#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4h s SER 2 N 0.00 0.94 0.09 1.61 0.15 -1.26 -5.15 113.70 110.08 1x4h s SER 2 Ca 0.00 -0.25 -0.27 0.00 0.70 0.00 0.00 55.95 56.13 1x4h s SER 2 Cb 0.00 -0.07 0.08 0.00 -1.71 0.00 0.00 66.02 64.32 1x4h s SER 2 CO 0.00 0.03 1.02 -0.94 1.20 0.00 0.00 173.24 174.54 1x4h s SER 3 N -0.56 -0.18 0.00 5.45 1.04 -1.26 -5.18 113.70 113.01 1x4h s SER 3 Ca 0.00 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.15 1x4h s SER 3 Cb -0.05 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1x4h s SER 3 CO 0.00 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.11 1x4h n GLY 4 N -0.43 4.25 3.42 7.32 0.00 -1.26 -5.16 105.19 113.33 1x4h n GLY 4 Ca -0.07 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 1x4h n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x4h s SER 5 N 0.00 3.44 -0.63 1.61 1.04 -1.26 -5.03 113.70 112.87 1x4h s SER 5 Ca 0.00 -0.82 -0.31 0.00 0.48 0.00 0.00 55.95 55.29 1x4h s SER 5 Cb 0.00 -0.26 -0.17 0.00 0.10 0.00 0.00 66.02 65.68 1x4h s SER 5 CO 0.00 0.14 2.02 -1.20 0.98 0.00 0.00 173.24 175.18 1x4h n SER 6 N 0.43 0.43 0.00 7.02 7.64 -1.26 -4.31 113.62 123.56 1x4h n SER 6 Ca -0.14 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.09 1x4h n SER 6 Cb 0.55 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1x4h n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x4h n GLY 7 N 5.81 -1.74 3.89 0.23 0.00 -1.26 -5.00 105.19 107.11 1x4h n GLY 7 Ca 0.51 -1.40 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 1x4h n GLY 7 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1x4h s LEU 8 N -2.41 4.31 0.56 0.99 0.05 -1.26 -5.09 118.68 115.83 1x4h s LEU 8 Ca 0.00 0.33 -0.19 0.00 0.05 0.00 0.00 54.13 54.32 1x4h s LEU 8 Cb 0.00 -2.53 -0.05 0.00 -2.05 0.00 0.00 46.19 41.56 1x4h s LEU 8 CO 0.00 0.27 1.13 -2.16 -0.55 0.00 0.00 176.35 175.04 1x4h s PRO 9 N -1.85 3.28 -0.29 1.48 0.04 -1.26 -5.06 135.00 131.35 1x4h s PRO 9 Ca 0.26 1.58 -0.15 0.00 0.04 0.00 0.00 61.00 62.73 1x4h s PRO 9 Cb -0.12 -2.00 0.15 0.00 0.04 0.00 0.00 34.50 32.57 1x4h s PRO 9 CO 0.17 -0.90 0.93 -1.12 0.04 0.00 0.00 177.00 176.12 1x4h s SER 10 N -1.89 -0.63 -0.41 6.66 0.01 -1.26 -5.13 113.70 111.05 1x4h s SER 10 Ca 0.72 0.92 -0.04 0.00 1.31 0.00 0.00 55.95 58.86 1x4h s SER 10 Cb -0.23 1.54 0.11 0.00 0.21 0.00 0.00 66.02 67.65 1x4h s SER 10 CO 0.29 -0.14 0.21 1.51 0.41 0.00 0.00 173.24 175.53 1x4h s ASP 11 N 2.04 5.30 0.08 2.44 -4.77 -1.26 -4.95 116.67 115.56 1x4h s ASP 11 Ca -0.06 -1.98 -0.16 0.00 -3.30 0.00 0.00 52.55 47.05 1x4h s ASP 11 Cb -0.06 -1.85 -0.10 0.00 -1.09 0.00 0.00 42.92 39.82 1x4h s ASP 11 CO -0.17 -0.55 1.39 0.58 0.70 0.00 0.00 175.17 177.12 1x4h h VAL 12 N 6.33 1.32 -3.62 2.11 2.07 -2.02 -3.41 116.25 119.02 1x4h h VAL 12 Ca -0.14 -1.45 -0.66 0.00 0.82 0.00 0.00 66.70 65.27 1x4h h VAL 12 Cb 1.05 1.69 -0.24 0.00 -1.52 0.00 0.00 31.29 32.27 1x4h h VAL 12 CO 0.71 0.45 -0.62 -0.89 0.02 0.00 0.00 177.57 177.25 1x4h s THR 13 N -4.30 4.23 -0.95 2.57 2.01 -1.26 -5.04 115.64 112.89 1x4h s THR 13 Ca -0.13 -0.38 -0.12 0.00 0.31 0.00 0.00 61.69 61.38 1x4h s THR 13 Cb 0.08 -3.06 0.24 0.00 0.01 0.00 0.00 72.50 69.77 1x4h s THR 13 CO 0.81 0.22 0.92 -1.83 -0.69 0.00 0.00 174.62 174.05 1x4h s GLU 14 N 1.58 3.86 -0.44 4.92 -1.05 -1.26 -4.87 118.70 121.44 1x4h s GLU 14 Ca 0.05 -2.79 0.05 0.00 -0.15 0.00 0.00 54.97 52.13 1x4h s GLU 14 Cb -0.16 -4.49 0.42 0.00 -0.44 0.00 0.00 34.13 29.47 1x4h s GLU 14 CO 0.03 -1.27 1.12 0.41 0.95 0.00 0.00 175.26 176.51 1x4h n GLY 15 N 3.43 6.02 3.02 -3.83 0.00 -1.26 -5.00 105.19 107.57 1x4h n GLY 15 Ca 0.18 -2.76 -0.30 0.00 0.00 0.00 0.00 