1.88 0.00 0.00 4.28 -2.24 -0.02 -5.03 114.28 109.39 2df7 n THR 23 Ca 0.02 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 2df7 n THR 23 Cb 0.14 -0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 2df7 n THR 23 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2df7 n GLY 24 N 1.17 1.80 3.94 3.38 0.00 -0.75 -5.03 105.19 109.71 2df7 n GLY 24 Ca 0.18 -2.21 -0.24 0.00 0.00 0.00 0.00 46.02 43.76 2df7 n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2df7 s PRO 25 N -1.60 2.40 0.03 1.61 0.04 -1.26 -4.59 135.00 131.62 2df7 s PRO 25 Ca 0.00 -0.41 -0.28 0.00 0.04 0.00 0.00 61.00 60.35 2df7 s PRO 25 Cb 0.00 -2.29 0.07 0.00 0.04 0.00 0.00 34.50 32.32 2df7 s PRO 25 CO 0.00 -0.99 0.66 0.00 0.04 0.00 0.00 177.00 176.71 2df7 s ALA 26 N -3.05 -1.71 0.34 8.56 0.00 -1.26 -4.95 121.76 119.69 2df7 s ALA 26 Ca 0.58 1.01 -0.26 0.00 0.00 0.00 0.00 51.96 53.30 2df7 s ALA 26 Cb -0.11 0.32 -0.10 0.00 0.00 0.00 0.00 23.12 23.24 2df7 s ALA 26 CO 0.42 -0.53 0.98 -1.12 0.00 0.00 0.00 175.76 175.52 2df7 s SER 27 N -1.80 7.20 0.02 0.00 0.01 -1.26 -4.92 113.70 112.94 2df7 s SER 27 Ca -0.06 1.91 -0.30 0.00 1.31 0.00 0.00 55.95 58.81 2df7 s SER 27 Cb -0.00 -2.58 -0.06 0.00 0.21 0.00 0.00 66.02 63.58 2df7 s SER 27 CO 0.01 -0.17 1.52 -0.63 0.41 0.00 0.00 173.24 174.37 2df7 s ILE 28 N -1.60 3.45 -0.04 1.44 1.01 -1.26 -4.75 121.20 119.45 2df7 s ILE 28 Ca 0.52 0.83 -0.05 0.00 0.00 0.00 0.00 60.65 61.95 2df7 s ILE 28 Cb -0.20 -3.54 -0.22 0.00 0.01 0.00 0.00 42.46 38.52 2df7 s ILE 28 CO 0.26 -0.01 3.05 -0.81 0.00 0.00 0.00 174.94 177.43 2df7 n PRO 29 N 5.64 1.68 0.00 2.79 -0.04 -1.26 -4.84 135.00 138.96 2df7 n PRO 29 Ca 0.15 -0.85 0.00 0.00 -0.04 0.00 0.00 63.50 62.76 2df7 n PRO 29 Cb 0.42 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 2df7 n PRO 29 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2df7 n ASP 30 N 2.63 0.34 -1.02 3.54 5.68 -1.26 -4.40 116.55 122.06 2df7 n ASP 30 Ca 0.36 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.74 2df7 n ASP 30 Cb 0.74 0.00 0.23 0.00 -1.14 0.00 0.00 41.12 40.95 2df7 n ASP 30 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2df7 n ASP 31 N 0.00 3.43 -3.66 -1.12 8.00 -1.26 -4.72 116.55 117.21 2df7 n ASP 31 Ca 0.00 -1.98 -0.41 0.00 0.71 0.00 0.00 54.79 53.11 2df7 n ASP 31 Cb 0.00 -0.34 -0.00 0.00 -0.02 0.00 0.00 41.12 40.75 2df7 n ASP 31 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2df7 n THR 32 N 1.16 4.11 -2.05 -3.53 -1.04 -1.26 -4.93 114.28 106.75 2df7 n THR 32 Ca 0.18 -3.51 -0.27 0.00 -2.04 0.00 0.00 64.05 58.41 2df7 n THR 32 Cb 0.53 -2.47 -0.05 0.00 -1.82 0.00 0.00 70.33 66.52 2df7 n THR 32 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2df7 s LEU 33 N 0.56 3.15 0.09 -4.42 1.43 -1.26 -4.96 118.68 113.27 2df7 s LEU 33 Ca 0.50 -0.82 0.09 0.00 -1.03 0.00 0.00 54.13 52.87 2df7 s LEU 33 Cb 0.14 -2.56 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 2df7 s LEU 33 CO -0.06 -2.80 -0.23 -1.61 0.23 0.00 0.00 176.35 171.88 2df7 s GLU 34 N 6.94 1.72 -0.04 1.70 2.02 -1.26 -5.07 118.70 124.72 2df7 s GLU 34 Ca 0.70 -1.18 -0.30 0.00 0.02 0.00 0.00 54.97 54.21 2df7 s GLU 34 Cb -0.06 -2.03 -0.04 0.00 0.10 0.00 0.00 34.13 32.10 2df7 s GLU 34 CO 0.01 0.49 1.29 0.15 0.02 0.00 0.00 175.26 177.23 2df7 s LYS 35 N -1.78 4.31 0.25 1.61 1.02 -1.26 -4.35 119.74 119.55 2df7 s LYS 35 Ca 0.15 1.80 -0.01 0.00 0.02 0.00 0.00 55.97 57.93 2df7 s LYS 35 Cb -0.10 -3.58 0.00 0.00 -0.52 0.00 0.00 37.83 33.63 2df7 s LYS 35 CO 0.06 -0.52 0.34 -2.39 -0.92 0.00 0.00 175.35 171.92 2df7 n HIS 36 N 5.38 -1.11 -4.25 3.18 1.44 0.25 -4.64 115.22 115.46 2df7 n HIS 36 Ca 0.12 -1.72 -0.15 0.00 -2.01 0.00 0.00 57.72 53.96 2df7 n HIS 36 Cb 0.45 0.38 -0.10 0.00 0.12 0.00 0.00 29.99 30.84 2df7 n HIS 36 CO 0.00 0.00 0.00 -0.08 -2.81 0.00 0.00 176.34 173.45 2df7 s THR 37 N -2.73 1.26 -0.11 0.61 -1.32 -0.48 -1.19 115.64 111.67 2df7 s THR 37 Ca 0.22 -1.98 -0.02 0.00 -1.21 0.00 0.00 61.69 58.70 2df7 s THR 37 Cb -0.01 -1.77 -0.03 0.00 -1.51 0.00 0.00 72.50 69.19 2df7 s THR 37 CO 0.15 -0.65 -0.04 -0.76 -2.21 0.00 0.00 174.62 171.12 2df7 s LEU 38 N -2.99 3.28 0.04 9.08 1.43 -1.26 -0.79 118.68 127.48 2df7 s LEU 38 Ca 0.15 -0.04 -0.06 0.00 -1.03 0.00 0.00 54.13 53.14 2df7 s LEU 38 Cb 0.00 -1.76 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 2df7 s LEU 38 CO 0.02 0.28 0.12 -0.13 0.23 0.00 0.00 176.35 176.86 2df7 s ARG 39 N -0.28 0.63 -0.06 1.70 1.81 -0.68 -4.99 118.95 117.09 2df7 s ARG 39 Ca 0.05 -0.76 0.06 0.00 -1.72 0.00 0.00 55.73 53.36 2df7 s ARG 39 Cb -0.13 0.25 -0.01 0.00 -0.45 0.00 0.00 34.95 34.61 2df7 s ARG 39 CO 0.02 -0.17 -0.25 -1.12 -0.68 0.00 0.00 175.30 173.11 2df7 s SER 40 N -2.20 3.09 -0.09 0.23 0.01 -1.26 -0.46 113.70 113.03 2df7 s SER 40 Ca -0.04 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.74 2df7 s SER 40 Cb -0.00 -0.81 0.02 0.00 0.21 0.00 0.00 66.02 65.43 2df7 s SER 40 CO -0.05 0.25 -0.13 -1.61 0.41 0.00 0.00 173.24 172.12 2df7 s GLU 41 N -0.20 1.86 0.58 12.44 0.41 0.19 -4.95 118.70 129.02 2df7 s GLU 41 Ca -0.02 -0.44 -0.07 0.00 -0.41 0.00 0.00 54.97 54.03 2df7 s GLU 41 Cb -0.13 -1.60 -0.00 0.00 -1.78 0.00 0.00 34.13 30.61 2df7 s GLU 41 CO 0.03 -0.05 0.91 0.95 -0.49 0.00 0.00 175.26 176.61 2df7 s THR 42 N 0.93 3.94 -0.06 3.63 -4.23 -1.26 -0.84 115.64 117.75 2df7 s THR 42 Ca -0.09 0.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.57 2df7 s THR 42 Cb -0.15 -3.56 0.02 0.00 1.34 0.00 0.00 72.50 70.16 2df7 s THR 42 CO 0.00 -0.60 -0.03 -0.44 -0.54 0.00 0.00 174.62 173.01 2df7 s SER 43 N -4.27 1.20 -0.04 3.99 0.01 -0.36 0.24 113.70 114.46 2df7 s SER 43 Ca 0.53 -0.12 -0.02 0.00 1.31 0.00 0.00 55.95 57.65 2df7 s SER 43 Cb -0.11 -0.47 0.03 0.00 0.21 0.00 0.00 66.02 65.69 2df7 s SER 43 CO 0.46 -0.10 0.07 0.42 0.41 0.00 0.00 173.24 174.51 2df7 s THR 44 N 1.27 -0.12 -0.01 1.44 -4.23 -1.26 -0.70 115.64 112.02 2df7 s THR 44 Ca -0.05 0.37 -0.01 0.00 -1.18 0.00 0.00 61.69 60.81 2df7 s THR 44 Cb -0.14 -0.17 0.00 0.00 1.34 0.00 0.00 72.50 73.54 2df7 s THR 44 CO -0.02 0.16 0.04 -0.31 -0.54 0.00 0.00 174.62 173.94 2df7 s TYR 45 N 1.97 -0.03 -0.46 3.99 1.51 -0.09 -4.99 117.35 119.26 2df7 s TYR 45 Ca 0.02 0.07 -0.00 0.00 -1.01 0.00 0.00 57.07 56.15 2df7 s TYR 45 Cb -0.12 0.00 0.12 0.00 -0.11 0.00 0.00 41.96 41.85 2df7 s TYR 45 CO -0.04 -0.04 0.23 -0.80 -1.11 0.00 0.00 175.55 173.80 2df7 s ASN 46 N -0.09 4.98 0.09 2.29 0.01 -1.26 -0.19 114.94 120.78 2df7 s ASN 46 Ca -0.01 -2.41 -0.18 0.00 -0.71 0.00 0.00 52.86 49.55 2df7 s ASN 46 Cb -0.01 -1.76 -0.07 0.00 0.41 0.00 0.00 41.25 39.83 2df7 s ASN 46 CO 0.00 -0.41 0.56 -0.76 -1.51 0.00 0.00 177.10 174.98 2df7 s LEU 47 N 0.58 4.47 -0.20 0.60 1.43 0.14 -4.90 118.68 120.81 2df7 s LEU 47 Ca 0.12 1.21 -0.13 0.00 -1.03 0.00 0.00 54.13 54.31 2df7 s LEU 47 Cb -0.22 -3.00 -0.05 0.00 0.03 0.00 0.00 46.19 42.95 2df7 s LEU 47 CO -0.04 0.23 0.24 -0.89 0.23 0.00 0.00 176.35 176.12 2df7 s THR 48 N -1.21 5.32 0.10 5.49 2.01 -1.26 -0.38 115.64 125.71 2df7 s THR 48 Ca 0.31 0.41 -0.30 0.00 0.31 0.00 0.00 61.69 62.42 2df7 s THR 48 Cb -0.18 -3.58 -0.06 0.00 0.01 0.00 0.00 72.50 68.68 2df7 s THR 48 CO 0.19 0.37 1.20 -0.69 -0.69 0.00 0.00 174.62 174.99 2df7 s VAL 49 N 0.73 3.87 0.44 3.82 1.01 -0.54 -4.94 120.40 124.80 2df7 s VAL 49 Ca 0.13 1.41 -0.07 0.00 0.00 0.00 0.00 61.98 63.45 2df7 s VAL 49 Cb -0.13 -3.90 0.11 0.00 0.00 0.00 0.00 36.38 32.45 2df7 s VAL 49 CO 0.03 0.15 0.47 0.61 0.00 0.00 0.00 175.10 176.36 2df7 n GLY 50 N 2.88 -2.02 0.17 4.51 0.00 -1.26 -1.23 105.19 108.24 2df7 n GLY 50 Ca 0.07 -1.56 0.13 0.00 0.00 0.00 0.00 46.02 44.67 2df7 n GLY 50 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2df7 h ASP 51 N -1.26 0.00 0.79 1.61 3.04 -1.94 -2.72 116.42 115.95 2df7 h ASP 51 Ca -0.16 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.63 2df7 h ASP 51 Cb 0.48 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.77 2df7 h ASP 51 CO 0.11 0.00 -0.33 0.35 -2.04 0.00 0.00 179.24 177.33 2df7 n THR 52 N -2.51 0.10 -1.04 1.15 -2.24 -1.26 -4.85 114.28 103.63 2df7 n THR 52 Ca 0.02 -0.07 -0.01 0.00 -2.27 0.00 0.00 64.05 61.72 2df7 n THR 52 Cb 0.29 -0.11 -0.01 0.00 -2.10 0.00 0.00 70.33 68.40 2df7 n THR 52 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2df7 n GLY 53 N 1.46 0.48 3.24 3.38 0.00 -1.02 -4.59 105.19 108.14 2df7 n GLY 53 Ca 0.06 -0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 2df7 n GLY 53 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2df7 s SER 54 N -2.25 2.30 0.28 1.61 0.01 -1.26 -1.74 113.70 112.66 2df7 s SER 54 Ca 0.00 -0.61 -0.19 0.00 1.31 0.00 0.00 55.95 56.46 2df7 s SER 54 Cb 0.00 -0.14 0.06 0.00 0.21 0.00 0.00 66.02 66.16 2df7 s SER 54 CO 0.00 0.06 0.91 -0.83 0.41 0.00 0.00 173.24 173.79 2df7 s GLY 55 N -1.62 0.23 -0.05 3.44 0.00 -0.43 -1.54 107.32 107.35 2df7 s GLY 55 Ca 0.05 -0.53 -0.02 0.00 0.00 0.00 0.00 44.72 44.22 2df7 s GLY 55 CO 0.03 1.02 0.11 -2.27 0.00 0.00 0.00 173.10 171.98 2df7 s LEU 56 N -3.23 0.75 -0.18 0.66 2.96 0.12 -1.86 118.68 117.90 2df7 s LEU 56 Ca 0.18 0.21 -0.04 0.00 -0.22 0.00 0.00 54.13 54.26 2df7 s LEU 56 Cb -0.04 0.20 -0.03 0.00 0.50 0.00 0.00 46.19 46.83 2df7 s LEU 56 CO 0.08 -0.15 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.31 2df7 s ILE 57 N 1.26 3.92 -0.24 6.68 1.01 0.18 -0.61 121.20 133.40 2df7 s ILE 57 Ca -0.08 -0.33 -0.09 0.00 0.00 0.00 0.00 60.65 60.15 2df7 s ILE 57 Cb -0.12 -2.75 -0.04 0.00 0.01 0.00 0.00 42.46 39.56 2df7 s ILE 57 CO -0.05 0.45 0.12 -0.69 0.00 0.00 0.00 174.94 174.78 2df7 s VAL 58 N 0.76 4.90 0.07 2.92 1.01 0.69 -1.44 120.40 129.31 2df7 s VAL 58 Ca -0.01 0.02 0.05 0.00 0.00 0.00 0.00 61.98 62.04 2df7 s VAL 58 Cb -0.14 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 2df7 s VAL 58 CO 0.02 0.34 -0.02 -0.36 0.00 0.00 0.00 175.10 175.08 2df7 s PHE 59 N 1.30 2.96 -0.78 5.22 0.40 0.63 -0.85 117.98 126.87 2df7 s PHE 59 Ca 0.06 -0.03 0.02 0.00 -0.60 0.00 0.00 56.93 56.38 2df7 s PHE 59 Cb -0.15 -1.55 0.23 0.00 0.51 0.00 0.00 43.02 42.07 2df7 s PHE 59 CO 0.05 0.46 0.79 1.19 0.70 0.00 0.00 175.22 178.41 2df7 n PHE 60 N 0.76 3.55 -0.35 0.36 3.01 -0.59 -1.28 117.46 122.92 2df7 n PHE 60 Ca -0.12 -4.00 0.24 0.00 1.01 0.00 0.00 57.45 54.58 2df7 n PHE 60 Cb 0.52 -0.82 0.49 0.00 -0.01 0.00 0.00 39.48 39.66 2df7 n PHE 60 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2df7 h PRO 61 N 5.11 0.34 -0.67 -1.08 0.13 -1.82 -0.51 132.00 133.51 2df7 h PRO 61 Ca 0.18 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 2df7 h PRO 61 Cb 0.72 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2df7 h PRO 61 CO 0.88 0.23 0.00 0.41 -0.23 0.00 0.00 178.00 179.28 2df7 n GLY 62 N -1.36 2.48 3.68 1.56 0.00 -1.26 -4.85 105.19 105.44 2df7 n GLY 62 Ca 0.31 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 2df7 n GLY 62 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2df7 n PHE 63 N 1.21 2.58 -2.02 1.61 7.35 -0.20 -4.34 117.46 123.64 2df7 n PHE 63 Ca 0.24 -0.28 -0.42 0.00 -0.76 0.00 0.00 57.45 56.23 2df7 n PHE 63 Cb 0.78 -2.78 0.00 0.00 0.35 0.00 0.00 39.48 37.83 2df7 n PHE 63 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2df7 n PRO 64 N 6.65 3.01 -2.00 -7.13 -0.04 -1.26 -4.79 135.00 129.44 2df7 n PRO 64 Ca 0.19 -2.87 0.00 0.00 -0.04 0.00 0.00 63.50 60.77 2df7 n PRO 64 Cb 0.39 -3.31 0.00 0.00 -0.04 0.00 0.00 33.50 30.55 2df7 n PRO 64 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2df7 n GLY 65 N 4.33 -0.53 0.01 0.55 0.00 -1.26 -4.85 105.19 103.45 2df7 n GLY 65 Ca 0.50 -0.86 0.13 0.00 0.00 0.00 0.00 46.02 45.80 2df7 n GLY 65 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2df7 n SER 66 N 0.00 0.19 -4.60 1.61 7.64 -1.26 -4.80 113.62 112.39 2df7 n SER 66 Ca 0.00 0.15 -0.43 0.00 1.01 0.00 0.00 58.87 59.60 2df7 n SER 66 Cb 0.00 -0.23 -0.03 0.00 -1.01 0.00 0.00 64.21 62.94 2df7 n SER 66 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2df7 s ILE 67 N -2.93 4.55 -0.22 0.44 1.01 -1.26 -2.08 121.20 120.70 2df7 s ILE 67 Ca 0.15 1.22 0.08 0.00 0.00 0.00 0.00 60.65 62.09 2df7 s ILE 67 Cb 0.19 -4.36 -0.21 0.00 0.01 0.00 0.00 42.46 38.09 2df7 s ILE 67 CO 0.57 -0.58 -0.06 0.52 0.00 0.00 0.00 174.94 175.39 2df7 n VAL 68 N 6.04 1.47 -3.17 2.92 0.31 0.46 -4.72 118.33 121.65 2df7 n VAL 68 Ca 0.08 -0.69 0.00 0.00 -0.01 0.00 0.00 64.34 63.72 2df7 n VAL 68 Cb 0.48 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.33 2df7 n VAL 68 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2df7 n GLY 69 N 2.04 -1.20 3.13 2.92 0.00 -0.62 -1.55 105.19 109.91 2df7 n GLY 69 Ca -0.40 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.64 2df7 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2df7 s ALA 70 N -1.00 -0.59 -0.15 4.61 0.00 -0.03 0.39 121.76 124.99 2df7 s ALA 70 Ca 0.00 0.64 -0.05 0.00 0.00 0.00 0.00 51.96 52.55 2df7 s ALA 70 Cb 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 2df7 s ALA 70 CO 0.00 -0.12 0.02 -1.58 0.00 0.00 0.00 175.76 174.08 2df7 s HIS 71 N 0.03 3.17 -0.01 0.00 2.46 -0.07 -0.22 115.29 120.65 2df7 s HIS 71 Ca -0.01 0.01 0.05 0.00 0.47 0.00 0.00 55.06 55.57 2df7 s HIS 71 Cb -0.02 -1.96 -0.01 0.00 -0.13 0.00 0.00 32.58 30.46 2df7 s HIS 71 CO 0.00 0.20 -0.15 0.71 -2.47 0.00 0.00 174.74 173.03 2df7 s TYR 72 N 0.00 1.33 -0.00 3.88 1.51 0.22 -0.63 117.35 123.67 2df7 s TYR 72 Ca 0.04 -0.26 -0.01 0.00 -1.01 0.00 0.00 57.07 55.83 2df7 s TYR 72 Cb -0.13 -0.86 -0.04 0.00 -0.11 0.00 0.00 41.96 40.82 2df7 s TYR 72 CO 0.02 -0.03 0.11 0.95 -1.11 0.00 0.00 175.55 175.49 2df7 s THR 73 N -0.33 4.93 -0.13 -0.71 -4.23 -0.40 0.13 115.64 114.90 2df7 s THR 73 Ca 0.05 -0.36 -0.20 0.00 -1.18 0.00 0.00 61.69 60.01 2df7 s THR 73 Cb -0.06 -3.28 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 2df7 s THR 73 CO -0.01 0.33 0.55 -0.22 -0.54 0.00 0.00 174.62 174.73 2df7 s LEU 74 N -1.84 4.25 0.38 4.79 