#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ud1 h GLU 11 N 0.00 0.37 -0.27 3.52 4.11 -1.96 -2.30 114.58 118.05 1ud1 h GLU 11 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1ud1 h GLU 11 Cb 0.00 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1ud1 h GLU 11 CO 0.00 0.24 0.00 0.00 0.07 0.00 0.00 179.01 179.32 1ud1 n GLN 13 N 1.12 3.12 -3.62 0.00 7.27 -0.87 -4.90 117.38 119.51 1ud1 n GLN 13 Ca 0.18 -3.20 -0.37 0.00 0.07 0.00 0.00 57.00 53.68 1ud1 n GLN 13 Cb 0.52 -3.49 -0.09 0.00 2.41 0.00 0.00 30.24 29.60 1ud1 n GLN 13 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 1ud1 s ILE 14 N 4.34 5.33 -0.06 1.69 1.01 -1.26 -4.99 121.20 127.26 1ud1 s ILE 14 Ca 0.54 0.28 -0.23 0.00 0.00 0.00 0.00 60.65 61.23 1ud1 s ILE 14 Cb 0.05 -3.54 -0.18 0.00 0.01 0.00 0.00 42.46 38.79 1ud1 s ILE 14 CO 0.07 0.33 0.93 0.06 0.00 0.00 0.00 174.94 176.33 1ud1 h GLN 15 N 7.43 -0.11 -2.54 2.79 3.07 -1.94 -3.47 115.11 120.35 1ud1 h GLN 15 Ca -0.38 0.01 -0.09 0.00 0.09 0.00 0.00 58.65 58.28 1ud1 h GLN 15 Cb 1.17 0.02 -0.25 0.00 0.08 0.00 0.00 27.48 28.50 1ud1 h GLN 15 CO 0.67 0.43 -0.21 0.15 0.09 0.00 0.00 178.83 179.96 1ud1 s LYS 16 N -3.35 0.48 0.66 0.06 1.02 -1.26 -4.62 119.74 112.73 1ud1 s LYS 16 Ca -0.14 0.81 0.02 0.00 0.02 0.00 0.00 55.97 56.68 1ud1 s LYS 16 Cb 0.00 0.08 0.10 0.00 -0.52 0.00 0.00 37.83 37.49 1ud1 s LYS 16 CO 0.55 -0.13 0.91 -0.51 -0.92 0.00 0.00 175.35 175.25 1ud1 s LEU 17 N 1.10 3.07 -0.22 3.17 1.43 -0.00 -5.05 118.68 122.19 1ud1 s LEU 17 Ca -0.07 -0.38 -0.20 0.00 -1.03 0.00 0.00 54.13 52.45 1ud1 s LEU 17 Cb -0.06 -2.12 0.06 0.00 0.03 0.00 0.00 46.19 44.10 1ud1 s LEU 17 CO -0.10 -1.61 0.59 0.20 0.23 0.00 0.00 176.35 175.66 1ud1 s ASN 18 N -4.65 -0.62 -0.49 2.29 -0.87 -1.26 -4.85 114.94 104.48 1ud1 s ASN 18 Ca 0.63 1.19 -0.27 0.00 -1.57 0.00 0.00 52.86 52.84 1ud1 s ASN 18 Cb -0.06 1.20 -0.02 0.00 -0.02 0.00 0.00 41.25 42.35 1ud1 s ASN 18 CO 0.42 -0.21 1.83 0.00 -2.57 0.00 0.00 177.10 176.58 1ud1 s ALA 19 N 0.33 2.45 0.17 0.60 0.00 -1.26 -4.78 121.76 119.27 1ud1 s ALA 19 Ca -0.00 -0.27 -0.26 0.00 0.00 0.00 0.00 51.96 51.43 1ud1 s ALA 19 Cb -0.04 -4.18 -0.08 0.00 0.00 0.00 0.00 23.12 18.82 1ud1 s ALA 19 CO 0.01 -3.38 0.81 -0.51 0.00 0.00 0.00 175.76 172.69 1ud1 s LEU 20 N 8.20 4.59 0.32 0.00 1.43 0.18 -4.76 118.68 128.63 1ud1 s LEU 20 Ca 0.72 1.69 0.09 0.00 -1.03 0.00 0.00 54.13 55.60 1ud1 s LEU 20 