46.02 43.14 1x4h n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x4h s LYS 16 N -3.55 2.27 0.10 1.61 1.02 -1.26 -4.93 119.74 115.00 1x4h s LYS 16 Ca 0.48 -0.62 -0.01 0.00 0.02 0.00 0.00 55.97 55.85 1x4h s LYS 16 Cb 0.40 -2.18 -0.04 0.00 -0.52 0.00 0.00 37.83 35.49 1x4h s LYS 16 CO -0.18 -0.27 0.01 0.99 -0.92 0.00 0.00 175.35 174.97 1x4h s THR 17 N 1.46 0.22 -0.27 2.17 2.01 -1.26 -4.08 115.64 115.90 1x4h s THR 17 Ca 0.04 -1.87 -0.08 0.00 0.31 0.00 0.00 61.69 60.09 1x4h s THR 17 Cb -0.13 -1.80 0.12 0.00 0.01 0.00 0.00 72.50 70.70 1x4h s THR 17 CO -0.10 -0.73 0.56 0.68 -0.69 0.00 0.00 174.62 174.34 1x4h s VAL 18 N -3.95 -0.88 -0.18 3.82 -7.23 -0.43 -4.03 120.40 107.53 1x4h s VAL 18 Ca 0.16 0.05 -0.03 0.00 -1.81 0.00 0.00 61.98 60.34 1x4h s VAL 18 Cb 0.08 -0.89 -0.02 0.00 0.56 0.00 0.00 36.38 36.11 1x4h s VAL 18 CO -0.04 0.02 -0.06 0.12 -0.31 0.00 0.00 175.10 174.83 1x4h s PHE 19 N 2.79 2.95 -0.19 2.82 2.19 0.84 -0.12 117.98 129.26 1x4h s PHE 19 Ca -0.01 -0.69 -0.10 0.00 0.33 0.00 0.00 56.93 56.46 1x4h s PHE 19 Cb -0.12 -2.02 -0.05 0.00 -1.31 0.00 0.00 43.02 39.52 1x4h s PHE 19 CO -0.17 -0.34 0.14 0.42 1.83 0.00 0.00 175.22 177.11 1x4h s ILE 20 N 0.95 5.41 0.36 3.12 1.09 -0.24 -1.14 121.20 130.75 1x4h s ILE 20 Ca -0.00 0.22 0.04 0.00 -1.10 0.00 0.00 60.65 59.81 1x4h s ILE 20 Cb -0.15 -3.48 0.04 0.00 -1.06 0.00 0.00 42.46 37.82 1x4h s ILE 20 CO 0.01 0.45 0.33 -1.14 -0.10 0.00 0.00 174.94 174.48 1x4h n ARG 21 N 3.38 0.91 -3.89 2.79 0.63 0.25 -1.99 116.66 118.74 1x4h n ARG 21 Ca -0.16 -2.14 -0.28 0.00 -0.92 0.00 0.00 57.85 54.35 1x4h n ARG 21 Cb 0.52 0.13 -0.03 0.00 0.45 0.00 0.00 32.46 33.54 1x4h n ARG 21 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1x4h n ASN 22 N -2.07 -1.09 -4.83 6.15 5.15 -1.08 -3.38 115.26 114.12 1x4h n ASN 22 Ca 0.02 -0.92 -0.33 0.00 -0.60 0.00 0.00 54.58 52.75 1x4h n ASN 22 Cb 0.40 -1.12 -0.07 0.00 -0.53 0.00 0.00 39.78 38.46 1x4h n ASN 22 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1x4h s LEU 23 N -6.44 4.05 0.34 1.20 1.43 -1.02 -4.45 118.68 113.79 1x4h s LEU 23 Ca 0.17 1.55 -0.26 0.00 -1.03 0.00 0.00 54.13 54.56 1x4h s LEU 23 Cb -0.10 -4.27 -0.09 0.00 0.03 0.00 0.00 46.19 41.76 1x4h s LEU 23 CO 0.70 -0.25 1.02 -0.44 0.23 0.00 0.00 176.35 177.61 1x4h s SER 24 N -2.12 7.11 0.34 2.29 0.01 -1.26 -4.65 113.70 115.43 1x4h s SER 24 Ca 0.57 2.03 0.26 0.00 1.31 0.00 0.00 55.95 60.11 1x4h s SER 24 Cb -0.11 -2.60 1.16 0.00 0.21 0.00 0.00 66.02 64.69 1x4h s SER 24 CO 0.16 -0.24 1.78 -0.26 0.41 0.00 0.00 173.24 175.09 1x4h h PHE 25 N 3.13 0.00 0.00 2.43 0.04 -1.96 -1.82 116.94 118.75 1x4h h PHE 25 Ca -0.47 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1x4h h PHE 25 Cb 1.21 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.36 1x4h h PHE 25 CO 0.59 0.00 -1.30 -0.25 -0.60 0.00 0.00 178.31 176.75 1x4h n ASP 26 N -2.42 0.51 -4.64 2.17 9.92 -1.26 -4.69 116.55 116.14 1x4h n ASP 26 Ca 0.01 -0.07 -0.37 0.00 -0.53 0.00 0.00 54.79 53.83 1x4h n ASP 26 Cb 0.19 1.08 0.07 0.00 -0.64 0.00 0.00 41.12 41.82 1x4h n ASP 26 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 1x4h n SER 27 N -2.18 0.94 -4.01 -2.24 2.88 -0.69 -5.03 113.62 103.29 1x4h n SER 27 Ca -0.00 0.75 -0.17 0.00 -1.33 0.00 0.00 58.87 58.12 1x4h n SER 27 Cb 0.49 -1.44 -0.14 0.00 -0.75 0.00 0.00 64.21 62.38 1x4h n SER 27 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1x4h s GLU 28 N -3.14 0.60 0.33 -1.46 2.02 -1.26 -4.98 118.70 110.80 1x4h s GLU 28 Ca 0.77 -0.37 0.14 0.00 0.02 0.00 0.00 54.97 55.53 1x4h s GLU 28 Cb -0.38 -0.55 1.11 0.00 0.10 0.00 0.00 34.13 34.41 1x4h s GLU 28 CO 0.46 0.14 1.49 -1.91 