2.96 -0.59 -0.48 118.68 128.15 2df7 s LEU 74 Ca 0.25 0.87 -0.00 0.00 -0.22 0.00 0.00 54.13 55.02 2df7 s LEU 74 Cb -0.12 -2.80 -0.03 0.00 0.50 0.00 0.00 46.19 43.74 2df7 s LEU 74 CO 0.16 -0.09 0.60 -1.10 -1.32 0.00 0.00 176.35 174.61 2df7 s GLN 75 N 0.99 3.43 0.53 1.98 -0.21 0.55 -4.41 119.66 122.53 2df7 s GLN 75 Ca 0.28 -0.27 0.29 0.00 0.02 0.00 0.00 55.36 55.68 2df7 s GLN 75 Cb -0.16 -2.60 1.44 0.00 1.00 0.00 0.00 33.01 32.69 2df7 s GLN 75 CO 0.12 0.03 1.93 0.66 -2.12 0.00 0.00 175.29 175.91 2df7 h SER 76 N 0.62 0.01 0.00 5.90 4.64 -1.97 0.29 113.55 123.04 2df7 h SER 76 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2df7 h SER 76 Cb 1.22 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2df7 h SER 76 CO 0.61 0.01 0.00 -0.46 -0.87 0.00 0.00 176.83 176.11 2df7 n ASN 77 N -4.32 0.00 0.00 4.97 0.23 -1.26 -4.88 115.26 110.00 2df7 n ASN 77 Ca 0.15 -1.24 0.00 0.00 -0.53 0.00 0.00 54.58 52.96 2df7 n ASN 77 Cb 0.81 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.51 2df7 n ASN 77 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2df7 n GLY 78 N 0.83 1.04 3.93 4.83 0.00 0.10 -5.05 105.19 110.87 2df7 n GLY 78 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2df7 n GLY 78 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2df7 s ASN 79 N -2.89 6.39 0.37 1.61 0.01 -1.26 -4.83 114.94 114.34 2df7 s ASN 79 Ca 0.00 0.37 -0.10 0.00 -0.71 0.00 0.00 52.86 52.42 2df7 s ASN 79 Cb 0.00 -2.00 -0.06 0.00 0.41 0.00 0.00 41.25 39.60 2df7 s ASN 79 CO 0.00 0.01 0.72 -0.31 -1.51 0.00 0.00 177.10 176.01 2df7 s TYR 80 N -1.79 3.46 -0.06 2.20 1.51 -1.26 -0.33 117.35 121.10 2df7 s TYR 80 Ca 0.38 0.97 0.02 0.00 -1.01 0.00 0.00 57.07 57.42 2df7 s TYR 80 Cb -0.11 -2.37 0.02 0.00 -0.11 0.00 0.00 41.96 39.38 2df7 s TYR 80 CO 0.28 -0.03 -0.08 0.21 -1.11 0.00 0.00 175.55 174.82 2df7 s LYS 81 N -3.72 1.24 0.26 -0.62 2.20 0.37 -4.61 119.74 114.87 2df7 s LYS 81 Ca 0.50 -0.25 -0.30 0.00 -0.36 0.00 0.00 55.97 55.56 2df7 s LYS 81 Cb -0.10 -1.12 -0.10 0.00 -1.51 0.00 0.00 37.83 35.00 2df7 s LYS 81 CO 0.30 -0.04 1.45 0.12 -0.36 0.00 0.00 175.35 176.82 2df7 s PHE 82 N 0.82 2.98 -0.01 4.03 5.36 -1.26 -1.28 117.98 128.62 2df7 s PHE 82 Ca -0.12 1.04 -0.02 0.00 -0.96 0.00 0.00 56.93 56.87 2df7 s PHE 82 Cb -0.15 -3.84 -0.01 0.00 -0.34 0.00 0.00 43.02 38.69 2df7 s PHE 82 CO 0.02 -2.70 -0.03 -3.47 -1.46 0.00 0.00 175.22 167.57 2df7 n ASP 83 N 2.16 0.22 -3.64 6.13 2.03 0.20 -4.88 116.55 118.77 2df7 n ASP 83 Ca 0.06 0.04 -0.05 0.00 0.52 0.00 0.00 54.79 55.36 2df7 n ASP 83 Cb 0.40 -0.41 -0.02 0.00 -0.72 0.00 0.00 41.12 40.37 2df7 n ASP 83 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2df7 s GLN 84 N -1.21 0.90 0.48 -0.67 -2.07 -1.17 -5.00 119.66 110.93 2df7 s GLN 84 Ca -0.03 -0.44 -0.13 0.00 -1.82 0.00 0.00 55.36 52.94 2df7 s GLN 84 Cb 0.00 0.35 -0.07 0.00 -1.09 0.00 0.00 33.01 32.20 2df7 s GLN 84 CO 0.04 -0.41 0.89 -1.64 -1.32 0.00 0.00 175.29 172.86 2df7 s MET 85 N -3.06 3.82 -0.22 9.60 -1.94 -1.26 -0.89 119.30 125.35 2df7 s MET 85 Ca 0.10 0.70 -0.02 0.00 -1.71 0.00 0.00 55.69 54.75 2df7 s MET 85 Cb -0.00 -2.24 0.01 0.00 2.01 0.00 0.00 34.83 34.60 2df7 s MET 85 CO -0.03 -0.21 -0.08 -0.51 -0.01 0.00 0.00 175.02 174.18 2df7 s LEU 86 N -4.13 2.81 0.00 -0.03 1.43 0.16 -4.88 118.68 114.04 2df7 s LEU 86 Ca 0.55 -0.59 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2df7 s LEU 86 Cb -0.10 -1.66 -0.00 0.00 0.03 0.00 0.00 46.19 44.46 2df7 s LEU 86 CO 0.34 -0.05 0.00 0.18 0.23 0.00 0.00 176.35 177.06 2df7 n LEU 87 N 4.72 0.00 -4.94 1.79 4.77 -1.26 -0.40 117.00 121.68 2df7 n LEU 87 Ca -0.18 -0.73 -0.24 0.00 -0.03 0.00 0.00 56.01 54.82 2df7 n LEU 87 Cb 0.50 0.09 0.02 0.00 -2.33 0.00 0.00 43.42 41.70 2df7 n LEU 87 CO 0.28 -0.10 0.40 0.42 -1.33 0.00 0.00 177.39 177.05 2df7 s THR 88 N -1.45 3.63 0.25 -5.08 -4.23 -0.88 -4.62 115.64 103.26 2df7 s THR 88 Ca 0.00 -0.32 -0.02 0.00 -1.18 0.00 0.00 61.69 60.16 2df7 s THR 88 Cb 0.00 -3.39 0.23 0.00 1.34 0.00 0.00 72.50 70.69 2df7 s THR 88 CO 0.00 -0.33 1.73 0.00 -0.54 0.00 0.00 174.62 175.49 2df7 h ALA 89 N 0.10 1.15 -2.18 3.99 0.00 -0.53 -3.42 119.26 118.38 2df7 h ALA 89 Ca -0.45 0.12 -0.57 0.00 0.00 0.00 0.00 54.91 54.00 2df7 h ALA 89 Cb 1.26 0.08 -0.14 0.00 0.00 0.00 0.00 17.79 18.99 2df7 h ALA 89 CO 0.58 -0.20 -0.74 1.14 0.00 0.00 0.00 179.25 180.03 2df7 s GLN 90 N -5.99 1.61 -0.71 0.00 -2.07 -1.26 -5.08 119.66 106.15 2df7 s GLN 90 Ca -0.12 -1.75 -0.24 0.00 -1.82 0.00 0.00 55.36 51.43 2df7 s GLN 90 Cb 0.21 -1.58 0.05 0.00 -1.09 0.00 0.00 33.01 30.61 2df7 s GLN 90 CO 0.77 0.26 1.12 1.21 -1.32 0.00 0.00 175.29 177.33 2df7 s ASN 91 N -3.47 6.19 0.26 12.60 2.47 -1.26 -4.93 114.94 126.79 2df7 s ASN 91 Ca 0.28 -0.81 -0.02 0.00 0.42 0.00 0.00 52.86 52.74 2df7 s ASN 91 Cb -0.03 -2.48 0.53 0.00 -1.45 0.00 0.00 41.25 37.82 2df7 s ASN 91 CO 0.13 -1.60 1.70 -0.07 -3.72 0.00 0.00 177.10 173.54 2df7 h LEU 92 N 12.09 0.18 -2.46 3.21 3.38 -1.95 -1.14 115.31 128.63 2df7 h LEU 92 Ca -0.26 0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2df7 h LEU 92 Cb 1.06 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2df7 h LEU 92 CO 1.23 0.02 0.13 -0.65 0.09 0.00 0.00 178.44 179.26 2df7 h PRO 93 N 0.36 0.00 0.00 1.13 0.11 -1.82 0.14 132.00 131.92 2df7 h PRO 93 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.56 2df7 h PRO 93 Cb 0.77 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2df7 h PRO 93 CO -0.48 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.31 2df7 h ALA 94 N 1.73 1.00 0.00 -0.75 0.00 -1.58 -3.35 119.26 116.31 2df7 h ALA 94 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2df7 h ALA 94 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2df7 h ALA 94 CO 0.00 0.00 -0.53 0.43 0.00 0.00 0.00 179.25 179.15 2df7 n SER 95 N -2.45 2.64 -4.16 0.00 7.64 0.18 -4.99 113.62 112.49 2df7 n SER 95 Ca 0.04 -0.15 -0.13 0.00 1.01 0.00 0.00 58.87 59.64 2df7 n SER 95 Cb 0.39 0.82 -0.11 0.00 -1.01 0.00 0.00 64.21 64.30 2df7 n SER 95 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2df7 s TYR 96 N -1.35 0.94 -0.07 1.43 1.51 0.23 -1.19 117.35 118.84 2df7 s TYR 96 Ca 0.00 -0.72 0.11 0.00 -1.01 0.00 0.00 57.07 55.46 2df7 s TYR 96 Cb 0.00 -0.53 -0.17 0.00 -0.11 0.00 0.00 41.96 41.16 2df7 s TYR 96 CO 0.00 -0.06 0.15 0.09 -1.11 0.00 0.00 175.55 174.62 2df7 n ASN 97 N 0.50 2.17 -4.18 2.29 3.02 -0.49 -4.30 115.26 114.27 2df7 n ASN 97 Ca -0.16 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.24 2df7 n ASN 97 Cb 0.58 1.15 -0.11 0.00 -0.61 0.00 0.00 39.78 40.79 2df7 n ASN 97 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2df7 s TYR 98 N -2.55 1.12 0.10 3.10 1.51 -1.19 -1.00 117.35 118.43 2df7 s TYR 98 Ca -0.05 -0.59 -0.19 0.00 -1.01 0.00 0.00 57.07 55.23 2df7 s TYR 98 Cb 0.06 -0.61 0.05 0.00 -0.11 0.00 0.00 41.96 41.34 2df7 s TYR 98 CO 0.49 0.03 0.47 0.00 -1.11 0.00 0.00 175.55 175.43 2df7 s ARG 100 N -3.20 0.33 -0.08 0.00 0.52 -0.57 -0.14 118.95 115.80 2df7 s ARG 100 Ca -0.01 0.24 -0.23 0.00 -0.52 0.00 0.00 55.73 55.21 2df7 s ARG 100 Cb 0.00 0.15 -0.04 0.00 0.52 0.00 0.00 34.95 35.59 2df7 s ARG 100 CO -0.08 -0.05 0.66 -1.17 0.02 0.00 0.00 175.30 174.69 2df7 s LEU 101 N -0.10 4.30 -0.24 2.53 2.96 -1.26 -1.59 118.68 125.27 2df7 s LEU 101 Ca -0.02 1.12 -0.13 0.00 -0.22 0.00 0.00 54.13 54.88 2df7 s LEU 101 Cb -0.02 -3.02 -0.16 0.00 0.50 0.00 0.00 46.19 43.49 2df7 s LEU 101 CO 0.01 -0.11 -0.11 0.52 -1.32 0.00 0.00 176.35 175.34 2df7 n VAL 102 N 3.81 1.55 -3.53 1.68 0.31 0.84 -4.91 118.33 118.08 2df7 n VAL 102 Ca -0.02 -0.34 -0.08 0.00 -0.01 0.00 0.00 64.34 63.89 2df7 n VAL 102 Cb 0.51 -1.84 -0.02 0.00 -0.91 0.00 0.00 33.84 31.58 2df7 n VAL 102 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2df7 s SER 103 N -7.13 -0.32 -0.14 4.52 1.04 -1.18 -4.79 113.70 105.68 2df7 s SER 103 Ca -0.34 -0.01 -0.29 0.00 0.48 0.00 0.00 55.95 55.79 2df7 s SER 103 Cb 0.11 0.35 0.09 0.00 0.10 0.00 0.00 66.02 66.66 2df7 s SER 103 CO 0.56 -0.56 0.79 -0.60 0.98 0.00 0.00 173.24 174.40 2df7 s ARG 104 N -3.01 0.86 -0.11 4.02 3.52 -1.26 -0.74 118.95 122.24 2df7 s ARG 104 Ca 0.06 0.44 -0.18 0.00 -0.13 0.00 0.00 55.73 55.92 2df7 s ARG 104 Cb -0.01 0.41 0.04 0.00 -1.56 0.00 0.00 34.95 33.83 2df7 s ARG 104 CO -0.08 -0.22 0.45 -1.54 -0.81 0.00 0.00 175.30 173.10 2df7 s SER 105 N -0.68 -0.42 0.01 -2.12 1.04 -0.70 -1.22 113.70 109.62 2df7 s SER 105 Ca -0.05 0.67 0.01 0.00 0.48 0.00 0.00 55.95 57.05 2df7 s SER 105 Cb -0.02 0.72 -0.01 0.00 0.10 0.00 0.00 66.02 66.81 2df7 s SER 105 CO 0.05 -0.30 -0.03 -0.76 0.98 0.00 0.00 173.24 173.18 2df7 s LEU 106 N -0.37 2.10 0.08 2.42 1.43 -0.47 -0.87 118.68 123.00 2df7 s LEU 106 Ca -0.05 -0.22 0.09 0.00 -1.03 0.00 0.00 54.13 52.91 2df7 s LEU 106 Cb -0.03 -0.04 -0.03 0.00 0.03 0.00 0.00 46.19 46.11 2df7 s LEU 106 CO 0.03 -0.10 -0.23 0.42 0.23 0.00 0.00 176.35 176.70 2df7 s THR 107 N -0.60 2.46 -0.10 5.49 -4.23 0.48 0.34 115.64 119.48 2df7 s THR 107 Ca -0.05 -1.44 0.01 0.00 -1.18 0.00 0.00 61.69 59.02 2df7 s THR 107 Cb -0.04 -2.04 0.02 0.00 1.34 0.00 0.00 72.50 71.77 2df7 s THR 107 CO -0.00 0.25 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.54 2df7 s VAL 108 N -0.95 1.13 0.06 2.29 1.01 -0.06 -1.69 120.40 122.19 2df7 s VAL 108 Ca 0.14 -0.40 -0.27 0.00 0.00 0.00 0.00 61.98 61.45 2df7 s VAL 108 Cb -0.10 -1.10 0.07 0.00 0.00 0.00 0.00 36.38 35.25 2df7 s VAL 108 CO 0.05 0.37 0.64 0.00 0.00 0.00 0.00 175.10 176.17 2df7 s ARG 109 N 1.29 1.17 0.35 2.72 1.70 -0.89 -0.75 118.95 124.54 2df7 s ARG 109 Ca -0.02 -0.15 -0.26 0.00 -0.47 0.00 0.00 55.73 54.83 2df7 s ARG 109 Cb -0.14 0.54 -0.09 0.00 -0.57 0.00 0.00 34.95 34.69 2df7 s ARG 109 CO -0.04 -0.45 1.01 0.45 -1.08 0.00 0.00 175.30 175.18 2df7 s SER 110 N -2.07 7.08 0.00 -2.89 0.15 -0.31 -0.19 113.70 115.47 2df7 s SER 110 Ca -0.04 1.97 0.00 0.00 0.70 0.00 0.00 55.95 58.58 2df7 s SER 110 Cb -0.01 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.72 2df7 s SER 110 CO -0.03 -0.26 0.42 -1.54 1.20 0.00 0.00 173.24 173.03 2df7 n SER 111 N 0.35 0.76 -4.00 5.45 3.41 -0.48 -4.72 113.62 114.39 2df7 n SER 111 Ca 0.03 -1.13 -0.10 0.00 -0.26 0.00 0.00 58.87 57.41 2df7 n SER 111 Cb 0.49 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.38 2df7 n SER 111 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2df7 s THR 112 N -0.13 0.03 -0.27 6.66 2.01 -1.24 -4.96 115.64 117.74 2df7 s THR 112 Ca 0.00 -1.47 -0.02 0.00 0.31 0.00 0.00 61.69 60.51 2df7 s THR 112 Cb 0.00 -2.06 0.16 0.00 0.01 0.00 0.00 72.50 70.61 2df7 s THR 112 CO 0.00 -0.14 0.49 -1.48 -0.69 0.00 0.00 174.62 172.80 2df7 s LEU 113 N -3.01 -1.01 0.04 4.42 0.05 -1.26 -4.38 118.68 113.53 2df7 s LEU 113 Ca 0.22 0.58 0.02 0.00 0.05 0.00 0.00 54.13 54.99 2df7 s LEU 113 Cb 0.02 1.65 0.08 0.00 -2.05 0.00 0.00 46.19 45.89 2df7 s LEU 113 CO 0.05 -0.28 0.82 -0.81 -0.55 0.00 0.00 176.35 175.58 2df7 n PRO 114 N 5.40 0.01 0.00 1.48 -0.04 -1.26 -5.06 135.00 135.53 2df7 n PRO 114 Ca -0.03 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 2df7 n PRO 114 Cb 0.51 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 2df7 n PRO 114 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 2df7 n LEU 120 N -1.36 0.00 -3.15 1.53 7.94 -1.26 -5.14 117.00 115.57 2df7 n LEU 120 Ca -0.00 0.00 0.05 0.00 -1.11 0.00 0.00 56.01 54.94 2df7 n LEU 120 Cb 0.26 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.20 2df7 n LEU 120 CO 0.01 -0.18 0.31 0.54 -1.11 0.00 0.00 177.39 176.96 2df7 s ASN 121 N -1.38 -1.05 0.00 1.96 6.03 -1.26 -5.01 114.94 114.23 2df7 s ASN 121 Ca 0.00 0.45 0.00 0.00 -1.03 0.00 0.00 52.86 52.28 2df7 s ASN 121 Cb 0.00 1.80 0.00 0.00 -3.03 0.00 0.00 41.25 40.02 2df7 s ASN 121 CO 0.00 -0.20 0.00 0.61 -2.03 0.00 0.00 177.10 175.48 2df7 n GLY 122 N 5.40 2.28 3.16 0.45 0.00 -1.04 -4.22 105.19 111.22 2df7 n GLY 122 Ca 0.00 -1.96 -0.10 0.00 0.00 0.00 0.00 46.02 43.96 2df7 n GLY 122 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2df7 s THR 123 N -2.71 0.37 0.02 2.61 -4.23 -0.85 -1.84 115.64 109.01 2df7 s THR 123 Ca 0.00 -1.90 0.06 0.00 -1.18 0.00 0.00 61.69 58.67 2df7 s THR 123 Cb 0.00 -1.86 -0.02 0.00 1.34 0.00 0.00 72.50 71.96 2df7 s THR 123 CO 0.00 -0.68 -0.19 -0.63 -0.54 0.00 0.00 174.62 172.58 2df7 s ILE 124 N -3.85 1.49 -0.03 2.99 1.01 0.54 -1.88 121.20 121.46 2df7 s ILE 124 Ca 0.17 -1.02 0.05 0.00 0.00 0.00 0.00 60.65 59.85 2df7 s ILE 124 Cb 0.07 -1.28 -0.01 0.00 0.01 0.00 0.00 42.46 41.25 2df7 s ILE 124 CO -0.02 0.23 -0.19 0.20 0.00 0.00 0.00 174.94 175.16 2df7 s ASN 125 N -0.93 2.30 -0.01 3.58 0.01 -0.11 -1.26 114.94 118.52 2df7 s ASN 125 Ca 0.06 -0.37 -0.05 0.00 -0.71 0.00 0.00 52.86 51.80 2df7 s ASN 125 Cb -0.08 -0.46 -0.00 0.00 0.41 0.00 0.00 41.25 41.12 2df7 s ASN 125 CO 0.01 0.20 0.09 0.00 -1.51 0.00 0.00 177.10 175.89 2df7 s ALA 126 N -0.21 -0.21 -0.02 0.60 0.00 -0.20 -0.31 121.76 121.40 2df7 s ALA 126 Ca 0.02 -0.08 -0.20 0.00 0.00 0.00 0.00 51.96 51.69 2df7 s ALA 126 Cb -0.10 0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.08 2df7 s ALA 126 CO 0.01 -0.15 0.43 0.54 0.00 0.00 0.00 175.76 176.59 2df7 s VAL 127 N -0.93 0.04 -0.25 0.00 0.11 -0.68 -0.63 120.40 118.07 2df7 s VAL 127 Ca -0.10 -0.33 -0.04 0.00 -2.93 0.00 0.00 61.98 58.58 2df7 s VAL 127 Cb -0.06 -0.75 0.01 0.00 -1.53 0.00 0.00 36.38 34.04 2df7 s VAL 127 CO 0.01 -0.18 -0.02 -0.89 -3.33 0.00 0.00 175.10 170.69 2df7 s THR 128 N -1.36 3.37 -0.13 5.04 2.01 0.86 -0.78 115.64 124.65 2df7 s THR 128 Ca -0.12 -0.70 -0.08 0.00 0.31 0.00 0.00 61.69 61.10 2df7 s THR 128 Cb -0.03 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 2df7 s THR 128 CO 0.06 0.27 0.14 0.12 -0.69 0.00 0.00 174.62 174.52 2df7 s PHE 129 N 1.44 3.56 -1.53 4.92 5.36 0.11 -4.74 117.98 127.10 2df7 s PHE 129 Ca 0.03 0.50 0.00 0.00 -0.96 0.00 0.00 56.93 56.50 2df7 s PHE 129 Cb -0.16 -1.99 0.01 