#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m0v n ASN 2 N 0.00 -0.93 0.00 6.12 0.23 -1.26 -4.43 115.26 114.99 1m0v n ASN 2 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1m0v n ASN 2 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1m0v n ASN 2 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1m0v n LEU 3 N 0.00 0.50 0.00 -4.53 4.32 -1.26 -4.98 117.00 111.04 1m0v n LEU 3 Ca 0.00 0.54 0.00 0.00 -0.02 0.00 0.00 56.01 56.53 1m0v n LEU 3 Cb 0.00 -0.37 0.00 0.00 -1.62 0.00 0.00 43.42 41.43 1m0v n LEU 3 CO 0.00 -0.37 0.00 -1.20 -1.22 0.00 0.00 177.39 174.60 1m0v n SER 4 N -1.62 0.00 -0.07 -1.43 7.64 -1.26 -4.94 113.62 111.93 1m0v n SER 4 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 1m0v n SER 4 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 1m0v n SER 4 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1m0v n LEU 5 N 0.00 1.69 -0.22 -3.43 -0.00 -1.24 -3.52 117.00 110.28 1m0v n LEU 5 Ca 0.00 0.44 0.01 0.00 -0.00 0.00 0.00 56.01 56.46 1m0v n LEU 5 Cb 0.00 -0.77 0.13 0.00 -0.00 0.00 0.00 43.42 42.77 1m0v n LEU 5 CO 0.00 -0.38 1.01 0.77 -0.00 0.00 0.00 177.39 178.79 1m0v h SER 6 N -0.90 0.30 0.26 1.96 4.64 -1.88 0.48 113.55 118.41 1m0v h SER 6 Ca 0.00 0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 1m0v h SER 6 Cb 0.69 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 1m0v h SER 6 CO 0.00 0.17 -0.13 0.44 -0.87 0.00 0.00 176.83 176.44 1m0v h ASP 7 N 0.47 -0.30 -0.86 4.97 5.19 -1.88 -0.56 116.42 123.45 1m0v h ASP 7 Ca 0.33 0.01 0.22 0.00 -0.62 0.00 0.00 57.03 56.97 1m0v h ASP 7 Cb 0.41 0.08 -0.14 0.00 0.18 0.00 0.00 39.33 39.85 1m0v h ASP 7 CO -0.31 0.03 0.14 0.25 -3.12 0.00 0.00 179.24 176.23 1m0v h LEU 8 N -0.85 -0.17 -0.11 1.55 5.85 -1.59 0.47 115.31 120.47 1m0v h LEU 8 Ca -0.04 0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1m0v h LEU 8 Cb 0.27 0.32 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 1m0v h LEU 8 CO 0.06 -0.19 0.05 -0.74 -0.34 0.00 0.00 178.44 177.28 1m0v h HIS 9 N 0.15 0.15 -0.33 1.25 2.76 -0.10 -1.19 115.15 117.84 1m0v h HIS 9 Ca 0.52 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.75 1m0v h HIS 9 Cb 1.01 -0.05 -0.08 0.00 1.55 0.00 0.00 27.41 29.84 1m0v h HIS 9 CO -0.34 0.20 -0.34 0.00 -1.30 0.00 0.00 177.93 176.15 1m0v h ARG 10 N 0.06 -0.29 0.31 5.26 2.47 0.16 0.91 114.38 123.25 1m0v h ARG 10 Ca 0.04 0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.76 1m0v h ARG 10 Cb 0.11 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.49 1m0v h ARG 10 CO -0.01 -0.19 -0.15 -0.56 0.56 0.00 0.00 179.97 179.62 1m0v h GLN 11 N -0.30 -0.40 -0.45 0.04 -0.00 -1.10 -1.15 115.11 111.74 1m0v h GLN 11 Ca 0.15 0.03 0.06 0.00 -0.00 0.00 0.00 58.65 58.88 1m0v h GLN 11 Cb 0.55 0.09 -0.05 0.00 -0.00 0.00 0.00 27.48 28.07 1m0v h GLN 11 CO -0.50 -0.08 0.17 -0.24 -0.00 0.00 0.00 178.83 178.18 1m0v h VAL 12 N -0.79 0.86 0.72 1.86 3.04 -1.07 0.12 116.25 120.99 1m0v h VAL 12 Ca -0.04 -0.12 -0.03 0.00 -1.01 0.00 0.00 66.70 65.50 1m0v h VAL 12 Cb 0.51 0.49 0.00 0.00 -2.01 0.00 0.00 31.29 30.28 1m0v h VAL 12 CO 0.07 0.06 -0.40 -1.28 -1.01 0.00 0.00 177.57 175.02 1m0v h SER 13 N 0.34 -0.97 -0.11 3.17 0.87 0.81 -1.74 113.55 115.91 1m0v h SER 13 Ca 0.21 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.85 1m0v h SER 13 Cb 0.20 0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.43 1m0v h SER 13 CO -0.21 -0.64 0.12 0.03 -0.53 0.00 0.00 176.83 175.60 1m0v h ARG 14 N -1.04 0.00 0.28 2.24 3.08 -1.01 0.52 114.38 118.46 1m0v h ARG 14 Ca -0.09 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1m0v h ARG 14 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1m0v h ARG 14 CO 0.13 0.00 -0.14 -0.07 -1.07 0.00 0.00 179.97 178.82 1m0v h LEU 15 N 0.00 -0.32 -0.82 3.04 3.38 -0.07 -0.13 115.31 120.38 1m0v h LEU 15 Ca 0.05 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1m0v h LEU 15 Cb 0.28 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1m0v h LEU 15 CO -0.00 -0.14 -0.34 0.58 0.09 0.00 0.00 178.44 178.63 1m0v h VAL 16 N -0.57 0.74 0.00 1.22 2.07 -1.18 0.91 116.25 119.44 1m0v h VAL 16 Ca -0.04 -1.49 -0.06 0.00 0.82 0.00 0.00 66.70 65.94 1m0v h VAL 16 Cb 0.29 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1m0v h VAL 16 CO 0.06 0.33 -0.27 1.56 0.02 0.00 0.00 177.57 179.27 1m0v h GLN 17 N 0.00 0.00 -0.51 1.57 1.08 -0.03 -2.54 115.11 114.68 1m0v h GLN 17 Ca -0.00 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 