0.02 0.00 0.00 175.26 175.47 1x4h n GLU 29 N 2.61 -0.06 0.47 1.61 2.13 -1.26 -0.17 120.64 125.96 1x4h n GLU 29 Ca -0.15 1.34 -0.19 0.00 0.66 0.00 0.00 57.16 58.82 1x4h n GLU 29 Cb 0.57 -2.32 -0.09 0.00 0.27 0.00 0.00 31.44 29.87 1x4h n GLU 29 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1x4h h GLU 30 N 0.00 -1.15 0.24 5.31 5.08 -1.95 -1.98 114.58 120.13 1x4h h GLU 30 Ca 0.73 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 59.18 1x4h h GLU 30 Cb 1.84 0.26 -0.02 0.00 0.50 0.00 0.00 28.75 31.33 1x4h h GLU 30 CO -0.78 -0.76 -0.25 0.00 -1.00 0.00 0.00 179.01 176.22 1x4h h ALA 31 N -1.25 -0.51 -0.77 3.43 0.00 -1.05 -0.61 119.26 118.50 1x4h h ALA 31 Ca -0.12 -0.07 0.16 0.00 0.00 0.00 0.00 54.91 54.87 1x4h h ALA 31 Cb 0.92 0.37 -0.14 0.00 0.00 0.00 0.00 17.79 18.93 1x4h h ALA 31 CO 0.20 -0.82 -0.14 1.25 0.00 0.00 0.00 179.25 179.74 1x4h h LEU 32 N -0.53 -0.61 -0.09 0.00 6.46 -0.60 -0.63 115.31 119.30 1x4h h LEU 32 Ca -0.00 0.22 -0.01 0.00 -0.12 0.00 0.00 57.88 57.97 1x4h h LEU 32 Cb 0.50 0.44 -0.00 0.00 -0.73 0.00 0.00 40.66 40.87 1x4h h LEU 32 CO -0.06 -0.24 0.02 1.23 -0.62 0.00 0.00 178.44 178.76 1x4h h GLY 33 N 0.02 0.16 1.25 3.75 0.00 -1.01 -2.50 103.07 104.74 1x4h h GLY 33 Ca 0.38 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1x4h h GLY 33 CO -0.76 0.10 0.34 0.83 0.00 0.00 0.00 176.54 177.05 1x4h h GLU 34 N -0.09 0.00 0.09 4.80 5.08 0.39 0.29 114.58 125.15 1x4h h GLU 34 Ca 0.03 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 1x4h h GLU 34 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1x4h h GLU 34 CO 0.00 0.00 -0.89 0.28 -1.00 0.00 0.00 179.01 177.40 1x4h h VAL 35 N 0.00 1.35 0.00 3.13 2.07 -0.88 -3.34 116.25 118.58 1x4h h VAL 35 Ca 0.00 -2.42 0.00 0.00 0.82 0.00 0.00 66.70 65.10 1x4h h VAL 35 Cb 0.69 2.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.44 1x4h h VAL 35 CO 0.00 0.65 0.00 -0.07 0.02 0.00 0.00 177.57 178.17 1x4h h LEU 36 N -0.55 0.00 -1.13 2.57 3.38 -0.81 -3.22 115.31 115.56 1x4h h LEU 36 Ca -0.19 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1x4h h LEU 36 Cb 1.51 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.23 1x4h h LEU 36 CO 0.05 0.00 0.48 1.56 0.09 0.00 0.00 178.44 180.62 1x4h h GLN 37 N 0.00 1.07 -0.96 1.13 4.20 -0.65 -2.67 115.11 117.23 1x4h h GLN 37 Ca 0.00 -0.09 0.29 0.00 0.06 0.00 0.00 58.65 58.91 1x4h h GLN 37 Cb 0.84 -0.23 -0.17 0.00 0.30 0.00 0.00 27.48 28.22 1x4h h GLN 37 CO 0.00 0.75 0.19 -0.56 -0.67 0.00 0.00 178.83 178.54 1x4h h GLN 38 N 1.09 0.07 0.39 1.46 3.07 -1.69 -1.14 115.11 118.37 1x4h h GLN 38 Ca 0.29 -0.00 -0.02 0.00 0.09 0.00 0.00 58.65 59.00 1x4h h GLN 38 Cb -0.05 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 27.50 1x4h h GLN 38 CO -0.05 0.04 -0.19 0.74 0.09 0.00 0.00 178.83 179.46 1x4h h PHE 39 N 0.07 -0.49 -3.61 0.06 0.04 -1.72 -3.48 116.94 107.81 1x4h h PHE 39 Ca 0.64 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 61.34 1x4h h PHE 39 Cb 1.40 0.16 -0.09 0.00 2.20 0.00 0.00 35.95 39.62 1x4h h PHE 39 CO -0.33 -0.23 -0.10 0.20 -0.60 0.00 0.00 178.31 177.24 1x4h s GLY 40 N -2.92 0.45 -0.13 -1.45 0.00 -0.43 -5.00 107.32 97.84 1x4h s GLY 40 Ca -0.10 -0.79 -0.29 0.00 0.00 0.00 0.00 44.72 43.53 1x4h s GLY 40 CO 0.32 -0.58 1.68 0.99 0.00 0.00 0.00 173.10 175.50 1x4h s ASP 41 N -3.00 6.48 -0.12 1.64 1.01 -1.26 -4.01 116.67 117.41 1x4h s ASP 41 Ca 0.20 1.98 -0.30 0.00 0.71 0.00 0.00 52.55 55.15 1x4h s ASP 41 Cb -0.01 -2.53 -0.02 0.00 1.01 0.00 0.00 42.92 41.37 1x4h s ASP 41 CO 0.07 -1.12 1.18 -0.76 0.21 0.00 0.00 175.17 174.75 1x4h s LEU 42 N 4.75 4.22 0.05 1.23 1.43 -1.26 -2.23 118.68 126.86 1x4h s