#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m19 h GLU 4 N 0.00 0.60 0.10 0.00 5.08 -1.94 0.24 114.58 118.66 3m19 h GLU 4 Ca 0.00 -0.14 -0.27 0.00 -1.00 0.00 0.00 59.36 57.95 3m19 h GLU 4 Cb 0.00 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3m19 h GLU 4 CO 0.00 0.64 -1.24 1.79 -1.00 0.00 0.00 179.01 179.20 3m19 h THR 5 N 0.57 1.49 -0.05 1.13 1.35 -1.96 -2.63 112.91 112.81 3m19 h THR 5 Ca 0.12 -3.10 -0.23 0.00 -0.55 0.00 0.00 66.41 62.65 3m19 h THR 5 Cb 0.39 2.90 0.01 0.00 -1.73 0.00 0.00 68.15 69.72 3m19 h THR 5 CO 0.02 0.90 -0.90 0.58 -0.25 0.00 0.00 175.52 175.86 3m19 h VAL 6 N 0.06 1.33 0.00 6.82 2.07 -1.83 -3.33 116.25 121.37 3m19 h VAL 6 Ca -0.13 -2.22 -0.28 0.00 0.82 0.00 0.00 66.70 64.89 3m19 h VAL 6 Cb 1.94 2.25 -0.05 0.00 -1.52 0.00 0.00 31.29 33.91 3m19 h VAL 6 CO 0.18 0.68 -1.61 0.71 0.02 0.00 0.00 177.57 177.56 3m19 h THR 7 N 0.36 0.95 0.00 2.57 1.35 -0.66 -3.42 112.91 114.07 3m19 h THR 7 Ca -0.08 -2.78 0.00 0.00 -0.55 0.00 0.00 66.41 63.00 3m19 h THR 7 Cb 1.53 2.47 0.00 0.00 -1.73 0.00 0.00 68.15 70.42 3m19 h THR 7 CO 0.17 0.54 0.00 0.61 -0.25 0.00 0.00 175.52 176.59 3m19 n GLY 8 N 1.52 0.90 2.47 5.82 0.00 -0.99 -4.74 105.19 110.17 3m19 n GLY 8 Ca -0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.69 3m19 n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m19 s THR 10 N -1.94 5.16 -0.15 0.00 2.01 -0.59 -4.51 115.64 115.61 3m19 s THR 10 Ca 0.13 0.90 -0.03 0.00 0.31 0.00 0.00 61.69 63.00 3m19 s THR 10 Cb -0.01 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.66 3m19 s THR 10 CO 0.08 0.25 -0.04 0.00 -0.69 0.00 0.00 174.62 174.23 3m19 s ASN 12 N 0.26 4.36 0.32 0.00 3.84 -0.30 -4.98 114.94 118.44 3m19 s ASN 12 Ca -0.03 -2.15 0.00 0.00 0.21 0.00 0.00 52.86 50.90 3m19 s ASN 12 Cb -0.14 -1.32 0.52 0.00 -0.55 0.00 0.00 41.25 39.75 3m19 s ASN 12 CO 0.03 -0.36 1.93 -0.08 -2.79 0.00 0.00 177.10 175.83 3m19 h GLU 13 N 7.53 0.87 -0.28 0.43 4.57 -1.96 -1.03 114.58 124.70 3m19 h GLU 13 Ca -0.07 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 3m19 h GLU 13 Cb 0.99 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.40 3m19 h GLU 13 CO 0.52 0.65 0.18 0.78 -1.18 0.00 0.00 179.01 179.97 3m19 h GLY 14 N 0.94 0.39 -1.84 1.92 0.00 -1.96 -2.17 103.07 100.36 3m19 h GLY 14 Ca 0.22 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.40 3m19 h GLY 14 CO -0.03 0.14 0.00 0.28 0.00 0.00 0.00 176.54 176.93 3m19 n LYS 15 N -4.49 2.09 -4.04 4.80 5.02 -0.83 -4.96 118.16 115.74 3m19 n LYS 15 Ca 0.01 -1.90 -0.28 0.00 -2.02 0.00 0.00 58.31 54.12 3m19 n LYS 15 Cb 0.07 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 3m19 n LYS 15 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3m19 n LYS 16 N 1.24 -3.02 -5.23 1.97 4.01 -0.46 -4.64 118.16 112.04 3m19 n LYS 16 Ca 0.14 0.36 -0.32 0.00 -0.51 0.00 0.00 58.31 57.99 3m19 n LYS 16 Cb 0.54 -4.52 -0.16 0.00 -0.51 0.00 0.00 35.03 30.38 3m19 n LYS 16 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 3m19 s GLU 17 N -6.72 2.50 -0.24 1.97 2.12 -0.79 -0.18 118.70 117.37 3m19 s GLU 17 Ca 0.13 -0.89 -0.01 0.00 0.36 0.00 0.00 54.97 54.56 3m19 s GLU 17 Cb -0.07 -2.17 0.02 0.00 0.26 0.00 0.00 34.13 32.17 3m19 s GLU 17 CO 0.91 0.42 -0.08 0.08 -0.54 0.00 0.00 175.26 176.06 3m19 s VAL 18 N -0.27 2.79 -0.32 3.70 1.01 -0.33 -1.15 120.40 125.82 3m19 s VAL 18 Ca -0.00 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 3m19 s VAL 18 Cb -0.13 -2.39 0.07 0.00 0.00 0.00 0.00 36.38 33.92 3m19 s VAL 18 CO 0.03 0.24 0.04 -0.62 0.00 0.00 0.00 175.10 174.78 3m19 s ASP 19 N 1.32 4.94 -0.07 3.32 2.15 0.12 -1.27 116.67 127.18 3m19 s ASP 19 Ca 0.01 -1.49 0.16 0.00 0.43 0.00 0.00 52.55 51.66 3m19 s ASP 19 Cb -0.16 -1.72 0.53 0.00 -0.30 0.00 0.00 42.92 41.26 3m19 s ASP 19 CO -0.05 -0.32 1.45 0.00 -0.17 0.00 0.00 175.17 176.07 3m19 n GLN 21 N 0.70 1.94 -0.82 0.00 7.27 -1.20 -1.27 117.38 124.00 3m19 n GLN 21 Ca 0.20 0.70 0.00 0.00 0.07 0.00 0.00 57.00 57.97 3m19 n GLN 21 Cb 0.69 -2.45 0.00 0.00 2.41 0.00 0.00 30.24 30.88 3m19 n GLN 21 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3m19 n GLY 22 N 3.39 1.30 3.73 1.69 0.00 -0.61 -5.00 105.19 109.68 3m19 n GLY 22 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 3m19 n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m19 s LYS 23 N -0.02 4.29 0.13 1.61 -0.14 -0.39 -4.90 119.74 120.31 3m19 s LYS 23 Ca 0.00 0.38 -0.31 0.00 -1.36 0.00 0.00 55.97 54.68 3m19 s LYS 23 Cb 0.00 -3.42 -0.10 0.00 -1.68 0.00 0.00 37.83 32.63 3m19 s LYS 23 CO 0.00 0.21 1.75 -1.12 -0.76 0.00 0.00 175.35 175.43 3m19 s SER 24 N 0.46 6.47 -0.01 2.83 0.01 -1.26 -4.32 113.70 117.87 3m19 s SER 24 Ca 0.24 2.70 0.05 0.00 1.31 0.00 0.00 55.95 60.25 3m19 s SER 24 Cb -0.15 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.50 3m19 s SER 24 CO 0.09 -0.96 -0.16 -0.76 0.41 0.00 0.00 173.24 171.86 3m19 s LEU 25 N 2.31 2.02 0.21 2.44 1.43 0.86 -5.02 118.68 122.94 3m19 s LEU 25 Ca 0.77 -0.30 0.23 0.00 -1.03 0.00 0.00 54.13 53.81 3m19 s LEU 25 Cb -0.45 -0.85 0.20 0.00 0.03 0.00 0.00 46.19 45.12 3m19 s LEU 25 CO 0.34 0.20 1.25 0.44 0.23 0.00 0.00 176.35 178.81 3m19 h ASP 26 N 5.78 0.00 -4.99 2.29 3.32 -1.92 -3.39 116.42 117.51 3m19 h ASP 26 Ca -0.36 -0.08 0.10 0.00 0.02 0.00 0.00 57.03 56.72 3m19 h ASP 26 Cb 1.15 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.60 3m19 h ASP 26 CO 0.48 0.04 0.39 -0.94 -1.72 0.00 0.00 179.24 177.50 3m19 s SER 27 N -5.04 -0.33 0.28 6.45 1.04 -1.26 -4.82 113.70 110.02 3m19 s SER 27 Ca 0.03 -0.23 -0.30 0.00 0.48 0.00 0.00 55.95 55.94 3m19 s SER 27 Cb 0.10 0.51 -0.11 0.00 0.10 0.00 0.00 66.02 66.63 3m19 s SER 27 CO 0.74 -0.89 1.53 -0.69 0.98 0.00 0.00 173.24 174.90 3m19 s VAL 28 N -3.42 2.31 0.74 5.02 1.01 -1.26 -4.92 120.40 119.88 3m19 s VAL 28 Ca 0.07 0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.20 3m19 s VAL 28 Cb -0.02 -3.17 0.04 0.00 0.00 0.00 0.00 36.38 33.24 3m19 s VAL 28 CO -0.04 0.04 1.10 -2.16 0.00 0.00 0.00 175.10 174.05 3m19 s PRO 29 N -0.54 2.38 0.69 2.72 0.04 -1.26 -5.05 135.00 133.98 3m19 s PRO 29 Ca 0.61 1.27 -0.09 0.00 0.04 0.00 0.00 61.00 62.83 3m19 s PRO 29 Cb -0.45 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.22 3m19 s PRO 29 CO 0.47 -1.56 1.04 -1.12 0.04 0.00 0.00 177.00 175.86 3m19 s SER 30 N -3.07 5.15 0.00 6.66 0.01 -1.26 -4.47 113.70 116.72 3m19 s SER 30 Ca 0.64 0.78 0.00 0.00 1.31 0.00 0.00 55.95 58.67 3m19 s SER 30 Cb -0.19 -1.53 0.00 0.00 0.21 0.00 0.00 66.02 64.51 3m19 s SER 30 CO 0.51 -1.44 0.00 0.61 0.41 0.00 0.00 173.24 173.33 3m19 n GLY 31 N -2.93 0.72 3.67 3.44 0.00 -1.26 -4.06 105.19 104.78 3m19 n GLY 31 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 3m19 n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m19 s ILE 32 N -2.36 3.41 0.42 -0.61 -1.09 -1.26 -4.83 121.20 114.87 3m19 s ILE 32 Ca 0.00 0.65 -0.26 0.00 -2.23 0.00 0.00 60.65 58.81 3m19 s ILE 32 Cb 0.00 -3.42 -0.09 0.00 -1.58 0.00 0.00 42.46 37.37 3m19 s ILE 32 CO 0.00 -0.03 1.43 -2.84 -1.23 0.00 0.00 174.94 172.27 3m19 s PRO 33 N 3.43 3.83 0.59 2.79 0.02 -1.26 -4.86 135.00 139.54 3m19 s PRO 33 Ca 0.73 2.44 0.30 0.00 0.02 0.00 0.00 61.00 64.49 3m19 s PRO 33 Cb -0.35 -2.76 1.81 0.00 0.02 0.00 0.00 34.50 33.22 3m19 s PRO 33 CO 0.30 -0.70 2.24 0.00 -0.33 0.00 0.00 177.00 178.51 3m19 h ALA 34 N 2.55 1.49 -0.27 -1.55 0.00 -1.92 -1.16 119.26 118.40 3m19 h ALA 34 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3m19 h ALA 34 Cb 1.