0.00 -0.34 0.00 0.00 43.02 40.54 2df7 s PHE 129 CO -0.02 0.64 0.77 1.04 -1.46 0.00 0.00 175.22 176.20 2df7 n GLN 130 N 2.30 1.02 -0.18 10.12 6.02 -1.26 -1.76 117.38 133.64 2df7 n GLN 130 Ca -0.19 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.78 2df7 n GLN 130 Cb 0.54 -1.24 0.00 0.00 1.02 0.00 0.00 30.24 30.57 2df7 n GLN 130 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2df7 n GLY 131 N 0.27 7.46 3.94 1.08 0.00 -1.26 -4.79 105.19 111.90 2df7 n GLY 131 Ca 0.00 -2.03 -0.19 0.00 0.00 0.00 0.00 46.02 43.81 2df7 n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2df7 s SER 132 N 0.82 5.40 0.20 1.61 1.04 -1.26 -3.55 113.70 117.96 2df7 s SER 132 Ca 0.00 -0.54 -0.21 0.00 0.48 0.00 0.00 55.95 55.67 2df7 s SER 132 Cb 0.00 -0.69 0.14 0.00 0.10 0.00 0.00 66.02 65.57 2df7 s SER 132 CO 0.00 -0.66 1.56 0.25 0.98 0.00 0.00 173.24 175.37 2df7 h LEU 133 N 0.86 -1.43 -0.38 2.42 5.85 -1.95 -0.50 115.31 120.19 2df7 h LEU 133 Ca -0.41 0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.58 2df7 h LEU 133 Cb 1.27 0.70 0.00 0.00 0.37 0.00 0.00 40.66 43.00 2df7 h LEU 133 CO 0.52 -0.30 0.00 -1.54 -0.34 0.00 0.00 178.44 176.78 2df7 n SER 134 N -5.43 0.25 0.02 1.25 3.41 -1.26 -2.30 113.62 109.55 2df7 n SER 134 Ca 0.06 0.58 0.13 0.00 -0.26 0.00 0.00 58.87 59.38 2df7 n SER 134 Cb 0.36 -0.62 0.42 0.00 -0.26 0.00 0.00 64.21 64.11 2df7 n SER 134 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2df7 n GLU 135 N -1.79 0.07 -1.95 4.33 1.02 -0.20 -4.86 120.64 117.26 2df7 n GLU 135 Ca 0.02 0.04 -0.41 0.00 -0.02 0.00 0.00 57.16 56.79 2df7 n GLU 135 Cb 0.13 -1.57 -0.01 0.00 -0.02 0.00 0.00 31.44 29.96 2df7 n GLU 135 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2df7 s LEU 136 N -3.37 4.37 0.10 -4.62 1.43 -0.97 -4.91 118.68 110.71 2df7 s LEU 136 Ca 0.12 2.83 0.23 0.00 -1.03 0.00 0.00 54.13 56.28 2df7 s LEU 136 Cb 0.17 -3.65 0.13 0.00 0.03 0.00 0.00 46.19 42.87 2df7 s LEU 136 CO 0.62 -0.73 1.11 0.35 0.23 0.00 0.00 176.35 177.93 2df7 n THR 137 N 1.26 0.31 -3.66 5.49 -2.24 -1.26 -4.85 114.28 109.33 2df7 n THR 137 Ca 0.03 -0.32 -0.06 0.00 -2.27 0.00 0.00 64.05 61.43 2df7 n THR 137 Cb 0.40 -0.01 -0.08 0.00 -2.10 0.00 0.00 70.33 68.54 2df7 n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2df7 s ASP 138 N -4.30 -0.55 -0.16 3.42 -1.08 -1.26 -5.04 116.67 107.70 2df7 s ASP 138 Ca 0.03 1.18 0.18 0.00 -0.52 0.00 0.00 52.55 53.42 2df7 s ASP 138 Cb 0.13 1.61 0.42 0.00 -1.46 0.00 0.00 42.92 43.62 2df7 s ASP 138 CO 0.77 -0.23 1.29 1.33 0.52 0.00 0.00 175.17 178.86 2df7 n VAL 139 N 5.34 2.11 -1.63 1.11 0.24 -1.26 -4.09 118.33 120.15 2df7 n VAL 139 Ca -0.10 -2.08 -0.31 0.00 -2.04 0.00 0.00 64.34 59.81 2df7 n VAL 139 Cb 0.50 -0.25 0.05 0.00 -1.47 0.00 0.00 33.84 32.67 2df7 n VAL 139 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2df7 s SER 140 N -2.39 5.41 0.20 -1.34 1.04 -1.26 -4.84 113.70 110.52 2df7 s SER 140 Ca 0.37 1.52 -0.15 0.00 0.48 0.00 0.00 55.95 58.18 2df7 s SER 140 Cb 0.31 -2.41 0.21 0.00 0.10 0.00 0.00 66.02 64.23 2df7 s SER 140 CO 0.06 -1.41 1.62 0.22 0.98 0.00 0.00 173.24 174.71 2df7 h TYR 141 N -0.70 -0.45 0.04 5.02 3.20 -1.96 -2.07 116.97 120.05 2df7 h TYR 141 Ca -0.44 0.06 -0.25 0.00 3.14 0.00 0.00 58.73 61.23 2df7 h TYR 141 Cb 1.22 0.29 -0.02 0.00 1.54 0.00 0.00 36.73 39.75 2df7 h TYR 141 CO 0.60 -0.29 -1.27 -0.91 -1.64 0.00 0.00 178.16 174.64 2df7 h ASN 142 N -0.04 0.13 -0.68 -2.11 2.35 -1.99 -3.34 115.58 109.90 2df7 h ASN 142 Ca 0.28 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 2df7 h ASN 142 Cb 0.48 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.77 2df7 h ASN 142 CO -0.64 1.14 0.42 1.23 -1.65 0.00 0.00 177.43 177.93 2df7 h GLY 143 N 2.65 0.99 -0.31 2.83 0.00 -1.80 -2.72 103.07 104.71 2df7 h GLY 143 Ca -0.12 -0.40 0.29 0.00 0.00 0.00 0.00 47.33 47.10 2df7 h GLY 143 CO 0.14 0.39 0.67 1.41 0.00 0.00 0.00 176.54 179.15 2df7 h LEU 144 N 0.95 0.46 -0.62 3.11 3.38 -1.51 -2.23 115.31 118.85 2df7 h LEU 144 Ca 0.25 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2df7 h LEU 144 Cb -0.05 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2df7 h LEU 144 CO -0.05 0.03 0.16 0.23 0.09 0.00 0.00 178.44 178.90 2df7 n MET 145 N -4.72 0.06 -0.01 1.13 2.81 -1.02 -0.86 117.12 114.51 2df7 n MET 145 Ca 0.28 0.50 0.06 0.00 -1.81 0.00 0.00 57.70 56.73 2df7 n MET 145 Cb 0.95 -1.86 0.06 0.00 -0.71 0.00 0.00 33.22 31.65 2df7 n MET 145 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2df7 n SER 146 N -1.81 2.04 0.17 7.83 7.64 -0.84 -4.59 113.62 124.07 2df7 n SER 146 Ca -0.01 -1.52 0.18 0.00 1.01 0.00 0.00 58.87 58.54 2df7 n SER 146 Cb 0.17 -0.01 0.80 0.00 -1.01 0.00 0.00 64.21 64.16 2df7 n SER 146 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2df7 h ALA 147 N 2.32 1.88 -2.53 -0.43 0.00 -1.14 -3.41 119.26 115.95 2df7 h ALA 147 Ca 0.00 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2df7 h ALA 147 Cb 0.51 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.14 2df7 h ALA 147 CO 0.00 -0.44 -0.69 -0.08 0.00 0.00 0.00 179.25 178.03 2df7 s THR 148 N -4.57 0.24 -0.89 0.00 -1.32 -1.26 -4.80 115.64 103.04 2df7 s THR 148 Ca -0.04 -1.50 0.23 0.00 -1.21 0.00 0.00 61.69 59.17 2df7 s THR 148 Cb 0.15 -1.08 -0.10 0.00 -1.51 0.00 0.00 72.50 69.95 2df7 s THR 148 CO 0.52 -0.80 1.14 0.00 -2.21 0.00 0.00 174.62 173.28 2df7 n ALA 149 N 0.64 3.89 -2.37 11.08 0.00 -1.26 -4.90 120.51 127.60 2df7 n ALA 149 Ca -0.17 -0.44 -0.43 0.00 0.00 0.00 0.00 53.44 52.39 2df7 n ALA 149 Cb 0.59 -0.97 -0.02 0.00 0.00 0.00 0.00 19.45 19.05 2df7 n ALA 149 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2df7 s ASN 150 N -3.26 6.72 0.55 0.00 0.01 -1.26 -4.90 114.94 112.80 2df7 s ASN 150 Ca 0.08 1.45 0.27 0.00 -0.71 0.00 0.00 52.86 53.95 2df7 s ASN 150 Cb 0.16 -2.54 1.58 0.00 0.41 0.00 0.00 41.25 40.86 2df7 s ASN 150 CO 0.78 -0.99 2.15 -0.29 -1.51 0.00 0.00 177.10 177.24 2df7 h ILE 151 N 5.82 0.61 -0.29 0.60 6.09 -1.93 -1.07 117.51 127.34 2df7 h ILE 151 Ca -0.28 -0.27 0.00 0.00 -1.37 0.00 0.00 64.86 62.94 2df7 h ILE 151 Cb 1.11 1.17 0.00 0.00 0.47 0.00 0.00 36.82 39.57 2df7 h ILE 151 CO 1.01 0.06 0.00 0.59 -3.07 0.00 0.00 178.15 176.74 2df7 n ASN 152 N -3.83 1.58 -0.10 2.19 3.02 -1.26 -3.67 115.26 113.19 2df7 n ASN 152 Ca -0.02 -2.00 0.07 0.00 -0.03 0.00 0.00 54.58 52.59 2df7 n ASN 152 Cb 0.16 -0.20 0.10 0.00 -0.61 0.00 0.00 39.78 39.23 2df7 n ASN 152 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2df7 n ASP 153 N 0.36 1.98 -3.86 6.41 10.43 -0.41 -2.18 116.55 129.28 2df7 n ASP 153 Ca 0.10 -2.73 -0.10 0.00 2.57 0.00 0.00 54.79 54.62 2df7 n ASP 153 Cb 0.25 -0.32 -0.09 0.00 1.84 0.00 0.00 41.12 42.80 2df7 n ASP 153 CO 0.00 0.00 0.00 -1.59 -1.07 0.00 0.00 177.20 174.54 2df7 s LYS 154 N -2.18 0.64 -0.20 -1.24 -2.85 -1.24 -0.10 119.74 112.58 2df7 s LYS 154 Ca 0.22 -0.61 -0.11 0.00 -1.00 0.00 0.00 55.97 54.47 2df7 s LYS 154 Cb 0.20 0.26 0.06 0.00 -2.06 0.00 0.00 37.83 36.29 2df7 s LYS 154 CO 0.02 -0.18 0.49 -1.50 0.10 0.00 0.00 175.35 174.28 2df7 s ILE 155 N -2.38 -0.02 0.00 3.79 1.10 0.20 -4.92 121.20 118.97 2df7 s ILE 155 Ca -0.07 0.06 0.08 0.00 -0.51 0.00 0.00 60.65 60.22 2df7 s ILE 155 Cb -0.02 -0.71 -0.02 0.00 0.15 0.00 0.00 42.46 41.85 2df7 s ILE 155 CO -0.03 0.03 -0.25 -0.83 -2.11 0.00 0.00 174.94 171.75 2df7 s GLY 156 N 1.40 1.35 -1.49 1.50 0.00 -1.26 -1.03 107.32 107.78 2df7 s GLY 156 Ca -0.09 -1.17 -0.08 0.00 0.00 0.00 0.00 44.72 43.38 2df7 s GLY 156 CO -0.14 -1.01 0.72 0.70 0.00 0.00 0.00 173.10 173.37 2df7 n ASN 157 N 2.14 -2.46 -4.78 1.64 3.02 -0.39 -4.97 115.26 109.47 2df7 n ASN 157 Ca -0.16 -0.91 -0.37 0.00 -0.03 0.00 0.00 54.58 53.10 2df7 n ASN 157 Cb 0.51 -3.41 -0.04 0.00 -0.61 0.00 0.00 39.78 36.23 2df7 n ASN 157 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2df7 s VAL 158 N -3.56 3.64 0.09 2.41 1.01 -0.53 -4.70 120.40 118.76 2df7 s VAL 158 Ca 0.37 1.35 -0.31 0.00 0.00 0.00 0.00 61.98 63.39 2df7 s VAL 158 Cb -0.19 -3.75 -0.07 0.00 0.00 0.00 0.00 36.38 32.37 2df7 s VAL 158 CO 0.87 0.10 1.31 -0.76 0.00 0.00 0.00 175.10 176.62 2df7 s LEU 159 N -2.34 4.37 0.46 3.92 1.43 -1.26 -0.34 118.68 124.92 2df7 s LEU 159 Ca 0.54 2.19 0.20 0.00 -1.03 0.00 0.00 54.13 56.03 2df7 s LEU 159 Cb -0.25 -3.58 1.18 0.00 0.03 0.00 0.00 46.19 43.57 2df7 s LEU 159 CO 0.31 -0.58 1.94 1.62 0.23 0.00 0.00 176.35 179.87 2df7 h VAL 160 N 4.39 0.76 -0.01 -1.59 3.04 -1.65 0.16 116.25 121.35 2df7 h VAL 160 Ca -0.42 -0.09 -0.09 0.00 -1.01 0.00 0.00 66.70 65.09 2df7 h VAL 160 Cb 1.21 0.47 -0.01 0.00 -2.01 0.00 0.00 31.29 30.95 2df7 h VAL 160 CO 0.84 0.05 -0.43 1.23 -1.01 0.00 0.00 177.57 178.26 2df7 h GLY 161 N 0.26 0.02 0.94 3.17 0.00 -1.84 -0.78 103.07 104.85 2df7 h GLY 161 Ca 0.34 -0.02 -0.25 0.00 0.00 0.00 0.00 47.33 47.40 2df7 h GLY 161 CO -0.08 0.02 -1.07 0.83 0.00 0.00 0.00 176.54 176.24 2df7 h GLU 162 N 0.02 0.42 0.00 4.80 5.08 -1.38 -3.42 114.58 120.10 2df7 h GLU 162 Ca -0.00 -0.69 0.00 0.00 -1.00 0.00 0.00 59.36 57.67 2df7 h GLU 162 Cb 0.76 0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2df7 h GLU 162 CO 0.06 1.32 0.00 0.41 -1.00 0.00 0.00 179.01 179.80 2df7 n GLY 163 N 1.62 0.03 3.23 -3.84 0.00 -0.45 -4.57 105.19 101.21 2df7 n GLY 163 Ca -0.15 -1.77 -0.25 0.00 0.00 0.00 0.00 46.02 43.86 2df7 n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2df7 s VAL 164 N -2.28 1.56 -0.12 1.61 1.01 0.07 -1.06 120.40 121.19 2df7 s VAL 164 Ca 0.00 -1.13 0.02 0.00 0.00 0.00 0.00 61.98 60.87 2df7 s VAL 164 Cb 0.00 -1.36 -0.00 0.00 0.00 0.00 0.00 36.38 35.02 2df7 s VAL 164 CO 0.00 0.19 -0.20 -0.89 0.00 0.00 0.00 175.10 174.21 2df7 s THR 165 N -0.78 2.39 -0.27 3.92 2.01 0.93 -0.89 115.64 122.96 2df7 s THR 165 Ca 0.06 -0.89 -0.13 0.00 0.31 0.00 0.00 61.69 61.05 2df7 s THR 165 Cb -0.08 -1.96 -0.04 0.00 0.01 0.00 0.00 72.50 70.42 2df7 s THR 165 CO 0.01 0.54 0.26 -0.69 -0.69 0.00 0.00 174.62 174.06 2df7 s VAL 166 N 0.52 5.26 -0.10 3.82 1.01 0.15 -0.20 120.40 130.86 2df7 s VAL 166 Ca -0.12 0.34 0.01 0.00 0.00 0.00 0.00 61.98 62.20 2df7 s VAL 166 Cb -0.17 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 2df7 s VAL 166 CO 0.05 0.22 -0.13 -0.22 0.00 0.00 0.00 175.10 175.01 2df7 s LEU 167 N 1.84 2.74 -0.27 3.92 2.96 0.13 -1.36 118.68 128.65 2df7 s LEU 167 Ca 0.10 -0.26 -0.21 0.00 -0.22 0.00 0.00 54.13 53.54 2df7 s LEU 167 Cb -0.16 -1.59 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 2df7 s LEU 167 CO 0.10 0.24 0.67 -0.55 -1.32 0.00 0.00 176.35 175.49 2df7 s SER 168 N -0.10 6.60 0.00 3.68 0.15 -0.36 -4.50 113.70 119.18 2df7 s SER 168 Ca -0.02 0.68 0.01 0.00 0.70 0.00 0.00 55.95 57.32 2df7 s SER 168 Cb -0.14 -2.36 -0.04 0.00 -1.71 0.00 0.00 66.02 61.78 2df7 s SER 168 CO 0.04 -0.44 0.05 -0.76 1.20 0.00 0.00 173.24 173.33 2df7 s LEU 169 N 2.62 3.74 0.52 3.45 1.43 -1.26 -4.58 118.68 124.60 2df7 s LEU 169 Ca 0.28 0.08 -0.21 0.00 -1.03 0.00 0.00 54.13 53.24 2df7 s LEU 169 Cb -0.15 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.81 2df7 s LEU 169 CO 0.09 0.27 1.03 -0.81 0.23 0.00 0.00 176.35 177.16 2df7 n PRO 170 N 1.22 1.20 -3.14 1.29 -0.04 -1.26 -4.96 135.00 129.31 2df7 n PRO 170 Ca -0.13 0.45 -0.25 0.00 -0.04 0.00 0.00 63.50 63.52 2df7 n PRO 170 Cb 0.53 -2.18 -0.05 0.00 -0.04 0.00 0.00 33.50 31.76 2df7 n PRO 170 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2df7 n THR 171 N -1.14 1.78 0.00 0.52 -2.24 -1.26 -5.03 114.28 106.91 2df7 n THR 171 Ca 0.11 -5.10 0.00 0.00 -2.27 0.00 0.00 64.05 56.79 2df7 n THR 171 Cb 0.44 -1.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.26 2df7 n THR 171 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2df7 n SER 172 N 0.33 -0.10 -4.11 3.42 2.88 -1.26 -4.80 113.62 109.98 2df7 n SER 172 Ca 0.28 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.58 2df7 n SER 172 Cb 0.47 0.26 -0.04 0.00 -0.75 0.00 0.00 64.21 64.15 2df7 n SER 172 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2df7 n TYR 173 N 1.14 0.44 -2.86 0.66 0.53 -1.26 -4.70 117.16 111.11 2df7 n TYR 173 Ca 0.00 -1.91 -0.22 0.00 -1.02 0.00 0.00 57.90 54.75 2df7 n TYR 173 Cb 0.00 -0.29 0.02 0.00 -1.03 0.00 0.00 39.34 38.05 2df7 n TYR 173 CO 0.00 0.00 0.00 -0.25 -1.02 0.00 0.00 176.86 175.59 2df7 n ASP 174 N -1.41 -6.12 -4.82 7.72 8.00 -1.26 -4.98 116.55 113.68 2df7 n ASP 174 Ca -0.12 -0.22 -0.35 0.00 0.71 0.00 0.00 54.79 54.81 2df7 n ASP 174 Cb 0.50 -4.98 -0.06 0.00 -0.02 0.00 0.00 41.12 36.55 2df7 n ASP 174 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2df7 s LEU 175 N -6.53 4.16 0.93 0.64 1.43 -1.26 -4.96 118.68 113.09 2df7 s LEU 175 Ca 0.23 1.55 -0.13 0.00 -1.03 0.00 0.00 54.13 54.75 2df7 s LEU 175 Cb -0.10 -4.07 0.15 0.00 0.03 0.00 0.00 46.19 42.20 2df7 s LEU 175 CO 0.28 -0.16 1.15 -0.83 0.23 0.00 0.00 176.35 177.02 2df7 s GLY 176 N -1.94 1.59 0.40 -3.19 0.00 -1.26 -4.92 107.32 97.99 2df7 s GLY 176 Ca 0.53 -0.60 -0.24 0.00 0.00 0.00 0.00 44.72 44.41 2df7 s GLY 176 CO 0.19 -0.01 1.02 -0.19 0.00 0.00 0.00 173.10 174.10 2df7 s TYR 177 N -3.32 3.32 -0.10 1.90 1.51 -1.26 -4.84 117.35 114.55 2df7 s TYR 177 Ca 0.65 1.66 -0.04 0.00 -1.01 0.00 0.00 57.07 58.33 2df7 s TYR 177 Cb -0.14 -3.05 -0.04 0.00 -0.11 0.00 0.00 41.96 38.63 2df7 s TYR 177 CO 0.53 -0.43 0.03 0.08 -1.11 0.00 0.00 175.55 174.66 2df7 s VAL 178 N -1.76 4.59 0.21 0.71 1.01 0.80 -4.84 120.40 121.12 2df7 s VAL 178 Ca 0.58 -0.14 -0.30 0.00 0.00 0.00 0.00 61.98 62.13 2df7 s VAL 178 Cb -0.19 -2.96 -0.08 0.00 0.00 0.00 0.00 36.38 33.15 2df7 s VAL 178 CO 0.24 0.59 1.13 -0.60 0.00 0.00 0.00 175.10 176.46 2df7 s ARG 179 N -0.74 4.57 0.00 2.72 6.06 -1.26 -0.73 118.95 129.57 2df7 s ARG 179 Ca 0.12 1.80 0.29 0.00 -2.50 0.00 0.00 55.73 55.43 2df7 s ARG 179 Cb -0.12 -3.24 1.20 0.00 0.06 0.00 0.00 34.95 32.86 2df7 s ARG 179 CO 0.02 0.06 1.83 1.28 -2.50 0.00 0.00 175.30 175.99 2df7 n LEU 180 N 2.07 