56.90 1m0v h GLN 17 Cb 0.93 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 28.14 1m0v h GLN 17 CO 0.04 0.27 -0.64 1.04 -0.95 0.00 0.00 178.83 178.59 1m0v n GLN 18 N -3.27 1.04 0.00 1.46 6.02 -0.06 -5.00 117.38 117.58 1m0v n GLN 18 Ca 0.01 -2.32 0.00 0.00 -0.01 0.00 0.00 57.00 54.69 1m0v n GLN 18 Cb 0.55 -1.04 0.00 0.00 1.02 0.00 0.00 30.24 30.77 1m0v n GLN 18 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1m0v n GLU 19 N 0.17 0.00 0.00 -1.09 2.13 0.25 -4.72 120.64 117.38 1m0v n GLU 19 Ca 0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1m0v n GLU 19 Cb 0.72 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.43 1m0v n GLU 19 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1m0v n SER 20 N 0.00 0.00 0.00 4.31 7.64 0.25 -4.94 113.62 120.88 1m0v n SER 20 Ca 0.00 0.08 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1m0v n SER 20 Cb 0.00 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 1m0v n SER 20 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m0v n GLY 21 N 2.36 2.23 0.00 0.23 0.00 -0.95 -4.62 105.19 104.44 1m0v n GLY 21 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1m0v n GLY 21 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1m0v n ASP 22 N 0.05 0.00 -3.11 1.61 5.75 -1.26 -4.92 116.55 114.67 1m0v n ASP 22 Ca 0.00 -0.15 0.00 0.00 -0.01 0.00 0.00 54.79 54.63 1m0v n ASP 22 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1m0v n ASP 22 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1m0v s THR 24 N -0.38 3.88 -0.10 0.00 2.01 -0.68 -1.04 115.64 119.33 1m0v s THR 24 Ca 0.00 -1.23 -0.01 0.00 0.31 0.00 0.00 61.69 60.76 1m0v s THR 24 Cb 0.00 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.17 1m0v s THR 24 CO 0.00 -0.19 -0.04 -0.83 -0.69 0.00 0.00 174.62 172.87 1m0v s GLY 25 N -4.04 1.74 -0.29 4.40 0.00 -1.19 0.11 107.32 108.04 1m0v s GLY 25 Ca 0.41 -0.85 -0.08 0.00 0.00 0.00 0.00 44.72 44.20 1m0v s GLY 25 CO 0.28 -0.43 0.11 1.25 0.00 0.00 0.00 173.10 174.32 1m0v s LYS 26 N -0.39 3.37 0.02 2.90 2.36 -0.41 -3.54 119.74 124.05 1m0v s LYS 26 Ca 0.06 -0.68 0.00 0.00 -2.55 0.00 0.00 55.97 52.80 1m0v s LYS 26 Cb -0.12 -3.46 -0.04 0.00 -1.05 0.00 0.00 37.83 33.16 1m0v s LYS 26 CO 0.02 -0.36 0.09 -1.17 1.55 0.00 0.00 175.35 175.49 1m0v s LEU 27 N 1.59 3.93 0.00 5.43 0.20 -1.24 -0.56 118.68 128.03 1m0v s LEU 27 Ca 0.05 0.13 0.00 0.00 0.69 0.00 0.00 54.13 55.00 1m0v s LEU 27 Cb -0.17 -2.38 0.00 0.00 -0.43 0.00 0.00 46.19 43.21 1m0v s LEU 27 CO 0.05 0.24 0.00 0.54 -0.29 0.00 0.00 176.35 176.89 1m0v n ARG 28 N 0.95 0.00 0.00 1.98 3.00 -1.26 -4.58 116.66 116.75 1m0v n ARG 28 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.73 1m0v n ARG 28 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.98 1m0v n ARG 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1m0v n GLY 29 N 0.00 1.93 3.63 -0.13 0.00 -1.26 -4.96 105.19 104.41 1m0v n GLY 29 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1m0v n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1m0v s ASN 30 N -2.52 -0.29 -0.22 1.61 6.03 -1.26 -4.76 114.94 113.54 1m0v s ASN 30 Ca 0.00 -0.22 -0.05 0.00 -1.03 0.00 0.00 52.86 51.56 1m0v s ASN 30 Cb 0.00 0.47 -0.02 0.00 -3.03 0.00 0.00 41.25 38.68 1m0v s ASN 30 CO 0.00 -0.82 -0.02 0.54 -2.03 0.00 0.00 177.10 174.77 1m0v s VAL 31 N -3.30 3.63 0.36 3.54 0.11 -1.24 -3.95 120.40 119.55 1m0v s VAL 31 Ca 0.08 -0.41 0.07 0.00 -2.93 0.00 0.00 61.98 58.80 1m0v s VAL 31 Cb -0.01 -2.65 -0.02 0.00 -1.53 0.00 0.00 36.38 32.16 1m0v s VAL 31 CO -0.03 0.41 0.38 0.00 -3.33 0.00 0.00 175.10 172.53 1m0v s ALA 32 N 1.36 4.06 -0.45 1.54 0.00 0.27 -4.52 121.76 124.02 1m0v s ALA 32 Ca 0.04 -1.65 -0.13 0.00 0.00 0.00 0.00 51.96 50.23 1m0v s ALA 32 Cb -0.14 -1.32 0.08 0.00 0.00 0.00 0.00 23.12 21.73 1m0v s ALA 32 CO -0.01 -0.07 0.34 0.00 0.00 0.00 0.00 175.76 176.02 1m0v s ALA 33 N -2.31 3.44 -1.07 0.00 0.00 -1.26 -1.29 121.76 119.28 1m0v s ALA 33 Ca 0.45 -2.15 -0.22 0.00 0.00 0.00 0.00 51.96 50.03 1m0v s ALA 33 Cb -0.07 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.18 1m0v s ALA 33 CO 0.29 -1.71 1.69 1.21 0.00 0.00 0.00 175.76 177.24 1m0v s ASN 34 N 2.42 6.06 -1.14 0.00 2.47 0.30 -4.88 114.94 120.17 1m0v s ASN 34 Ca 0.04 -1.49 -0.08 0.00 0.42 0.00 0.00 52.86 51.74 1m0v s ASN 34 Cb -0.24 -2.57 0.26 0.00 -1.45 0.00 0.00 41.25 37.25 1m0v s ASN 34 CO 0.04 -1.93 1.43 1.17 -3.72 0.00 0.00 177.10 174.09 1m0v n LYS 35 N 8.71 3.91 0.00 0.43 0.00 -1.26 -1.68 118.16 128.26 1m0v n LYS 35 Ca 0.39 -4.27 0.00 0.00 0.00 0.00 0.00 58.31 54.44 1m0v n LYS 35 Cb 0.48 -2.66 0.00 0.00 0.00 0.00 0.00 35.03 32.85 1m0v n LYS 35 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1m0v n GLU 36 N 2.72 0.00 -0.69 1.64 4.07 -1.26 -5.11 120.64 122.01 1m0v n GLU 36 Ca 0.29 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.39 1m0v n GLU 36 Cb 0.37 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.75 1m0v n GLU 36 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1m0v n THR 37 N 0.00 0.00 -3.15 6.31 -1.04 -1.26 -5.13 114.28 110.01 1m0v n THR 37 Ca 0.00 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.06 1m0v n THR 37 Cb 0.00 -0.96 -0.00 0.00 -1.82 0.00 0.00 70.33 67.54 1m0v n THR 37 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1m0v s THR 38 N 1.28 -0.56 0.03 12.58 -4.23 -1.26 -4.68 115.64 118.81 1m0v s THR 38 Ca 0.00 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.57 1m0v s THR 38 Cb 0.00 -0.66 -0.03 0.00 1.34 0.00 0.00 72.50 73.15 1m0v s THR 38 CO 0.00 0.00 -0.15 -0.36 -0.54 0.00 0.00 174.62 173.57 1m0v s PHE 39 N 2.91 2.63 -0.45 3.99 0.08 -1.26 -5.05 117.98 120.84 1m0v s PHE 39 Ca 0.17 -0.21 0.07 0.00 0.12 0.00 0.00 56.93 57.09 1m0v s PHE 39 Cb -0.07 -1.50 0.28 0.00 -0.57 0.00 0.00 43.02 41.17 1m0v s PHE 39 CO -0.22 0.28 0.88 0.00 -0.10 0.00 0.00 175.22 176.06 1m0v n GLN 40 N 1.53 0.88 -1.29 0.44 0.00 -1.26 -4.09 117.38 113.59 1m0v n GLN 40 Ca -0.16 -2.28 -0.00 0.00 0.00 0.00 0.00 57.00 54.55 1m0v n GLN 40 Cb 0.52 -1.32 -0.00 0.00 0.00 0.00 0.00 30.24 29.44 1m0v n GLN 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1m0v n GLY 41 N 0.98 -3.09 0.00 2.61 0.00 -1.26 -4.28 105.19 100.15 1m0v n GLY 41 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1m0v n GLY 41 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1m0v n LEU 42 N 0.15 0.00 -1.43 0.99 -0.00 -1.23 -4.76 117.00 110.73 1m0v n LEU 42 Ca -0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.98 1m0v n LEU 42 Cb 0.02 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.46 1m0v n LEU 42 CO 0.01 0.00 0.31 0.41 -0.00 0.00 0.00 177.39 178.12 1m0v n THR 43 N 0.00 0.00 -0.73 1.96 -1.04 -1.25 0.13 114.28 113.35 1m0v n THR 43 Ca 0.00 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 1m0v n THR 43 Cb 0.00 0.50 0.00 0.00 -1.82 0.00 0.00 70.33 69.01 1m0v n THR 43 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 1m0v n ILE 44 N -0.39 0.00 -0.08 12.58 5.41 -1.26 -4.78 119.36 130.84 1m0v n ILE 44 Ca -0.11 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.54 1m0v n ILE 44 Cb 0.58 -0.56 -0.05 0.00 -0.71 0.00 0.00 39.64 38.89 1m0v n ILE 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1m0v h ALA 45 N 0.00 0.08 0.00 -1.39 0.00 -1.93 -3.35 119.26 112.68 1m0v h ALA 45 Ca 0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 54.91 54.23 1m0v h ALA 45 Cb 0.29 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1m0v h ALA 45 CO 0.00 0.50 -0.01 1.03 0.00 0.00 0.00 179.25 180.77 1m0v h SER 46 N -1.00 0.00 0.00 0.00 0.87 -1.98 -3.43 113.55 108.01 1m0v h SER 46 Ca -0.11 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1m0v h SER 46 Cb 0.73 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1m0v h SER 46 CO -0.07 0.01 0.00 0.61 -0.53 0.00 0.00 176.83 176.85 1m0v n GLY 47 N -1.15 0.23 0.00 5.77 0.00 -1.26 -5.14 105.19 103.63 1m0v n GLY 47 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1m0v n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m0v n ALA 48 N 0.00 0.00 -3.10 4.61 0.00 -1.25 -4.97 120.51 115.80 1m0v n ALA 48 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1m0v n ALA 48 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1m0v n ALA 48 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1m0v s ARG 49 N -1.54 0.30 0.56 0.00 1.70 -1.26 -4.68 118.95 114.03 1m0v s ARG 49 Ca 0.00 0.15 0.41 0.00 -0.47 0.00 0.00 55.73 55.82 1m0v s ARG 49 Cb 0.00 0.14 1.56 0.00 -0.57 0.00 0.00 34.95 36.08 1m0v s ARG 49 CO 0.00 -0.05 1.67 1.49 -1.08 0.00 0.00 175.30 177.33 1m0v h GLU 50 N 5.47 0.00 0.32 3.89 4.81 -1.98 -1.79 114.58 125.31 1m0v h GLU 50 Ca -0.27 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1m0v h GLU 50 Cb 1.19 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.57 1m0v h GLU 50 CO 0.38 0.00 -0.24 0.77 -0.73 0.00 0.00 179.01 179.19 1m0v h SER 51 N 0.00 -0.64 0.24 1.04 0.02 -1.91 -0.74 113.55 111.56 1m0v h SER 51 Ca 0.68 