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3m19 h ALA 34 CO 0.62 0.01 0.00 -0.40 0.00 0.00 0.00 179.25 179.49 3m19 n ASP 35 N -3.81 1.96 -4.75 0.00 5.75 -1.26 -4.34 116.55 110.11 3m19 n ASP 35 Ca -0.03 -2.11 -0.41 0.00 -0.01 0.00 0.00 54.79 52.22 3m19 n ASP 35 Cb 0.10 -0.31 -0.02 0.00 -1.03 0.00 0.00 41.12 39.85 3m19 n ASP 35 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3m19 s THR 36 N -1.64 2.84 -0.17 2.12 2.01 -0.44 -4.89 115.64 115.48 3m19 s THR 36 Ca 0.20 0.74 0.12 0.00 0.31 0.00 0.00 61.69 63.05 3m19 s THR 36 Cb 0.12 -3.47 -0.19 0.00 0.01 0.00 0.00 72.50 68.98 3m19 s THR 36 CO 0.11 0.13 0.00 -0.62 -0.69 0.00 0.00 174.62 173.55 3m19 n GLU 37 N 2.01 1.17 -3.85 4.92 1.02 0.75 -2.68 120.64 123.99 3m19 n GLU 37 Ca 0.05 0.02 -0.26 0.00 -0.02 0.00 0.00 57.16 56.95 3m19 n GLU 37 Cb 0.41 -1.41 -0.17 0.00 -0.02 0.00 0.00 31.44 30.25 3m19 n GLU 37 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 3m19 s LYS 38 N -2.40 1.16 -0.21 3.49 2.20 -0.84 0.28 119.74 123.42 3m19 s LYS 38 Ca -0.12 -0.16 0.00 0.00 -0.36 0.00 0.00 55.97 55.33 3m19 s LYS 38 Cb 0.05 -1.43 0.05 0.00 -1.51 0.00 0.00 37.83 34.99 3m19 s LYS 38 CO 0.62 -0.31 -0.06 -1.17 -0.36 0.00 0.00 175.35 174.07 3m19 s LEU 39 N 1.80 2.26 -0.40 5.43 2.96 -0.11 -1.19 118.68 129.43 3m19 s LEU 39 Ca 0.04 -1.00 -0.12 0.00 -0.22 0.00 0.00 54.13 52.83 3m19 s LEU 39 Cb -0.13 -1.11 0.04 0.00 0.50 0.00 0.00 46.19 45.49 3m19 s LEU 39 CO -0.07 -0.21 0.26 -0.62 -1.32 0.00 0.00 176.35 174.38 3m19 s ASP 40 N 1.46 5.85 -0.15 3.68 -1.08 -0.39 -1.98 116.67 124.06 3m19 s ASP 40 Ca -0.03 -1.09 0.17 0.00 -0.52 0.00 0.00 52.55 51.08 3m19 s ASP 40 Cb -0.18 -2.07 0.32 0.00 -1.46 0.00 0.00 42.92 39.54 3m19 s ASP 40 CO -0.07 -0.45 1.17 0.18 0.52 0.00 0.00 175.17 176.52 3m19 n LEU 41 N 5.04 2.46 -4.75 -1.34 4.77 0.07 -0.34 117.00 122.91 3m19 n LEU 41 Ca -0.11 -3.27 -0.41 0.00 -0.03 0.00 0.00 56.01 52.18 3m19 n LEU 41 Cb 0.45 -0.45 -0.03 0.00 -2.33 0.00 0.00 43.42 41.06 3m19 n LEU 41 CO 0.39 0.87 0.88 -1.58 -1.33 0.00 0.00 177.39 176.62 3m19 s GLN 42 N -2.96 4.51 -1.21 3.23 0.74 -1.06 -3.67 119.66 119.24 3m19 s GLN 42 Ca 0.34 1.95 -0.01 0.00 0.05 0.00 0.00 55.36 57.69 3m19 s GLN 42 Cb 0.30 -3.17 -0.01 0.00 1.10 0.00 0.00 33.01 31.23 3m19 s GLN 42 CO 0.01 -0.01 0.91 0.43 -0.55 0.00 0.00 175.29 176.08 3m19 n SER 43 N 1.55 -2.42 -0.17 6.67 7.64 -0.46 -1.58 113.62 124.84 3m19 n SER 43 Ca 0.01 -0.69 0.03 0.00 1.01 0.00 0.00 58.87 59.23 3m19 n SER 43 Cb 0.44 -4.83 0.01 0.00 -1.01 0.00 0.00 64.21 58.82 3m19 n SER 43 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3m19 n THR 44 N -4.06 0.00 -1.14 0.44 -2.24 -1.24 -2.75 114.28 103.28 3m19 n THR 44 Ca -0.26 -0.47 -0.05 0.00 -2.27 0.00 0.00 64.05 61.00 3m19 n THR 44 Cb 0.66 1.09 -0.02 0.00 -2.10 0.00 0.00 70.33 69.96 3m19 n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m19 n GLY 45 N 0.56 0.75 3.76 3.38 0.00 -1.26 -0.10 105.19 112.28 3m19 n GLY 45 Ca 0.03 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 3m19 n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m19 s LEU 46 N -1.10 4.38 -0.00 0.99 1.43 -1.26 -4.66 118.68 118.46 3m19 s LEU 46 Ca 0.00 2.76 0.03 0.00 -1.03 0.00 0.00 54.13 55.90 3m19 s LEU 46 Cb 0.00 -3.64 -0.05 0.00 0.03 0.00 0.00 46.19 42.53 3m19 s LEU 46 CO 0.00 -0.70 0.07 0.00 0.23 0.00 0.00 176.35 175.95 3m19 n ALA 47 N 1.57 2.13 -2.63 4.21 0.00 -1.26 -0.16 120.51 124.37 3m19 n ALA 47 Ca 0.04 -0.08 -0.09 0.00 0.00 0.00 0.00 53.44 53.31 3m19 n ALA 47 Cb 0.40 -0.12 -0.09 0.00 0.00 0.00 0.00 19.45 19.65 3m19 n ALA 47 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3m19 s THR 48 N -2.22 0.14 0.06 0.00 -4.23 -1.26 -4.06 115.64 104.07 3m19 s THR 48 Ca -0.01 -1.15 0.02 0.00 -1.18 0.00 0.00 61.69 59.36 3m19 s THR 48 Cb 0.02 -1.11 -0.03 0.00 1.34 0.00 0.00 72.50 72.72 3m19 s THR 48 CO 0.14 -0.64 -0.07 -0.76 -0.54 0.00 0.00 174.62 172.76 3m19 s LEU 49 N -2.44 2.36 0.40 4.79 1.43 -1.26 -4.84 118.68 119.12 3m19 s LEU 49 Ca -0.01 -0.74 0.06 0.00 -1.03 0.00 0.00 54.13 52.42 3m19 s LEU 49 Cb 0.02 -0.08 -0.07 0.00 0.03 0.00 0.00 46.19 46.08 3m19 s LEU 49 CO -0.07 -0.33 0.02 -0.94 0.23 0.00 0.00 176.35 175.26 3m19 s SER 50 N -2.18 3.55 0.19 2.29 1.04 -1.26 -4.20 113.70 113.13 3m19 s SER 50 Ca -0.02 -1.40 0.12 0.00 0.48 0.00 0.00 55.95 55.14 3m19 s SER 50 Cb -0.03 -0.24 0.66 0.00 0.10 0.00 0.00 66.02 66.51 3m19 s SER 50 CO -0.02 -0.52 1.36 0.47 0.98 0.00 0.00 173.24 175.50 3m19 n ASP 51 N -0.94 0.32 0.08 7.02 8.00 -1.26 -2.06 116.55 127.70 3m19 n ASP 51 Ca -0.05 0.63 0.11 0.00 0.71 0.00 0.00 54.79 56.19 3m19 n ASP 51 Cb 0.67 -0.66 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 3m19 n ASP 51 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3m19 n ALA 52 N -1.64 2.61 -0.13 2.24 0.00 -1.26 -4.63 120.51 117.69 3m19 n ALA 52 Ca -0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 53.44 53.09 3m19 n ALA 52 Cb 0.05 -1.02 0.04 0.00 0.00 0.00 0.00 19.45 18.52 3m19 n ALA 52 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3m19 h THR 53 N 0.00 0.73 -0.50 0.00 2.02 -1.74 -2.06 112.91 111.36 3m19 h THR 53 Ca 0.00 -0.06 -0.18 0.00 0.77 0.00 0.00 66.41 66.95 3m19 h THR 53 Cb 0.99 0.54 -0.10 0.00 -1.74 0.00 0.00 68.15 67.84 3m19 h THR 53 CO 0.00 0.03 0.12 0.49 0.37 0.00 0.00 175.52 176.53 3m19 n PHE 54 N -5.15 1.64 -1.65 3.16 3.72 -1.26 -5.02 117.46 112.90 3m19 n PHE 54 Ca 0.04 -1.31 -0.47 0.00 -0.05 0.00 0.00 57.45 55.65 3m19 n PHE 54 Cb 0.21 -0.55 -0.04 0.00 -0.94 0.00 0.00 39.48 38.17 3m19 n PHE 54 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3m19 n ARG 55 N -0.69 1.94 -0.87 -1.08 3.00 -0.78 -2.44 116.66 115.75 3m19 n ARG 55 Ca 0.35 0.70 0.00 0.00 -0.00 0.00 0.00 57.85 58.90 3m19 n ARG 55 Cb 1.16 -2.43 0.00 0.00 0.00 0.00 0.00 32.46 31.19 3m19 n ARG 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3m19 n GLY 56 N 3.08 0.67 2.52 5.14 0.00 -1.26 -4.93 105.19 110.41 3m19 n GLY 56 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3m19 n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3m19 n LEU 57 N 0.00 7.90 0.01 0.99 4.77 -1.02 -4.70 117.00 124.95 3m19 n LEU 57 Ca 0.00 -4.91 0.09 0.00 -0.03 0.00 0.00 56.01 51.16 3m19 n LEU 57 Cb 0.00 -1.36 0.39 0.00 -2.33 0.00 0.00 43.42 40.12 3m19 n LEU 57 CO 0.00 2.01 0.79 0.35 -1.33 0.00 0.00 177.39 179.21 3m19 n THR 58 N 1.71 0.78 1.01 -5.08 -2.24 -1.26 -2.41 114.28 106.79 3m19 n THR 58 Ca 0.60 0.19 0.12 0.00 -2.27 0.00 0.00 64.05 62.68 3m19 n THR 58 Cb 0.26 -0.90 0.09 0.00 -2.10 0.00 0.00 70.33 67.68 3m19 n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3m19 n LYS 59 N -1.57 2.12 -2.37 -0.78 5.02 -1.26 -4.26 118.16 115.06 3m19 n LYS 59 Ca 0.04 -1.74 -0.42 0.00 -2.02 0.00 0.00 58.31 54.17 3m19 n LYS 59 Cb 0.21 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 3m19 n LYS 59 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3m19 s LEU 60 N -2.08 4.35 -0.02 -0.35 2.96 -1.01 -4.32 118.68 118.20 3m19 s LEU 60 Ca 0.27 2.04 0.11 0.00 -0.22 0.00 0.00 54.13 56.33 3m19 s LEU 60 Cb 0.20 -3.57 -0.17 0.00 0.50 0.00 0.00 46.19 43.14 3m19 s LEU 60 CO 0.35 -0.55 0.24 0.35 -1.32 0.00 0.00 176.35 175.42 3m19 n THR 61 N 4.14 0.01 -3.64 3.68 -2.24 0.14 -2.64 114.28 113.75 3m19 n THR 61 Ca 0.10 -0.26 -0.18 0.00 -2.27 0.00 0.00 64.05 61.45 3m19 n THR 61 Cb 0.45 0.23 -0.15 0.00 -2.10 0.00 0.00 70.33 68.76 3m19 n THR 61 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 3m19 s TRP 62 N -2.76 -0.16 -0.09 4.78 -0.00 -0.63 0.04 118.94 120.12 3m19 s TRP 62 Ca -0.04 0.48 0.00 0.00 -0.00 0.00 0.00 56.10 56.55 3m19 s TRP 62 Cb 0.07 -0.31 0.02 0.00 -0.00 0.00 0.00 33.47 33.25 3m19 s TRP 62 CO 0.46 -0.33 -0.08 -1.17 -0.00 0.00 0.00 176.95 175.83 3m19 s LEU 63 N 2.29 1.28 -0.23 5.86 2.96 -0.71 -0.93 118.68 129.19 3m19 s LEU 63 Ca 0.04 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.70 3m19 s LEU 63 Cb -0.13 -0.76 0.05 0.00 0.50 0.00 0.00 46.19 45.85 3m19 s LEU 63 CO -0.07 -0.08 -0.12 0.21 -1.32 0.00 0.00 176.35 174.98 3m19 s ASN 64 N 1.35 3.94 -0.16 3.68 3.84 -0.84 -0.82 114.94 125.94 3m19 s ASN 64 Ca -0.02 -1.14 0.17 0.00 0.21 0.00 0.00 52.86 52.07 3m19 s ASN 64 Cb -0.14 -1.43 0.41 0.00 -0.55 0.00 0.00 41.25 39.55 3m19 s ASN 64 CO -0.04 -0.16 1.29 0.18 -2.79 0.00 0.00 177.10 175.58 3m19 n LEU 65 N 4.54 3.12 -4.74 3.21 4.77 0.60 -0.75 117.00 127.75 3m19 n LEU 65 Ca -0.15 -3.13 -0.37 0.00 -0.03 0.00 0.00 56.01 52.33 3m19 n LEU 65 Cb 0.44 -0.49 0.05 0.00 -2.33 0.00 0.00 43.42 41.09 3m19 n LEU 65 CO 0.21 0.75 0.91 -1.81 -1.33 0.00 0.00 177.39 176.12 3m19 s ASP 66 N -2.48 4.95 -1.32 -1.43 1.01 -1.19 -3.85 116.67 112.36 3m19 s ASP 66 Ca 0.37 2.60 -0.06 0.00 0.71 0.00 0.00 52.55 56.17 3m19 s ASP 66 Cb 0.32 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.64 3m19 s ASP 66 CO 0.05 -1.77 0.84 -1.22 0.21 0.00 0.00 175.17 173.28 3m19 n TYR 67 N -1.56 -2.26 -2.71 4.23 4.01 -0.40 -1.35 117.16 117.11 3m19 n TYR 67 Ca 0.14 0.72 0.00 0.00 -0.16 0.00 0.00 57.90 58.60 3m19 n TYR 67 Cb 0.48 -4.47 0.00 0.00 -0.31 0.00 0.00 39.34 35.03 3m19 n TYR 67 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3m19 n ASN 68 N -2.40 1.03 -1.97 7.72 4.13 -1.23 -3.62 115.26 118.93 3m19 n ASN 68 Ca -0.04 -0.20 -0.13 0.00 1.68 0.00 0.00 54.58 55.89 3m19 n ASN 68 Cb 0.58 0.00 0.05 0.00 -1.54 0.00 0.00 39.78 38.87 3m19 n ASN 68 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3m19 n GLN 69 N -0.10 2.70 -2.16 3.52 3.00 0.77 -4.33 117.38 120.79 3m19 n GLN 69 Ca 0.00 -3.78 -0.42 0.00 -0.01 0.00 0.00 57.00 52.80 3m19 n GLN 69 Cb 0.00 -1.91 -0.03 0.00 0.00 0.00 0.00 30.24 28.30 3m19 n GLN 69 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3m19 s LEU 70 N -3.39 4.39 -0.07 1.08 1.43 -1.22 -4.57 118.68 116.34 3m19 s LEU 70 Ca 0.43 2.41 0.08 0.00 -1.03 0.00 0.00 54.13 56.03 3m19 s LEU 70 Cb 0.38 -3.60 -0.12 0.00 0.03 0.00 0.00 46.19 42.88 3m19 s LEU 70 CO -0.01 -0.61 0.08 0.00 0.23 0.00 0.00 176.35 176.05 3m19 n GLN 71 N 3.14 1.90 -3.82 1.70 6.02 -1.26 0.04 117.38 125.10 3m19 n GLN 71 Ca 0.08 -0.03 -0.12 0.00 -0.01 0.00 0.00 57.00 56.92 3m19 n GLN 71 Cb 0.42 -1.23 -0.12 0.00 1.02 0.00 0.00 30.24 30.33 3m19 n GLN 71 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3m19 s THR 72 N -2.34 0.01 -0.08 5.09 2.01 -1.26 -1.55 115.64 117.51 3m19 s THR 72 Ca -0.04 -0.08 0.02 0.00 0.31 0.00 0.00 61.69 61.90 3m19 s THR 72 Cb 0.04 -0.27 -0.02 0.00 0.01 0.00 0.00 72.50 72.25 3m19 s THR 72 CO 0.37 -0.04 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.36 3m19 s LEU 73 N -0.08 2.74 0.53 4.42 1.43 -1.26 -4.62 118.68 121.84 3m19 s LEU 73 Ca -0.02 -0.24 -0.21 0.00 -1.03 0.00 0.00 54.13 52.63 3m19 s LEU 73 Cb -0.02 -1.58 -0.05 0.00 0.03 0.00 0.00 46.19 44.57 3m19 s LEU 73 CO 0.00 0.27 1.24 -0.94 0.23 0.00 0.00 176.35 177.16 3m19 s SER 74 N -0.30 5.56 0.53 2.29 1.04 -1.26 -4.65 113.70 116.92 3m19 s SER 74 Ca 0.02 2.48 0.30 0.00 0.48 0.00 0.00 55.95 59.24 3m19 s SER 74 Cb -0.13 -2.61 1.46 0.00 0.10 0.00 0.00 66.02 64.84 3m19 s SER 74 CO 0.03 -1.34 2.05 0.00 0.98 0.00 0.00 173.24 174.95 3m19 h ALA 75 N 1.49 1.15 -0.56 5.32 0.00 -1.95 -2.74 119.26 121.97 3m19 h ALA 75 Ca -0.50 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.31 3m19 h ALA 75 Cb 1.28 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3m19 h ALA 75 CO 0.58 0.13 0.00 0.41 0.00 0.00 0.00 179.25 180.36 3m19 n GLY 76 N -0.44 2.85 0.34 0.00 0.00 -1.26 -4.34 105.19 102.34 3m19 n GLY 76 Ca -0.01 -0.75 0.04 0.00 0.00 0.00 0.00 46.02 45.30 3m19 n GLY 76 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3m19 h VAL 77 N 3.40 1.10 -0.46 1.61 3.04 -1.75 -1.76 116.25 121.43 3m19 h VAL 77 Ca 0.00 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 3m19 h VAL 77 Cb 1.19 0.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.67 3m19 h VAL 77 CO 0.13 0.15 0.00 0.49 -1.01 0.00 0.00 177.57 177.33 3m19 n PHE 78 N -4.46 1.00 0.26 3.17 3.72 -1.26 -4.52 117.46 115.36 3m19 n PHE 78 Ca 0.09 -0.63 0.12 0.00 -0.05 0.00 0.00 57.45 56.97 3m19 n PHE 78 Cb 0.13 -0.18 0.69 0.00 -0.94 0.00 0.00 39.48 39.17 3m19 n PHE 78 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3m19 h ASP 79 N 2.88 0.00 0.59 4.37 3.32 -1.64 -1.75 116.42 124.19 3m19 h ASP 79 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3m19 h ASP 79 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3m19 h ASP 79 CO 0.14 0.14 -0.22 0.47 -1.72 0.00 0.00 179.24 178.05 3m19 n ASP 80 N -3.72 0.37 -2.56 6.45 9.92 -1.26 -4.48 116.55 121.27 3m19 n ASP 80 Ca -0.02 -0.16 -0.29 0.00 -0.53 0.00 0.00 54.79 53.80 3m19 n ASP 80 Cb 0.25 -0.08 -0.05 0.00 -0.64 0.00 0.00 41.12 40.60 3m19 n ASP 80 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 3m19 n LEU 81 N -1.29 6.62 0.29 0.64 4.77 -0.66 -4.08 117.00 123.29 3m19 n LEU 81 Ca 0.09 -4.17 0.19 0.00 -0.03 0.00 0.00 56.01 52.09 3m19 n LEU 81 Cb 0.32 -1.22 0.88 0.00 -2.33 0.00 0.00 43.42 41.07 3m19 n LEU 81 CO 0.29 1.74 1.06 0.71 -1.33 0.00 0.00 177.39 179.86 3m19 h THR 82 N 2.01 0.00 -0.47 -5.08 1.35 -1.78 -1.69 112.91 107.25 3m19 h THR 82 Ca 0.42 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 3m19 h THR 82 Cb 0.63 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 3m19 h THR 82 CO 0.95 0.00 0.00 1.21 -0.25 0.00 0.00 175.52 177.43 3m19 n GLU 83 N -3.02 2.16 -2.25 4.72 4.07 -1.26 -4.40 120.64 120.66 3m19 n GLU 83 Ca -0.01 -1.80 -0.41 0.00 -0.06 0.00 0.00 57.16 54.88 3m19 n GLU 83 Cb 0.20 -1.40 -0.03 0.00 -0.06 0.00 0.00 31.44 30.15 3m19 n GLU 83 CO 0.00 0.00 0.00 -1.17 -0.06 0.00 0.00 177.13 175.90 3m19 s LEU 84 N -1.08 4.41 -0.11 4.31 2.96 -0.64 -4.30 118.68 124.23 3m19 s LEU 84 Ca 0.34 2.33 0.08 0.00 -0.22 0.00 0.00 54.13 56.67 3m19 s LEU 84 Cb 0.18 -3.60 -0.13 0.00 0.50 0.00 0.00 46.19 43.14 3m19 s LEU 84 CO 0.24 -0.52 0.01 0.61 -1.32 0.00 0.00 176.35 175.38 3m19 n GLY 85 N 2.56 -0.49 2.95 7.98 0.00 0.11 -2.64 105.19 115.66 3m19 n GLY 85 Ca 0.07 -0.17 -0.25 0.00 0.00 0.00 0.00 46.02 45.67 3m19 n GLY 85 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m19 s THR 86 N -2.27 0.97 -0.20 2.61 2.01 -0.75 -0.23 115.64 117.78 3m19 s THR 86 Ca -0.07 -0.33 0.01 0.00 0.31 0.00 0.00 61.69 61.61 3m19 s THR 86 Cb 0.03 -0.94 0.05 0.00 0.01 0.00 0.00 72.50 71.65 3m19 s THR 86 CO 0.43 0.33 -0.09 -0.22 -0.69 0.00 0.00 174.62 174.38 3m19 s LEU 87 N 1.12 2.31 -0.37 4.42 2.96 -0.69 -1.73 118.68 126.70 3m19 s LEU 87 Ca -0.06 -0.93 -0.15 0.00 -0.22 0.00 0.00 54.13 52.76 3m19 s LEU 87 Cb -0.14 -1.21 -0.00 0.00 0.50 0.00 0.00 46.19 45.34 3m19 s LEU 87 CO -0.01 -0.17 0.34 -0.83 -1.32 0.00 0.00 176.35 174.36 3m19 s GLY 88 N 1.41 1.93 -0.07 7.98 0.00 0.00 -1.33 107.32 117.24 3m19 s GLY 88 Ca -0.02 -1.39 0.10 0.00 0.00 0.00 0.00 44.72 43.41 3m19 s GLY 88 CO -0.08 0.97 1.08 1.04 0.00 0.00 0.00 173.10 176.12 3m19 n LEU 89 N 5.34 1.29 -4.78 0.66 4.77 0.20 -0.29 117.00 124.19 3m19 n LEU 89 Ca -0.10 -2.14 -0.37 0.00 -0.03 0.00 0.00 56.01 53.36 3m19 n LEU 89 Cb 0.49 -0.23 -0.05 0.00 -2.33 0.00 0.00 43.42 41.30 3m19 n LEU 89 CO 0.41 0.50 0.73 0.00 -1.33 0.00 0.00 177.39 177.70 3m19 s ALA 90 N -1.57 3.18 -0.84 -1.18 0.00 -1.12 -4.02 121.76 116.21 3m19 s ALA 90 Ca 0.18 0.71 -0.03 0.00 0.00 0.00 0.00 51.96 52.81 3m19 s ALA 90 Cb 0.15 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 20.01 3m19 s ALA 90 CO 0.02 -0.13 0.72 0.09 0.00 0.00 0.00 175.76 176.46 3m19 n ASN 91 N 0.34 -3.53 0.00 0.00 5.03 0.26 -1.28 115.26 116.08 3m19 n ASN 91 Ca 0.03 -0.38 0.00 0.00 0.87 0.00 0.00 54.58 55.10 3m19 n ASN 91 Cb 0.49 -3.50 0.00 0.00 -1.02 0.00 0.00 39.78 35.75 3m19 n ASN 91 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3m19 n ASN 92 N -1.90 0.55 -1.39 6.41 3.02 -1.20 -3.08 115.26 117.67 3m19 n ASN 92 Ca -0.09 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.43 3m19 n ASN 92 Cb 0.57 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.85 3m19 n ASN 92 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m19 n GLN 93 N 0.00 1.92 -1.67 3.52 6.02 0.11 -4.43 117.38 122.84 3m19 n GLN 93 Ca 0.00 -3.36 -0.45 0.00 -0.01 0.00 0.00 57.00 53.18 3m19 n GLN 93 Cb 0.00 -1.54 -0.04 0.00 1.02 0.00 0.00 30.24 29.68 3m19 n GLN 93 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3m19 n LEU 94 N -0.68 3.81 0.01 1.08 4.77 -0.91 -4.32 117.00 120.75 3m19 n LEU 94 Ca 0.23 