0.91 -0.96 -0.88 4.77 -0.17 -2.71 117.00 120.02 2df7 n LEU 180 Ca 0.02 -0.25 -0.04 0.00 -0.03 0.00 0.00 56.01 55.71 2df7 n LEU 180 Cb 0.45 -0.06 0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2df7 n LEU 180 CO 0.55 0.16 0.03 0.61 -1.33 0.00 0.00 177.39 177.40 2df7 n GLY 181 N 1.19 0.61 3.81 -0.72 0.00 -0.28 -4.64 105.19 105.17 2df7 n GLY 181 Ca 0.18 -0.55 -0.34 0.00 0.00 0.00 0.00 46.02 45.31 2df7 n GLY 181 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2df7 s ASP 182 N -3.02 6.75 0.51 1.61 -4.77 -1.08 -4.63 116.67 112.03 2df7 s ASP 182 Ca 0.09 1.81 -0.22 0.00 -3.30 0.00 0.00 52.55 50.93 2df7 s ASP 182 Cb -0.04 -2.55 -0.06 0.00 -1.09 0.00 0.00 42.92 39.18 2df7 s ASP 182 CO 0.11 -0.49 1.23 -2.84 0.70 0.00 0.00 175.17 173.88 2df7 s PRO 183 N -3.06 3.43 0.23 2.11 0.02 -1.26 -0.74 135.00 135.73 2df7 s PRO 183 Ca 0.63 1.92 0.09 0.00 0.02 0.00 0.00 61.00 63.65 2df7 s PRO 183 Cb -0.13 -2.27 -0.04 0.00 0.02 0.00 0.00 34.50 32.07 2df7 s PRO 183 CO 0.17 -0.86 0.02 0.96 -0.33 0.00 0.00 177.00 176.96 2df7 s ILE 184 N -1.48 3.64 0.20 2.83 -4.36 0.39 -4.79 121.20 117.62 2df7 s ILE 184 Ca 0.68 -1.69 -0.32 0.00 -0.26 0.00 0.00 60.65 59.07 2df7 s ILE 184 Cb -0.32 -2.90 -0.12 0.00 1.25 0.00 0.00 42.46 40.37 2df7 s ILE 184 CO 0.38 -0.27 1.71 -2.84 0.24 0.00 0.00 174.94 174.15 2df7 s PRO 185 N -3.42 4.14 -0.22 0.37 0.02 -1.26 -4.80 135.00 129.84 2df7 s PRO 185 Ca 0.30 2.57 -0.27 0.00 0.02 0.00 0.00 61.00 63.62 2df7 s PRO 185 Cb -0.08 -3.11 0.12 0.00 0.02 0.00 0.00 34.50 31.45 2df7 s PRO 185 CO 0.20 -0.74 0.98 0.00 -0.33 0.00 0.00 177.00 177.11 2df7 s ALA 186 N 1.24 -1.93 0.05 -1.55 0.00 -1.26 -5.09 121.76 113.22 2df7 s ALA 186 Ca 0.74 1.73 0.07 0.00 0.00 0.00 0.00 51.96 54.50 2df7 s ALA 186 Cb -0.49 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 21.58 2df7 s ALA 186 CO 0.32 -0.28 -0.19 0.96 0.00 0.00 0.00 175.76 176.57 2df7 s ILE 187 N -0.40 1.57 0.08 0.00 -4.36 -1.26 -5.06 121.20 111.77 2df7 s ILE 187 Ca 0.00 -1.21 -0.20 0.00 -0.26 0.00 0.00 60.65 58.98 2df7 s ILE 187 Cb -0.03 -1.38 0.05 0.00 1.25 0.00 0.00 42.46 42.35 2df7 s ILE 187 CO -0.02 0.13 0.48 -0.83 0.24 0.00 0.00 174.94 174.95 2df7 s GLY 188 N -1.27 -0.39 0.38 6.27 0.00 -1.26 -5.03 107.32 106.02 2df7 s GLY 188 Ca 0.06 0.40 0.12 0.00 0.00 0.00 0.00 44.72 45.30 2df7 s GLY 188 CO 0.02 0.11 1.86 1.41 0.00 0.00 0.00 173.10 176.50 2df7 h LEU 189 N 2.64 0.06 -9.30 0.66 3.38 -2.02 -3.42 115.31 107.30 2df7 h LEU 189 Ca -0.32 -0.02 -0.56 0.00 0.09 0.00 0.00 57.88 57.08 2df7 h LEU 189 Cb 1.23 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.92 2df7 h LEU 189 CO 0.42 0.36 0.35 -0.62 0.09 0.00 0.00 178.44 179.05 2df7 s ASP 190 N -6.94 7.15 0.40 -0.43 -1.08 -1.26 -4.94 116.67 109.58 2df7 s ASP 190 Ca -0.04 1.40 0.16 0.00 -0.52 0.00 0.00 52.55 53.56 2df7 s ASP 190 Cb 0.15 -2.50 0.84 0.00 -1.46 0.00 0.00 42.92 39.94 2df7 s ASP 190 CO 0.73 -0.30 1.85 -0.65 0.52 0.00 0.00 175.17 177.31 2df7 h PRO 191 N 6.99 0.00 -0.36 4.34 0.11 -2.05 -2.39 132.00 138.65 2df7 h PRO 191 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2df7 h PRO 191 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2df7 h PRO 191 CO 0.80 0.33 0.00 1.63 -0.21 0.00 0.00 178.00 180.55 2df7 n LYS 192 N -3.91 1.62 -2.01 1.05 5.02 -1.26 -4.91 118.16 113.76 2df7 n LYS 192 Ca -0.02 -0.78 -0.41 0.00 -2.02 0.00 0.00 58.31 55.09 2df7 n LYS 192 Cb 0.40 -1.28 -0.02 0.00 -0.02 0.00 0.00 35.03 34.11 2df7 n LYS 192 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 2df7 s MET 193 N -1.67 4.27 -0.03 1.97 1.75 -0.90 -5.03 119.30 119.66 2df7 s MET 193 Ca 0.14 2.33 0.02 0.00 -1.25 0.00 0.00 55.69 56.94 2df7 s MET 193 Cb 0.08 -3.06 0.01 0.00 2.84 0.00 0.00 34.83 34.70 2df7 s MET 193 CO 0.08 -0.34 -0.09 0.08 -0.65 0.00 0.00 175.02 174.10 2df7 s VAL 194 N -0.78 0.80 -0.05 10.11 1.01 -1.26 -5.05 120.40 125.17 2df7 s VAL 194 Ca 0.53 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 62.15 2df7 s VAL 194 Cb -0.42 -0.72 0.03 0.00 0.00 0.00 0.00 36.38 35.27 2df7 s VAL 194 CO 0.52 0.26 0.04 0.00 0.00 0.00 0.00 175.10 175.92 2df7 s ALA 195 N 0.34 0.34 0.12 5.51 0.00 -1.26 -5.10 121.76 121.71 2df7 s ALA 195 Ca -0.06 0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.05 2df7 s ALA 195 Cb -0.10 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 2df7 s ALA 195 CO 0.01 -0.43 -0.07 0.95 0.00 0.00 0.00 175.76 176.22 2df7 s THR 196 N 1.97 0.87 -0.31 0.00 -4.23 -1.26 -0.46 115.64 112.22 2df7 s THR 196 Ca 0.03 -1.99 -0.08 0.00 -1.18 0.00 0.00 61.69 58.48 2df7 s THR 196 Cb -0.12 -1.79 0.01 0.00 1.34 0.00 0.00 72.50 71.94 2df7 s THR 196 CO -0.03 -0.79 0.11 0.00 -0.54 0.00 0.00 174.62 173.37 2df7 s ASP 198 N 1.51 6.27 -0.04 0.00 1.01 -1.26 -1.12 116.67 123.04 2df7 s ASP 198 Ca 0.02 0.30 -0.31 0.00 0.71 0.00 0.00 52.55 53.27 2df7 s ASP 198 Cb -0.18 -1.92 -0.09 0.00 1.01 0.00 0.00 42.92 41.74 2df7 s ASP 198 CO 0.04 -0.25 1.99 -0.24 0.21 0.00 0.00 175.17 176.92 2df7 n SER 199 N -1.68 3.80 0.00 0.27 2.88 -1.10 -4.65 113.62 113.14 2df7 n SER 199 Ca -0.06 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.30 2df7 n SER 199 Cb 0.57 -1.48 0.00 0.00 -0.75 0.00 0.00 64.21 62.54 2df7 n SER 199 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2df7 n SER 200 N 7.94 1.25 -4.56 -3.46 3.41 -1.26 -3.14 113.62 113.79 2df7 n SER 200 Ca 0.23 0.00 -0.46 0.00 -0.26 0.00 0.00 58.87 58.38 2df7 n SER 200 Cb 0.38 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 2df7 n SER 200 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2df7 n ASP 201 N -1.83 1.00 -2.68 4.04 9.92 -1.26 -2.18 116.55 123.55 2df7 n ASP 201 Ca 0.00 1.17 -0.11 0.00 -0.53 0.00 0.00 54.79 55.32 2df7 n ASP 201 Cb 0.16 -1.23 0.05 0.00 -0.64 0.00 0.00 41.12 39.46 2df7 n ASP 201 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2df7 n ARG 202 N 0.96 -2.89 -1.36 -1.24 5.12 -1.26 -4.03 116.66 111.97 2df7 n ARG 202 Ca 0.12 0.59 -0.33 0.00 -1.93 0.00 0.00 57.85 56.30 2df7 n ARG 202 Cb 0.30 -4.62 0.10 0.00 -1.16 0.00 0.00 32.46 27.07 2df7 n ARG 202 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2df7 s PRO 203 N -4.39 2.10 -0.11 5.56 0.04 -1.17 -0.66 135.00 136.36 2df7 s PRO 203 Ca 0.17 1.57 -0.03 0.00 0.04 0.00 0.00 61.00 62.75 2df7 s PRO 203 Cb -0.02 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.64 2df7 s PRO 203 CO 0.50 -1.82 0.01 0.50 0.04 0.00 0.00 177.00 176.23 2df7 s ARG 204 N -4.20 3.27 -0.09 4.56 3.52 -0.77 -4.13 118.95 121.11 2df7 s ARG 204 Ca 0.70 -0.40 0.02 0.00 -0.13 0.00 0.00 55.73 55.91 2df7 s ARG 204 Cb -0.25 -2.90 0.02 0.00 -1.56 0.00 0.00 34.95 30.26 2df7 s ARG 204 CO 0.48 0.56 -0.13 0.08 -0.81 0.00 0.00 175.30 175.48 2df7 s VAL 205 N -0.49 1.30 -0.14 7.11 1.01 -1.26 -0.44 120.40 127.49 2df7 s VAL 205 Ca 0.09 -0.54 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 2df7 s VAL 205 Cb -0.12 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 2df7 s VAL 205 CO 0.02 0.40 -0.05 -0.31 0.00 0.00 0.00 175.10 175.16 2df7 s TYR 206 N 0.95 3.00 -0.20 5.22 1.51 0.03 -4.96 117.35 122.89 2df7 s TYR 206 Ca -0.08 -0.27 -0.02 0.00 -1.01 0.00 0.00 57.07 55.68 2df7 s TYR 206 Cb -0.15 -1.91 -0.00 0.00 -0.11 0.00 0.00 41.96 39.79 2df7 s TYR 206 CO -0.00 0.01 -0.09 0.99 -1.11 0.00 0.00 175.55 175.35 2df7 s THR 207 N 0.18 2.98 -0.19 -0.71 2.01 -1.26 -0.27 115.64 118.37 2df7 s THR 207 Ca -0.02 -0.63 -0.00 0.00 0.31 0.00 0.00 61.69 61.34 2df7 s THR 207 Cb -0.14 -2.33 0.02 0.00 0.01 0.00 0.00 72.50 70.06 2df7 s THR 207 CO 0.03 0.46 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.64 2df7 s ILE 208 N 1.36 2.38 -0.67 1.82 1.01 -0.26 -4.97 121.20 121.87 2df7 s ILE 208 Ca 0.05 -0.87 -0.18 0.00 0.00 0.00 0.00 60.65 59.65 2df7 s ILE 208 Cb -0.14 -2.05 0.13 0.00 0.01 0.00 0.00 42.46 40.42 2df7 s ILE 208 CO -0.06 0.48 0.74 -0.89 0.00 0.00 0.00 174.94 175.22 2df7 s THR 209 N 1.33 5.01 0.14 2.92 2.01 -1.26 -0.30 115.64 125.49 2df7 s THR 209 Ca 0.05 -1.40 0.21 0.00 0.31 0.00 0.00 61.69 60.85 2df7 s THR 209 Cb -0.14 -4.50 0.18 0.00 0.01 0.00 0.00 72.50 68.05 2df7 s THR 209 CO -0.10 -1.12 1.77 0.00 -0.69 0.00 0.00 174.62 174.47 2df7 h ALA 210 N 8.85 1.00 -1.98 7.40 0.00 -1.62 -3.46 119.26 129.45 2df7 h ALA 210 Ca -0.17 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 2df7 h ALA 210 Cb 1.07 -0.05 -0.21 0.00 0.00 0.00 0.00 17.79 18.60 2df7 h ALA 210 CO 1.03 0.39 0.15 0.00 0.00 0.00 0.00 179.25 180.82 2df7 s ALA 211 N -3.62 -1.79 -0.42 0.00 0.00 -1.18 -4.88 121.76 109.87 2df7 s ALA 211 Ca 0.00 1.95 0.03 0.00 0.00 0.00 0.00 51.96 53.94 2df7 s ALA 211 Cb 0.11 -1.06 0.16 0.00 0.00 0.00 0.00 23.12 22.32 2df7 s ALA 211 CO 0.67 -0.34 0.30 0.34 0.00 0.00 0.00 175.76 176.73 2df7 s ASP 212 N 0.20 2.47 -1.11 0.00 2.15 -1.23 -0.45 116.67 118.70 2df7 s ASP 212 Ca -0.01 -2.83 -0.04 0.00 0.43 0.00 0.00 52.55 50.10 2df7 s ASP 212 Cb -0.04 -0.61 0.00 0.00 -0.30 0.00 0.00 42.92 41.97 2df7 s ASP 212 CO 0.02 -0.22 0.95 0.47 -0.17 0.00 0.00 175.17 176.22 2df7 n ASP 213 N 3.20 -3.98 -4.71 -0.34 10.43 -0.08 -4.96 116.55 116.11 2df7 n ASP 213 Ca 0.21 -0.50 -0.42 0.00 2.57 0.00 0.00 54.79 56.65 2df7 n ASP 213 Cb 0.42 -4.46 -0.03 0.00 1.84 0.00 0.00 41.12 38.89 2df7 n ASP 213 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 2df7 s TYR 214 N -3.29 3.42 -0.33 1.24 5.04 -0.16 -4.75 117.35 118.51 2df7 s TYR 214 Ca 0.26 1.27 -0.15 0.00 -2.44 0.00 0.00 57.07 56.01 2df7 s TYR 214 Cb -0.12 -3.45 -0.02 0.00 0.35 0.00 0.00 41.96 38.73 2df7 s TYR 214 CO 0.63 -1.38 0.35 -0.65 -1.34 0.00 0.00 175.55 173.15 2df7 s GLN 215 N 1.04 3.65 -0.10 4.97 -0.21 -1.26 -0.99 119.66 126.76 2df7 s GLN 215 Ca 0.59 -0.36 -0.03 0.00 0.02 0.00 0.00 55.36 55.59 2df7 s GLN 215 Cb -0.30 -3.78 -0.03 0.00 1.00 0.00 0.00 33.01 29.90 2df7 s GLN 215 CO 0.29 -0.47 0.01 0.12 -2.12 0.00 0.00 175.29 173.13 2df7 s PHE 216 N 2.00 3.20 -0.18 0.91 5.36 0.00 -5.00 117.98 124.27 2df7 s PHE 216 Ca 0.12 0.19 -0.07 0.00 -0.96 0.00 0.00 56.93 56.21 2df7 s PHE 216 Cb -0.16 -1.83 0.08 0.00 -0.34 0.00 0.00 43.02 40.77 2df7 s PHE 216 CO 0.11 0.45 0.38 0.45 -1.46 0.00 0.00 175.22 175.16 2df7 s SER 217 N -0.76 -0.15 -0.09 6.13 0.15 -1.26 -1.76 113.70 115.96 2df7 s SER 217 Ca 0.12 0.90 -0.24 0.00 0.70 0.00 0.00 55.95 57.42 2df7 s SER 217 Cb -0.12 1.17 0.06 0.00 -1.71 0.00 0.00 66.02 65.42 2df7 s SER 217 CO 0.02 -0.23 0.57 -0.55 1.20 0.00 0.00 173.24 174.26 2df7 s SER 218 N 2.47 -0.54 0.60 5.45 0.15 0.20 -5.00 113.70 117.03 2df7 s SER 218 Ca -0.02 0.71 -0.18 0.00 0.70 0.00 0.00 55.95 57.17 2df7 s SER 218 Cb -0.12 0.68 -0.03 0.00 -1.71 0.00 0.00 66.02 64.84 2df7 s SER 218 CO -0.12 -0.46 1.13 -1.58 1.20 0.00 0.00 173.24 173.42 2df7 s GLN 219 N -0.79 3.07 1.25 5.44 0.74 -1.26 -0.37 119.66 127.74 2df7 s GLN 219 Ca -0.08 1.57 -0.17 0.00 0.05 0.00 0.00 55.36 56.72 2df7 s GLN 219 Cb -0.02 -1.97 0.30 0.00 1.10 0.00 0.00 33.01 32.42 2df7 s GLN 219 CO 0.06 -1.07 1.01 -0.47 -0.55 0.00 0.00 175.29 174.27 2df7 s TYR 220 N -1.96 0.64 -0.27 1.67 5.04 0.57 -4.82 117.35 118.21 2df7 s TYR 220 Ca 0.71 0.83 -0.25 0.00 -2.44 0.00 0.00 57.07 55.92 2df7 s TYR 220 Cb -0.24 -3.10 0.12 0.00 0.35 0.00 0.00 41.96 39.10 2df7 s TYR 220 CO 0.33 -4.17 1.04 -0.65 -1.34 0.00 0.00 175.55 170.77 2df7 s GLN 221 N -4.87 0.50 0.16 4.97 -0.21 -1.26 -5.00 119.66 113.95 2df7 s GLN 221 Ca 0.68 0.55 -0.32 0.00 0.02 0.00 0.00 55.36 56.30 2df7 s GLN 221 Cb -0.18 0.24 -0.10 0.00 1.00 0.00 0.00 33.01 33.98 2df7 s GLN 221 CO 0.60 -0.07 1.55 0.45 -2.12 0.00 0.00 175.29 175.70 2df7 s SER 222 N 0.13 6.61 0.00 5.90 0.15 -1.26 -0.68 113.70 124.55 2df7 s SER 222 Ca 0.03 2.59 0.00 0.00 0.70 0.00 0.00 55.95 59.26 2df7 s SER 222 Cb -0.05 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.67 2df7 s SER 222 CO -0.06 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.19 2df7 n GLY 223 N 3.72 0.20 0.00 9.45 0.00 -1.26 -4.96 105.19 112.34 2df7 n GLY 223 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 2df7 n GLY 223 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2df7 n GLY 224 N -2.00 -1.99 3.53 -0.02 0.00 0.15 -4.90 105.19 99.95 2df7 n GLY 224 Ca 0.00 -1.