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.67 1m0v h SER 51 Cb 2.86 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 65.58 1m0v h SER 51 CO -0.01 -0.35 -0.32 -0.33 -1.14 0.00 0.00 176.83 174.68 1m0v h GLU 52 N -0.55 -0.57 -0.71 3.45 3.07 -1.37 0.73 114.58 118.63 1m0v h GLU 52 Ca -0.04 0.04 0.13 0.00 -0.50 0.00 0.00 59.36 58.99 1m0v h GLU 52 Cb 0.45 0.13 -0.13 0.00 -0.84 0.00 0.00 28.75 28.36 1m0v h GLU 52 CO 0.01 -0.38 -0.26 1.57 -1.40 0.00 0.00 179.01 178.56 1m0v h LYS 53 N -0.59 -0.06 -0.50 2.33 2.10 -1.63 0.93 116.57 119.15 1m0v h LYS 53 Ca -0.03 0.00 0.03 0.00 -2.00 0.00 0.00 60.65 58.66 1m0v h LYS 53 Cb 0.53 0.01 -0.03 0.00 -0.90 0.00 0.00 32.23 31.85 1m0v h LYS 53 CO -0.08 -0.04 0.33 0.28 -2.00 0.00 0.00 179.45 177.94 1m0v h VAL 54 N -0.06 1.05 -0.28 0.07 2.07 -0.92 -1.02 116.25 117.15 1m0v h VAL 54 Ca 0.31 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.62 1m0v h VAL 54 Cb 0.56 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1m0v h VAL 54 CO -0.76 0.10 0.10 0.15 0.02 0.00 0.00 177.57 177.18 1m0v h PHE 55 N 0.56 0.44 -0.42 1.57 3.04 0.32 0.83 116.94 123.28 1m0v h PHE 55 Ca 0.20 -0.04 0.04 0.00 3.98 0.00 0.00 57.97 62.15 1m0v h PHE 55 Cb 0.12 -0.13 -0.04 0.00 2.56 0.00 0.00 35.95 38.46 1m0v h PHE 55 CO -0.00 0.46 0.20 0.00 -2.02 0.00 0.00 178.31 176.95 1m0v h ALA 56 N 0.94 0.53 -0.39 2.41 0.00 0.43 0.25 119.26 123.42 1m0v h ALA 56 Ca 0.09 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1m0v h ALA 56 Cb 0.21 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1m0v h ALA 56 CO -0.01 -0.16 0.17 1.96 0.00 0.00 0.00 179.25 181.21 1m0v h GLN 57 N 0.41 0.57 0.78 0.00 1.08 -1.07 0.24 115.11 117.12 1m0v h GLN 57 Ca 0.19 -0.10 -0.04 0.00 -1.45 0.00 0.00 58.65 57.25 1m0v h GLN 57 Cb 0.11 -0.10 0.01 0.00 -0.05 0.00 0.00 27.48 27.45 1m0v h GLN 57 CO -0.14 0.53 -0.38 1.15 -0.95 0.00 0.00 178.83 179.04 1m0v h THR 58 N 0.48 0.22 -0.17 -0.54 2.02 -0.29 0.23 112.91 114.86 1m0v h THR 58 Ca 0.13 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.32 1m0v h THR 58 Cb 0.16 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 66.78 1m0v h THR 58 CO -0.01 0.00 0.08 1.62 0.37 0.00 0.00 175.52 177.57 1m0v h VAL 59 N -1.06 0.98 -0.73 3.16 3.04 -0.51 -1.00 116.25 120.15 1m0v h VAL 59 Ca -0.11 -0.06 0.14 0.00 -1.01 0.00 0.00 66.70 65.66 1m0v h VAL 59 Cb 0.81 0.80 -0.05 0.00 -2.01 0.00 0.00 31.29 30.85 1m0v h VAL 59 CO 0.17 0.03 0.49 0.25 -1.01 0.00 0.00 177.57 177.50 1m0v h LEU 60 N 0.17 0.40 0.03 3.16 5.85 -0.45 1.00 115.31 125.48 1m0v h LEU 60 Ca 0.07 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 1m0v h LEU 60 Cb 0.02 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1m0v h LEU 60 CO -0.06 0.22 -0.02 0.28 -0.34 0.00 0.00 178.44 178.53 1m0v h SER 61 N 0.43 -0.04 0.49 1.25 0.02 0.02 -2.96 113.55 112.77 1m0v h SER 61 Ca 0.35 -0.56 -0.04 0.00 -0.84 0.00 0.00 61.79 60.70 1m0v h SER 61 Cb 0.76 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.31 1m0v h SER 61 CO -0.11 0.56 -0.17 -0.74 -1.14 0.00 0.00 176.83 175.23 1m0v h HIS 62 N -0.66 0.00 -0.93 3.45 2.76 -0.72 -2.07 115.15 116.97 1m0v h HIS 62 Ca -0.00 0.00 -0.50 0.00 -2.20 0.00 0.00 60.37 57.66 1m0v h HIS 62 Cb 0.60 0.00 -0.29 0.00 1.55 0.00 0.00 27.41 29.27 1m0v h HIS 62 CO 0.13 0.17 0.64 0.28 -1.30 0.00 0.00 177.93 177.85 1m0v n VAL 63 N -3.63 3.12 -0.66 5.26 0.31 0.30 -4.82 118.33 118.21 1m0v n VAL 63 Ca -0.01 -1.91 -0.22 0.00 -0.01 0.00 0.00 64.34 62.19 1m0v n VAL 63 Cb 0.30 -0.59 -0.02 0.00 -0.91 0.00 0.00 33.84 32.62 1m0v n VAL 63 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1m0v n ALA 64 N -1.01 3.74 0.00 3.52 0.00 -0.78 -4.06 120.51 121.93 1m0v n ALA 64 Ca 0.56 -1.85 0.00 0.00 0.00 0.00 0.00 53.44 52.15 1m0v n ALA 64 Cb 1.49 -3.02 0.00 0.00 0.00 0.00 0.00 19.45 17.91 1m0v n ALA 64 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1m0v n ASN 65 N 4.95 0.00 0.00 0.00 5.03 -1.26 -5.10 115.26 118.88 1m0v n ASN 65 Ca 0.37 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.82 1m0v n ASN 65 Cb 0.15 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.91 1m0v n ASN 65 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 1m0v n VAL 66 N 0.00 0.00 0.00 2.41 0.24 -1.26 -3.86 118.33 115.86 1m0v n VAL 66 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1m0v n VAL 66 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1m0v n VAL 66 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 1m0v