0.95 0.11 0.00 -0.03 0.00 0.00 56.01 57.26 3m19 n LEU 94 Cb 0.86 -1.46 -0.07 0.00 -2.33 0.00 0.00 43.42 40.42 3m19 n LEU 94 CO 0.10 0.07 -0.23 0.00 -1.33 0.00 0.00 177.39 176.00 3m19 n ALA 95 N 6.81 3.49 -3.58 -1.18 0.00 -0.60 -0.44 120.51 125.02 3m19 n ALA 95 Ca 0.21 -0.47 -0.05 0.00 0.00 0.00 0.00 53.44 53.12 3m19 n ALA 95 Cb 0.35 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 3m19 n ALA 95 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3m19 s SER 96 N -3.96 -0.23 -0.08 0.00 1.04 -1.26 -4.37 113.70 104.85 3m19 s SER 96 Ca 0.01 -0.08 0.04 0.00 0.48 0.00 0.00 55.95 56.40 3m19 s SER 96 Cb 0.14 0.30 -0.01 0.00 0.10 0.00 0.00 66.02 66.55 3m19 s SER 96 CO 0.85 -0.51 -0.20 -0.76 0.98 0.00 0.00 173.24 173.60 3m19 s LEU 97 N -2.52 2.35 0.44 2.42 1.43 -1.26 -4.66 118.68 116.89 3m19 s LEU 97 Ca 0.08 -0.41 -0.23 0.00 -1.03 0.00 0.00 54.13 52.54 3m19 s LEU 97 Cb -0.00 -1.47 -0.08 0.00 0.03 0.00 0.00 46.19 44.67 3m19 s LEU 97 CO -0.05 0.24 1.12 -2.16 0.23 0.00 0.00 176.35 175.73 3m19 s PRO 98 N -0.12 3.90 0.06 1.29 0.04 -1.26 -4.65 135.00 134.25 3m19 s PRO 98 Ca -0.04 1.67 -0.37 0.00 0.04 0.00 0.00 61.00 62.30 3m19 s PRO 98 Cb -0.14 -2.44 -0.19 0.00 0.04 0.00 0.00 34.50 31.77 3m19 s PRO 98 CO 0.04 -0.41 1.07 1.28 0.04 0.00 0.00 177.00 179.02 3m19 n LEU 99 N -0.36 0.33 0.00 -3.56 4.32 -1.26 -2.14 117.00 114.33 3m19 n LEU 99 Ca 0.07 1.15 0.00 0.00 -0.02 0.00 0.00 56.01 57.20 3m19 n LEU 99 Cb 0.49 -1.01 0.00 0.00 -1.62 0.00 0.00 43.42 41.28 3m19 n LEU 99 CO 0.46 -1.80 0.00 0.61 -1.22 0.00 0.00 177.39 175.45 3m19 n GLY 100 N 1.81 0.89 0.42 -0.72 0.00 -1.26 -4.92 105.19 101.40 3m19 n GLY 100 Ca 0.19 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.43 3m19 n GLY 100 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3m19 h VAL 101 N 0.00 0.64 -0.25 1.61 3.04 -1.63 -1.21 116.25 118.46 3m19 h VAL 101 Ca 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 3m19 h VAL 101 Cb 0.01 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 29.67 3m19 h VAL 101 CO 0.00 0.04 0.00 0.49 -1.01 0.00 0.00 177.57 177.09 3m19 n PHE 102 N -4.42 0.32 0.10 3.17 3.72 -1.26 -4.58 117.46 114.50 3m19 n PHE 102 Ca 0.18 -0.27 0.11 0.00 -0.05 0.00 0.00 57.45 57.42 3m19 n PHE 102 Cb 0.77 -0.01 0.59 0.00 -0.94 0.00 0.00 39.48 39.89 3m19 n PHE 102 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3m19 h ASP 103 N 2.74 0.14 0.53 4.37 5.19 -1.50 -1.15 116.42 126.73 3m19 h ASP 103 Ca 0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3m19 h ASP 103 Cb 0.71 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.19 3m19 h ASP 103 CO 0.00 0.09 -0.06 1.41 -3.12 0.00 0.00 179.24 177.57 3m19 n HIS 104 N -4.48 0.00 -2.23 4.55 8.25 -1.26 -4.40 115.22 115.65 3m19 n HIS 104 Ca 0.03 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.10 3m19 n HIS 104 Cb 0.25 -0.26 0.01 0.00 1.12 0.00 0.00 29.99 31.11 3m19 n HIS 104 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3m19 n LEU 105 N -1.20 7.55 0.15 2.41 4.77 -0.44 -4.34 117.00 125.90 3m19 n LEU 105 Ca 0.14 -5.03 0.13 0.00 -0.03 0.00 0.00 56.01 51.21 3m19 n LEU 105 Cb 0.26 -1.23 0.46 0.00 -2.33 0.00 0.00 43.42 40.58 3m19 n LEU 105 CO 0.24 2.00 0.88 0.71 -1.33 0.00 0.00 177.39 179.89 3m19 h THR 106 N 2.31 0.00 -0.50 -5.08 1.35 -1.77 -1.58 112.91 107.64 3m19 h THR 106 Ca 0.59 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 66.04 3m19 h THR 106 Cb 0.32 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 3m19 h THR 106 CO 1.29 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.56 3m19 n GLN 107 N -2.41 2.41 -1.75 4.72 6.02 -1.26 -4.34 117.38 120.77 3m19 n GLN 107 Ca 0.03 -2.17 -0.42 0.00 -0.01 0.00 0.00 57.00 54.44 3m19 n GLN 107 Cb 0.33 -1.49 -0.02 0.00 1.02 0.00 0.00 30.24 30.08 3m19 n GLN 107 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3m19 s LEU 108 N -1.24 4.35 -0.15 1.08 2.96 -0.59 -4.48 118.68 120.61 3m19 s LEU 108 Ca 0.40 2.92 0.03 0.00 -0.22 0.00 0.00 54.13 57.26 3m19 s LEU 108 Cb 0.22 -3.62 -0.11 0.00 0.50 0.00 0.00 46.19 43.18 3m19 s LEU 108 CO 0.30 -0.95 -0.10 -0.67 -1.32 0.00 0.00 176.35 173.61 3m19 n ASP 109 N 3.01 2.66 -3.92 3.68 2.03 0.68 -2.73 116.55 121.97 3m19 n ASP 109 Ca 0.12 -0.07 -0.21 0.00 0.52 0.00 0.00 54.79 55.16 3m19 n ASP 109 Cb 0.36 -0.03 -0.16 0.00 -0.72 0.00 0.00 41.12 40.57 3m19 n ASP 109 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 3m19 s LYS 110 N -2.30 0.98 -0.16 -0.67 1.02 -0.75 -0.42 119.74 117.44 3m19 s LYS 110 Ca -0.18 -0.17 -0.00 0.00 0.02 0.00 0.00 55.97 55.64 3m19 s LYS 110 Cb 0.05 -0.93 0.04 0.00 -0.52 0.00 0.00 37.83 36.47 3m19 s LYS 110 CO 0.38 -0.04 -0.08 -1.17 -0.92 0.00 0.00 175.35 173.52 3m19 s LEU 111 N 0.79 1.67 -0.33 3.17 2.96 -0.54 -1.70 118.68 124.71 3m19 s LEU 111 Ca -0.12 -0.62 -0.09 0.00 -0.22 0.00 0.00 54.13 53.08 3m19 s LEU 111 Cb -0.14 -0.99 0.01 0.00 0.50 0.00 0.00 46.19 45.57 3m19 s LEU 111 CO 0.01 -0.15 0.15 -0.31 -1.32 0.00 0.00 176.35 174.73 3m19 s TYR 112 N 1.58 3.20 -0.01 5.38 2.02 -0.44 -1.64 117.35 127.45 3m19 s TYR 112 Ca 0.02 -0.91 0.01 0.00 -0.37 0.00 0.00 57.07 55.82 3m19 s TYR 112 Cb -0.15 -2.35 0.02 0.00 -0.40 0.00 0.00 41.96 39.08 3m19 s TYR 112 CO -0.08 -0.59 0.95 1.28 -1.57 0.00 0.00 175.55 175.54 3m19 n LEU 113 N 4.94 1.76 -4.79 -1.29 4.77 0.28 -0.63 117.00 122.04 3m19 n LEU 113 Ca -0.13 -1.81 -0.34 0.00 -0.03 0.00 0.00 56.01 53.70 3m19 n LEU 113 Cb 0.47 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.55 3m19 n LEU 113 CO 0.34 0.45 0.74 -0.83 -1.33 0.00 0.00 177.39 176.76 3m19 s GLY 114 N -0.99 2.34 -0.31 -0.72 0.00 -1.10 -4.05 107.32 102.49 3m19 s GLY 114 Ca 0.02 0.59 -0.01 0.00 0.00 0.00 0.00 44.72 45.32 3m19 s GLY 114 CO 0.00 0.93 0.08 0.61 0.00 0.00 0.00 173.10 174.72 3m19 n GLY 115 N -0.42 0.36 0.00 0.20 0.00 -0.62 -0.58 105.19 104.14 3m19 n GLY 115 Ca 0.10 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.47 3m19 n GLY 115 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3m19 n ASN 116 N 1.04 1.52 -0.49 1.61 3.02 -1.07 -3.05 115.26 117.84 3m19 n ASN 116 Ca -0.03 0.00 0.07 0.00 -0.03 0.00 0.00 54.58 54.59 3m19 n ASN 116 Cb 0.53 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.89 3m19 n ASN 116 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m19 n GLN 117 N 0.00 1.53 -2.10 3.52 1.13 0.42 -4.38 117.38 117.49 3m19 n GLN 117 Ca 0.00 -3.14 -0.42 0.00 -1.94 0.00 0.00 57.00 51.50 3m19 n GLN 117 Cb 0.00 -1.60 -0.03 0.00 0.11 0.00 0.00 30.24 28.73 3m19 n GLN 117 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3m19 s LEU 118 N -3.16 4.35 -0.04 1.08 1.43 -1.02 -4.57 118.68 116.75 3m19 s LEU 118 Ca 0.37 2.34 0.17 0.00 -1.03 0.00 0.00 54.13 55.98 3m19 s LEU 118 Cb 0.35 -3.58 -0.27 0.00 0.03 0.00 0.00 46.19 42.73 3m19 s LEU 118 CO -0.05 -0.74 0.35 0.29 0.23 0.00 0.00 176.35 176.44 3m19 n LYS 119 N 4.67 0.60 -3.79 1.70 5.02 -1.26 -0.20 118.16 124.90 3m19 n LYS 119 Ca 0.13 -0.15 -0.10 0.00 -2.02 0.00 0.00 58.31 56.18 3m19 n LYS 119 Cb 0.42 -1.42 -0.05 0.00 -0.02 0.00 0.00 35.03 33.96 3m19 n LYS 119 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3m19 s SER 120 N -4.10 -0.11 -0.01 4.39 1.04 -1.26 -1.13 113.70 112.51 3m19 s SER 120 Ca -0.07 -0.57 0.04 0.00 0.48 0.00 0.00 55.95 55.84 3m19 s SER 120 Cb 0.11 0.47 -0.01 0.00 0.10 0.00 0.00 66.02 66.69 3m19 s SER 120 CO 0.72 -0.90 -0.15 -0.76 0.98 0.00 0.00 173.24 173.13 3m19 s LEU 121 N -2.88 2.01 0.49 2.42 1.43 -1.26 -4.71 118.68 116.18 3m19 s LEU 121 Ca 0.09 -0.27 -0.23 0.00 -1.03 0.00 0.00 54.13 52.69 3m19 s LEU 121 Cb 0.02 -0.77 -0.06 0.00 0.03 0.00 0.00 46.19 45.40 3m19 s LEU 121 CO -0.06 0.18 1.28 -2.16 0.23 0.00 0.00 176.35 175.81 3m19 s PRO 122 N -0.30 3.52 0.17 1.29 0.04 -1.26 -4.70 135.00 133.76 3m19 s PRO 122 Ca 0.05 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.91 3m19 s PRO 122 Cb -0.06 -2.40 0.08 0.00 0.04 0.00 0.00 34.50 32.16 3m19 s PRO 122 CO -0.00 -0.83 1.59 0.66 