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.14 2df7 n GLY 224 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2df7 s VAL 225 N -2.48 4.75 -0.11 1.61 1.01 -0.52 -4.79 120.40 119.87 2df7 s VAL 225 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.91 2df7 s VAL 225 Cb 0.00 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 2df7 s VAL 225 CO 0.00 0.33 0.07 -0.89 0.00 0.00 0.00 175.10 174.60 2df7 s THR 226 N 1.48 4.87 0.09 3.92 2.01 -1.26 -1.07 115.64 125.68 2df7 s THR 226 Ca 0.06 -0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.05 2df7 s THR 226 Cb -0.15 -3.09 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 2df7 s THR 226 CO 0.06 0.60 -0.08 0.27 -0.69 0.00 0.00 174.62 174.78 2df7 s ILE 227 N -0.87 0.73 -0.48 1.82 -4.36 -0.56 -5.00 121.20 112.47 2df7 s ILE 227 Ca 0.13 -1.68 -0.10 0.00 -0.26 0.00 0.00 60.65 58.74 2df7 s ILE 227 Cb -0.12 -1.38 0.12 0.00 1.25 0.00 0.00 42.46 42.34 2df7 s ILE 227 CO 0.03 -0.69 0.36 -0.89 0.24 0.00 0.00 174.94 173.99 2df7 s THR 228 N -2.85 4.30 0.30 8.37 2.01 -1.26 -1.47 115.64 125.05 2df7 s THR 228 Ca 0.06 -1.78 0.01 0.00 0.31 0.00 0.00 61.69 60.29 2df7 s THR 228 Cb -0.00 -3.83 0.28 0.00 0.01 0.00 0.00 72.50 68.96 2df7 s THR 228 CO -0.02 -0.79 1.89 0.25 -0.69 0.00 0.00 174.62 175.26 2df7 h LEU 229 N 8.48 0.91 -7.33 4.42 5.85 -1.41 -3.45 115.31 122.78 2df7 h LEU 229 Ca -0.22 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.60 2df7 h LEU 229 Cb 1.07 -0.17 -0.11 0.00 0.37 0.00 0.00 40.66 41.82 2df7 h LEU 229 CO 0.88 0.56 0.37 0.72 -0.34 0.00 0.00 178.44 180.62 2df7 s PHE 230 N -5.91 -0.32 -0.07 1.25 -0.12 -1.25 -5.03 117.98 106.52 2df7 s PHE 230 Ca -0.12 0.07 -0.03 0.00 -0.05 0.00 0.00 56.93 56.80 2df7 s PHE 230 Cb 0.20 0.60 0.04 0.00 -0.63 0.00 0.00 43.02 43.23 2df7 s PHE 230 CO 0.80 -0.82 0.16 0.45 -0.05 0.00 0.00 175.22 175.76 2df7 s SER 231 N -2.74 0.06 0.01 1.98 0.15 -1.26 -2.38 113.70 109.52 2df7 s SER 231 Ca 0.07 0.32 -0.00 0.00 0.70 0.00 0.00 55.95 57.04 2df7 s SER 231 Cb -0.02 0.22 -0.01 0.00 -1.71 0.00 0.00 66.02 64.50 2df7 s SER 231 CO -0.05 -0.17 -0.01 0.00 1.20 0.00 0.00 173.24 174.21 2df7 s ALA 232 N 1.42 0.06 -0.06 5.45 0.00 -0.04 -4.98 121.76 123.60 2df7 s ALA 232 Ca -0.07 -0.32 -0.29 0.00 0.00 0.00 0.00 51.96 51.28 2df7 s ALA 232 Cb -0.12 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 2df7 s ALA 232 CO -0.06 -0.09 0.96 -0.80 0.00 0.00 0.00 175.76 175.77 2df7 s ASN 233 N -0.82 7.27 0.16 0.00 0.01 -1.26 -0.69 114.94 119.61 2df7 s ASN 233 Ca -0.09 1.54 -0.06 0.00 -0.71 0.00 0.00 52.86 53.55 2df7 s ASN 233 Cb -0.06 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.04 2df7 s ASN 233 CO -0.01 -0.33 0.20 0.27 -1.51 0.00 0.00 177.10 175.72 2df7 s ILE 234 N 1.47 0.07 -0.01 0.60 -4.36 -0.99 -4.93 121.20 113.05 2df7 s ILE 234 Ca 0.49 -1.63 0.05 0.00 -0.26 0.00 0.00 60.65 59.30 2df7 s ILE 234 Cb -0.19 -2.00 -0.01 0.00 1.25 0.00 0.00 42.46 41.50 2df7 s ILE 234 CO 0.22 -0.31 -0.17 -1.81 0.24 0.00 0.00 174.94 173.11 2df7 s ASP 235 N -3.02 2.04 -0.26 4.36 1.01 -1.26 -3.54 116.67 116.00 2df7 s ASP 235 Ca 0.22 -0.33 -0.19 0.00 0.71 0.00 0.00 52.55 52.96 2df7 s ASP 235 Cb 0.05 -0.22 0.07 0.00 1.01 0.00 0.00 42.92 43.83 2df7 s ASP 235 CO 0.02 0.20 0.67 0.00 0.21 0.00 0.00 175.17 176.27 2df7 s ALA 236 N -0.45 -1.74 0.00 5.23 0.00 -1.01 -4.95 121.76 118.84 2df7 s ALA 236 Ca 0.06 2.15 0.00 0.00 0.00 0.00 0.00 51.96 54.18 2df7 s ALA 236 Cb -0.07 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.79 2df7 s ALA 236 CO -0.00 -0.35 0.00 -0.89 0.00 0.00 0.00 175.76 174.52 2df7 n ILE 237 N 3.64 0.00 -4.27 0.00 5.41 -1.26 -1.02 119.36 121.86 2df7 n ILE 237 Ca -0.18 0.00 -0.13 0.00 1.00 0.00 0.00 62.75 63.45 2df7 n ILE 237 Cb 0.57 -0.83 -0.03 0.00 -0.71 0.00 0.00 39.64 38.64 2df7 n ILE 237 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2df7 n THR 238 N -2.02 0.00 -1.54 1.39 -2.24 -1.26 -4.92 114.28 103.69 2df7 n THR 238 Ca 0.00 -1.06 -0.44 0.00 -2.27 0.00 0.00 64.05 60.28 2df7 n THR 238 Cb 0.47 0.30 -0.01 0.00 -2.10 0.00 0.00 70.33 68.99 2df7 n THR 238 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2df7 n SER 239 N -1.50 0.54 -4.02 3.42 3.41 -1.26 -4.82 113.62 109.38 2df7 n SER 239 Ca -0.06 1.11 -0.08 0.00 -0.26 0.00 0.00 58.87 59.58 2df7 n SER 239 Cb 0.28 -1.21 -0.09 0.00 -0.26 0.00 0.00 64.21 62.93 2df7 n SER 239 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2df7 s LEU 240 N 0.97 1.84 0.08 1.04 2.34 -0.92 -2.12 118.68 121.90 2df7 s LEU 240 Ca 0.61 -0.94 0.05 0.00 0.06 0.00 0.00 54.13 53.91 2df7 s LEU 240 Cb -0.71 0.58 -0.03 0.00 -0.56 0.00 0.00 46.19 45.47 2df7 s LEU 240 CO 0.59 -0.70 -0.15 -0.44 -1.06 0.00 0.00 176.35 174.58 2df7 s SER 241 N -2.94 1.78 -0.11 1.48 0.01 -0.09 -0.39 113.70 113.44 2df7 s SER 241 Ca 0.12 -0.63 0.01 0.00 1.31 0.00 0.00 55.95 56.76 2df7 s SER 241 Cb 0.06 -0.06 0.02 0.00 0.21 0.00 0.00 66.02 66.25 2df7 s SER 241 CO -0.06 -0.06 -0.13 -0.63 0.41 0.00 0.00 173.24 172.77 2df7 s ILE 242 N -1.27 1.34 0.23 1.44 1.01 -0.14 -0.11 121.20 123.71 2df7 s ILE 242 Ca -0.01 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.13 2df7 s ILE 242 Cb -0.10 -1.26 -0.05 0.00 0.01 0.00 0.00 42.46 41.06 2df7 s ILE 242 CO 0.02 0.41 0.05 -0.83 0.00 0.00 0.00 174.94 174.60 2df7 s GLY 243 N 1.18 1.59 0.00 6.18 0.00 -0.30 -1.09 107.32 114.89 2df7 s GLY 243 Ca -0.03 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 42.90 2df7 s GLY 243 CO -0.04 -1.61 0.00 0.61 0.00 0.00 0.00 173.10 172.07 2df7 n GLY 244 N -0.41 0.51 3.43 0.20 0.00 -1.21 -0.52 105.19 107.19 2df7 n GLY 244 Ca -0.03 -2.17 -0.16 0.00 0.00 0.00 0.00 46.02 43.67 2df7 n GLY 244 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2df7 s GLU 245 N -0.73 1.00 -0.08 1.61 -1.05 -1.06 0.07 118.70 118.45 2df7 s GLU 245 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 54.97 54.84 2df7 s GLU 245 Cb 0.00 0.46 -0.03 0.00 -0.44 0.00 0.00 34.13 34.12 2df7 s GLU 245 CO 0.00 -0.33 -0.07 -0.51 0.95 0.00 0.00 175.26 175.31 2df7 s LEU 246 N -1.49 3.15 -0.19 1.83 1.43 0.84 -3.07 118.68 121.19 2df7 s LEU 246 Ca -0.09 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 52.94 2df7 s LEU 246 Cb -0.01 -1.70 -0.00 0.00 0.03 0.00 0.00 46.19 44.51 2df7 s LEU 246 CO 0.05 0.32 -0.11 -0.69 0.23 0.00 0.00 176.35 176.15 2df7 s VAL 247 N -0.56 2.88 -0.08 -1.59 1.01 0.59 0.08 120.40 122.73 2df7 s VAL 247 Ca 0.08 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.38 2df7 s VAL 247 Cb -0.12 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 2df7 s VAL 247 CO 0.02 0.48 -0.01 -0.36 0.00 0.00 0.00 175.10 175.23 2df7 s PHE 248 N 1.17 3.12 0.03 5.22 0.40 0.54 -1.90 117.98 126.57 2df7 s PHE 248 Ca 0.02 0.16 0.08 0.00 -0.60 0.00 0.00 56.93 56.59 2df7 s PHE 248 Cb -0.14 -1.77 -0.02 0.00 0.51 0.00 0.00 43.02 41.59 2df7 s PHE 248 CO -0.04 0.45 -0.24 -1.01 0.70 0.00 0.00 175.22 175.09 2df7 s HIS 249 N -0.89 2.07 0.02 0.36 3.76 0.36 -1.50 115.29 119.46 2df7 s HIS 249 Ca 0.14 -0.39 -0.22 0.00 -0.15 0.00 0.00 55.06 54.43 2df7 s HIS 249 Cb -0.11 -1.26 0.05 0.00 1.11 0.00 0.00 32.58 32.36 2df7 s HIS 249 CO 0.03 0.08 0.50 -0.08 -0.85 0.00 0.00 174.74 174.42 2df7 s THR 250 N -0.74 0.03 -0.33 1.30 -1.32 -1.26 -0.25 115.64 113.08 2df7 s THR 250 Ca 0.09 -0.27 0.12 0.00 -1.21 0.00 0.00 61.69 60.43 2df7 s THR 250 Cb -0.09 -0.92 -0.15 0.00 -1.51 0.00 0.00 72.50 69.83 2df7 s THR 250 CO 0.01 -0.15 0.40 -1.20 -2.21 0.00 0.00 174.62 171.47 2df7 n SER 251 N 0.67 1.25 -4.80 8.08 7.64 -1.26 -2.86 113.62 122.34 2df7 n SER 251 Ca -0.19 -0.46 -0.39 0.00 1.01 0.00 0.00 58.87 58.85 2df7 n SER 251 Cb 0.59 1.22 -0.06 0.00 -1.01 0.00 0.00 64.21 64.95 2df7 n SER 251 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2df7 s VAL 252 N -2.40 4.68 0.26 0.44 1.01 -1.26 -4.98 120.40 118.16 2df7 s VAL 252 Ca 0.01 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.30 2df7 s VAL 252 Cb 0.08 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 2df7 s VAL 252 CO 0.49 0.54 0.45 -1.00 0.00 0.00 0.00 175.10 175.57 2df7 s HIS 253 N -1.04 3.48 0.00 5.22 0.09 -1.26 -4.48 115.29 117.30 2df7 s HIS 253 Ca 0.30 0.30 0.00 0.00 -0.00 0.00 0.00 55.06 55.66 2df7 s HIS 253 Cb -0.20 -1.83 0.00 0.00 -0.00 0.00 0.00 32.58 30.55 2df7 s HIS 253 CO 0.20 0.29 0.00 0.41 -0.00 0.00 0.00 174.74 175.65 2df7 n GLY 254 N -1.17 0.57 3.78 -2.22 0.00 -1.26 -3.51 105.19 101.37 2df7 n GLY 254 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2df7 n GLY 254 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2df7 s LEU 255 N 0.00 4.44 -0.01 0.99 1.43 -1.26 -0.72 118.68 123.55 2df7 s LEU 255 Ca 0.00 1.78 0.03 0.00 -1.03 0.00 0.00 54.13 54.91 2df7 s LEU 255 Cb 0.00 -3.78 -0.00 0.00 0.03 0.00 0.00 46.19 42.43 2df7 s LEU 255 CO 0.00 0.03 -0.08 0.00 0.23 0.00 0.00 176.35 176.52 2df7 s ALA 256 N -1.45 0.73 -0.00 4.21 0.00 0.20 -0.57 121.76 124.88 2df7 s ALA 256 Ca 0.45 -0.35 0.06 0.00 0.00 0.00 0.00 51.96 52.13 2df7 s ALA 256 Cb -0.20 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.68 2df7 s ALA 256 CO 0.25 0.16 -0.20 -0.51 0.00 0.00 0.00 175.76 175.47 2df7 s LEU 257 N -0.12 2.47 -0.06 0.00 1.43 0.14 -1.53 118.68 121.01 2df7 s LEU 257 Ca 0.02 -0.38 0.06 0.00 -1.03 0.00 0.00 54.13 52.79 2df7 s LEU 257 Cb -0.04 -1.46 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 2df7 s LEU 257 CO -0.00 0.30 -0.23 -1.81 0.23 0.00 0.00 176.35 174.84 2df7 s ASP 258 N -1.00 3.27 -0.02 2.29 1.01 -0.42 -0.95 116.67 120.86 2df7 s ASP 258 Ca 0.12 -0.45 0.02 0.00 0.71 0.00 0.00 52.55 52.95 2df7 s ASP 258 Cb -0.10 -0.84 0.00 0.00 1.01 0.00 0.00 42.92 42.99 2df7 s ASP 258 CO 0.02 0.26 -0.06 0.00 0.21 0.00 0.00 175.17 175.60 2df7 s ALA 259 N -0.26 0.60 -0.01 5.23 0.00 -0.47 0.58 121.76 127.44 2df7 s ALA 259 Ca -0.00 -0.20 0.03 0.00 0.00 0.00 0.00 51.96 51.78 2df7 s ALA 259 Cb -0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.74 2df7 s ALA 259 CO 0.03 0.09 -0.09 0.99 0.00 0.00 0.00 175.76 176.78 2df7 s THR 260 N 0.22 0.68 -0.12 0.00 2.01 0.21 -0.64 115.64 118.00 2df7 s THR 260 Ca -0.03 -0.37 -0.05 0.00 0.31 0.00 0.00 61.69 61.56 2df7 s THR 260 Cb -0.07 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.83 2df7 s THR 260 CO -0.00 0.19 0.06 -0.51 -0.69 0.00 0.00 174.62 173.67 2df7 s ILE 261 N -0.19 4.82 -0.03 1.82 1.10 0.58 -0.90 121.20 128.41 2df7 s ILE 261 Ca 0.03 -0.05 0.05 0.00 -0.51 0.00 0.00 60.65 60.18 2df7 s ILE 261 Cb -0.03 -3.09 -0.01 0.00 0.15 0.00 0.00 42.46 39.48 2df7 s ILE 261 CO -0.00 0.58 -0.20 -0.31 -2.11 0.00 0.00 174.94 172.90 2df7 s TYR 262 N -0.67 1.86 -0.24 3.50 1.51 -0.20 -1.04 117.35 122.06 2df7 s TYR 262 Ca 0.12 -0.46 -0.03 0.00 -1.01 0.00 0.00 57.07 55.69 2df7 s TYR 262 Cb -0.12 -1.22 0.01 0.00 -0.11 0.00 0.00 41.96 40.52 2df7 s TYR 262 CO 0.02 -0.11 -0.03 -0.51 -1.11 0.00 0.00 175.55 173.81 2df7 s LEU 263 N -0.22 3.15 -0.03 -1.29 1.43 0.63 -1.47 118.68 120.87 2df7 s LEU 263 Ca 0.01 -0.63 -0.09 0.00 -1.03 0.00 0.00 54.13 52.40 2df7 s LEU 263 Cb -0.10 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 2df7 s LEU 263 CO 0.01 -0.09 0.26 -0.63 0.23 0.00 0.00 176.35 176.13 2df7 s ILE 264 N 1.42 5.30 0.69 -0.59 -1.09 0.48 -0.43 121.20 126.98 2df7 s ILE 264 Ca 0.03 0.35 -0.06 0.00 -2.23 0.00 0.00 60.65 58.74 2df7 s ILE 264 Cb -0.16 -3.55 0.06 0.00 -1.58 0.00 0.00 42.46 37.23 2df7 s ILE 264 CO -0.03 0.50 1.00 -0.83 -1.23 0.00 0.00 174.94 174.34 2df7 s GLY 265 N -1.34 1.69 0.55 6.18 0.00 0.76 -0.31 107.32 114.85 2df7 s GLY 265 Ca 0.23 -0.95 0.24 0.00 0.00 0.00 0.00 44.72 44.24 2df7 s GLY 265 CO 0.12 -0.55 2.06 -2.75 0.00 0.00 0.00 173.10 171.98 2df7 h PHE 266 N -0.54 0.00 -0.28 1.90 3.57 -1.86 -0.24 116.94 119.49 2df7 h PHE 266 Ca -0.44 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.06 2df7 h PHE 266 Cb 1.31 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.05 2df7 h PHE 266 CO 0.34 0.00 0.00 -0.40 -2.23 0.00 0.00 178.31 176.02 2df7 n ASP 267 N -4.23 1.66 0.00 0.41 5.68 -1.26 -4.88 116.55 113.93 2df7 n ASP 267 Ca 0.04 -1.92 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 2df7 n ASP 267 Cb 0.40 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 2df7 n ASP 267 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2df7 n GLY 268 N 1.03 1.74 3.80 6.12 0.00 -0.10 -4.75 105.19 113.03 2df7 n GLY 268 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 2df7 n GLY 268 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2df7 s THR 269 N -2.97 3.97 -0.09 2.61 2.01 -1.26 -4.74 115.64 115.16 2df7 s THR 269 Ca 0.00 1.21 -0.28 0.00 0.31 0.00 0.00 61.69 62.93 2df7 s THR 269 Cb 0.00 -3.49 -0.02 0.00 0.01 0.00 0.00 72.50 69.00 2df7 s THR 269 CO 0.00 -0.28 0.95 -0.89 -0.69 0.00 0.00 174.62 173.71 2df7 s THR 270 N -2.06 4.84 -0.23 -0.82 2.01 -1.26 -0.17 115.64 117.94 2df7 s THR 270 Ca 0.66 1.93 0.04 0.00 0.31 0.00 0.00 61.69 64.62 2df7 s THR 270 Cb -0.14 -4.26 -0.17 0.00 0.01 0.00 0.00 72.50 67.94 2df7 s THR 270 CO 0.19 0.06 -0.18 0.52 -0.69 0.00 0.00 174.62 174.52 2df7 n VAL 271 N 4.39 1.37 -3.87 3.82 0.31 0.43 -4.89 118.33 119.90 2df7 n VAL 271 Ca 0.07 -0.56 -0.12 0.00 -0.01 0.00 0.00 64.34 63.72 2df7 n VAL 271 Cb 0.49 -1.25 -0.14 0.00 -0.91 0.00 0.00 33.84 32.04 2df7 n VAL 271 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2df7 s ILE 272 N -2.48 0.00 -0.02 2.52 1.01 -0.96 -4.83 121.20 116.45 2df7 s ILE 272 Ca -0.30 -0.03 0.03 0.00 0.00 0.00 0.00 60.65 60.35 2df7 s ILE 272 Cb 0.08 -0.05 -0.00 0.00 0.01 0.00 0.00 42.46 42.50 2df7 s ILE 272 CO 0.58 -0.02 -0.11 0.42 0.00 0.00 0.00 174.94 175.81 2df7 s THR 273 N -0.04 0.92 -0.03 2.92 -4.23 -1.26 -0.27 115.64 113.64 2df7 s THR 273 Ca -0.01 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.04 2df7 s THR 273 Cb -0.01 -0.79 0.03 0.00 1.34 0.00 0.00 72.50 73.08 2df7 s THR 273 CO 0.00 0.27 0.01 -0.13 -0.54 0.00 0.00 174.62 174.23 2df7 s ARG 274 N -0.07 0.26 0.26 3.99 1.81 -0.21 -4.99 118.95 120.01 2df7 s ARG 274 Ca 0.01 0.11 -0.30 0.00 -1.72 0.00 0.00 55.73 53.83 2df7 s ARG 274 Cb -0.07 -0.49 -0.09 0.00 -0.45 0.00 0.00 34.95 33.85 2df7 s ARG 274 CO 0.00 -0.16 1.02 0.00 -0.68 0.00 0.00 175.30 175.48 2df7 s ALA 275 N 1.17 3.37 0.00 2.13 0.00 -1.26 -0.30 121.76 126.87 2df7 s ALA 275 Ca -0.08 0.75 0.00 0.00 0.00 0.00 0.00 51.96 52.64 2df7 s ALA 275 Cb -0.13 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.72 2df7 s ALA 275 CO -0.02 0.03 0.00 0.28 0.00 0.00 0.00 175.76 176.05 2df7 n VAL 276 N 1.31 0.00 -3.70 0.00 0.31 0.19 -4.90 118.33 111.54 2df7 n VAL 276 Ca -0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.20 2df7 n VAL 276 Cb 0.46 0.27 -0.10 0.00 -0.91 0.00 0.00 33.84 33.56 2df7 n VAL 276 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2df7 s ALA 277 N -1.91 -1.15 -0.14 3.52 0.00 -1.11 -4.81 121.76 116.16 2df7 s ALA 277 Ca 0.00 1.46 -0.03 0.00 0.00 0.00 0.00 51.96 53.40 2df7 s ALA 277 Cb 0.00 -0.87 0.05 0.00 0.00 0.00 0.00 23.12 22.30 2df7 s ALA 277 CO 0.00 -0.25 0.04 0.45 0.00 0.00 0.00 175.76 176.01 2df7 s SER 278 N 0.81 2.22 -1.43 0.00 0.15 -1.26 -1.37 113.70 112.82 2df7 s SER 278 Ca -0.05 -0.47 -0.04 0.00 0.70 0.00 0.00 55.95 56.09 2df7 s SER 278 Cb -0.05 -0.42 0.03 0.00 -1.71 0.00 0.00 66.02 63.87 2df7 s SER 278 CO -0.06 -0.28 0.57 -0.67 1.20 0.00 0.00 173.24 173.99 2df7 n ASP 279 N 5.16 -1.23 -4.56 5.45 4.64 -1.04 -4.87 116.55 120.11 2df7 n ASP 279 Ca -0.07 -0.95 -0.43 0.00 -1.38 0.00 0.00 54.79 51.96 2df7 n ASP 279 Cb 0.49 -3.28 -0.04 0.00 -1.04 0.00 0.00 41.12 37.24 2df7 n ASP 279 CO 0.00 0.00 0.00 0.21 -0.82 0.00 0.00 177.20 176.59 2df7 