LEU 42 Ca 0.74 1.68 -0.23 0.00 -1.03 0.00 0.00 54.13 55.30 1x4h s LEU 42 Cb -0.30 -3.55 -0.15 0.00 0.03 0.00 0.00 46.19 42.22 1x4h s LEU 42 CO 0.30 -0.64 1.49 0.50 0.23 0.00 0.00 176.35 178.23 1x4h h LYS 43 N 7.66 0.15 -2.35 1.70 1.63 -0.29 -3.46 116.57 121.61 1x4h h LYS 43 Ca -0.29 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.39 1x4h h LYS 43 Cb 1.13 -0.02 -0.23 0.00 -0.60 0.00 0.00 32.23 32.51 1x4h h LYS 43 CO 0.92 0.39 -0.08 1.52 -3.45 0.00 0.00 179.45 178.75 1x4h s TYR 44 N -5.07 -0.69 -0.19 1.91 -0.85 -1.23 -4.99 117.35 106.23 1x4h s TYR 44 Ca -0.14 1.58 0.01 0.00 -0.52 0.00 0.00 57.07 58.00 1x4h s TYR 44 Cb 0.05 0.29 0.04 0.00 0.38 0.00 0.00 41.96 42.72 1x4h s TYR 44 CO 0.69 -0.35 -0.12 0.54 -1.52 0.00 0.00 175.55 174.80 1x4h s VAL 45 N 0.71 1.67 -0.04 -3.49 0.11 -1.26 -1.51 120.40 116.59 1x4h s VAL 45 Ca -0.03 -0.95 0.03 0.00 -2.93 0.00 0.00 61.98 58.10 1x4h s VAL 45 Cb -0.05 -1.69 0.00 0.00 -1.53 0.00 0.00 36.38 33.11 1x4h s VAL 45 CO -0.05 0.24 -0.14 -0.60 -3.33 0.00 0.00 175.10 171.23 1x4h s ARG 46 N 1.40 1.47 -0.28 1.54 3.52 0.13 -4.98 118.95 121.76 1x4h s ARG 46 Ca 0.00 -0.48 0.01 0.00 -0.13 0.00 0.00 55.73 55.14 1x4h s ARG 46 Cb -0.15 -1.30 0.06 0.00 -1.56 0.00 0.00 34.95 32.00 1x4h s ARG 46 CO -0.09 0.17 -0.07 0.54 -0.81 0.00 0.00 175.30 175.05 1x4h s VAL 47 N 0.16 2.50 0.52 7.11 0.11 -1.26 0.27 120.40 129.82 1x4h s VAL 47 Ca -0.05 -1.53 -0.22 0.00 -2.93 0.00 0.00 61.98 57.25 1x4h s VAL 47 Cb -0.11 -2.46 -0.05 0.00 -1.53 0.00 0.00 36.38 32.23 1x4h s VAL 47 CO 0.02 -0.06 1.33 0.54 -3.33 0.00 0.00 175.10 173.60 1x4h s VAL 48 N 1.16 2.26 0.28 2.04 0.11 -1.16 -4.99 120.40 120.11 1x4h s VAL 48 Ca -0.07 0.20 0.10 0.00 -2.93 0.00 0.00 61.98 59.27 1x4h s VAL 48 Cb -0.20 -3.10 -0.05 0.00 -1.53 0.00 0.00 36.38 31.50 1x4h s VAL 48 CO -0.03 -0.00 -0.14 -0.76 -3.33 0.00 0.00 175.10 170.83 1x4h s LEU 49 N -3.38 2.60 0.39 2.54 1.43 -1.26 -3.52 118.68 117.48 1x4h s LEU 49 Ca 0.69 -1.10 -0.27 0.00 -1.03 0.00 0.00 54.13 52.43 1x4h s LEU 49 Cb -0.39 -0.92 -0.11 0.00 0.03 0.00 0.00 46.19 44.80 1x4h s LEU 49 CO 0.46 -0.12 1.33 1.57 0.23 0.00 0.00 176.35 179.82 1x4h n HIS 50 N -0.61 2.39 -0.12 0.29 -0.00 -0.57 -4.73 115.22 111.86 1x4h n HIS 50 Ca -0.06 0.50 -0.13 0.00 0.46 0.00 0.00 57.72 58.50 1x4h n HIS 50 Cb 0.61 -2.43 -0.02 0.00 -0.12 0.00 0.00 29.99 28.04 1x4h n HIS 50 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1x4h h PRO 51 N 2.42 0.95 0.00 1.57 0.13 -1.99 -3.36 132.00 131.71 1x4h h PRO 51 Ca -0.48 -0.49 0.00 0.00 -0.87 0.00 0.00 66.00 64.15 1x4h h PRO 51 Cb 1.28 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1x4h h PRO 51 CO 0.62 1.15 -0.06 0.22 -0.23 0.00 0.00 178.00 179.70 1x4h h ASP 52 N 0.77 0.00 -4.72 1.44 3.58 -2.00 -3.48 116.42 112.01 1x4h h ASP 52 Ca 0.06 0.00 -0.30 0.00 0.42 0.00 0.00 57.03 57.21 1x4h h ASP 52 Cb 0.97 0.00 0.06 0.00 1.72 0.00 0.00 39.33 42.08 1x4h h ASP 52 CO 0.09 0.48 0.08 0.35 -2.88 0.00 0.00 179.24 177.36 1x4h n THR 53 N -4.48 0.00 -1.64 2.25 -2.24 -1.26 -5.02 114.28 101.90 1x4h n THR 53 Ca -0.01 -1.02 -0.20 0.00 -2.27 0.00 0.00 64.05 60.55 1x4h n THR 53 Cb 0.03 -1.07 0.10 0.00 -2.10 0.00 0.00 70.33 67.29 1x4h n THR 53 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1x4h n GLU 54 N -2.22 2.72 -2.84 -0.78 2.13 -1.26 -4.12 120.64 114.27 1x4h n GLU 54 Ca 0.11 -3.58 -0.19 0.00 0.66 0.00 0.00 57.16 54.15 1x4h n GLU 54 Cb 0.39 -2.12 0.04 0.00 0.27 0.00 0.00 31.44 30.02 1x4h n GLU 54 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1x4h s HIS 55 N -3.53 2.49 -0.59 4.31 3.76 -1.26 -4.89 115.29 115.59 1x4h s HIS 55 Ca 0.52 -0.30 -0.26 0.00 -0.15 