0.04 0.00 0.00 177.00 178.46 3m19 h SER 123 N 1.89 -1.15 -0.84 6.66 4.64 -1.98 -2.43 113.55 120.33 3m19 h SER 123 Ca -0.50 0.21 -0.42 0.00 -0.47 0.00 0.00 61.79 60.60 3m19 h SER 123 Cb 1.27 0.55 -0.25 0.00 -0.31 0.00 0.00 62.40 63.65 3m19 h SER 123 CO 0.59 -0.32 0.47 0.61 -0.87 0.00 0.00 176.83 177.32 3m19 n GLY 124 N -1.42 4.51 0.25 -0.77 0.00 -1.26 -4.51 105.19 101.98 3m19 n GLY 124 Ca 0.02 -1.11 0.07 0.00 0.00 0.00 0.00 46.02 45.00 3m19 n GLY 124 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3m19 h VAL 125 N 1.15 1.01 -0.02 1.61 3.04 -1.77 -1.35 116.25 119.91 3m19 h VAL 125 Ca 0.52 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.95 3m19 h VAL 125 Cb 2.58 1.14 0.00 0.00 -2.01 0.00 0.00 31.29 33.00 3m19 h VAL 125 CO 0.93 0.07 -0.12 0.49 -1.01 0.00 0.00 177.57 177.94 3m19 n PHE 126 N -4.39 0.00 -0.05 3.17 3.72 -1.26 -4.55 117.46 114.10 3m19 n PHE 126 Ca -0.03 0.00 0.20 0.00 -0.05 0.00 0.00 57.45 57.57 3m19 n PHE 126 Cb 0.15 0.00 0.65 0.00 -0.94 0.00 0.00 39.48 39.34 3m19 n PHE 126 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3m19 h ASP 127 N 3.72 0.10 0.52 4.37 3.32 -1.52 -1.29 116.42 125.63 3m19 h ASP 127 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3m19 h ASP 127 Cb 0.85 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.38 3m19 h ASP 127 CO 0.00 0.05 -0.28 0.54 -1.72 0.00 0.00 179.24 177.83 3m19 n ARG 128 N -4.40 0.29 -1.80 3.56 5.12 -1.26 -4.43 116.66 113.74 3m19 n ARG 128 Ca 0.11 -0.13 -0.37 0.00 -1.93 0.00 0.00 57.85 55.54 3m19 n ARG 128 Cb 0.61 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 30.39 3m19 n ARG 128 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3m19 n LEU 129 N -1.24 7.73 0.11 0.55 4.77 -0.49 -4.57 117.00 123.86 3m19 n LEU 129 Ca 0.09 -4.63 0.11 0.00 -0.03 0.00 0.00 56.01 51.55 3m19 n LEU 129 Cb 0.33 -1.36 0.46 0.00 -2.33 0.00 0.00 43.42 40.52 3m19 n LEU 129 CO 0.29 1.99 0.84 0.35 -1.33 0.00 0.00 177.39 179.54 3m19 n THR 130 N 1.75 0.82 0.28 -5.08 -2.24 -1.26 -1.62 114.28 106.92 3m19 n THR 130 Ca 0.61 0.19 0.09 0.00 -2.27 0.00 0.00 64.05 62.66 3m19 n THR 130 Cb 0.32 -1.09 0.14 0.00 -2.10 0.00 0.00 70.33 67.61 3m19 n THR 130 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3m19 n LYS 131 N -2.13 2.01 -1.73 -0.78 4.76 -1.26 -4.04 118.16 115.00 3m19 n LYS 131 Ca 0.03 -1.89 -0.42 0.00 -2.87 0.00 0.00 58.31 53.16 3m19 n LYS 131 Cb 0.24 -1.37 -0.03 0.00 -1.84 0.00 0.00 35.03 32.03 3m19 n LYS 131 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3m19 s LEU 132 N -1.24 4.37 -0.18 -0.35 2.96 -0.64 -4.59 118.68 119.02 3m19 s LEU 132 Ca 0.27 2.88 0.11 0.00 -0.22 0.00 0.00 54.13 57.17 3m19 s LEU 132 Cb 0.16 -3.60 -0.18 0.00 0.50 0.00 0.00 46.19 43.06 3m19 s LEU 132 CO 0.23 -0.97 -0.01 0.29 -1.32 0.00 0.00 176.35 174.56 3m19 n LYS 133 N 3.87 1.09 -4.89 1.98 5.02 0.44 -2.43 118.16 123.25 3m19 n LYS 133 Ca 0.15 0.03 -0.28 0.00 -2.02 0.00 0.00 58.31 56.20 3m19 n LYS 133 Cb 0.35 -1.42 -0.17 0.00 -0.02 0.00 0.00 35.03 33.77 3m19 n LYS 133 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3m19 s GLU 134 N -2.40 2.20 -0.15 1.97 2.12 -0.58 -0.37 118.70 121.49 3m19 s GLU 134 Ca -0.14 -0.64 -0.01 0.00 0.36 0.00 0.00 54.97 54.54 3m19 s GLU 134 Cb 0.06 -1.77 0.04 0.00 0.26 0.00 0.00 34.13 32.72 3m19 s GLU 134 CO 0.62 0.15 -0.01 -1.17 -0.54 0.00 0.00 175.26 174.31 3m19 s LEU 135 N 0.36 1.23 -0.21 2.70 2.96 -0.22 -1.47 118.68 124.04 3m19 s LEU 135 Ca -0.13 -0.57 -0.04 0.00 -0.22 0.00 0.00 54.13 53.17 3m19 s LEU 135 Cb -0.15 -0.70 -0.01 0.00 0.50 0.00 0.00 46.19 45.83 3m19 s LEU 135 CO 0.05 -0.23 -0.05 -0.13 -1.32 0.00 0.00 176.35 174.67 3m19 s ARG 136 N 1.79 3.39 -0.02 1.98 1.81 -0.65 -1.37 118.95 125.87 3m19 s ARG 136 Ca 0.01 -0.63 0.03 0.00 -1.72 0.00 0.00 55.73 53.43 3m19 s ARG 136 Cb -0.15 -2.97 0.05 0.00 -0.45 0.00 0.00 34.95 31.42 3m19 s ARG 136 CO -0.07 -0.15 0.86 1.28 -0.68 0.00 0.00 175.30 176.54 3m19 n LEU 137 N 4.65 1.10 -4.76 2.53 4.77 0.34 -0.56 117.00 125.09 3m19 n LEU 137 Ca -0.18 -1.37 -0.33 0.00 -0.03 0.00 0.00 56.01 54.09 3m19 n LEU 137 Cb 0.51 -0.07 0.06 0.00 -2.33 0.00 0.00 43.42 41.59 3m19 n LEU 137 CO 0.29 0.33 0.76 0.54 -1.33 0.00 0.00 177.39 177.98 3m19 s ASN 138 N -0.97 4.84 -1.06 -1.43 4.22 -0.96 -4.03 114.94 115.55 3m19 s ASN 138 Ca 0.05 2.10 -0.01 0.00 -2.14 0.00 0.00 52.86 52.86 3m19 s ASN 138 Cb 0.05 -2.56 0.00 0.00 1.28 0.00 0.00 41.25 40.01 3m19 s ASN 138 CO 0.00 -1.81 0.89 0.41 -2.04 0.00 0.00 177.10 174.55 3m19 n THR 139 N -2.50 -4.70 -2.46 0.54 -1.04 -0.04 -1.59 114.28 102.50 3m19 n THR 139 Ca 0.11 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 3m19 n THR 139 Cb 0.51 -4.47 0.00 0.00 -1.82 0.00 0.00 70.33 64.55 3m19 n THR 139 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3m19 n ASN 140 N -2.75 0.91 -2.33 8.00 3.02 -0.92 -1.82 115.26 119.36 3m19 n ASN 140 Ca -0.20 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.25 3m19 n ASN 140 Cb 0.63 0.00 0.04 0.00 -0.61 0.00 0.00 39.78 39.84 3m19 n ASN 140 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m19 n GLN 141 N 0.00 2.44 -1.73 3.52 6.02 0.72 -4.33 117.38 124.02 3m19 n GLN 141 Ca 0.00 -3.71 -0.42 0.00 -0.01 0.00 0.00 57.00 52.86 3m19 n GLN 141 Cb 0.00 -1.81 -0.03 0.00 1.02 0.00 0.00 30.24 29.42 3m19 n GLN 141 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3m19 s LEU 142 N -3.51 4.40 0.05 1.08 1.43 -0.90 -4.27 118.68 116.96 3m19 s LEU 142 Ca 0.38 2.69 0.19 0.00 -1.03 0.00 0.00 54.13 56.36 3m19 s LEU 142 Cb 0.36 -3.55 -0.15 0.00 0.03 0.00 0.00 46.19 42.88 3m19 s LEU 142 CO -0.01 -1.01 0.73 0.00 0.23 0.00 0.00 176.35 176.29 3m19 n GLN 143 N 6.28 0.63 -3.81 1.70 6.02 -0.29 -0.84 117.38 127.08 3m19 n GLN 143 Ca 0.18 0.11 -0.05 0.00 -0.01 0.00 0.00 57.00 57.23 3m19 n GLN 143 Cb 0.39 -1.74 -0.01 0.00 1.02 0.00 0.00 30.24 29.91 3m19 n GLN 143 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3m19 s SER 144 N -5.47 -0.16 -0.11 1.08 1.04 -1.26 -4.37 113.70 104.45 3m19 s SER 144 Ca -0.04 -0.60 0.01 0.00 0.48 0.00 0.00 55.95 55.79 3m19 s SER 144 Cb 0.09 0.62 -0.02 0.00 0.10 0.00 0.00 66.02 66.82 3m19 s SER 144 CO 0.82 -1.17 -0.13 -0.63 0.98 0.00 0.00 173.24 173.11 3m19 s ILE 145 N -3.28 3.09 0.44 -1.02 -1.09 -1.26 -4.63 121.20 113.46 3m19 s ILE 145 Ca 0.13 -0.66 -0.26 0.00 -2.23 0.00 0.00 60.65 57.63 3m19 s ILE 145 Cb -0.04 -2.28 -0.09 0.00 -1.58 0.00 0.00 42.46 38.48 3m19 s ILE 145 CO 0.05 0.54 1.43 -2.84 -1.23 0.00 0.00 174.94 172.90 3m19 s PRO 146 N 0.05 3.75 0.28 2.79 0.02 -1.26 -4.60 135.00 136.03 3m19 s PRO 146 Ca -0.05 2.43 -0.30 0.00 0.02 0.00 0.00 61.00 63.11 3m19 s PRO 146 Cb -0.14 -2.70 -0.13 0.00 0.02 0.00 0.00 34.50 31.54 3m19 s PRO 146 CO 0.04 -0.77 1.38 0.00 -0.33 0.00 0.00 177.00 177.33 3m19 n ALA 147 N -0.09 1.33 -0.97 -1.55 0.00 -1.26 -2.00 120.51 115.96 3m19 n ALA 147 Ca 0.04 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3m19 n ALA 147 Cb 0.41 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.58 3m19 n ALA 147 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m19 n GLY 148 N 1.66 0.83 0.40 0.00 0.00 -1.26 -4.91 105.19 101.91 3m19 n GLY 148 Ca 0.09 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.30 3m19 n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m19 h ALA 149 N 0.00 2.18 -0.19 4.61 0.00 -1.63 -1.63 119.26 122.60 3m19 h ALA 149 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3m19 h ALA 149 Cb 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3m19 h ALA 149 CO 0.00 -0.49 0.00 1.19 0.00 0.00 0.00 179.25 179.95 3m19 n PHE 150 N -4.54 0.23 -0.15 0.00 3.72 -1.26 -4.55 117.46 110.91 3m19 n PHE 150 Ca 0.20 -0.19 0.08 0.00 -0.05 0.00 0.00 57.45 57.50 3m19 n PHE 150 Cb 0.72 -0.01 0.40 0.00 -0.94 0.00 0.00 39.48 39.65 3m19 n PHE 150 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3m19 h ASP 151 N 2.82 0.57 0.49 4.37 5.19 -1.57 -0.83 116.42 127.46 3m19 h ASP 151 Ca 0.00 