s ASN 280 N -4.15 6.46 0.38 1.67 3.84 -0.12 -4.78 114.94 118.25 2df7 s ASN 280 Ca 0.15 0.02 -0.25 0.00 0.21 0.00 0.00 52.86 53.00 2df7 s ASN 280 Cb -0.08 -2.44 -0.09 0.00 -0.55 0.00 0.00 41.25 38.09 2df7 s ASN 280 CO 0.87 -1.04 1.04 -0.83 -2.79 0.00 0.00 177.10 174.35 2df7 s GLY 281 N 2.29 2.77 -0.18 1.21 0.00 -1.26 0.29 107.32 112.43 2df7 s GLY 281 Ca 0.35 0.69 -0.08 0.00 0.00 0.00 0.00 44.72 45.67 2df7 s GLY 281 CO 0.25 1.13 0.09 1.08 0.00 0.00 0.00 173.10 175.65 2df7 s LEU 282 N -2.47 3.98 -0.13 0.66 1.43 0.27 -4.93 118.68 117.50 2df7 s LEU 282 Ca 0.56 0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 53.70 2df7 s LEU 282 Cb -0.22 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 43.94 2df7 s LEU 282 CO 0.28 0.20 0.27 -0.89 0.23 0.00 0.00 176.35 176.44 2df7 s THR 283 N 0.22 5.31 0.59 5.49 2.01 -1.26 -4.47 115.64 123.52 2df7 s THR 283 Ca 0.06 0.50 -0.17 0.00 0.31 0.00 0.00 61.69 62.39 2df7 s THR 283 Cb -0.12 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 2df7 s THR 283 CO -0.00 0.47 1.08 0.42 -0.69 0.00 0.00 174.62 175.90 2df7 s THR 284 N -0.12 3.56 -1.96 -0.82 -4.23 -1.26 -3.81 115.64 107.00 2df7 s THR 284 Ca 0.17 0.80 0.00 0.00 -1.18 0.00 0.00 61.69 61.48 2df7 s THR 284 Cb -0.13 -3.31 0.00 0.00 1.34 0.00 0.00 72.50 70.40 2df7 s THR 284 CO 0.05 -0.38 0.00 0.61 -0.54 0.00 0.00 174.62 174.36 2df7 n GLY 285 N -0.58 0.91 3.24 3.99 0.00 -1.13 -4.97 105.19 106.65 2df7 n GLY 285 Ca 0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 2df7 n GLY 285 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2df7 s ILE 286 N -2.83 0.04 -0.28 -0.61 -4.36 -1.25 -5.10 121.20 106.82 2df7 s ILE 286 Ca 0.00 -1.82 -0.27 0.00 -0.26 0.00 0.00 60.65 58.30 2df7 s ILE 286 Cb 0.00 -2.23 0.01 0.00 1.25 0.00 0.00 42.46 41.49 2df7 s ILE 286 CO 0.00 -0.19 0.96 -1.81 0.24 0.00 0.00 174.94 174.14 2df7 s ASP 287 N -3.08 6.90 -0.29 4.36 1.01 -1.26 -4.61 116.67 119.70 2df7 s ASP 287 Ca 0.29 1.06 -0.13 0.00 0.71 0.00 0.00 52.55 54.48 2df7 s ASP 287 Cb 0.06 -2.49 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 2df7 s ASP 287 CO 0.07 -0.70 0.26 0.20 0.21 0.00 0.00 175.17 175.21 2df7 s ASN 288 N 1.47 6.10 -0.18 0.27 0.01 -0.56 -4.94 114.94 117.10 2df7 s ASN 288 Ca 0.40 -0.02 -0.09 0.00 -0.71 0.00 0.00 52.86 52.45 2df7 s ASN 288 Cb -0.14 -2.15 -0.05 0.00 0.41 0.00 0.00 41.25 39.32 2df7 s ASN 288 CO 0.11 -0.14 0.12 -0.76 -1.51 0.00 0.00 177.10 174.92 2df7 s LEU 289 N 1.86 4.19 -0.41 0.60 1.43 -1.26 -0.34 118.68 124.75 2df7 s LEU 289 Ca 0.09 0.26 0.03 0.00 -1.03 0.00 0.00 54.13 53.49 2df7 s LEU 289 Cb -0.16 -2.07 0.12 0.00 0.03 0.00 0.00 46.19 44.11 2df7 s LEU 289 CO 0.11 0.23 0.16 -0.32 0.23 0.00 0.00 176.35 176.77 2df7 s MET 290 N 0.03 1.48 0.60 1.70 -2.45 0.11 -4.98 119.30 115.79 2df7 s MET 290 Ca 0.09 -2.02 -0.13 0.00 -1.25 0.00 0.00 55.69 52.38 2df7 s MET 290 Cb -0.11 -2.87 -0.04 0.00 1.25 0.00 0.00 34.83 33.06 2df7 s MET 290 CO -0.00 -1.05 1.02 -1.25 1.05 0.00 0.00 175.02 174.79 2df7 s PRO 291 N 0.51 3.56 -0.10 4.11 0.04 -1.26 -0.11 135.00 141.75 2df7 s PRO 291 Ca 0.14 0.88 0.04 0.00 0.04 0.00 0.00 61.00 62.10 2df7 s PRO 291 Cb -0.22 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.24 2df7 s PRO 291 CO -0.06 -0.60 -0.23 -0.06 0.04 0.00 0.00 177.00 176.09 2df7 s PHE 292 N -2.94 2.45 -0.39 0.56 0.40 0.11 -4.91 117.98 113.27 2df7 s PHE 292 Ca 0.57 -1.01 0.12 0.00 -0.60 0.00 0.00 56.93 56.01 2df7 s PHE 292 Cb -0.12 -1.65 0.36 0.00 0.51 0.00 0.00 43.02 42.13 2df7 s PHE 292 CO 0.46 -0.41 0.79 0.09 0.70 0.00 0.00 175.22 176.85 2df7 n ASN 293 N 3.57 1.39 -4.84 1.36 3.02 -1.25 -3.33 115.26 115.18 2df7 n ASN 293 Ca -0.19 -3.07 -0.37 0.00 -0.03 0.00 0.00 54.58 50.92 2df7 n ASN 293 Cb 0.53 -0.60 -0.06 0.00 -0.61 0.00 0.00 39.78 39.04 2df7 n ASN 293 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2df7 s LEU 294 N -2.65 4.39 -0.14 3.41 1.43 -0.25 -4.98 118.68 119.90 2df7 s LEU 294 Ca 0.40 0.59 -0.01 0.00 -1.03 0.00 0.00 54.13 54.08 2df7 s LEU 294 Cb 0.36 -2.23 0.03 0.00 0.03 0.00 0.00 46.19 44.37 2df7 s LEU 294 CO -0.08 0.34 -0.06 -0.69 0.23 0.00 0.00 176.35 176.10 2df7 s VAL 295 N -0.81 1.00 -0.37 -1.59 1.01 -1.26 -0.97 120.40 117.42 2df7 s VAL 295 Ca 0.17 -0.43 -0.07 0.00 0.00 0.00 0.00 61.98 61.65 2df7 s VAL 295 Cb -0.13 -1.12 0.06 0.00 0.00 0.00 0.00 36.38 35.18 2df7 s VAL 295 CO 0.06 0.23 0.17 -0.63 0.00 0.00 0.00 175.10 174.93 2df7 s ILE 296 N 1.70 3.97 0.60 2.22 1.09 0.48 -5.01 121.20 126.24 2df7 s ILE 296 Ca 0.03 -1.27 -0.16 0.00 -1.10 0.00 0.00 60.65 58.15 2df7 s ILE 296 Cb -0.14 -3.34 -0.03 0.00 -1.06 0.00 0.00 42.46 37.89 2df7 s ILE 296 CO -0.08 -0.33 1.08 -2.16 -0.10 0.00 0.00 174.94 173.35 2df7 s PRO 297 N 1.40 3.19 0.29 2.79 0.04 -1.26 -2.17 135.00 139.28 2df7 s PRO 297 Ca 0.01 1.34 -0.00 0.00 0.04 0.00 0.00 61.00 62.39 2df7 s PRO 297 Cb -0.21 -2.01 0.50 0.00 0.04 0.00 0.00 34.50 32.83 2df7 s PRO 297 CO 0.02 -0.93 1.88 1.15 0.04 0.00 0.00 177.00 179.16 2df7 h THR 298 N 0.51 1.04 0.00 1.26 2.02 -1.93 -1.96 112.91 113.84 2df7 h THR 298 Ca -0.47 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.34 2df7 h THR 298 Cb 1.24 -0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 2df7 h THR 298 CO 0.56 0.20 0.00 -0.46 0.37 0.00 0.00 175.52 176.19 2df7 n ASN 299 N -4.52 0.63 0.08 4.18 6.94 -1.26 -1.88 115.26 119.43 2df7 n ASN 299 Ca 0.16 0.72 0.12 0.00 -0.02 0.00 0.00 54.58 55.55 2df7 n ASN 299 Cb 0.23 -0.83 0.07 0.00 -2.36 0.00 0.00 39.78 36.90 2df7 n ASN 299 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 2df7 h GLU 300 N 0.00 0.00 -6.26 -3.83 5.08 -1.73 -3.43 114.58 104.40 2df7 h GLU 300 Ca 0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 2df7 h GLU 300 Cb 0.18 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.33 2df7 h GLU 300 CO 0.00 0.00 0.80 0.42 -1.00 0.00 0.00 179.01 179.23 2df7 s ILE 301 N -3.27 4.17 -0.76 3.13 1.01 -0.79 -4.88 121.20 119.81 2df7 s ILE 301 Ca 0.03 0.62 0.25 0.00 0.00 0.00 0.00 60.65 61.54 2df7 s ILE 301 Cb 0.11 -4.65 0.06 0.00 0.01 0.00 0.00 42.46 37.99 2df7 s ILE 301 CO 0.76 -1.26 1.40 0.35 0.00 0.00 0.00 174.94 176.19 2df7 n THR 302 N 6.46 0.25 -3.50 2.92 -2.24 -1.26 -4.91 114.28 111.99 2df7 n THR 302 Ca 0.05 -0.19 -0.17 0.00 -2.27 0.00 0.00 64.05 61.48 2df7 n THR 302 Cb 0.48 -0.07 -0.05 0.00 -2.10 0.00 0.00 70.33 68.59 2df7 n THR 302 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2df7 s GLN 303 N -3.11 1.10 0.14 -0.78 -2.07 -1.26 -4.88 119.66 108.79 2df7 s GLN 303 Ca 0.08 0.11 -0.34 0.00 -1.82 0.00 0.00 55.36 53.40 2df7 s GLN 303 Cb 0.15 0.52 -0.17 0.00 -1.09 0.00 0.00 33.01 32.41 2df7 s GLN 303 CO 0.70 -0.37 1.03 -2.30 -1.32 0.00 0.00 175.29 173.03 2df7 n PRO 304 N 0.67 0.69 -3.29 9.60 -0.02 -1.26 -4.88 135.00 136.50 2df7 n PRO 304 Ca -0.19 0.25 -0.38 0.00 -2.02 0.00 0.00 63.50 61.16 2df7 n PRO 304 Cb 0.59 -1.66 -0.06 0.00 -0.02 0.00 0.00 33.50 32.35 2df7 n PRO 304 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2df7 s ILE 305 N -0.28 5.13 0.00 4.25 1.09 -0.19 -3.04 121.20 128.16 2df7 s ILE 305 Ca 0.76 1.02 0.00 0.00 -1.10 0.00 0.00 60.65 61.33 2df7 s ILE 305 Cb -0.96 -3.84 0.00 0.00 -1.06 0.00 0.00 42.46 36.60 2df7 s ILE 305 CO 0.54 0.35 0.41 0.35 -0.10 0.00 0.00 174.94 176.49 2df7 n THR 306 N 3.41 0.00 -3.45 2.92 -2.24 0.57 -2.41 114.28 113.09 2df7 n THR 306 Ca -0.07 -0.44 -0.11 0.00 -2.27 0.00 0.00 64.05 61.16 2df7 n THR 306 Cb 0.52 1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 69.84 2df7 n THR 306 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2df7 s SER 307 N -0.05 -0.51 -0.01 3.42 1.04 -1.07 -2.35 113.70 114.17 2df7 s SER 307 Ca 0.00 -0.01 0.02 0.00 0.48 0.00 0.00 55.95 56.44 2df7 s SER 307 Cb 0.00 0.54 -0.00 0.00 0.10 0.00 0.00 66.02 66.66 2df7 s SER 307 CO 0.00 -0.87 -0.08 -0.51 0.98 0.00 0.00 173.24 172.76 2df7 s ILE 308 N -3.57 0.62 0.02 -1.02 2.07 0.13 -0.39 121.20 119.06 2df7 s ILE 308 Ca 0.02 -0.32 -0.01 0.00 -1.41 0.00 0.00 60.65 58.93 2df7 s ILE 308 Cb -0.01 -0.53 -0.02 0.00 0.13 0.00 0.00 42.46 42.03 2df7 s ILE 308 CO -0.12 0.18 -0.00 -1.59 -1.91 0.00 0.00 174.94 171.50 2df7 s LYS 309 N -0.07 0.34 -0.15 3.50 -2.85 -0.54 -0.86 119.74 119.11 2df7 s LYS 309 Ca 0.01 -0.59 -0.01 0.00 -1.00 0.00 0.00 55.97 54.39 2df7 s LYS 309 Cb -0.04 0.13 -0.01 0.00 -2.06 0.00 0.00 37.83 35.84 2df7 s LYS 309 CO -0.00 -0.06 -0.13 -1.17 0.10 0.00 0.00 175.35 174.09 2df7 s LEU 310 N -1.47 2.65 -0.12 2.77 2.96 -1.00 -1.03 118.68 123.43 2df7 s LEU 310 Ca -0.16 -0.39 -0.03 0.00 -0.22 0.00 0.00 54.13 53.33 2df7 s LEU 310 Cb -0.09 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 2df7 s LEU 310 CO -0.01 0.11 -0.02 -1.61 -1.32 0.00 0.00 176.35 173.51 2df7 s GLU 311 N 0.68 3.37 -0.07 1.98 2.02 -0.08 -0.94 118.70 125.67 2df7 s GLU 311 Ca -0.06 -0.46 0.05 0.00 0.02 0.00 0.00 54.97 54.52 2df7 s GLU 311 Cb -0.15 -2.87 -0.01 0.00 0.10 0.00 0.00 34.13 31.19 2df7 s GLU 311 CO 0.02 0.45 -0.24 0.42 0.02 0.00 0.00 175.26 175.93 2df7 s ILE 312 N -0.19 2.14 -0.21 -1.63 -1.09 -0.54 -0.62 121.20 119.05 2df7 s ILE 312 Ca 0.04 -1.03 -0.02 0.00 -2.23 0.00 0.00 60.65 57.42 2df7 s ILE 312 Cb -0.13 -1.79 0.01 0.00 -1.58 0.00 0.00 42.46 38.97 2df7 s ILE 312 CO 0.02 0.57 -0.11 -0.69 -1.23 0.00 0.00 174.94 173.50 2df7 s VAL 313 N -0.03 2.78 -0.18 2.92 1.01 0.20 -1.50 120.40 125.60 2df7 s VAL 313 Ca -0.07 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.06 2df7 s VAL 313 Cb -0.15 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2df7 s VAL 313 CO 0.05 0.43 0.08 -0.89 0.00 0.00 0.00 175.10 174.77 2df7 s THR 314 N 1.38 5.00 0.12 3.92 2.01 -0.23 -1.30 115.64 126.54 2df7 s THR 314 Ca 0.04 0.04 -0.01 0.00 0.31 0.00 0.00 61.69 62.08 2df7 s THR 314 Cb -0.14 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.11 2df7 s THR 314 CO -0.07 0.47 0.17 -1.54 -0.69 0.00 0.00 174.62 172.95 2df7 n SER 315 N 3.42 -0.47 -4.88 3.53 3.41 -0.58 -1.44 113.62 116.62 2df7 n SER 315 Ca -0.17 -1.61 -0.36 0.00 -0.26 0.00 0.00 58.87 56.47 2df7 n SER 315 Cb 0.52 0.86 -0.06 0.00 -0.26 0.00 0.00 64.21 65.28 2df7 n SER 315 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2df7 s LYS 316 N -2.25 3.49 0.03 4.33 1.02 -1.26 -0.62 119.74 124.47 2df7 s LYS 316 Ca 0.09 -0.11 0.18 0.00 0.02 0.00 0.00 55.97 56.15 2df7 s LYS 316 Cb -0.00 -3.17 0.77 0.00 -0.52 0.00 0.00 37.83 34.90 2df7 s LYS 316 CO 0.07 0.75 1.58 -1.13 -0.92 0.00 0.00 175.35 175.69 2df7 n SER 317 N 1.76 0.08 0.00 2.83 3.41 0.11 -4.77 113.62 117.04 2df7 n SER 317 Ca -0.18 0.52 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 2df7 n SER 317 Cb 0.54 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 2df7 n SER 317 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2df7 n GLY 318 N 0.29 -1.16 0.16 5.00 0.00 -1.26 -5.03 105.19 103.17 2df7 n GLY 318 Ca 0.04 -0.80 0.01 0.00 0.00 0.00 0.00 46.02 45.27 2df7 n GLY 318 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2df7 h GLY 319 N 0.00 0.00 0.56 -0.02 0.00 -1.98 -3.20 103.07 98.43 2df7 h GLY 319 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 2df7 h GLY 319 CO 0.00 0.00 0.45 -1.61 0.00 0.00 0.00 176.54 175.38 2df7 h GLN 320 N 0.00 0.75 -5.97 4.80 5.75 -1.98 -3.44 115.11 115.02 2df7 h GLN 320 Ca -0.01 -0.05 -0.55 0.00 -0.15 0.00 0.00 58.65 57.90 2df7 h GLN 320 Cb 1.00 -0.17 0.24 0.00 1.07 0.00 0.00 27.48 29.62 2df7 h GLN 320 CO 0.07 0.50 -1.84 0.00 -2.65 0.00 0.00 178.83 174.90 2df7 n ALA 321 N -2.37 -5.44 -2.17 3.38 0.00 -1.21 -4.97 120.51 107.73 2df7 n ALA 321 Ca 0.12 -0.67 -0.27 0.00 0.00 0.00 0.00 53.44 52.62 2df7 n ALA 321 Cb 0.25 -1.14 0.01 0.00 0.00 0.00 0.00 19.45 18.57 2df7 n ALA 321 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2df7 s GLY 322 N -1.00 1.55 -0.00 0.00 0.00 -1.23 -5.03 107.32 101.61 2df7 s GLY 322 Ca 0.40 -0.54 0.10 0.00 0.00 0.00 0.00 44.72 44.69 2df7 s GLY 322 CO 0.82 -0.32 0.43 1.22 0.00 0.00 0.00 173.10 175.25 2df7 n ASP 323 N -2.42 0.68 -4.27 1.64 9.92 -1.26 -4.63 116.55 116.21 2df7 n ASP 323 Ca 0.02 -0.68 -0.42 0.00 -0.53 0.00 0.00 54.79 53.18 2df7 n ASP 323 Cb 0.56 1.05 -0.02 0.00 -0.64 0.00 0.00 41.12 42.07 2df7 n ASP 323 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2df7 s GLN 324 N -2.07 3.94 0.19 -1.24 -1.52 -1.26 0.21 119.66 117.91 2df7 s GLN 324 Ca 0.03 -3.24 -0.30 0.00 -1.95 0.00 0.00 55.36 49.90 2df7 s GLN 324 Cb 0.08 -4.38 -0.08 0.00 -0.22 0.00 0.00 33.01 28.40 2df7 s GLN 324 CO 0.43 -1.25 1.26 -1.64 -0.25 0.00 0.00 175.29 173.85 2df7 s MET 325 N -1.29 4.43 -0.02 2.91 -1.94 0.51 -4.84 119.30 119.06 2df7 s MET 325 Ca 0.30 1.97 -0.24 0.00 -1.71 0.00 0.00 55.69 56.01 2df7 s MET 325 Cb -0.09 -3.21 0.05 0.00 2.01 0.00 0.00 34.83 33.58 2df7 s MET 325 CO -0.09 -0.18 0.52 -1.54 -0.01 0.00 0.00 175.02 173.72 2df7 s SER 326 N 0.24 -0.46 0.10 3.03 1.04 -1.26 0.62 113.70 117.02 2df7 s SER 326 Ca 0.55 0.39 -0.26 0.00 0.48 0.00 0.00 55.95 57.11 2df7 s SER 326 Cb -0.35 0.45 0.08 0.00 0.10 0.00 0.00 66.02 66.31 2df7 s SER 326 CO 0.38 -0.58 0.79 -1.66 0.98 0.00 0.00 173.24 173.15 2df7 s TRP 327 N -1.52 -0.36 0.00 5.02 1.48 -0.72 -4.52 118.94 118.32 2df7 s TRP 327 Ca -0.11 0.14 0.07 0.00 -1.06 0.00 0.00 56.10 55.15 2df7 s TRP 327 Cb -0.02 0.58 -0.02 0.00 -1.16 0.00 0.00 33.47 32.85 2df7 s TRP 327 CO 0.06 -0.75 -0.22 -1.54 -4.06 0.00 0.00 176.95 170.43 2df7 s SER 328 N -2.68 2.60 0.07 -2.66 1.04 0.66 -0.82 113.70 111.91 2df7 s SER 328 Ca 0.05 -0.44 0.04 0.00 0.48 0.00 0.00 55.95 56.09 2df7 s SER 328 Cb -0.02 -0.27 -0.03 0.00 0.10 0.00 0.00 66.02 65.80 2df7 s SER 328 CO -0.07 0.25 -0.12 0.00 0.98 0.00 0.00 173.24 174.28 2df7 s ALA 329 N -0.59 1.01 0.01 5.32 0.00 -0.16 -0.48 121.76 126.86 2df7 s ALA 329 Ca 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.09 2df7 s ALA 329 Cb -0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 2df7 s ALA 329 CO -0.00 0.09 -0.02 -1.12 0.00 0.00 0.00 175.76 174.71 2df7 s SER 330 N -1.78 0.22 0.00 0.00 0.01 -0.80 -0.90 113.70 110.45 2df7 s SER 330 Ca -0.03 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.00 2df7 s SER 330 Cb -0.09 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.17 2df7 s SER 330 CO 0.02 -0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.16 2df7 n GLY 331 N 2.42 2.93 3.12 3.44 0.00 0.40 -0.30 105.19 117.20 2df7 n GLY 331 Ca -0.17 -0.51 -0.19 0.00 0.00 0.00 0.00 46.02 45.14 2df7 n GLY 331 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2df7 s SER 332 N 0.00 1.53 0.21 1.61 0.01 -1.17 -1.43 113.70 114.46 2df7 s SER 332 Ca 0.00 -0.44 0.11 0.00 1.31 0.00 0.00 55.95 56.94 2df7 s SER 332 Cb 0.00 -0.09 -0.05 0.00 0.21 0.00 0.00 66.02 66.09 2df7 s SER 332 CO 0.00 0.02 -0.22 -0.76 0.41 0.00 0.00 173.24 172.69 2df7 s LEU 333 N -1.09 2.47 -0.12 2.44 1.43 0.59 -2.56 118.68 121.85 2df7 s LEU 333 Ca 0.01 -0.90 -0.00 0.00 -1.03 0.00 0.00 54.13 52.20 2df7 s LEU 333 Cb -0.08 -1.11 0.02 0.00 0.03 0.00 0.00 46.19 45.06 2df7 s LEU 333 CO 0.01 0.08 -0.09 0.00 0.23 0.00 0.00 176.35 176.58 2df7 s ALA 334 N -1.91 1.45 -0.30 4.21 0.00 0.32 -1.10 121.76 124.43 2df7 s ALA 334 Ca 0.22 -0.63 -0.10 0.00 0.00 0.00 0.00 51.96 51.44 2df7 s ALA 334 Cb -0.07 -0.95 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 2df7 s ALA 334 CO 0.10 -0.41 0.17 0.08 0.00 0.00 0.00 175.76 175.71 2df7 s VAL 335 N 1.66 4.93 -0.27 0.00 1.01 0.63 -1.15 120.40 127.21 2df7 s VAL 335 Ca 0.05 -0.15 -0.07 0.00 0.00 0.00 0.00 61.98 61.81 2df7 s VAL 335 Cb -0.13 -3.44 -0.00 0.00 0.00 0.00 0.00 36.38 32.81 2df7 s VAL 335 CO -0.09 0.15 0.06 -0.89 0.00 0.00 0.00 175.10 174.34 2df7 s THR 336 N 1.68 4.02 -0.44 3.92 2.01 0.85 -0.79 115.64 126.89 2df7 s THR 336 Ca 0.06 -0.50 -0.18 0.00 0.31 0.00 0.00 61.69 61.38 2df7 s THR 336 Cb -0.16 -2.98 0.03 0.00 0.01 0.00 0.00 72.50 69.39 2df7 s THR 336 CO 0.08 0.20 0.49 -0.63 -0.69 0.00 0.00 174.62 174.07 2df7 s ILE 337 N 1.54 5.03 0.09 1.82 -1.09 0.41 -0.91 121.20 128.08 2df7 s ILE 337 Ca 0.04 -0.34 -0.32 0.00 -2.23 0.00 0.00 60.65 57.80 2df7 s ILE 337 Cb -0.16 -4.10 -0.11 0.00 -1.58 0.00 0.00 42.46 36.50 2df7 s ILE 337 CO 0.02 -0.51 1.82 1.41 -1.23 0.00 0.00 174.94 176.45 2df7 n HIS 338 N 5.75 2.52 -0.95 3.97 8.25 -0.90 -0.84 115.22 133.02 2df7 n HIS 338 Ca -0.07 -0.08 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 2df7 n HIS 338 Cb 0.47 -2.70 0.00 0.00 1.12 0.00 0.00 29.99 28.88 2df7 n HIS 338 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2df7 n GLY 339 N 4.17 0.17 0.36 -1.41 0.00 -0.93 -4.59 105.19 102.96 2df7 n GLY 339 Ca 0.19 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.31 2df7 n GLY 339 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2df7 h GLY 340 N 0.00 0.89 -0.44 -0.02 0.00 -0.99 -2.10 103.07 100.41 2df7 h GLY 340 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2df7 h GLY 340 CO 0.00 0.14 0.00 0.70 0.00 0.00 0.00 176.54 177.38 2df7 n ASN 341 N -4.49 1.25 -4.68 0.19 3.02 0.16 -4.05 115.26 106.66 2df7 n ASN 341 Ca 0.12 -1.62 -0.42 0.00 -0.03 0.00 0.00 54.58 52.64 2df7 n ASN 341 Cb 0.36 -0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.43 2df7 n ASN 341 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2df7 s TYR 342 N -1.86 2.61 -0.22 3.10 5.04 -0.79 -4.88 117.35 120.34 2df7 s TYR 342 Ca 0.32 0.64 -0.38 0.00 -2.44 0.00 0.00 57.07 55.21 2df7 s TYR 342 Cb 0.17 -3.74 -0.14 0.00 0.35 0.00 0.00 41.96 38.60 2df7 s TYR 342 CO 0.26 -2.85 1.80 -2.30 -1.34 0.00 0.00 175.55 171.12 2df7 n PRO 343 N 5.92 1.50 0.00 4.97 -0.02 -1.26 -0.43 135.00 145.68 2df7 n PRO 343 Ca 0.14 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2df7 n PRO 343 Cb 0.43 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 2df7 n PRO 343 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2df7 n GLY 344 N 4.32 2.94 0.22 -1.23 0.00 0.66 -4.87 105.19 107.23 2df7 n GLY 344 Ca 0.25 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 2df7 n GLY 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2df7 h ALA 345 N 0.00 0.67 0.00 4.61 0.00 -0.94 -2.55 119.26 121.04 2df7 h ALA 345 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2df7 h ALA 345 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2df7 h ALA 345 CO 0.00 0.68 -0.49 1.28 0.00 0.00 0.00 179.25 180.72 2df7 n LEU 346 N -3.98 0.00 -4.20 0.00 4.77 -1.26 -4.92 117.00 107.42 2df7 n LEU 346 Ca -0.03 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.76 2df7 n LEU 346 Cb 0.60 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.57 2df7 n LEU 346 CO 0.47 0.00 -0.46 0.00 -1.33 0.00 0.00 177.39 176.07 2df7 s ARG 347 N -1.46 0.88 0.59 3.23 1.70 -1.26 -4.21 118.95 118.42 2df7 s ARG 347 Ca 0.00 -1.02 -0.08 0.00 -0.47 0.00 0.00 55.73 54.16 2df7 s ARG 347 Cb 0.00 -0.91 0.13 0.00 -0.57 0.00 0.00 34.95 33.60 2df7 s ARG 347 CO 0.00 0.20 0.80 -0.35 -1.08 0.00 0.00 175.30 174.87 2df7 n PRO 348 N 1.15 -0.56 -4.07 3.89 -0.04 -1.26 -0.24 135.00 133.87 2df7 n PRO 348 Ca -0.20 -1.45 -0.15 0.00 -0.04 0.00 0.00 63.50 61.66 2df7 n PRO 348 Cb 0.54 -0.75 -0.15 0.00 -0.04 0.00 0.00 33.50 33.10 2df7 n PRO 348 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2df7 s VAL 349 N -2.60 0.30 -0.17 0.52 1.01 -0.72 -4.38 120.40 114.36 2df7 s VAL 349 Ca 0.47 -0.13 -0.00 0.00 0.00 0.00 0.00 61.98 62.32 2df7 s VAL 349 Cb -0.02 -0.28 0.00 0.00 0.00 0.00 0.00 36.38 36.09 2df7 s VAL 349 CO 0.32 0.10 -0.15 -0.89 0.00 0.00 0.00 175.10 174.49 2df7 s THR 350 N 0.10 2.62 -0.17 3.92 2.01 -0.41 0.06 115.64 123.77 2df7 s THR 350 Ca -0.01 -0.77 -0.07 0.00 0.31 0.00 0.00 61.69 61.15 2df7 s THR 350 Cb -0.04 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 2df7 s THR 350 CO -0.00 0.51 0.06 -0.76 -0.69 0.00 0.00 174.62 173.73 2df7 s LEU 351 N 1.02 3.82 -0.25 4.42 1.43 0.04 -0.27 118.68 128.89 2df7 s LEU 351 Ca -0.01 0.11 0.03 0.00 -1.03 0.00 0.00 54.13 53.22 2df7 s LEU 351 Cb -0.15 -1.95 0.06 0.00 0.03 0.00 0.00 46.19 44.18 2df7 s LEU 351 CO -0.03 0.21 -0.11 -0.69 0.23 0.00 0.00 176.35 175.96 2df7 s VAL 352 N 0.15 2.10 -0.08 -1.59 1.01 -0.52 -1.69 120.40 119.78 2df7 s VAL 352 Ca 0.05 -1.57 -0.01 0.00 0.00 0.00 0.00 61.98 60.44 2df7 s VAL 352 Cb -0.12 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 2df7 s VAL 352 CO 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 175.10 175.08 2df7 s ALA 353 N 1.14 3.25 0.07 5.51 0.00 0.58 -0.64 121.76 131.66 2df7 s ALA 353 Ca -0.08 -0.83 0.06 0.00 0.00 0.00 0.00 51.96 51.11 2df7 s ALA 353 Cb -0.20 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.46 2df7 s ALA 353 CO -0.05 0.59 -0.15 1.52 0.00 0.00 0.00 175.76 177.66 2df7 s TYR 354 N -0.90 1.33 0.08 0.00 -0.85 -0.78 -0.93 117.35 115.30 2df7 s TYR 354 Ca 0.14 -0.43 -0.11 0.00 -0.52 0.00 0.00 57.07 56.15 2df7 s TYR 354 Cb -0.11 -0.75 0.01 0.00 0.38 0.00 0.00 41.96 41.48 2df7 s TYR 354 CO 0.03 0.08 0.26 -1.83 -1.52 0.00 0.00 175.55 172.57 2df7 s GLU 355 N -1.62 0.87 -1.03 -3.49 -1.05 -0.79 -1.31 118.70 110.29 2df7 s GLU 355 Ca 0.00 -0.78 0.00 0.00 -0.15 0.00 0.00 54.97 54.05 2df7 s GLU 355 Cb -0.09 0.37 0.00 0.00 -0.44 0.00 0.00 34.13 33.96 2df7 s GLU 355 CO 0.02 -0.29 0.00 0.54 0.95 0.00 0.00 175.26 176.48 2df7 n ARG 356 N 0.11 -0.75 -3.37 -4.83 3.00 -0.74 -2.01 116.66 108.08 2df7 n ARG 356 Ca -0.16 0.75 -0.38 0.00 -0.01 0.00 0.00 57.85 58.04 2df7 n ARG 356 Cb 0.62 -4.73 -0.06 0.00 0.00 0.00 0.00 32.46 28.29 2df7 n ARG 356 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2df7 s VAL 357 N -2.42 4.94 0.18 1.55 1.01 -0.71 -2.49 120.40 122.46 2df7 s VAL 357 Ca 0.00 1.02 -0.33 0.00 0.00 0.00 0.00 61.98 62.67 2df7 s VAL 357 Cb 0.00 -3.81 -0.14 0.00 0.00 0.00 0.00 36.38 32.43 2df7 s VAL 357 CO 0.00 0.52 1.47 0.00 0.00 0.00 0.00 175.10 177.08 2df7 n ALA 358 N 2.15 0.92 -1.75 5.51 0.00 -1.26 -4.22 120.51 121.86 2df7 n ALA 358 Ca -0.11 0.44 -0.42 0.00 0.00 0.00 0.00 53.44 53.36 2df7 n ALA 358 Cb 0.52 -2.28 -0.00 0.00 0.00 0.00 0.00 19.45 17.68 2df7 n ALA 358 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2df7 n THR 359 N 2.64 1.87 -0.57 0.00 -1.04 -1.26 -1.75 114.28 114.17 2df7 n THR 359 Ca 0.15 -0.47 0.00 0.00 -2.04 0.00 0.00 64.05 61.69 2df7 n THR 359 Cb 0.29 -1.87 0.00 0.00 -1.82 0.00 0.00 70.33 66.92 2df7 n THR 359 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2df7 n GLY 360 N 0.75 1.30 3.73 3.41 0.00 -0.37 -4.71 105.19 109.31 2df7 n GLY 360 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2df7 n GLY 360 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2df7 s SER 361 N -3.16 3.12 -0.18 1.61 0.01 -0.71 -4.68 113.70 109.72 2df7 s SER 361 Ca 0.00 1.10 -0.02 0.00 1.31 0.00 0.00 55.95 58.34 2df7 s SER 361 Cb 0.00 -1.73 -0.01 0.00 0.21 0.00 0.00 66.02 64.49 2df7 s SER 361 CO 0.00 -2.81 -0.08 -0.69 0.41 0.00 0.00 173.24 170.07 2df7 s VAL 362 N -3.11 3.26 -0.32 3.43 1.01 -1.26 -1.46 120.40 121.95 2df7 s VAL 362 Ca 0.64 -0.56 -0.12 0.00 0.00 0.00 0.00 61.98 61.94 2df7 s VAL 362 Cb -0.17 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.75 2df7 s VAL 362 CO 0.55 0.47 0.22 -0.69 0.00 0.00 0.00 175.10 175.66 2df7 s VAL 363 N 0.92 5.30 -0.13 2.92 1.01 0.49 -1.39 120.40 129.52 2df7 s VAL 363 Ca -0.01 -0.06 -0.12 0.00 0.00 0.00 0.00 61.98 61.78 2df7 s VAL 363 Cb -0.15 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 2df7 s VAL 363 CO 0.00 0.09 0.27 -0.89 0.00 0.00 0.00 175.10 174.58 2df7 s THR 364 N 1.74 5.30 -0.09 3.92 2.01 0.74 -0.68 115.64 128.58 2df7 s THR 364 Ca 0.06 0.51 0.04 0.00 0.31 0.00 0.00 61.69 62.61 2df7 s THR 364 Cb -0.17 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 68.74 2df7 s THR 364 CO 0.11 0.47 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.61 2df7 s VAL 365 N -0.07 2.44 -0.09 3.82 1.01 0.73 -2.10 120.40 126.15 2df7 s VAL 365 Ca 0.17 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 2df7 s VAL 365 Cb -0.13 -1.95 0.05 0.00 0.00 0.00 0.00 36.38 34.35 2df7 s VAL 365 CO 0.05 0.56 0.19 0.00 0.00 0.00 0.00 175.10 175.90 2df7 s ALA 366 N 0.04 -0.33 0.37 5.51 0.00 -0.68 -0.91 121.76 125.75 2df7 s ALA 366 Ca -0.08 0.74 -0.15 0.00 0.00 0.00 0.00 51.96 52.48 2df7 s ALA 366 Cb -0.15 -0.68 0.04 0.00 0.00 0.00 0.00 23.12 22.33 2df7 s ALA 366 CO 0.05 -0.36 0.74 0.20 0.00 0.00 0.00 175.76 176.39 2df7 s GLY 367 N 1.71 0.46 -0.00 0.00 0.00 0.12 -0.39 107.32 109.22 2df7 s GLY 367 Ca -0.04 -0.80 0.02 0.00 0.00 0.00 0.00 44.72 43.91 2df7 s GLY 367 CO -0.07 -0.38 -0.07 0.14 0.00 0.00 0.00 173.10 172.72 2df7 s VAL 368 N -2.63 0.59 -0.06 1.40 1.01 -0.05 -1.22 120.40 119.44 2df7 s VAL 368 Ca 0.17 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.82 2df7 s VAL 368 Cb -0.05 -0.50 -0.00 0.00 0.00 0.00 0.00 36.38 35.83 2df7 s VAL 368 CO 0.12 0.13 -0.21 -0.44 0.00 0.00 0.00 175.10 174.69 2df7 s SER 369 N -0.28 2.67 -0.11 3.32 0.01 -0.02 -1.72 113.70 117.57 2df7 s SER 369 Ca 0.02 -0.45 0.01 0.00 1.31 0.00 0.00 55.95 56.84 2df7 s SER 369 Cb -0.03 -0.89 -0.02 0.00 0.21 0.00 0.00 66.02 65.28 2df7 s SER 369 CO -0.00 0.18 -0.14 0.20 0.41 0.00 0.00 173.24 173.89 2df7 s ASN 370 N 0.09 3.99 0.15 2.44 0.01 0.09 -0.64 114.94 121.07 2df7 s ASN 370 Ca -0.08 -0.30 0.05 0.00 -0.71 0.00 0.00 52.86 51.82 2df7 s ASN 370 Cb -0.14 -1.40 -0.04 0.00 0.41 0.00 0.00 41.25 40.07 2df7 s ASN 370 CO 0.04 0.21 -0.11 -0.36 -1.51 0.00 0.00 177.10 175.37 2df7 s PHE 371 N 0.06 1.33 -0.20 2.20 0.40 0.40 -0.11 117.98 122.06 2df7 s PHE 371 Ca -0.05 -0.69 -0.08 0.00 -0.60 0.00 0.00 56.93 55.50 2df7 s PHE 371 Cb -0.15 -0.67 -0.04 0.00 0.51 0.00 0.00 43.02 42.67 2df7 s PHE 371 CO 0.04 0.13 0.09 -1.21 0.70 0.00 0.00 175.22 174.97 2df7 s GLU 372 N -3.50 4.02 0.09 0.44 2.02 -0.62 -1.68 118.70 119.47 2df7 s GLU 372 Ca 0.15 -0.31 0.02 0.00 0.02 0.00 0.00 54.97 54.85 2df7 s GLU 372 Cb 0.01 -3.30 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 2df7 s GLU 372 CO 0.02 0.23 -0.07 -0.51 0.02 0.00 0.00 175.26 174.96 2df7 s LEU 373 N 0.50 2.50 -0.18 1.80 1.43 0.03 -1.52 118.68 123.24 2df7 s LEU 373 Ca 0.05 -0.98 0.01 0.00 -1.03 0.00 0.00 54.13 52.17 2df7 s LEU 373 Cb -0.12 -0.07 0.02 0.00 0.03 0.00 0.00 46.19 46.05 2df7 s LEU 373 CO 0.00 -0.46 -0.19 -0.63 0.23 0.00 0.00 176.35 175.30 2df7 s ILE 374 N -3.52 2.05 0.74 -0.59 1.01 -0.80 -1.39 121.20 118.71 2df7 s ILE 374 Ca 0.11 -0.96 -0.14 0.00 0.00 0.00 0.00 60.65 59.66 2df7 s ILE 374 Cb 0.05 -1.86 0.05 0.00 0.01 0.00 0.00 42.46 40.70 2df7 s ILE 374 CO -0.05 0.52 1.16 -2.16 0.00 0.00 0.00 174.94 174.41 2df7 s PRO 375 N 1.29 2.15 0.96 2.79 0.04 -1.26 -1.40 135.00 139.56 2df7 s PRO 375 Ca 0.04 1.58 -0.14 0.00 0.04 0.00 0.00 61.00 62.53 2df7 s PRO 375 Cb -0.13 -1.85 0.17 0.00 0.04 0.00 0.00 34.50 32.72 2df7 s PRO 375 CO -0.13 -1.79 1.15 0.54 0.04 0.00 0.00 177.00 176.81 2df7 s ASN 376 N -2.39 3.07 0.24 6.66 2.20 -0.34 -4.41 114.94 119.98 2df7 s ASN 376 Ca 0.70 0.86 -0.06 0.00 -0.94 0.00 0.00 52.86 53.43 2df7 s ASN 376 Cb -0.25 -1.35 0.43 0.00 -2.00 0.00 0.00 41.25 38.08 2df7 s ASN 376 CO 0.47 -2.81 1.69 -0.65 -2.94 0.00 0.00 177.10 172.86 2df7 h PRO 377 N -1.68 0.28 -0.22 3.55 0.11 -1.96 0.10 132.00 132.19 2df7 h PRO 377 Ca -0.50 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2df7 h PRO 377 Cb 1.32 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 2df7 h PRO 377 CO 0.56 0.18 -0.02 1.49 -0.21 0.00 0.00 178.00 180.00 2df7 h GLU 378 N 0.29 0.39 0.00 1.05 4.57 -1.95 -3.06 114.58 115.88 2df7 h GLU 378 Ca 0.40 -0.13 -0.07 0.00 -1.18 0.00 0.00 59.36 58.37 2df7 h GLU 378 Cb 0.65 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.20 2df7 h GLU 378 CO -0.48 0.60 -0.35 1.25 -1.18 0.00 0.00 179.01 178.86 2df7 h LEU 379 N 0.14 0.00 -2.34 1.64 5.85 -1.74 -2.83 115.31 116.03 2df7 h LEU 379 Ca 0.06 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.79 2df7 h LEU 379 