n VAL 67 N 0.00 0.00 -2.73 3.34 3.14 -1.25 -4.89 118.33 115.94 1m0v n VAL 67 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1m0v n VAL 67 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1m0v n VAL 67 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1m0v n LEU 68 N -0.20 -3.25 -4.43 6.55 4.77 -0.86 0.11 117.00 119.69 1m0v n LEU 68 Ca 0.00 0.46 -0.30 0.00 -0.03 0.00 0.00 56.01 56.14 1m0v n LEU 68 Cb 0.00 -1.32 0.27 0.00 -2.33 0.00 0.00 43.42 40.04 1m0v n LEU 68 CO 0.00 -1.50 0.49 0.42 -1.33 0.00 0.00 177.39 175.47 1m0v s THR 69 N -0.62 1.45 0.49 -5.08 -4.23 -1.26 0.19 115.64 106.58 1m0v s THR 69 Ca 0.00 0.00 0.38 0.00 -1.18 0.00 0.00 61.69 60.89 1m0v s THR 69 Cb 0.00 -2.22 0.58 0.00 1.34 0.00 0.00 72.50 72.21 1m0v s THR 69 CO 0.00 0.00 1.63 -0.61 -0.54 0.00 0.00 174.62 175.10 1m0v h GLN 70 N -3.02 0.05 0.46 3.99 -0.00 0.16 0.45 115.11 117.20 1m0v h GLN 70 Ca -0.47 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 58.16 1m0v h GLN 70 Cb 1.33 -0.01 0.00 0.00 0.00 0.00 0.00 27.48 28.80 1m0v h GLN 70 CO 0.34 0.03 -0.22 1.49 0.00 0.00 0.00 178.83 180.47 1m0v h GLU 71 N 0.05 -0.60 -0.36 1.69 4.57 -1.87 -1.49 114.58 116.57 1m0v h GLU 71 Ca 0.83 0.04 0.01 0.00 -1.18 0.00 0.00 59.36 59.06 1m0v h GLU 71 Cb 2.95 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 31.65 1m0v h GLU 71 CO -0.23 -0.40 0.24 -0.44 -1.18 0.00 0.00 179.01 177.00 1m0v h ASP 72 N -0.79 0.41 0.48 1.04 3.32 -1.28 0.10 116.42 119.70 1m0v h ASP 72 Ca -0.06 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.96 1m0v h ASP 72 Cb 0.48 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1m0v h ASP 72 CO 0.10 0.29 -0.37 0.74 -1.72 0.00 0.00 179.24 178.29 1m0v h THR 73 N 0.48 0.00 -0.17 0.35 2.02 -0.17 0.86 112.91 116.28 1m0v h THR 73 Ca 0.14 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.36 1m0v h THR 73 Cb -0.03 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.37 1m0v h THR 73 CO -0.03 0.00 0.15 0.00 0.37 0.00 0.00 175.52 176.01 1m0v h ALA 74 N -1.26 1.93 0.35 6.16 0.00 -1.00 -1.26 119.26 124.19 1m0v h ALA 74 Ca -0.06 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1m0v h ALA 74 Cb 0.67 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 1m0v h ALA 74 CO 0.02 -0.23 -0.25 -0.22 0.00 0.00 0.00 179.25 178.57 1m0v h LYS 75 N 0.00 -0.54 -0.95 0.00 1.63 0.67 0.72 116.57 118.10 1m0v h LYS 75 Ca 0.08 0.04 0.09 0.00 -0.85 0.00 0.00 60.65 60.01 1m0v h LYS 75 Cb 0.37 0.12 -0.07 0.00 -0.60 0.00 0.00 32.23 32.06 1m0v h LYS 75 CO -0.00 -0.36 0.61 -0.07 -3.45 0.00 0.00 179.45 176.18 1m0v h LEU 76 N -0.56 0.91 -0.27 5.20 4.07 -0.48 -0.89 115.31 123.28 1m0v h LEU 76 Ca -0.05 0.02 0.04 0.00 0.08 0.00 0.00 57.88 57.98 1m0v h LEU 76 Cb 0.46 -0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.99 1m0v h LEU 76 CO 0.03 0.54 0.01 -0.07 -1.08 0.00 0.00 178.44 177.86 1m0v h LEU 77 N 1.01 -0.09 0.80 1.67 3.38 -0.86 0.93 115.31 122.14 1m0v h LEU 77 Ca 0.43 0.06 -0.04 0.00 0.09 0.00 0.00 57.88 58.42 1m0v h LEU 77 Cb 0.34 0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.20 1m0v h LEU 77 CO -0.19 -0.01 -0.38 1.56 0.09 0.00 0.00 178.44 179.50 1m0v h GLN 78 N 0.09 -1.03 0.61 1.13 4.20 0.18 0.36 115.11 120.66 1m0v h GLN 78 Ca 0.13 0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.88 1m0v h GLN 78 Cb 0.16 0.23 0.01 0.00 0.30 0.00 0.00 27.48 28.18 1m0v h GLN 78 CO -0.21 -0.68 -0.30 0.66 -0.67 0.00 0.00 178.83 177.63 1m0v h SER 79 N -1.11 -0.70 -0.81 1.46 4.64 -1.16 0.95 113.55 116.82 1m0v h SER 79 Ca -0.11 0.02 0.18 0.00 -0.47 0.00 0.00 61.79 61.41 1m0v h SER 79 Cb 0.83 0.18 -0.11 0.00 -0.31 0.00 0.00 62.40 62.99 1m0v h SER 79 CO 0.18 -0.38 0.31 0.00 -0.87 0.00 0.00 176.83 176.06 1m0v h THR 80 N -1.06 0.54 0.00 2.95 1.03 0.78 0.16 112.91 117.31 1m0v h THR 80 Ca -0.08 -0.13 0.00 0.00 -0.01 0.00 0.00 66.41 66.18 1m0v h THR 80 Cb 0.63 0.12 0.00 0.00 -1.07 0.00 0.00 68.15 67.84 1m0v h THR 80 CO 0.14 0.07 -0.47 0.52 -0.01 0.00 0.00 175.52 175.77 1m0v n VAL 81 N -5.06 0.22 -0.99 0.00 0.31 0.12 -3.98 118.33 108.96 1m0v n VAL 81 Ca 0.18 -0.16 -0.33 0.00 -0.01 0.00 0.00 64.34 64.02 1m0v n VAL 81 Cb 0.52 -0.08 0.02 0.00 -0.91 0.00 0.00 33.84 33.39 1m0v n VAL 81 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1m0v n LYS 82 N -1.87 0.00 -1.56 5.55 0.00 0.33 -4.55 118.16 116.06 1m0v n LYS 82 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 58.31 58.21 1m0v n LYS 82 Cb 0.40 -0.86 -0.08 0.00 0.00 0.00 0.00 