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 3m19 h ASP 151 Cb 0.69 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.08 3m19 h ASP 151 CO 0.00 0.36 -0.12 0.29 -3.12 0.00 0.00 179.24 176.65 3m19 n LYS 152 N -4.48 0.49 -1.76 3.56 4.76 -1.26 -4.46 118.16 115.01 3m19 n LYS 152 Ca 0.10 -0.15 -0.37 0.00 -2.87 0.00 0.00 58.31 55.03 3m19 n LYS 152 Cb 0.28 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.94 3m19 n LYS 152 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3m19 n LEU 153 N -1.12 7.81 0.15 -0.35 4.77 -0.32 -4.48 117.00 123.46 3m19 n LEU 153 Ca 0.13 -4.60 0.12 0.00 -0.03 0.00 0.00 56.01 51.62 3m19 n LEU 153 Cb 0.29 -1.38 0.55 0.00 -2.33 0.00 0.00 43.42 40.55 3m19 n LEU 153 CO 0.25 2.00 0.86 0.35 -1.33 0.00 0.00 177.39 179.52 3m19 n THR 154 N 1.93 0.90 0.14 -5.08 -2.24 -1.26 -1.76 114.28 106.91 3m19 n THR 154 Ca 0.62 0.46 0.09 0.00 -2.27 0.00 0.00 64.05 62.96 3m19 n THR 154 Cb 0.32 -1.43 0.18 0.00 -2.10 0.00 0.00 70.33 67.30 3m19 n THR 154 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3m19 n ASN 155 N -2.29 3.15 -4.71 3.42 3.02 -1.26 -4.08 115.26 112.51 3m19 n ASN 155 Ca 0.00 -1.91 -0.42 0.00 -0.03 0.00 0.00 54.58 52.22 3m19 n ASN 155 Cb 0.14 -0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 39.05 3m19 n ASN 155 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3m19 s LEU 156 N -1.23 4.37 -0.14 3.41 2.96 -0.72 -4.43 118.68 122.90 3m19 s LEU 156 Ca 0.32 2.79 0.09 0.00 -0.22 0.00 0.00 54.13 57.11 3m19 s LEU 156 Cb 0.18 -3.59 -0.15 0.00 0.50 0.00 0.00 46.19 43.13 3m19 s LEU 156 CO 0.25 -0.94 -0.01 0.00 -1.32 0.00 0.00 176.35 174.33 3m19 n GLN 157 N 4.25 1.45 -4.29 1.98 6.02 0.51 -2.22 117.38 125.07 3m19 n GLN 157 Ca 0.16 0.02 -0.21 0.00 -0.01 0.00 0.00 57.00 56.96 3m19 n GLN 157 Cb 0.36 -1.34 -0.16 0.00 1.02 0.00 0.00 30.24 30.12 3m19 n GLN 157 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3m19 s THR 158 N -2.33 0.70 -0.10 5.09 2.01 -0.52 -0.69 115.64 119.80 3m19 s THR 158 Ca -0.11 -0.23 -0.02 0.00 0.31 0.00 0.00 61.69 61.64 3m19 s THR 158 Cb 0.04 -0.68 0.03 0.00 0.01 0.00 0.00 72.50 71.91 3m19 s THR 158 CO 0.50 0.25 0.01 -0.22 -0.69 0.00 0.00 174.62 174.47 3m19 s LEU 159 N 0.76 0.73 -0.23 4.42 2.96 -0.31 -1.05 118.68 125.95 3m19 s LEU 159 Ca -0.12 -0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 53.49 3m19 s LEU 159 Cb -0.14 -0.49 -0.02 0.00 0.50 0.00 0.00 46.19 46.04 3m19 s LEU 159 CO 0.01 -0.21 0.02 -0.55 -1.32 0.00 0.00 176.35 174.30 3m19 s SER 160 N 1.94 4.84 0.00 3.68 0.15 -0.47 -1.76 113.70 122.08 3m19 s SER 160 Ca 0.04 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.44 3m19 s SER 160 Cb -0.13 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 3m19 s SER 160 CO -0.06 -0.00 0.83 0.18 1.20 0.00 0.00 173.24 175.39 3m19 n LEU 161 N 4.69 1.42 -4.77 3.45 4.77 -0.31 -0.50 117.00 125.75 3m19 n LEU 161 Ca -0.17 -1.42 -0.32 0.00 -0.03 0.00 0.00 56.01 54.07 3m19 n LEU 161 Cb 0.51 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 3m19 n LEU 161 CO 0.31 0.36 0.72 -0.94 -1.33 0.00 0.00 177.39 176.50 3m19 s SER 162 N -0.69 4.89 -1.15 -1.43 1.04 -1.13 -4.07 113.70 111.17 3m19 s SER 162 Ca 0.00 1.90 -0.14 0.00 0.48 0.00 0.00 55.95 58.19 3m19 s SER 162 Cb 0.00 -2.54 -0.02 0.00 0.10 0.00 0.00 66.02 63.56 3m19 s SER 162 CO 0.00 -1.78 0.80 0.41 0.98 0.00 0.00 173.24 173.65 3m19 n THR 163 N -2.90 -6.40 -3.29 2.02 -1.04 -0.05 -0.86 114.28 101.76 3m19 n THR 163 Ca 0.10 -0.99 0.00 0.00 -2.04 0.00 0.00 64.05 61.12 3m19 n THR 163 Cb 0.52 -4.75 0.00 0.00 -1.82 0.00 0.00 70.33 64.29 3m19 n THR 163 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3m19 n ASN 164 N -2.86 1.39 -1.13 8.00 4.13 -1.19 -1.27 115.26 122.33 3m19 n ASN 164 Ca -0.12 -0.29 -0.05 0.00 1.68 0.00 0.00 54.58 55.80 3m19 n ASN 164 Cb 0.61 0.00 0.17 0.00 -1.54 0.00 0.00 39.78 39.02 3m19 n ASN 164 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3m19 n GLN 165 N 0.00 2.05 -2.51 3.52 1.13 -0.02 -4.39 117.38 117.17 3m19 n GLN 165 Ca 0.00 -3.40 -0.42 0.00 -1.94 0.00 0.00 57.00 51.24 3m19 n GLN 165 Cb 0.00 -1.83 -0.03 0.00 0.11 0.00 0.00 30.24 28.49 3m19 n GLN 165 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3m19 s LEU 166 N -3.33 4.39 -0.01 1.08 1.43 -0.92 -4.39 118.68 116.93 3m19 s LEU 166 Ca 0.44 1.94 0.20 0.00 -1.03 0.00 0.00 54.13 55.67 3m19 s LEU 166 Cb 0.40 -3.58 -0.23 0.00 0.03 0.00 0.00 46.19 42.80 3m19 s LEU 166 CO -0.02 -0.38 0.75 0.00 0.23 0.00 0.00 176.35 176.92 3m19 n GLN 167 N 3.69 0.57 -3.76 1.70 6.02 -1.26 -1.79 117.38 122.55 3m19 n GLN 167 Ca 0.07 -0.04 -0.04 0.00 -0.01 0.00 0.00 57.00 56.98 3m19 n GLN 167 Cb 0.47 -1.43 -0.01 0.00 1.02 0.00 0.00 30.24 30.29 3m19 n GLN 167 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3m19 s SER 168 N -3.15 -0.20 0.04 1.08 1.04 -1.26 -0.72 113.70 110.53 3m19 s SER 168 Ca 0.04 -0.42 0.08 0.00 0.48 0.00 0.00 55.95 56.14 3m19 s SER 168 Cb 0.14 0.53 -0.03 0.00 0.10 0.00 0.00 66.02 66.76 3m19 s SER 168 CO 0.81 -0.97 -0.24 0.68 0.98 0.00 0.00 173.24 174.50 3m19 s VAL 169 N -3.39 1.95 0.51 5.02 -7.23 -1.26 -4.73 120.40 111.27 3m19 s VAL 169 Ca 0.12 -1.31 -0.23 0.00 -1.81 0.00 0.00 61.98 58.75 3m19 s VAL 169 Cb -0.02 -1.67 -0.06 0.00 0.56 0.00 0.00 36.38 35.18 3m19 s VAL 169 CO 0.03 0.31 1.36 -2.84 -0.31 0.00 0.00 175.10 173.65 3m19 s PRO 170 N -1.20 3.37 0.11 4.82 0.02 -1.26 -4.85 135.00 136.00 3m19 s PRO 170 Ca 0.10 2.26 -0.36 0.00 0.02 0.00 0.00 61.00 63.02 3m19 s PRO 170 Cb -0.09 -2.40 -0.16 0.00 0.02 0.00 0.00 34.50 31.86 3m19 s PRO 170 CO 0.02 -1.02 1.32 1.58 -0.33 0.00 0.00 177.00 178.57 3m19 n HIS 171 N -0.71 1.53 -1.01 6.54 -0.00 -1.26 -1.27 115.22 119.04 3m19 n HIS 171 Ca 0.08 0.62 -0.00 0.00 -0.00 0.00 0.00 57.72 58.42 3m19 n HIS 171 Cb 0.44 -2.34 -0.00 0.00 -0.00 0.00 0.00 29.99 28.09 3m19 n HIS 171 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3m19 n GLY 172 N 2.47 0.39 0.41 1.57 0.00 -1.26 -4.91 105.19 103.86 3m19 n GLY 172 Ca 0.17 -0.06 0.27 0.00 0.00 0.00 0.00 46.02 46.40 3m19 n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m19 h ALA 173 N 0.00 2.32 -0.25 4.61 0.00 -1.53 -1.80 119.26 122.61 3m19 h ALA 173 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3m19 h ALA 173 Cb 0.31 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3m19 h ALA 173 CO 0.01 -0.83 0.00 1.19 0.00 0.00 0.00 179.25 179.62 3m19 n PHE 174 N -4.72 0.33 0.22 0.00 3.72 -1.26 -4.55 117.46 111.20 3m19 n PHE 174 Ca 0.30 -0.37 0.09 0.00 -0.05 0.00 0.00 57.45 57.43 3m19 n PHE 174 Cb 1.06 -0.02 0.48 0.00 -0.94 0.00 0.00 39.48 40.05 3m19 n PHE 174 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3m19 h ASP 175 N 2.00 0.00 0.27 4.37 3.32 -1.74 -1.78 116.42 122.86 3m19 h ASP 175 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3m19 h ASP 175 Cb 0.65 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 3m19 h ASP 175 CO 0.00 0.24 -0.18 0.54 -1.72 0.00 0.00 179.24 178.12 3m19 n ARG 176 N -3.47 0.83 -1.83 3.56 5.12 -1.26 -4.60 116.66 115.00 3m19 n ARG 176 Ca -0.00 -0.41 -0.41 0.00 -1.93 0.00 0.00 57.85 55.09 3m19 n ARG 176 Cb 0.41 -1.49 -0.01 0.00 -1.16 0.00 0.00 32.46 30.22 3m19 n ARG 176 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3m19 n LEU 177 N -0.72 7.54 0.25 0.55 4.77 -0.67 -4.50 117.00 124.21 3m19 n LEU 177 Ca 0.14 -4.48 0.13 0.00 -0.03 0.00 0.00 56.01 51.77 3m19 n LEU 177 Cb 0.32 -1.53 0.62 0.00 -2.33 0.00 0.00 43.42 40.50 3m19 n LEU 177 CO 0.24 1.61 0.91 1.23 -1.33 0.00 0.00 177.39 180.06 3m19 h GLY 178 N 7.81 0.00 -2.51 -0.72 0.00 -1.81 -1.86 103.07 103.98 3m19 h GLY 178 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.96 3m19 h GLY 178 CO 1.72 0.00 0.00 0.28 0.00 0.00 0.00 176.54 178.54 3m19 n LYS 179 N -3.35 2.64 -1.71 4.80 5.02 -1.26 -4.99 118.16 119.30 3m19 n LYS 179 Ca -0.00 -2.51 -0.43 0.00 -2.02 0.00 0.00 58.31 53.35 3m19 n LYS 179 Cb 0.33 -1.54 -0.03 0.00 -0.02 0.00 0.00 35.03 33.77 