0.00 0.00 55.06 54.87 1x4h s HIS 55 Cb 0.44 -2.54 0.04 0.00 1.11 0.00 0.00 32.58 31.62 1x4h s HIS 55 CO 0.01 -0.82 1.07 0.45 -0.85 0.00 0.00 174.74 174.61 1x4h s SER 56 N -4.46 6.36 0.56 1.40 0.15 -1.26 -1.51 113.70 114.93 1x4h s SER 56 Ca 0.58 -0.22 0.45 0.00 0.70 0.00 0.00 55.95 57.46 1x4h s SER 56 Cb -0.09 -2.49 1.61 0.00 -1.71 0.00 0.00 66.02 63.34 1x4h s SER 56 CO 0.37 -1.39 1.60 0.50 1.20 0.00 0.00 173.24 175.52 1x4h h LYS 57 N 9.48 0.00 0.00 5.44 3.64 -1.85 -3.44 116.57 129.85 1x4h h LYS 57 Ca -0.26 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1x4h h LYS 57 Cb 1.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 1x4h h LYS 57 CO 1.15 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 178.74 1x4h n GLY 58 N -1.86 1.67 3.60 5.01 0.00 -1.26 -4.98 105.19 107.36 1x4h n GLY 58 Ca 0.37 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.25 1x4h n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x4h s ALA 60 N -0.16 -0.21 -0.12 0.00 0.00 -0.84 -2.97 121.76 117.46 1x4h s ALA 60 Ca -0.02 0.09 -0.06 0.00 0.00 0.00 0.00 51.96 51.96 1x4h s ALA 60 Cb -0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 1x4h s ALA 60 CO 0.02 -0.09 0.10 -0.06 0.00 0.00 0.00 175.76 175.74 1x4h s PHE 61 N -0.40 3.46 0.21 0.00 0.40 0.14 -1.08 117.98 120.71 1x4h s PHE 61 Ca -0.05 0.41 -0.00 0.00 -0.60 0.00 0.00 56.93 56.69 1x4h s PHE 61 Cb -0.03 -1.94 -0.04 0.00 0.51 0.00 0.00 43.02 41.52 1x4h s PHE 61 CO 0.00 0.60 0.10 0.00 0.70 0.00 0.00 175.22 176.62 1x4h s ALA 62 N -0.77 1.32 -0.01 5.36 0.00 0.82 -0.69 121.76 127.78 1x4h s ALA 62 Ca 0.13 -1.71 -0.02 0.00 0.00 0.00 0.00 51.96 50.37 1x4h s ALA 62 Cb -0.12 1.12 0.00 0.00 0.00 0.00 0.00 23.12 24.13 1x4h s ALA 62 CO 0.03 -0.51 0.04 -1.14 0.00 0.00 0.00 175.76 174.18 1x4h s GLN 63 N -4.08 0.09 0.45 0.00 0.74 -0.57 -1.31 119.66 114.99 1x4h s GLN 63 Ca 0.35 -0.01 0.08 0.00 0.05 0.00 0.00 55.36 55.84 1x4h s GLN 63 Cb 0.07 0.04 0.02 0.00 1.10 0.00 0.00 33.01 34.24 1x4h s GLN 63 CO 0.10 -0.01 0.57 -0.06 -0.55 0.00 0.00 175.29 175.34 1x4h s PHE 64 N -0.14 2.47 -0.06 1.67 0.40 -1.26 0.39 117.98 121.44 1x4h s PHE 64 Ca -0.02 -0.50 0.14 0.00 -0.60 0.00 0.00 56.93 55.95 1x4h s PHE 64 Cb -0.01 -2.29 -0.18 0.00 0.51 0.00 0.00 43.02 41.05 1x4h s PHE 64 CO 0.00 -0.50 0.81 0.52 0.70 0.00 0.00 175.22 176.75 1x4h h MET 65 N 0.63 0.00 -5.13 0.44 2.86 -1.80 -3.40 114.93 108.54 1x4h h MET 65 Ca -0.38 0.00 -0.41 0.00 -2.06 0.00 0.00 59.70 56.85 1x4h h MET 65 Cb 1.28 0.00 -0.25 0.00 0.06 0.00 0.00 31.60 32.69 1x4h h MET 65 CO 0.47 0.46 -0.78 0.95 1.06 0.00 0.00 176.91 179.07 1x4h s THR 66 N -2.74 0.97 0.15 2.22 -4.23 -1.26 -5.03 115.64 105.72 1x4h s THR 66 Ca -0.03 -0.92 -0.18 0.00 -1.18 0.00 0.00 61.69 59.38 1x4h s THR 66 Cb 0.08 -0.89 0.05 0.00 1.34 0.00 0.00 72.50 73.08 1x4h s THR 66 CO 0.82 -0.02 1.68 1.56 -0.54 0.00 0.00 174.62 178.11 1x4h h GLN 67 N 5.01 -0.02 -0.98 3.99 4.20 -1.91 -0.91 115.11 124.49 1x4h h GLN 67 Ca -0.37 0.00 0.19 0.00 0.06 0.00 0.00 58.65 58.53 1x4h h GLN 67 Cb 1.18 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.87 1x4h h GLN 67 CO 0.44 -0.01 0.61 1.49 -0.67 0.00 0.00 178.83 180.69 1x4h h GLU 68 N -0.02 0.68 0.33 1.46 4.81 -1.99 -2.29 114.58 117.56 1x4h h GLU 68 Ca 0.16 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1x4h h GLU 68 Cb 0.26 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 1x4h h GLU 68 CO -0.34 0.45 -0.46 0.00 -0.73 0.00 0.00 179.01 177.93 1x4h h ALA 69 N 1.62 -1.06 -0.66 2.92 0.00 -1.55 0.38 119.26 120.91 1x4h h ALA 69 Ca 0.54 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 55.44 1x4h h ALA 69 Cb 0.93 0.75 -0.13 