35.03 34.48 1m0v n LYS 82 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1m0v n HIS 83 N -1.67 1.10 0.00 5.64 -0.00 -1.26 -3.67 115.22 115.36 1m0v n HIS 83 Ca 0.03 -0.01 0.00 0.00 -0.00 0.00 0.00 57.72 57.74 1m0v n HIS 83 Cb 0.44 -2.49 0.00 0.00 -0.00 0.00 0.00 29.99 27.94 1m0v n HIS 83 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1m0v n ASN 84 N 17.83 0.00 -3.65 4.39 3.02 -1.26 -5.17 115.26 130.41 1m0v n ASN 84 Ca 0.48 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 55.04 1m0v n ASN 84 Cb 0.41 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 1m0v n ASN 84 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1m0v s LEU 85 N 0.00 -0.05 0.72 3.41 0.20 -1.24 -5.12 118.68 116.60 1m0v s LEU 85 Ca 0.00 -0.24 -0.01 0.00 0.69 0.00 0.00 54.13 54.58 1m0v s LEU 85 Cb 0.00 1.53 0.13 0.00 -0.43 0.00 0.00 46.19 47.42 1m0v s LEU 85 CO 0.00 -0.44 1.00 0.20 -0.29 0.00 0.00 176.35 176.82 1m0v s ASN 86 N -3.20 4.33 0.00 3.68 0.01 -1.26 -4.59 114.94 113.91 1m0v s ASN 86 Ca 0.18 -0.38 0.00 0.00 -0.71 0.00 0.00 52.86 51.95 1m0v s ASN 86 Cb 0.02 0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.69 1m0v s ASN 86 CO -0.02 -1.88 0.00 -3.20 -1.51 0.00 0.00 177.10 170.50 1m0v n ASN 87 N -2.84 0.00 -4.69 -1.22 5.15 -1.26 -4.31 115.26 106.08 1m0v n ASN 87 Ca 0.15 0.00 -0.34 0.00 -0.60 0.00 0.00 54.58 53.79 1m0v n ASN 87 Cb 0.61 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.77 1m0v n ASN 87 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 1m0v s TYR 88 N 0.00 3.15 0.11 1.20 1.51 -1.26 0.07 117.35 122.13 1m0v s TYR 88 Ca 0.00 0.16 0.06 0.00 -1.01 0.00 0.00 57.07 56.28 1m0v s TYR 88 Cb 0.00 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 40.07 1m0v s TYR 88 CO 0.00 0.48 -0.03 0.34 -1.11 0.00 0.00 175.55 175.23 1m0v s ASP 89 N -1.22 4.79 0.05 2.29 2.15 0.12 -4.91 116.67 119.94 1m0v s ASP 89 Ca 0.17 -0.28 0.00 0.00 0.43 0.00 0.00 52.55 52.87 1m0v s ASP 89 Cb -0.11 -1.05 -0.03 0.00 -0.30 0.00 0.00 42.92 41.42 1m0v s ASP 89 CO 0.06 0.16 -0.04 -0.76 -0.17 0.00 0.00 175.17 174.42 1m0v s LEU 90 N -2.39 2.40 0.08 -1.34 1.43 -1.23 -1.17 118.68 116.47 1m0v s LEU 90 Ca 0.25 -0.82 0.06 0.00 -1.03 0.00 0.00 54.13 52.60 1m0v s LEU 90 Cb -0.11 0.08 -0.03 0.00 0.03 0.00 0.00 46.19 46.16 1m0v s LEU 90 CO 0.17 -0.45 -0.17 -0.13 0.23 0.00 0.00 176.35 176.00 1m0v s ARG 91 N -2.98 0.96 0.15 1.70 1.81 -0.60 -4.92 118.95 115.07 1m0v s ARG 91 Ca -0.00 -1.04 0.04 0.00 -1.72 0.00 0.00 55.73 53.01 1m0v s ARG 91 Cb 0.01 -1.08 -0.04 0.00 -0.45 0.00 0.00 34.95 33.39 1m0v s ARG 91 CO -0.05 0.25 0.18 -1.54 -0.68 0.00 0.00 175.30 173.45 1m0v s SER 92 N -1.78 5.80 0.00 0.23 1.04 -1.26 0.11 113.70 117.83 1m0v s SER 92 Ca 0.02 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.43 1m0v s SER 92 Cb -0.10 -1.60 0.00 0.00 0.10 0.00 0.00 66.02 64.42 1m0v s SER 92 CO 0.03 0.08 0.00 1.33 0.98 0.00 0.00 173.24 175.66 1m0v n VAL 93 N -0.31 0.00 -1.28 5.02 0.24 0.29 -4.84 118.33 117.44 1m0v n VAL 93 Ca -0.08 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.22 1m0v n VAL 93 Cb 0.54 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 1m0v n VAL 93 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m0v n GLY 94 N -0.64 1.02 5.00 7.63 0.00 -1.26 0.20 105.19 117.15 1m0v n GLY 94 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1m0v n GLY 94 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1m0v n ASN 95 N 0.97 0.00 -1.03 1.61 5.15 -1.26 -2.43 115.26 118.28 1m0v n ASN 95 Ca 0.00 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 53.99 1m0v n ASN 95 Cb 0.28 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.53 1m0v n ASN 95 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1m0v n GLY 96 N 0.00 0.77 3.89 8.20 0.00 -1.26 -5.07 105.19 111.73 1m0v n GLY 96 Ca 0.00 -0.37 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 1m0v n GLY 96 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1m0v s ASN 97 N -1.33 5.38 0.11 1.61 0.01 0.13 0.89 114.94 121.74 1m0v s ASN 97 Ca 0.15 -0.49 -0.08 0.00 -0.71 0.00 0.00 52.86 51.73 1m0v s ASN 97 Cb 0.17 -0.92 -0.01 0.00 0.41 0.00 0.00 41.25 40.91 1m0v s ASN 97 CO -0.07 -0.45 0.21 -0.55 -1.51 0.00 0.00 177.10 174.73 1m0v s SER 98 N -4.07 0.11 0.16 -1.22 0.15 0.50 0.10 113.70 109.44 1m0v s SER 98 Ca 0.44 -0.75 0.04 0.00 0.70 0.00 0.00 55.95 56.38 1m0v s SER 98 Cb -0.06 0.37 -0.04 0.00 -1.71 0.00 0.00 66.02 64.58 1m0v s SER 98 CO 0.28 -0.78 0.18 0.54 