3m19 n LYS 179 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3m19 n LEU 180 N 1.56 3.88 -0.05 -0.35 7.94 -0.70 -4.28 117.00 124.99 3m19 n LEU 180 Ca 0.22 1.07 -0.07 0.00 -1.11 0.00 0.00 56.01 56.13 3m19 n LEU 180 Cb 0.61 -1.55 -0.05 0.00 0.53 0.00 0.00 43.42 42.96 3m19 n LEU 180 CO 0.16 0.10 -0.83 0.00 -1.11 0.00 0.00 177.39 175.70 3m19 n GLN 181 N 3.69 0.52 -3.93 1.96 6.02 0.13 -5.00 117.38 120.78 3m19 n GLN 181 Ca 0.15 0.05 -0.20 0.00 -0.01 0.00 0.00 57.00 57.00 3m19 n GLN 181 Cb 0.34 -1.21 -0.17 0.00 1.02 0.00 0.00 30.24 30.22 3m19 n GLN 181 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3m19 s THR 182 N -2.21 0.31 0.01 5.09 2.01 -0.56 -4.41 115.64 115.88 3m19 s THR 182 Ca -0.13 0.07 0.04 0.00 0.31 0.00 0.00 61.69 61.98 3m19 s THR 182 Cb 0.03 -0.42 -0.01 0.00 0.01 0.00 0.00 72.50 72.11 3m19 s THR 182 CO 0.25 0.20 -0.13 -0.51 -0.69 0.00 0.00 174.62 173.74 3m19 s ILE 183 N 1.36 1.04 -0.05 1.82 2.07 0.78 -1.16 121.20 127.06 3m19 s ILE 183 Ca -0.05 -0.71 0.05 0.00 -1.41 0.00 0.00 60.65 58.53 3m19 s ILE 183 Cb -0.13 -0.90 -0.02 0.00 0.13 0.00 0.00 42.46 41.54 3m19 s ILE 183 CO -0.02 0.18 -0.19 0.42 -1.91 0.00 0.00 174.94 173.41 3m19 s THR 184 N -0.51 2.63 0.00 4.00 -4.23 -0.72 -1.47 115.64 115.34 3m19 s THR 184 Ca 0.04 -0.88 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 3m19 s THR 184 Cb -0.06 -2.00 0.00 0.00 1.34 0.00 0.00 72.50 71.78 3m19 s THR 184 CO 0.00 0.58 0.04 0.18 -0.54 0.00 0.00 174.62 174.88 3m19 n LEU 185 N 2.51 0.00 -4.61 4.79 4.77 -1.26 -1.17 117.00 122.03 3m19 n LEU 185 Ca -0.17 -0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.51 3m19 n LEU 185 Cb 0.52 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.80 3m19 n LEU 185 CO 0.25 0.02 0.62 0.72 -1.33 0.00 0.00 177.39 177.68 3m19 s PHE 186 N 0.00 1.52 -0.78 -1.77 -0.12 -1.26 -4.01 117.98 111.56 3m19 s PHE 186 Ca 0.00 1.60 0.00 0.00 -0.05 0.00 0.00 56.93 58.48 3m19 s PHE 186 Cb 0.00 -3.26 0.00 0.00 -0.63 0.00 0.00 43.02 39.13 3m19 s PHE 186 CO 0.00 -3.18 0.00 0.41 -0.05 0.00 0.00 175.22 172.40 3m19 n GLY 187 N 0.42 0.94 3.52 1.99 0.00 -1.26 -0.87 105.19 109.94 3m19 n GLY 187 Ca 0.09 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 45.17 3m19 n GLY 187 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3m19 n ASN 188 N 0.82 2.40 -2.98 1.61 4.13 -1.26 -3.15 115.26 116.84 3m19 n ASN 188 Ca -0.07 -2.64 -0.24 0.00 1.68 0.00 0.00 54.58 53.31 3m19 n ASN 188 Cb 0.24 -0.15 -0.03 0.00 -1.54 0.00 0.00 39.78 38.30 3m19 n ASN 188 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3m19 n GLN 189 N -1.83 2.61 -1.86 3.52 6.02 -0.74 -4.89 117.38 120.21 3m19 n GLN 189 Ca 0.03 -4.42 -0.41 0.00 -0.01 0.00 0.00 57.00 52.19 3m19 n GLN 189 Cb 0.57 -2.08 -0.01 0.00 1.02 0.00 0.00 30.24 29.73 3m19 n GLN 189 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3m19 s PHE 190 N -3.20 2.79 -0.52 1.08 0.08 -1.20 -4.27 117.98 112.74 3m19 s PHE 190 Ca 0.46 0.97 -0.17 0.00 0.12 0.00 0.00 56.93 58.31 3m19 s PHE 190 Cb 0.31 -3.98 0.09 0.00 -0.57 0.00 0.00 43.02 38.87 3m19 s PHE 190 CO -0.12 -3.13 0.54 0.34 -0.10 0.00 0.00 175.22 172.75 3m19 s ASP 191 N 0.25 6.18 0.00 1.36 -1.08 0.10 -0.03 116.67 123.46 3m19 s ASP 191 Ca 0.59 -1.37 0.15 0.00 -0.52 0.00 0.00 52.55 51.40 3m19 s ASP 191 Cb -0.46 -2.24 0.61 0.00 -1.46 0.00 0.00 42.92 39.37 3m19 s ASP 191 CO 0.51 -0.86 1.43 0.00 0.52 0.00 0.00 175.17 176.77 3m19 n SER 193 N 0.02 0.96 -4.62 0.00 3.41 -1.26 -4.93 113.62 107.20 3m19 n SER 193 Ca 0.12 -0.76 -0.33 0.00 -0.26 0.00 0.00 58.87 57.64 3m19 n SER 193 Cb 0.22 0.27 -0.10 0.00 -0.26 0.00 0.00 64.21 64.34 3m19 n SER 193 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3m19 s ARG 194 N -2.69 2.69 0.55 4.33 0.52 -1.21 -5.01 118.95 118.13 3m19 s ARG 194 Ca 0.18 -0.63 0.23 0.00 -0.52 0.00 0.00 55.73 55.00 3m19 s ARG 194 Cb 0.18 -2.59 1.55 0.00 0.52 0.00 0.00 34.95 34.62 3m19 s ARG 194 CO 0.61 0.63 2.19 0.00 0.02 0.00 0.00 175.30 178.75 3m19 h GLU 196 N 0.00 0.00 0.00 0.00 3.07 -1.95 -2.09 114.58 113.62 3m19 h GLU 196 Ca -0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 3m19 h GLU 196 Cb 0.03 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.94 3m19 h GLU 196 CO 0.00 0.00 -0.10 0.97 -1.40 0.00 0.00 179.01 178.49 3m19 h ILE 197 N 0.00 0.33 -0.02 3.13 6.09 -1.25 -3.23 117.51 122.57 3m19 h ILE 197 Ca 0.34 -0.59 -0.08 0.00 -1.37 0.00 0.00 64.86 63.16 3m19 h ILE 197 Cb 1.61 1.44 -0.01 0.00 0.47 0.00 0.00 36.82 40.34 3m19 h ILE 197 CO -0.00 0.09 -0.34 -0.07 -3.07 0.00 0.00 178.15 174.76 3m19 h LEU 198 N 0.00 0.04 -0.01 2.19 4.07 -1.59 0.89 115.31 120.90 3m19 h LEU 198 Ca -0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 3m19 h LEU 198 Cb 0.44 -0.01 -0.00 0.00 1.08 0.00 0.00 40.66 42.16 3m19 h LEU 198 CO 0.01 0.38 0.00 0.22 -1.08 0.00 0.00 178.44 177.98 3m19 h TYR 199 N 0.03 0.01 -0.35 1.13 3.20 -1.76 -2.31 116.97 116.91 3m19 h TYR 199 Ca 0.00 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.79 3m19 h TYR 199 Cb 0.63 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 3m19 h TYR 199 CO 0.00 0.11 -0.09 1.25 -1.64 0.00 0.00 178.16 177.79 3m19 h LEU 200 N -0.09 0.69 -0.55 2.82 5.85 -1.37 -1.41 115.31 121.25 3m19 h LEU 200 Ca 0.00 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.36 3m19 h LEU 200 Cb 0.10 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3m19 h LEU 200 CO -0.00 0.90 0.36 0.77 -0.34 0.00 0.00 178.44 180.12 3m19 h SER 201 N 0.48 0.63 -0.61 1.25 4.64 -0.86 0.68 113.55 119.75 3m19 h SER 201 Ca 0.09 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.32 3m19 h SER 201 Cb 0.60 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.50 3m19 h SER 201 CO 0.04 0.47 0.12 -0.61 -0.87 0.00 0.00 176.83 175.98 3m19 h GLN 202 N 0.74 1.00 -0.29 4.77 5.75 -1.39 -1.10 115.11 124.59 3m19 h GLN 202 Ca 0.20 -0.25 0.01 0.00 -0.15 0.00 0.00 58.65 58.46 3m19 h GLN 202 Cb -0.07 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 3m19 h GLN 202 CO -0.04 0.92 0.16 2.35 -2.65 0.00 0.00 178.83 179.57 3m19 h TRP 203 N 0.91 0.31 -0.70 3.99 7.01 -1.00 -1.92 115.95 124.55 3m19 h TRP 203 Ca 0.19 0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.14 3m19 h TRP 203 Cb 0.39 -0.10 -0.03 0.00 -2.10 0.00 0.00 29.16 27.32 3m19 h TRP 203 CO 0.03 0.18 0.21 0.82 -2.79 0.00 0.00 178.44 176.89 3m19 h ILE 204 N 0.34 1.26 -0.62 2.65 2.04 -0.47 -0.52 117.51 122.19 3m19 h ILE 204 Ca 0.11 -0.90 0.06 0.00 1.00 0.00 0.00 64.86 65.13 3m19 h ILE 204 Cb 0.00 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 3m19 h ILE 204 CO -0.06 0.35 0.41 0.03 0.00 0.00 0.00 178.15 178.88 3m19 h ARG 205 N 1.03 0.59 0.00 2.37 3.08 -0.86 -1.10 114.38 119.49 3m19 h ARG 205 Ca 0.22 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.24 3m19 h ARG 205 Cb 0.32 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3m19 h ARG 205 CO -0.01 0.39 -0.68 0.39 -1.07 0.00 0.00 179.97 178.99 3m19 n GLU 206 N -4.47 0.14 -1.81 0.04 1.02 -0.75 -4.28 120.64 110.52 3m19 n GLU 206 Ca 0.09 0.02 -0.01 0.00 -0.02 0.00 0.00 57.16 57.23 3m19 n GLU 206 Cb 0.23 -1.56 0.06 0.00 -0.02 0.00 0.00 31.44 30.15 3m19 n GLU 206 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3m19 n ASN 207 N -1.75 1.92 0.23 1.62 3.02 -0.25 -4.92 115.26 115.12 3m19 n ASN 207 Ca 0.04 -2.64 0.05 0.00 -0.03 0.00 0.00 54.58 52.01 3m19 n ASN 207 Cb 0.38 -0.40 0.51 0.00 -0.61 0.00 0.00 39.78 39.66 3m19 n ASN 207 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3m19 h SER 208 N 1.66 0.00 0.57 6.41 0.02 -1.40 -0.77 113.55 120.05 3m19 h SER 208 Ca -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 3m19 h SER 208 Cb 1.