0.00 0.00 0.00 0.00 17.79 19.34 1x4h h ALA 69 CO -0.32 -1.12 -0.21 0.00 0.00 0.00 0.00 179.25 177.61 1x4h h ALA 70 N -0.87 0.35 -0.53 0.00 0.00 -1.32 0.78 119.26 117.66 1x4h h ALA 70 Ca -0.04 0.25 0.04 0.00 0.00 0.00 0.00 54.91 55.15 1x4h h ALA 70 Cb 0.75 0.58 -0.04 0.00 0.00 0.00 0.00 17.79 19.07 1x4h h ALA 70 CO -0.13 -0.47 0.29 1.96 0.00 0.00 0.00 179.25 180.90 1x4h h GLN 71 N -0.04 0.56 -0.12 0.00 1.08 -1.26 -0.83 115.11 114.50 1x4h h GLN 71 Ca 0.31 -0.03 0.03 0.00 -1.45 0.00 0.00 58.65 57.51 1x4h h GLN 71 Cb 0.51 -0.13 -0.00 0.00 -0.05 0.00 0.00 27.48 27.81 1x4h h GLN 71 CO -0.70 0.37 0.10 0.87 -0.95 0.00 0.00 178.83 178.52 1x4h h LYS 72 N 0.57 0.00 0.01 1.46 1.57 0.13 -0.55 116.57 119.77 1x4h h LYS 72 Ca 0.23 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.80 1x4h h LYS 72 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1x4h h LYS 72 CO -0.13 0.00 -0.90 0.00 -0.57 0.00 0.00 179.45 177.85 1x4h h LEU 74 N 0.12 -0.11 -1.76 0.00 3.38 -0.62 -0.43 115.31 115.89 1x4h h LEU 74 Ca -0.05 0.00 0.43 0.00 0.09 0.00 0.00 57.88 58.35 1x4h h LEU 74 Cb 1.53 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 42.25 1x4h h LEU 74 CO 0.14 -0.05 1.19 0.00 0.09 0.00 0.00 178.44 179.81 1x4h h ALA 75 N -1.88 3.38 0.11 1.53 0.00 -1.63 1.58 119.26 122.35 1x4h h ALA 75 Ca -0.01 -0.05 -0.29 0.00 0.00 0.00 0.00 54.91 54.55 1x4h h ALA 75 Cb 0.10 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1x4h h ALA 75 CO 0.02 -1.95 -1.42 0.00 0.00 0.00 0.00 179.25 175.90 1x4h h ALA 76 N 1.00 0.24 0.00 0.00 0.00 -1.53 -3.32 119.26 115.66 1x4h h ALA 76 Ca 0.70 -1.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 1x4h h ALA 76 Cb 3.07 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 21.02 1x4h h ALA 76 CO -0.01 1.11 -0.66 0.00 0.00 0.00 0.00 179.25 179.69 1x4h h ALA 77 N 0.56 0.77 -1.75 0.00 0.00 0.39 -3.00 119.26 116.23 1x4h h ALA 77 Ca -0.20 -0.60 -0.56 0.00 0.00 0.00 0.00 54.91 53.55 1x4h h ALA 77 Cb 1.99 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.64 1x4h h ALA 77 CO 0.17 0.82 1.21 0.45 0.00 0.00 0.00 179.25 181.90 1x4h s SER 78 N -6.68 5.95 0.05 0.00 0.15 0.56 -3.77 113.70 109.96 1x4h s SER 78 Ca 0.00 0.88 0.07 0.00 0.70 0.00 0.00 55.95 57.60 1x4h s SER 78 Cb 0.11 -2.53 0.33 0.00 -1.71 0.00 0.00 66.02 62.22 1x4h s SER 78 CO 0.76 -1.74 1.22 0.00 1.20 0.00 0.00 173.24 174.69 1x4h n LEU 79 N 10.16 0.09 -0.04 3.45 -0.00 -1.26 -2.15 117.00 127.25 1x4h n LEU 79 Ca 0.19 0.54 -0.19 0.00 -0.00 0.00 0.00 56.01 56.55 1x4h n LEU 79 Cb 0.48 -0.54 -0.13 0.00 -0.00 0.00 0.00 43.42 43.23 1x4h n LEU 79 CO 0.70 -0.49 -0.14 -0.08 -0.00 0.00 0.00 177.39 177.38 1x4h h GLU 80 N 0.00 0.12 -6.83 1.47 4.81 -1.92 -3.40 114.58 108.82 1x4h h GLU 80 Ca 0.00 -0.20 -0.57 0.00 -0.13 0.00 0.00 59.36 58.46 1x4h h GLU 80 Cb 0.08 0.07 0.16 0.00 0.63 0.00 0.00 28.75 29.70 1x4h h GLU 80 CO 0.00 1.10 0.14 0.00 -0.73 0.00 0.00 179.01 179.52 1x4h n ALA 81 N -2.93 0.22 -1.70 2.92 0.00 -0.92 -4.90 120.51 113.20 1x4h n ALA 81 Ca -0.21 0.02 -0.40 0.00 0.00 0.00 0.00 53.44 52.86 1x4h n ALA 81 Cb 0.71 -2.12 0.03 0.00 0.00 0.00 0.00 19.45 18.07 1x4h n ALA 81 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1x4h n GLU 82 N -0.96 1.69 0.00 0.00 -0.58 -1.26 -3.38 120.64 116.14 1x4h n GLU 82 Ca 0.13 0.61 0.00 0.00 -0.42 0.00 0.00 57.16 57.49 1x4h n GLU 82 Cb 0.47 -2.41 0.00 0.00 -0.57 0.00 0.00 31.44 28.93 1x4h n GLU 82 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1x4h n GLY 83 N 0.87 3.13 0.00 0.62 0.00 -1.26 -4.95 105.19 103.60 1x4h n GLY 83 Ca 0.09 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.25 1x4h