1.20 0.00 0.00 173.24 174.67 1m0v s VAL 99 N -3.90 4.75 -0.40 4.45 0.11 0.29 -2.04 120.40 123.66 1m0v s VAL 99 Ca 0.10 -0.96 -0.12 0.00 -2.93 0.00 0.00 61.98 58.06 1m0v s VAL 99 Cb 0.05 -3.44 0.04 0.00 -1.53 0.00 0.00 36.38 31.49 1m0v s VAL 99 CO -0.07 -0.11 0.26 -0.22 -3.33 0.00 0.00 175.10 171.63 1m0v s LEU 100 N -3.16 4.98 -0.29 2.54 2.96 -1.25 -1.56 118.68 122.89 1m0v s LEU 100 Ca 0.32 -1.07 0.03 0.00 -0.22 0.00 0.00 54.13 53.18 1m0v s LEU 100 Cb -0.10 -2.07 0.08 0.00 0.50 0.00 0.00 46.19 44.59 1m0v s LEU 100 CO 0.25 -0.45 -0.02 0.68 -1.32 0.00 0.00 176.35 175.49 1m0v s VAL 101 N 1.58 1.98 0.15 1.68 -7.23 -0.31 -4.51 120.40 113.73 1m0v s VAL 101 Ca 0.03 -1.82 -0.06 0.00 -1.81 0.00 0.00 61.98 58.33 1m0v s VAL 101 Cb -0.20 -2.30 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 1m0v s VAL 101 CO 0.07 -0.32 0.18 -0.55 -0.31 0.00 0.00 175.10 174.17 1m0v s SER 102 N 1.12 0.16 0.00 4.85 0.15 -1.25 0.10 113.70 118.83 1m0v s SER 102 Ca 0.01 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.65 1m0v s SER 102 Cb -0.19 0.37 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1m0v s SER 102 CO -0.08 -0.82 0.00 0.18 1.20 0.00 0.00 173.24 173.72 1m0v n LEU 103 N -0.16 0.00 -1.43 3.45 7.99 -0.60 -4.84 117.00 121.40 1m0v n LEU 103 Ca -0.07 0.00 0.10 0.00 -0.01 0.00 0.00 56.01 56.03 1m0v n LEU 103 Cb 0.63 0.00 0.33 0.00 -0.11 0.00 0.00 43.42 44.27 1m0v n LEU 103 CO 0.27 0.00 0.78 0.54 -1.51 0.00 0.00 177.39 177.47 1m0v n ARG 104 N 0.00 3.24 0.00 3.23 3.00 0.11 -4.95 116.66 121.28 1m0v n ARG 104 Ca 0.00 -2.61 0.00 0.00 -0.01 0.00 0.00 57.85 55.23 1m0v n ARG 104 Cb 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 32.46 30.71 1m0v n ARG 104 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1m0v n SER 105 N 1.21 0.00 -4.26 0.55 7.64 -1.26 -4.78 113.62 112.71 1m0v n SER 105 Ca 0.24 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.70 1m0v n SER 105 Cb 0.75 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.87 1m0v n SER 105 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1m0v s ASP 106 N 0.00 5.83 0.02 6.43 2.15 0.34 -4.43 116.67 127.01 1m0v s ASP 106 Ca 0.00 -1.73 -0.29 0.00 0.43 0.00 0.00 52.55 50.96 1m0v s ASP 106 Cb 0.00 -2.06 0.10 0.00 -0.30 0.00 0.00 42.92 40.65 1m0v s ASP 106 CO 0.00 -0.69 1.03 -1.10 -0.17 0.00 0.00 175.17 174.24 1m0v s GLN 107 N 1.45 0.80 -0.28 4.34 -0.21 -1.26 -3.48 119.66 121.03 1m0v s GLN 107 Ca 0.04 -0.39 -0.23 0.00 0.02 0.00 0.00 55.36 54.80 1m0v s GLN 107 Cb -0.26 0.31 0.11 0.00 1.00 0.00 0.00 33.01 34.17 1m0v s GLN 107 CO 0.01 -0.36 0.92 1.41 -2.12 0.00 0.00 175.29 175.15 1m0v s MET 108 N -2.96 0.59 0.24 2.91 1.75 -1.22 -4.27 119.30 116.34 1m0v s MET 108 Ca 0.10 0.75 0.06 0.00 -1.25 0.00 0.00 55.69 55.35 1m0v s MET 108 Cb -0.00 0.26 -0.03 0.00 2.84 0.00 0.00 34.83 37.89 1m0v s MET 108 CO -0.04 -0.08 0.24 0.95 -0.65 0.00 0.00 175.02 175.45 1m0v s THR 109 N 0.50 4.72 0.16 10.11 -4.23 -1.26 -3.17 115.64 122.47 1m0v s THR 109 Ca 0.00 -1.24 -0.24 0.00 -1.18 0.00 0.00 61.69 59.02 1m0v s THR 109 Cb -0.05 -3.54 0.05 0.00 1.34 0.00 0.00 72.50 70.29 1m0v s THR 109 CO -0.06 -0.32 1.58 -0.07 -0.54 0.00 0.00 174.62 175.20 1m0v h LEU 110 N 1.46 -1.28 -0.14 4.79 3.38 -1.23 -0.00 115.31 122.29 1m0v h LEU 110 Ca -0.50 0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.71 1m0v h LEU 110 Cb 1.23 0.59 -0.03 0.00 0.09 0.00 0.00 40.66 42.54 1m0v h LEU 110 CO 0.61 -0.34 -0.25 -0.61 0.09 0.00 0.00 178.44 177.94 1m0v h GLN 111 N -0.26 -0.20 -0.61 1.13 5.75 -1.81 -1.14 115.11 117.96 1m0v h GLN 111 Ca 0.17 0.01 0.11 0.00 -0.15 0.00 0.00 58.65 58.79 1m0v h GLN 111 Cb 0.56 0.05 -0.12 0.00 1.07 0.00 0.00 27.48 29.04 1m0v h GLN 111 CO -0.60 -0.14 -0.34 -0.44 -2.65 0.00 0.00 178.83 174.67 1m0v h ASP 112 N -0.21 -1.18 -0.29 -0.69 3.32 -1.80 0.61 116.42 116.19 1m0v h ASP 112 Ca 0.03 0.23 0.03 0.00 0.02 0.00 0.00 57.03 57.34 1m0v h ASP 112 Cb 0.28 0.59 -0.05 0.00 0.22 0.00 0.00 39.33 40.37 1m0v h ASP 112 CO -0.24 -0.30 -0.29 0.00 -1.72 0.00 0.00 179.24 176.69 1m0v h ALA 113 N 1.00 -0.47 0.00 3.45 0.00 -0.34 0.23 119.26 123.13 1m0v h ALA 113 Ca 0.24 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1m0v h ALA 113 Cb 0.55 0.99 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 1m0v h ALA 113 CO -0.69 -0.63 -0.05 1.57 0.00 0.00 0.00 179.25 179.45 1m0v h LYS 114 N -0.15 0.00 0.51 0.00 -0.00 -0.51 -0.86 116.57 115.57 1m0v h LYS 114 Ca 