Cb 0.44 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 2df7 h LEU 379 CO 0.01 0.35 0.04 0.00 -0.34 0.00 0.00 178.44 178.51 2df7 h ALA 380 N 1.65 1.68 0.00 1.25 0.00 -0.70 0.13 119.26 123.27 2df7 h ALA 380 Ca -0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2df7 h ALA 380 Cb 0.68 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2df7 h ALA 380 CO 0.05 -0.07 -0.18 0.87 0.00 0.00 0.00 179.25 179.92 2df7 h LYS 381 N 0.00 0.00 0.00 0.00 1.57 -1.52 -3.28 116.57 113.33 2df7 h LYS 381 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2df7 h LYS 381 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2df7 h LYS 381 CO -0.00 0.18 0.00 0.09 -0.57 0.00 0.00 179.45 179.15 2df7 n ASN 382 N -3.82 1.06 -4.14 0.86 3.02 -0.14 -4.99 115.26 107.12 2df7 n ASN 382 Ca -0.02 -1.21 -0.33 0.00 -0.03 0.00 0.00 54.58 52.99 2df7 n ASN 382 Cb 0.28 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.30 2df7 n ASN 382 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2df7 s LEU 383 N -0.21 3.14 0.37 3.41 1.98 -0.19 -5.10 118.68 122.08 2df7 s LEU 383 Ca 0.00 -1.05 -0.26 0.00 -2.89 0.00 0.00 54.13 49.93 2df7 s LEU 383 Cb 0.00 -1.59 -0.09 0.00 0.66 0.00 0.00 46.19 45.17 2df7 s LEU 383 CO 0.00 -0.14 1.13 -0.69 -1.89 0.00 0.00 176.35 174.76 2df7 s VAL 384 N 1.23 3.33 0.11 1.68 1.01 -1.26 -4.74 120.40 121.76 2df7 s VAL 384 Ca -0.03 1.15 0.09 0.00 0.00 0.00 0.00 61.98 63.19 2df7 s VAL 384 Cb -0.17 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 2df7 s VAL 384 CO -0.06 0.13 -0.22 0.42 0.00 0.00 0.00 175.10 175.37 2df7 s THR 385 N -1.41 1.79 0.23 3.92 -4.23 -1.26 -4.71 115.64 109.97 2df7 s THR 385 Ca 0.54 -1.57 -0.07 0.00 -1.18 0.00 0.00 61.69 59.41 2df7 s THR 385 Cb -0.29 -1.62 -0.02 0.00 1.34 0.00 0.00 72.50 71.90 2df7 s THR 385 CO 0.37 -0.04 0.31 -1.61 -0.54 0.00 0.00 174.62 173.11 2df7 s GLU 386 N -1.93 1.38 0.27 3.99 2.02 -0.33 -4.70 118.70 119.40 2df7 s GLU 386 Ca 0.07 -1.45 0.14 0.00 0.02 0.00 0.00 54.97 53.76 2df7 s GLU 386 Cb -0.10 0.37 0.11 0.00 0.10 0.00 0.00 34.13 34.61 2df7 s GLU 386 CO 0.04 -0.52 1.46 1.88 0.02 0.00 0.00 175.26 178.14 2df7 h TYR 387 N 2.43 0.00 0.00 1.61 -1.99 -1.85 0.73 116.97 117.91 2df7 h TYR 387 Ca -0.31 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.42 2df7 h TYR 387 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.98 2df7 h TYR 387 CO 0.39 0.55 0.00 0.41 -0.00 0.00 0.00 178.16 179.51 2df7 n GLY 388 N 1.12 0.05 2.26 3.88 0.00 -1.26 -4.81 105.19 106.43 2df7 n GLY 388 Ca 0.01 -1.30 -0.39 0.00 0.00 0.00 0.00 46.02 44.35 2df7 n GLY 388 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2df7 n ARG 389 N 1.49 0.00 -2.84 1.61 5.12 -1.26 -4.90 116.66 115.87 2df7 n ARG 389 Ca 0.00 0.00 -0.41 0.00 -1.93 0.00 0.00 57.85 55.51 2df7 n ARG 389 Cb 0.00 -0.95 -0.04 0.00 -1.16 0.00 0.00 32.46 30.31 2df7 n ARG 389 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2df7 s PHE 390 N 0.47 3.59 -0.40 -1.55 5.36 -1.26 -4.98 117.98 119.21 2df7 s PHE 390 Ca 0.60 1.49 0.03 0.00 -0.96 0.00 0.00 56.93 58.09 2df7 s PHE 390 Cb -0.84 -3.01 0.16 0.00 -0.34 0.00 0.00 43.02 38.99 2df7 s PHE 390 CO 0.40 -0.02 0.31 0.34 -1.46 0.00 0.00 175.22 174.79 2df7 s ASP 391 N 0.96 1.98 0.19 6.13 -1.08 -1.26 -5.04 116.67 118.55 2df7 s ASP 391 Ca 0.45 -2.84 -0.04 0.00 -0.52 0.00 0.00 52.55 49.60 2df7 s ASP 391 Cb -0.19 -0.47 0.36 0.00 -1.46 0.00 0.00 42.92 41.16 2df7 s ASP 391 CO 0.22 -0.21 1.05 -0.81 0.52 0.00 0.00 175.17 175.94 2df7 n PRO 392 N 3.16 -0.06 -0.43 4.34 -0.04 -1.26 -1.40 135.00 139.31 2df7 n PRO 392 Ca 0.24 1.04 0.08 0.00 -0.04 0.00 0.00 63.50 64.82 2df7 n PRO 392 Cb 0.44 -1.57 0.26 0.00 -0.04 0.00 0.00 33.50 32.59 2df7 n PRO 392 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2df7 n GLY 393 N -1.40 3.24 0.20 0.55 0.00 -1.26 -4.61 105.19 101.91 2df7 n GLY 393 Ca 0.12 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 45.29 2df7 n GLY 393 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2df7 h ALA 394 N 2.61 0.59 -0.52 4.61 0.00 -1.61 -1.35 119.26 123.59 2df7 h ALA 394 Ca 0.00 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2df7 h ALA 394 Cb 1.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2df7 h ALA 394 CO 0.17 0.09 -0.05 1.98 0.00 0.00 0.00 179.25 181.45 2df7 h MET 395 N 0.62 0.95 -0.64 0.00 -1.53 -1.78 -1.36 114.93 111.19 2df7 h MET 395 Ca 0.17 -0.33 -0.03 0.00 -3.44 0.00 0.00 59.70 56.06 2df7 h MET 395 Cb 0.01 -0.07 -0.03 0.00 -0.55 0.00 0.00 31.60 30.96 2df7 h MET 395 CO -0.03 0.99 0.26 -0.91 0.14 0.00 0.00 176.91 177.37 2df7 h ASN 396 N 0.82 0.86 -0.28 1.39 2.35 -1.83 0.17 115.58 119.06 2df7 h ASN 396 Ca 0.14 -0.11 -0.14 0.00 -0.55 0.00 0.00 56.30 55.64 2df7 h ASN 396 Cb 0.59 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.73 2df7 h ASN 396 CO 0.04 0.76 -0.33 0.22 -1.65 0.00 0.00 177.43 176.47 2df7 h TYR 397 N 0.92 0.95 -0.32 1.19 3.20 -1.01 0.38 116.97 122.27 2df7 h TYR 397 Ca 0.22 -0.26 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 2df7 h TYR 397 Cb 0.17 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 2df7 h TYR 397 CO 0.01 1.02 0.10 1.15 -1.64 0.00 0.00 178.16 178.80 2df7 h THR 398 N 0.68 1.21 -0.77 1.81 2.02 -0.58 -0.60 112.91 116.67 2df7 h THR 398 Ca 0.07 -0.67 -0.03 0.00 0.77 0.00 0.00 66.41 66.55 2df7 h THR 398 Cb 0.87 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 68.29 2df7 h THR 398 CO 0.08 0.23 0.36 0.11 0.37 0.00 0.00 175.52 176.67 2df7 h LYS 399 N 0.37 1.11 0.12 6.66 1.57 -0.80 -0.21 116.57 125.38 2df7 h LYS 399 Ca 0.10 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2df7 h LYS 399 Cb 0.25 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2df7 h LYS 399 CO -0.00 0.86 -0.06 1.25 -0.57 0.00 0.00 179.45 180.92 2df7 h LEU 400 N 1.10 -0.14 -0.20 2.94 5.85 -0.61 -0.14 115.31 124.11 2df7 h LEU 400 Ca 0.27 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.88 2df7 h LEU 400 Cb 0.12 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 2df7 h LEU 400 CO -0.03 0.07 -0.10 0.40 -0.34 0.00 0.00 178.44 178.44 2df7 h ILE 401 N -0.35 0.67 -0.52 4.05 1.08 -0.85 -1.78 117.51 119.82 2df7 h ILE 401 Ca -0.02 0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.39 2df7 h ILE 401 Cb 0.28 0.67 -0.02 0.00 -3.07 0.00 0.00 36.82 34.68 2df7 h ILE 401 CO 0.03 0.00 0.09 -0.07 -0.69 0.00 0.00 178.15 177.50 2df7 h LEU 402 N -0.09 0.78 -1.41 1.44 3.38 -0.97 -1.26 115.31 117.18 2df7 h LEU 402 Ca 0.11 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2df7 h LEU 402 Cb 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2df7 h LEU 402 CO -0.25 0.79 -0.29 0.77 0.09 0.00 0.00 178.44 179.55 2df7 h SER 403 N 0.79 0.00 -0.54 -0.43 4.64 -0.60 -2.13 113.55 115.28 2df7 h SER 403 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2df7 h SER 403 Cb 0.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2df7 h SER 403 CO 0.01 0.29 0.00 -0.62 -0.87 0.00 0.00 176.83 175.63 2df7 n GLU 404 N -3.90 4.61 -0.29 4.77 -0.58 -0.67 -4.64 120.64 119.93 2df7 n GLU 404 Ca -0.02 -2.92 0.11 0.00 -0.42 0.00 0.00 57.16 53.91 2df7 n GLU 404 Cb 0.36 -2.21 0.25 0.00 -0.57 0.00 0.00 31.44 29.28 2df7 n GLU 404 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2df7 h ARG 405 N 3.72 0.14 -0.23 3.49 2.43 -0.56 0.77 114.38 124.14 2df7 h ARG 405 Ca 0.00 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2df7 h ARG 405 Cb 1.87 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 31.38 2df7 h ARG 405 CO 0.45 0.09 -0.03 0.93 -1.51 0.00 0.00 179.97 179.90 2df7 h GLU 406 N 0.15 0.43 -0.17 0.20 3.07 -1.85 0.90 114.58 117.31 2df7 h GLU 406 Ca 0.52 -0.16 -0.09 0.00 -0.50 0.00 0.00 59.36 59.13 2df7 h GLU 406 Cb 1.03 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.89 2df7 h GLU 406 CO -0.70 0.65 -0.31 -0.09 -1.40 0.00 0.00 179.01 177.16 2df7 h ARG 407 N 0.18 0.33 0.00 2.33 2.43 -1.69 -2.76 114.38 115.20 2df7 h ARG 407 Ca 0.06 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2df7 h ARG 407 Cb 0.48 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2df7 h ARG 407 CO 0.02 0.61 -0.56 1.28 -1.51 0.00 0.00 179.97 179.81 2df7 n LEU 408 N -4.10 0.71 -1.63 3.80 4.77 0.18 -4.97 117.00 115.76 2df7 n LEU 408 Ca -0.01 0.26 -0.12 0.00 -0.03 0.00 0.00 56.01 56.12 2df7 n LEU 408 Cb 0.42 -0.20 0.02 0.00 -2.33 0.00 0.00 43.42 41.33 2df7 n LEU 408 CO 0.41 -0.07 -0.02 0.61 -1.33 0.00 0.00 177.39 176.99 2df7 n GLY 409 N 1.33 0.03 3.58 -0.72 0.00 0.22 -4.96 105.19 104.67 2df7 n GLY 409 Ca 0.03 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 2df7 n GLY 409 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2df7 s ILE 410 N -2.82 4.07 0.33 -0.61 1.01 -0.63 -5.01 121.20 117.54 2df7 s ILE 410 Ca 0.13 0.97 0.05 0.00 0.00 0.00 0.00 60.65 61.80 2df7 s ILE 410 Cb -0.06 -4.70 -0.02 0.00 0.01 0.00 0.00 42.46 37.70 2df7 s ILE 410 CO 0.17 -1.26 0.48 -0.54 0.00 0.00 0.00 174.94 173.78 2df7 s LYS 411 N 4.82 3.23 -0.07 2.79 1.02 -1.26 -4.88 119.74 125.39 2df7 s LYS 411 Ca 0.44 -0.81 0.18 0.00 0.02 0.00 0.00 55.97 55.80 2df7 s LYS 411 Cb -0.07 -2.79 -0.23 0.00 -0.52 0.00 0.00 37.83 34.22 2df7 s LYS 411 CO 0.27 0.12 0.46 0.25 -0.92 0.00 0.00 175.35 175.53 2df7 n THR 412 N -1.66 1.10 -4.46 2.17 -2.24 -0.93 -4.63 114.28 103.64 2df7 n THR 412 Ca -0.03 -0.73 -0.23 0.00 -2.27 0.00 0.00 64.05 60.79 2df7 n THR 412 Cb 0.58 -0.54 -0.16 0.00 -2.10 0.00 0.00 70.33 68.10 2df7 n THR 412 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2df7 s VAL 413 N -2.83 0.94 0.13 2.28 -7.23 -1.26 0.22 120.40 112.66 2df7 s VAL 413 Ca -0.07 -0.37 0.04 0.00 -1.81 0.00 0.00 61.98 59.78 2df7 s VAL 413 Cb 0.09 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 36.10 2df7 s VAL 413 CO 0.84 0.31 -0.11 0.26 -0.31 0.00 0.00 175.10 176.09 2df7 s TRP 414 N 0.73 1.22 -0.07 2.82 0.52 0.71 -4.76 118.94 120.11 2df7 s TRP 414 Ca -0.14 -0.71 -0.29 0.00 0.02 0.00 0.00 56.10 54.98 2df7 s TRP 414 Cb -0.15 -0.64 -0.02 0.00 -1.15 0.00 0.00 33.47 31.51 2df7 s TRP 414 CO 0.03 0.06 0.98 -2.14 0.02 0.00 0.00 176.95 175.91 2df7 s PRO 415 N -3.37 4.47 0.36 4.98 0.02 -1.26 -0.05 135.00 140.14 2df7 s PRO 415 Ca 0.13 1.38 0.14 0.00 0.02 0.00 0.00 61.00 62.67 2df7 s PRO 415 Cb 0.00 -3.51 1.00 0.00 0.02 0.00 0.00 34.50 32.01 2df7 s PRO 415 CO 0.01 -0.22 1.75 1.15 -0.33 0.00 0.00 177.00 179.36 2df7 h THR 416 N 4.99 0.54 -0.91 0.99 2.02 -1.34 -0.22 112.91 118.99 2df7 h THR 416 Ca -0.35 -0.17 0.04 0.00 0.77 0.00 0.00 66.41 66.71 2df7 h THR 416 Cb 1.17 0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 2df7 h THR 416 CO 0.82 0.09 0.59 0.03 0.37 0.00 0.00 175.52 177.42 2df7 h ARG 417 N 0.49 1.09 -0.22 6.66 3.08 -1.83 -0.80 114.38 122.84 2df7 h ARG 417 Ca 0.61 -0.07 -0.16 0.00 0.07 0.00 0.00 59.98 60.44 2df7 h ARG 417 Cb 1.37 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 2df7 h ARG 417 CO -0.37 0.72 -0.50 0.93 -1.07 0.00 0.00 179.97 179.68 2df7 h GLU 418 N 1.12 0.61 -0.55 0.04 5.08 -1.44 -2.08 114.58 117.36 2df7 h GLU 418 Ca 0.36 -0.36 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2df7 h GLU 418 Cb 0.04 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 2df7 h GLU 418 CO -0.11 0.97 0.09 -0.92 -1.00 0.00 0.00 179.01 178.04 2df7 h TYR 419 N 0.48 0.92 -0.64 4.33 3.20 -0.82 0.24 116.97 124.68 2df7 h TYR 419 Ca 0.02 -0.11 -0.08 0.00 3.14 0.00 0.00 58.73 61.71 2df7 h TYR 419 Cb 1.04 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 39.02 2df7 h TYR 419 CO 0.05 0.79 0.08 1.15 -1.64 0.00 0.00 178.16 178.59 2df7 h THR 420 N 0.84 1.26 -0.52 1.81 2.02 -0.98 -0.42 112.91 116.92 2df7 h THR 420 Ca 0.17 -1.05 -0.10 0.00 0.77 0.00 0.00 66.41 66.21 2df7 h THR 420 Cb 0.37 0.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.43 2df7 h THR 420 CO 0.01 0.39 -0.05 0.44 0.37 0.00 0.00 175.52 176.67 2df7 h ASP 421 N 1.00 0.91 -0.62 4.18 3.32 -0.78 -2.23 116.42 122.21 2df7 h ASP 421 Ca 0.19 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2df7 h ASP 421 Cb 0.45 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.73 2df7 h ASP 421 CO 0.02 1.00 0.35 0.15 -1.72 0.00 0.00 179.24 179.04 2df7 h PHE 422 N 0.85 0.86 -0.57 4.55 3.57 -0.43 -0.43 116.94 125.33 2df7 h PHE 422 Ca 0.15 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 2df7 h PHE 422 Cb 0.57 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 2df7 h PHE 422 CO 0.04 0.60 0.13 0.00 -2.23 0.00 0.00 178.31 176.84 2df7 h ARG 423 N 0.89 0.93 0.18 1.11 3.08 -0.51 -2.27 114.38 117.78 2df7 h ARG 423 Ca 0.23 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2df7 h ARG 423 Cb 0.02 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.95 2df7 h ARG 423 CO -0.04 0.87 -0.09 0.93 -1.07 0.00 0.00 179.97 180.57 2df7 h GLU 424 N 0.83 -0.24 0.00 0.04 5.08 -0.92 -1.06 114.58 118.32 2df7 h GLU 424 Ca 0.18 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2df7 h GLU 424 Cb 0.37 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2df7 h GLU 424 CO 0.00 0.01 0.14 0.98 -1.00 0.00 0.00 179.01 179.15 2df7 n TYR 425 N -5.10 0.60 -0.10 4.33 9.36 -0.23 -1.68 117.16 124.35 2df7 n TYR 425 Ca -0.09 0.32 -0.23 0.00 3.32 0.00 0.00 57.90 61.21 2df7 n TYR 425 Cb 0.19 -0.91 -0.12 0.00 -0.63 0.00 0.00 39.34 37.88 2df7 n TYR 425 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2df7 n PHE 426 N -2.17 0.63 0.66 2.98 -0.00 -0.86 -4.13 117.46 114.57 2df7 n PHE 426 Ca -0.01 0.21 0.01 0.00 -0.00 0.00 0.00 57.45 57.66 2df7 n PHE 426 Cb 0.17 -1.07 0.05 0.00 -0.00 0.00 0.00 39.48 38.63 2df7 n PHE 426 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.76 175.43 2df7 n MET 427 N -4.01 0.33 0.00 -4.13 2.81 -0.46 -5.11 117.12 106.56 2df7 n MET 427 Ca -0.41 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.48 2df7 n MET 427 Cb 0.86 -1.07 0.00 0.00 -0.71 0.00 0.00 33.22 32.30 2df7 n MET 427 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87