n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x4h n GLY 84 N 0.00 4.01 3.94 -0.02 0.00 -1.22 -5.13 105.19 106.78 1x4h n GLY 84 Ca 0.00 -1.57 -0.24 0.00 0.00 0.00 0.00 46.02 44.21 1x4h n GLY 84 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x4h s GLY 85 N 0.00 1.54 0.00 -0.02 0.00 -1.25 -4.62 107.32 102.97 1x4h s GLY 85 Ca 0.00 -0.96 -0.16 0.00 0.00 0.00 0.00 44.72 43.59 1x4h s GLY 85 CO 0.00 -0.79 0.46 1.08 0.00 0.00 0.00 173.10 173.85 1x4h s LEU 86 N -4.59 4.46 0.00 0.66 1.02 -1.13 -4.93 118.68 114.17 1x4h s LEU 86 Ca 0.48 1.02 0.02 0.00 0.02 0.00 0.00 54.13 55.68 1x4h s LEU 86 Cb -0.10 -2.68 -0.01 0.00 0.02 0.00 0.00 46.19 43.42 1x4h s LEU 86 CO 0.39 0.27 -0.08 -0.54 0.02 0.00 0.00 176.35 176.41 1x4h s LYS 87 N -0.86 0.59 -0.24 1.70 1.02 -1.26 -2.34 119.74 118.36 1x4h s LYS 87 Ca 0.25 -0.33 0.01 0.00 0.02 0.00 0.00 55.97 55.92 1x4h s LYS 87 Cb -0.17 -0.55 0.06 0.00 -0.52 0.00 0.00 37.83 36.65 1x4h s LYS 87 CO 0.14 0.15 -0.06 -1.17 -0.92 0.00 0.00 175.35 173.49 1x4h s LEU 88 N -0.37 2.76 -1.69 3.17 2.96 0.02 -4.72 118.68 120.81 1x4h s LEU 88 Ca 0.01 -1.23 0.00 0.00 -0.22 0.00 0.00 54.13 52.69 1x4h s LEU 88 Cb -0.04 -1.25 0.00 0.00 0.50 0.00 0.00 46.19 45.40 1x4h s LEU 88 CO -0.00 -0.23 0.00 0.47 -1.32 0.00 0.00 176.35 175.27 1x4h n ASP 89 N 4.62 -5.44 0.00 3.68 9.92 -1.26 -1.94 116.55 126.14 1x4h n ASP 89 Ca -0.12 0.07 0.00 0.00 -0.53 0.00 0.00 54.79 54.20 1x4h n ASP 89 Cb 0.44 -4.51 0.00 0.00 -0.64 0.00 0.00 41.12 36.41 1x4h n ASP 89 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1x4h n GLY 90 N -0.95 0.82 3.11 0.44 0.00 -1.26 -5.07 105.19 102.28 1x4h n GLY 90 Ca -0.22 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 44.89 1x4h n GLY 90 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x4h s ARG 91 N -2.38 2.33 -0.53 1.61 1.81 -0.82 -5.09 118.95 115.89 1x4h s ARG 91 Ca 0.00 -0.63 -0.28 0.00 -1.72 0.00 0.00 55.73 53.10 1x4h s ARG 91 Cb 0.00 -1.84 0.01 0.00 -0.45 0.00 0.00 34.95 32.68 1x4h s ARG 91 CO 0.00 0.09 1.41 -1.14 -0.68 0.00 0.00 175.30 174.97 1x4h s GLN 92 N 0.55 3.37 -0.05 3.54 2.00 -1.26 -0.80 119.66 127.01 1x4h s GLN 92 Ca -0.16 0.56 -0.30 0.00 -2.00 0.00 0.00 55.36 53.46 1x4h s GLN 92 Cb -0.17 -4.10 -0.02 0.00 0.80 0.00 0.00 33.01 29.52 1x4h s GLN 92 CO 0.06 -1.85 0.98 -0.51 -0.50 0.00 0.00 175.29 173.47 1x4h s LEU 93 N 5.89 4.32 -0.43 3.68 1.43 -0.99 -4.52 118.68 128.07 1x4h s LEU 93 Ca 0.54 1.59 -0.09 0.00 -1.03 0.00 0.00 54.13 55.14 1x4h s LEU 93 Cb -0.11 -3.55 0.09 0.00 0.03 0.00 0.00 46.19 42.65 1x4h s LEU 93 CO 0.27 -0.33 0.27 -0.54 0.23 0.00 0.00 176.35 176.24 1x4h s LYS 94 N 1.42 2.53 -0.24 1.70 1.02 -1.22 -4.68 119.74 120.27 1x4h s LYS 94 Ca 0.50 -1.54 -0.13 0.00 0.02 0.00 0.00 55.97 54.82 1x4h s LYS 94 Cb -0.20 -3.78 -0.04 0.00 -0.52 0.00 0.00 37.83 33.29 1x4h s LYS 94 CO 0.23 -1.00 0.28 0.08 -0.92 0.00 0.00 175.35 174.02 1x4h s VAL 95 N 1.39 5.26 0.01 3.17 1.01 -1.25 -0.59 120.40 129.41 1x4h s VAL 95 Ca 0.04 0.42 0.01 0.00 0.00 0.00 0.00 61.98 62.45 1x4h s VAL 95 Cb -0.24 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 1x4h s VAL 95 CO 0.01 0.26 -0.04 -0.62 0.00 0.00 0.00 175.10 174.71 1x4h s ASP 96 N 1.32 0.43 -0.51 3.32 2.15 -0.29 -4.63 116.67 118.46 1x4h s ASP 96 Ca 0.12 -0.27 -0.26 0.00 0.43 0.00 0.00 52.55 52.57 1x4h s ASP 96 Cb -0.15 0.01 -0.06 0.00 -0.30 0.00 0.00 42.92 42.42 1x4h s ASP 96 CO 0.08 -0.10 2.31 -0.22 -0.17 0.00 0.00 175.17 177.07 1x4h s LEU 97 N -0.74 3.39 0.00 -1.34 1.98 -1.26 -0.11 118.68 120.60 1x4h s LEU 97 Ca -0.05 0.94 -0.06 0.00 -2.89 0.00 0.00 54.13 52.07 1x4h s LEU 97 Cb -0.05 -2.51 0.11 0.00 0.66 0.00 0.00 46.19 44.40 1x4h s LEU 97 CO -0.00 -2.80 0.70 0.00 -1.89 0.00 0.00 176.35 172.36 1x4h n ALA 98 N 15.36 -0.53 -3.07 5.97 0.00 -1.26 -4.92 120.51 132.06 1x4h n ALA 98 Ca 0.34 -1.05 -0.17 0.00 0.00 0.00 0.00 53.44 52.56 1x4h n ALA 98 Cb 0.54 0.03 -0.15 0.00 0.00 0.00 0.00 19.45 19.88 1x4h n ALA 98 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1x4h s VAL 99 N -2.33 0.42 -0.54 0.00 1.01 -1.26 -4.54 120.40 113.16 1x4h s VAL 99 Ca 0.42 -0.