0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 60.65 60.67 1m0v h LYS 114 Cb 0.28 0.00 0.01 0.00 -0.00 0.00 0.00 32.23 32.51 1m0v h LYS 114 CO -0.35 0.05 -0.25 0.28 -0.00 0.00 0.00 179.45 179.19 1m0v h VAL 115 N 0.00 0.00 -0.44 0.07 2.07 0.35 1.07 116.25 119.37 1m0v h VAL 115 Ca -0.00 -0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 1m0v h VAL 115 Cb 0.29 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 1m0v h VAL 115 CO 0.01 0.00 0.05 -0.07 0.02 0.00 0.00 177.57 177.58 1m0v h LEU 116 N -0.69 0.64 -1.25 2.57 -0.00 -1.24 -0.82 115.31 114.52 1m0v h LEU 116 Ca -0.07 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 1m0v h LEU 116 Cb 0.53 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.02 1m0v h LEU 116 CO 0.12 0.68 0.00 -0.07 -0.00 0.00 0.00 178.44 179.16 1m0v h LEU 117 N 0.65 0.00 -0.01 1.67 4.07 -1.04 1.59 115.31 122.24 1m0v h LEU 117 Ca 0.14 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.04 1m0v h LEU 117 Cb 0.33 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.08 1m0v h LEU 117 CO 0.01 0.00 -0.25 -0.08 -1.08 0.00 0.00 178.44 177.04 1m0v h GLU 118 N 0.00 0.18 0.00 1.13 4.57 0.26 0.35 114.58 121.07 1m0v h GLU 118 Ca 0.00 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1m0v h GLU 118 Cb 0.52 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 1m0v h GLU 118 CO 0.00 0.90 0.00 0.00 -1.18 0.00 0.00 179.01 178.73 1m0v h ALA 119 N 0.28 1.00 0.00 2.92 0.00 -0.90 -0.71 119.26 121.86 1m0v h ALA 119 Ca -0.03 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1m0v h ALA 119 Cb 0.98 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1m0v h ALA 119 CO 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 179.25 179.03 1m0v h ALA 120 N 2.16 0.05 -0.00 0.00 0.00 0.24 -1.04 119.26 120.67 1m0v h ALA 120 Ca 0.00 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 1m0v h ALA 120 Cb 0.82 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1m0v h ALA 120 CO 0.00 0.16 -0.19 1.37 0.00 0.00 0.00 179.25 180.59 1m0v h LEU 121 N -1.00 0.01 0.25 0.00 -0.00 -0.36 0.94 115.31 115.14 1m0v h LEU 121 Ca -0.07 -0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.80 1m0v h LEU 121 Cb 0.87 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 1m0v h LEU 121 CO -0.04 0.20 -0.12 -0.09 -0.00 0.00 0.00 178.44 178.39 1m0v h ARG 122 N 0.01 -0.32 0.00 0.17 2.43 -1.20 1.86 114.38 117.33 1m0v h ARG 122 Ca -0.00 0.02 -0.31 0.00 -0.81 0.00 0.00 59.98 58.88 1m0v h ARG 122 Cb 0.34 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 1m0v h ARG 122 CO 0.02 0.03 -1.87 1.04 -1.51 0.00 0.00 179.97 177.68 1m0v n GLN 123 N -5.01 0.65 0.03 0.20 3.00 -0.39 -3.72 117.38 112.14 1m0v n GLN 123 Ca -0.08 0.22 -0.02 0.00 -0.01 0.00 0.00 57.00 57.11 1m0v n GLN 123 Cb 0.25 -1.72 -0.01 0.00 0.00 0.00 0.00 30.24 28.76 1m0v n GLN 123 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1m0v h GLU 124 N 0.00 -0.11 0.01 -1.09 4.39 0.78 -3.43 114.58 115.13 1m0v h GLU 124 Ca -0.35 0.01 -0.37 0.00 0.34 0.00 0.00 59.36 58.99 1m0v h GLU 124 Cb 2.06 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 30.68 1m0v h GLU 124 CO 0.07 -0.08 -2.07 0.43 -1.16 0.00 0.00 179.01 176.20 1m0v n SER 125 N -3.19 1.94 -0.96 1.42 7.64 -1.14 -5.04 113.62 114.30 1m0v n SER 125 Ca -0.01 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.18 1m0v n SER 125 Cb 0.05 -0.83 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 1m0v n SER 125 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m0v n GLY 126 N 1.47 0.06 2.29 0.23 0.00 0.62 -4.08 105.19 105.78 1m0v n GLY 126 Ca -0.45 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.07 1m0v n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m0v n ALA 127 N -0.59 -0.62 -0.02 4.61 0.00 -0.70 -4.83 120.51 118.36 1m0v n ALA 127 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1m0v n ALA 127 Cb 0.27 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1m0v n ALA 127 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1m0v n ARG 128 N -2.50 0.00 0.00 0.00 0.00 -1.26 -5.02 116.66 107.88 1m0v n ARG 128 Ca -0.13 0.19 0.00 0.00 -0.00 0.00 0.00 57.85 57.90 1m0v n ARG 128 Cb 0.54 -0.68 0.00 0.00 0.00 0.00 0.00 32.46 32.32 1m0v n ARG 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1m0v n GLY 129 N 1.71 2.67 0.00 5.14 0.00 -1.26 -4.82 105.19 108.63 1m0v n GLY 129 Ca 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1m0v n GLY 129 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06