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.03 3m19 h SER 208 CO 0.21 0.18 0.00 0.78 -1.14 0.00 0.00 176.83 176.85 3m19 h ASN 209 N 0.00 0.00 0.92 3.07 2.35 -1.91 -2.55 115.58 117.46 3m19 h ASN 209 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3m19 h ASN 209 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 3m19 h ASN 209 CO 0.02 0.00 -0.96 0.29 -1.65 0.00 0.00 177.43 175.13 3m19 n LYS 210 N -2.88 0.53 -2.87 0.81 5.02 -0.30 -4.86 118.16 113.61 3m19 n LYS 210 Ca -0.00 0.10 -0.42 0.00 -2.02 0.00 0.00 58.31 55.97 3m19 n LYS 210 Cb 0.20 -1.78 -0.04 0.00 -0.02 0.00 0.00 35.03 33.38 3m19 n LYS 210 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3m19 s VAL 211 N -3.32 4.80 0.16 -0.18 1.01 -0.96 -0.16 120.40 121.76 3m19 s VAL 211 Ca 0.01 1.55 0.06 0.00 0.00 0.00 0.00 61.98 63.60 3m19 s VAL 211 Cb 0.11 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 3m19 s VAL 211 CO 0.78 -0.12 -0.12 -0.54 0.00 0.00 0.00 175.10 175.09 3m19 s LYS 212 N 2.92 1.15 -0.10 2.72 1.02 -0.55 -0.28 119.74 126.62 3m19 s LYS 212 Ca 0.36 -1.46 -0.07 0.00 0.02 0.00 0.00 55.97 54.82 3m19 s LYS 212 Cb -0.15 -0.85 -0.27 0.00 -0.52 0.00 0.00 37.83 36.04 3m19 s LYS 212 CO 0.08 0.13 0.43 0.38 -0.92 0.00 0.00 175.35 175.46 3m19 h ASP 213 N 2.84 0.44 -3.41 2.83 2.03 -1.96 -3.41 116.42 115.79 3m19 h ASP 213 Ca -0.38 -0.93 -0.52 0.00 -0.73 0.00 0.00 57.03 54.47 3m19 h ASP 213 Cb 1.20 -0.14 0.05 0.00 -0.83 0.00 0.00 39.33 39.60 3m19 h ASP 213 CO 0.60 1.82 0.70 -0.70 -1.03 0.00 0.00 179.24 180.64 3m19 s GLU 221 N -2.56 4.33 -0.45 4.15 2.12 -1.26 -5.07 118.70 119.95 3m19 s GLU 221 Ca -0.21 2.18 0.07 0.00 0.36 0.00 0.00 54.97 57.37 3m19 s GLU 221 Cb 0.06 -3.15 0.33 0.00 0.26 0.00 0.00 34.13 31.64 3m19 s GLU 221 CO 0.79 -0.33 1.11 -1.13 -0.54 0.00 0.00 175.26 175.16 3m19 n SER 222 N 2.39 -2.05 0.13 -1.70 3.41 0.61 -4.98 113.62 111.43 3m19 n SER 222 Ca 0.06 -3.55 0.15 0.00 -0.26 0.00 0.00 58.87 55.27 3m19 n SER 222 Cb 0.41 1.66 0.68 0.00 -0.26 0.00 0.00 64.21 66.70 3m19 n SER 222 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3m19 h PRO 223 N 2.92 0.00 -0.00 4.33 0.13 -1.77 -2.03 132.00 135.58 3m19 h PRO 223 Ca -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.03 3m19 h PRO 223 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3m19 h PRO 223 CO 0.14 0.00 -0.22 -0.25 -0.23 0.00 0.00 178.00 177.44 3m19 n ASP 224 N -4.40 0.37 0.00 1.44 8.00 -1.26 -2.89 116.55 117.81 3m19 n ASP 224 Ca 0.04 -0.15 0.11 0.00 0.71 0.00 0.00 54.79 55.50 3m19 n ASP 224 Cb 0.37 -0.08 0.49 0.00 -0.02 0.00 0.00 41.12 41.87 3m19 n ASP 224 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3m19 n GLY 225 N 1.43 -1.26 3.49 0.44 0.00 -0.76 -4.49 105.19 104.04 3m19 n GLY 225 Ca 0.09 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3m19 n GLY 225 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m19 s VAL 226 N -2.97 4.81 0.16 1.61 1.01 -1.14 -4.64 120.40 119.25 3m19 s VAL 226 Ca 0.12 -0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.02 3m19 s VAL 226 Cb 0.15 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 3m19 s VAL 226 CO 0.41 -0.73 -0.17 0.42 0.00 0.00 0.00 175.10 175.02 3m19 s THR 227 N 2.83 1.75 0.75 3.92 -4.23 -1.26 -1.53 115.64 117.86 3m19 s THR 227 Ca 0.20 -1.93 -0.11 0.00 -1.18 0.00 0.00 61.69 58.67 3m19 s THR 227 Cb -0.16 -1.83 0.04 0.00 1.34 0.00 0.00 72.50 71.89 3m19 s THR 227 CO 0.16 -0.36 1.08 0.00 -0.54 0.00 0.00 174.62 174.95 3m19 h SER 229 N -0.95 0.00 0.03 0.00 4.64 -0.70 -2.59 113.55 113.98 3m19 h SER 229 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3m19 h SER 229 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3m19 h SER 229 CO 0.55 0.00 -0.23 -0.90 -0.87 0.00 0.00 176.83 175.38 3m19 n ASP 230 N -2.93 2.02 0.00 4.97 5.75 -1.26 -4.99 116.55 120.11 3m19 n ASP 230 Ca -0.02 -1.52 0.00 0.00 -0.01 0.00 0.00 54.79 53.24 3m19 n ASP 230 Cb 0.12 0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 3m19 n ASP 230 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3m19 n GLY 231 N 1.35 2.92 3.76 6.12 0.00 -0.98 -5.07 105.19 113.30 3m19 n GLY 231 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 3m19 n GLY 231 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m19 s LYS 232 N -0.75 3.70 -0.04 1.61 -0.14 -1.26 -4.74 119.74 118.12 3m19 s LYS 232 Ca 0.00 2.25 -0.30 0.00 -1.36 0.00 0.00 55.97 56.56 3m19 s LYS 232 Cb 0.00 -2.61 -0.03 0.00 -1.68 0.00 0.00 37.83 33.51 3m19 s LYS 232 CO 0.00 -0.75 1.13 0.08 -0.76 0.00 0.00 175.35 175.06 3m19 s VAL 233 N -1.26 4.40 0.21 3.17 1.01 -1.26 -0.35 120.40 126.31 3m19 s VAL 233 Ca 0.61 1.71 -0.09 0.00 0.00 0.00 0.00 61.98 64.22 3m19 s VAL 233 Cb -0.40 -4.10 0.16 0.00 0.00 0.00 0.00 36.38 32.04 3m19 s VAL 233 CO 0.51 0.04 1.73 0.58 0.00 0.00 0.00 175.10 177.96 3m19 h VAL 234 N 4.91 0.71 0.00 2.92 2.07 -1.59 -0.53 116.25 124.73 3m19 h VAL 234 Ca -0.36 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3m19 h VAL 234 Cb 1.18 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 3m19 h VAL 234 CO 0.85 0.06 0.00 -2.11 0.02 0.00 0.00 177.57 176.39 3m19 n ARG 235 N -5.05 0.00 0.00 1.57 1.85 -1.26 -1.18 116.66 112.59 3m19 n ARG 235 Ca 0.09 0.40 0.13 0.00 -1.00 0.00 0.00 57.85 57.48 3m19 n ARG 235 Cb 0.31 -1.50 0.50 0.00 -1.05 0.00 0.00 32.46 30.71 3m19 n ARG 235 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3m19 n THR 236 N -1.49 0.00 -3.29 8.89 -2.24 -0.21 -4.80 114.28 111.14 3m19 n THR 236 Ca 0.01 -0.05 -0.38 0.00 -2.27 0.00 0.00 64.05 61.36 3m19 n THR 236 Cb 0.06 -0.01 -0.06 0.00 -2.10 0.00 0.00 70.33 68.21 3m19 n THR 236 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3m19 s VAL 237 N -2.69 5.16 0.26 2.28 1.01 -0.33 -4.94 120.40 121.16 3m19 s VAL 237 Ca 0.22 0.93 0.05 0.00 0.00 0.00 0.00 61.98 63.17 3m19 s VAL 237 Cb 0.19 -3.82 -0.06 0.00 0.00 0.00 0.00 36.38 32.70 3m19 s VAL 237 CO 0.54 0.26 -0.02 0.42 0.00 0.00 0.00 175.10 176.30 3m19 s THR 238 N 1.09 1.31 0.43 3.92 -4.23 -1.26 -4.66 115.64 112.24 3m19 s THR 238 Ca 0.25 -2.06 0.19 0.00 -1.18 0.00 0.00 61.69 58.88 3m19 s THR 238 Cb -0.15 -2.45 0.39 0.00 1.34 0.00 0.00 72.50 71.63 3m19 s THR 238 CO 0.10 -0.27 1.84 -1.13 -0.54 0.00 0.00 174.62 174.62 3m19 h ASN 239 N 2.34 0.38 -0.81 3.99 -1.24 -1.96 -0.53 115.58 117.74 3m19 h ASN 239 Ca -0.39 0.05 0.01 0.00 0.71 0.00 0.00 56.30 56.67 3m19 h ASN 239 Cb 1.23 -0.02 -0.04 0.00 0.73 0.00 0.00 38.32 40.22 3m19 h ASN 239 CO 0.66 0.14 0.53 -0.08 -1.29 0.00 0.00 177.43 177.40 3m19 h GLU 240 N 0.37 1.06 -1.00 6.67 4.81 -1.96 0.19 114.58 124.72 3m19 h GLU 240 Ca 0.49 -0.06 0.21 0.00 -0.13 0.00 0.00 59.36 59.86 3m19 h GLU 240 Cb 1.28 -0.24 -0.10 0.00 0.63 0.00 0.00 28.75 30.32 3m19 h GLU 240 CO -0.18 0.70 0.61 1.15 -0.73 0.00 0.00 179.01 180.56 3m19 h THR 241 N 1.09 0.66 -0.51 0.32 2.02 -1.46 -0.49 112.91 114.53 3m19 h THR 241 Ca 0.30 -0.23 -0.08 0.00 0.77 0.00 0.00 66.41 67.16 3m19 h THR 241 Cb -0.12 -0.07 -0.05 0.00 -1.74 0.00 0.00 68.15 66.17 3m19 h THR 241 CO -0.07 0.12 0.10 0.18 0.37 0.00 0.00 175.52 176.23 3m19 n LEU 242 N -4.75 4.94 -1.92 2.58 4.77 -0.22 -4.88 117.00 117.51 3m19 n LEU 242 Ca 0.24 -2.53 -0.16 0.00 -0.03 0.00 0.00 56.01 53.52 3m19 n LEU 242 Cb 0.63 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 3m19 n LEU 242 CO 0.22 0.62 -0.16 0.29 -1.33 0.00 0.00 177.39 177.03 3m19 n LYS 243 N 0.23 -1.81 -1.50 3.23 5.02 -0.19 -1.97 118.16 121.16 3m19 n LYS 243 Ca 0.27 0.75 -0.18 0.00 -2.02 0.00 0.00 58.31 57.13 3m19 n LYS 243 Cb 1.08 -5.13 -0.08 0.00 -0.02 0.00 0.00 35.03 30.88 3m19 n LYS 243 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3m19 n TYR 244 N -4.06 -0.14 1.43 2.13 4.01 0.50 -4.87 117.16 116.16 3m19 n TYR 244 Ca -0.17 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.72 3m19 n TYR 244 Cb 0.63 -3.11 0.75 0.00 -0.31 0.00 0.00 39.34 37.30 3m19 n TYR 244 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3m19 n GLU 245 N -2.11 0.49 0.00 -0.72 1.02 -0.83 -5.03 120.64 113.45 3m19 n GLU 245 Ca -0.18 0.01 0.13 0.00 -0.02 0.00 0.00 57.16 57.11 3m19 n GLU 245 Cb 0.59 -1.50 0.33 0.00 -0.02 0.00 0.00 31.44 30.84 3m19 n GLU 245 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31