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.95 1x4h s VAL 99 Cb -0.01 -0.39 0.01 0.00 0.00 0.00 0.00 36.38 35.99 1x4h s VAL 99 CO 0.29 0.15 1.42 -0.89 0.00 0.00 0.00 175.10 176.06 1x4h s THR 100 N 0.24 3.81 -0.28 3.92 2.01 -1.26 -4.94 115.64 119.14 1x4h s THR 100 Ca -0.02 0.71 -0.25 0.00 0.31 0.00 0.00 61.69 62.43 1x4h s THR 100 Cb -0.06 -4.40 0.12 0.00 0.01 0.00 0.00 72.50 68.17 1x4h s THR 100 CO -0.00 -1.10 1.05 -0.60 -0.69 0.00 0.00 174.62 173.27 1x4h s ARG 101 N 5.42 0.49 -0.47 4.92 3.00 -1.26 -5.12 118.95 125.94 1x4h s ARG 101 Ca 0.54 0.56 -0.46 0.00 -1.00 0.00 0.00 55.73 55.37 1x4h s ARG 101 Cb -0.11 0.24 -0.19 0.00 0.00 0.00 0.00 34.95 34.89 1x4h s ARG 101 CO 0.26 -0.06 1.68 -0.25 0.00 0.00 0.00 175.30 176.93 1x4h n ASP 102 N 2.13 1.35 -4.45 -2.12 9.92 -1.26 -4.83 116.55 117.30 1x4h n ASP 102 Ca -0.12 1.12 -0.44 0.00 -0.53 0.00 0.00 54.79 54.81 1x4h n ASP 102 Cb 0.56 -0.92 -0.00 0.00 -0.64 0.00 0.00 41.12 40.11 1x4h n ASP 102 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1x4h s GLU 103 N 3.40 4.05 -0.20 -1.24 8.01 -1.26 -4.93 118.70 126.53 1x4h s GLU 103 Ca 1.06 -2.58 -0.14 0.00 0.01 0.00 0.00 54.97 53.31 1x4h s GLU 103 Cb -1.43 -4.98 0.06 0.00 -4.31 0.00 0.00 34.13 23.47 1x4h s GLU 103 CO 0.78 -1.70 0.51 0.00 0.01 0.00 0.00 175.26 174.87 1x4h s ALA 104 N 1.31 -1.32 0.26 5.21 0.00 -1.26 -5.17 121.76 120.79 1x4h s ALA 104 Ca 0.40 1.68 0.07 0.00 0.00 0.00 0.00 51.96 54.11 1x4h s ALA 104 Cb -0.04 -1.00 -0.05 0.00 0.00 0.00 0.00 23.12 22.03 1x4h s ALA 104 CO -0.02 -0.28 -0.08 0.00 0.00 0.00 0.00 175.76 175.39 1x4h s ALA 105 N 0.97 2.25 -0.87 0.00 0.00 -1.26 -5.10 121.76 117.75 1x4h s ALA 105 Ca -0.06 -1.84 -0.01 0.00 0.00 0.00 0.00 51.96 50.05 1x4h s ALA 105 Cb -0.06 0.14 0.21 0.00 0.00 0.00 0.00 23.12 23.42 1x4h s ALA 105 CO -0.08 -0.05 0.75 -1.12 0.00 0.00 0.00 175.76 175.25 1x4h s SER 106 N -3.41 5.85 -0.38 0.00 0.01 -1.26 -4.97 113.70 109.54 1x4h s SER 106 Ca 0.28 -3.74 0.01 0.00 1.31 0.00 0.00 55.95 53.80 1x4h s SER 106 Cb 0.03 -1.87 0.14 0.00 0.21 0.00 0.00 66.02 64.52 1x4h s SER 106 CO 0.11 -0.17 0.22 -0.83 0.41 0.00 0.00 173.24 172.98 1x4h s GLY 107 N -0.31 1.14 -0.95 3.44 0.00 -1.26 -5.07 107.32 104.31 1x4h s GLY 107 Ca 0.27 -2.12 -0.24 0.00 0.00 0.00 0.00 44.72 42.63 1x4h s GLY 107 CO -0.13 1.90 1.95 2.56 0.00 0.00 0.00 173.10 179.38 1x4h s PRO 108 N 0.82 2.54 0.13 2.90 0.04 -1.26 -4.88 135.00 135.29 1x4h s PRO 108 Ca 0.18 -0.44 -0.14 0.00 0.04 0.00 0.00 61.00 60.64 1x4h s PRO 108 Cb -0.23 -5.09 0.02 0.00 0.04 0.00 0.00 34.50 29.23 1x4h s PRO 108 CO 0.01 -3.49 0.35 0.45 0.04 0.00 0.00 177.00 174.36 1x4h s SER 109 N 7.77 -0.12 0.31 6.66 0.15 -1.26 -5.18 113.70 122.03 1x4h s SER 109 Ca 0.70 -0.48 0.03 0.00 0.70 0.00 0.00 55.95 56.89 1x4h s SER 109 Cb -0.06 0.45 -0.05 0.00 -1.71 0.00 0.00 66.02 64.66 1x4h s SER 109 CO 0.02 -0.85 0.11 -0.44 1.20 0.00 0.00 173.24 173.28 1x4h s SER 110 N -2.85 1.76 0.00 5.45 0.01 -1.26 -5.28 113.70 111.54 1x4h s SER 110 Ca 0.06 -1.48 0.00 0.00 1.31 0.00 0.00 55.95 55.84 1x4h s SER 110 Cb 0.02 0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.49 1x4h s SER 110 CO -0.09 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 173.39