Cb -0.16 -3.35 -0.05 0.00 0.03 0.00 0.00 46.19 42.66 1ud1 s LEU 20 CO 0.26 0.17 0.03 -1.59 0.23 0.00 0.00 176.35 175.46 1ud1 s LYS 21 N -1.00 2.20 1.07 1.70 -2.85 -1.26 -0.72 119.74 118.88 1ud1 s LYS 21 Ca 0.37 -1.60 -0.12 0.00 -1.00 0.00 0.00 55.97 53.63 1ud1 s LYS 21 Cb -0.23 -2.06 0.23 0.00 -2.06 0.00 0.00 37.83 33.71 1ud1 s LYS 21 CO 0.27 0.21 1.05 -0.35 0.10 0.00 0.00 175.35 176.62 1ud1 n PRO 22 N -0.97 -1.64 0.00 1.78 -0.04 -1.26 -4.87 135.00 128.00 1ud1 n PRO 22 Ca -0.05 -0.43 0.00 0.00 -0.04 0.00 0.00 63.50 62.98 1ud1 n PRO 22 Cb 0.61 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 1ud1 n PRO 22 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ud1 n ASP 23 N -4.60 2.71 -4.44 3.54 5.75 -1.17 -5.01 116.55 113.34 1ud1 n ASP 23 Ca 0.07 -0.04 -0.30 0.00 -0.01 0.00 0.00 54.79 54.50 1ud1 n ASP 23 Cb 0.53 0.62 -0.13 0.00 -1.03 0.00 0.00 41.12 41.12 1ud1 n ASP 23 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1ud1 s ASN 24 N -1.16 3.69 -0.15 -1.12 2.47 -1.16 -5.04 114.94 112.47 1ud1 s ASN 24 Ca 0.00 -0.48 -0.07 0.00 0.42 0.00 0.00 52.86 52.73 1ud1 s ASN 24 Cb 0.00 -0.54 0.06 0.00 -1.45 0.00 0.00 41.25 39.32 1ud1 s ASN 24 CO 0.00 0.25 0.34 -0.60 -3.72 0.00 0.00 177.10 173.37 1ud1 s ARG 25 N -1.49 0.28 -0.25 0.43 3.52 -1.26 -2.66 118.95 117.52 1ud1 s ARG 25 Ca 0.14 0.75 0.01 0.00 -0.13 0.00 0.00 55.73 56.51 1ud1 s ARG 25 Cb -0.10 0.01 0.07 0.00 -1.56 0.00 0.00 34.95 33.36 1ud1 s ARG 25 CO 0.05 -0.20 -0.04 0.42 -0.81 0.00 0.00 175.30 174.73 1ud1 s ILE 26 N 1.76 1.64 -0.31 4.11 1.01 0.30 -4.98 121.20 124.73 1ud1 s ILE 26 Ca -0.06 -1.41 -0.29 0.00 0.00 0.00 0.00 60.65 58.89 1ud1 s ILE 26 Cb -0.10 -1.94 0.01 0.00 0.01 0.00 0.00 42.46 40.44 1ud1 s ILE 26 CO -0.11 -0.19 1.18 -1.61 0.00 0.00 0.00 174.94 174.21 1ud1 s GLU 27 N 1.32 3.99 0.16 2.79 2.02 -1.26 -1.55 118.70 126.17 1ud1 s GLU 27 Ca -0.03 1.14 0.04 0.00 0.02 0.00 0.00 54.97 56.14 1ud1 s GLU 27 Cb -0.19 -3.80 -0.04 0.00 0.10 0.00 0.00 34.13 30.20 1ud1 s GLU 27 CO -0.08 -1.01 0.20 0.45 0.02 0.00 0.00 175.26 174.84 1ud1 s SER 28 N 2.17 5.86 0.24 -0.19 0.15 0.20 -4.86 113.70 117.27 1ud1 s SER 28 Ca 0.50 -0.00 -0.16 0.00 0.70 0.00 0.00 55.95 56.99 1ud1 s SER 28 Cb -0.14 -1.64 0.28 0.00 -1.71 0.00 0.00 66.02 62.81 1ud1 s SER 28 CO 0.19 0.06 1.55 -0.08 1.20 0.00 0.00 173.24 176.17 1ud1 h GLU 29 N 2.32 -0.00 -0.57 5.44 4.81 -1.91 -1.84 114.58 122.83 1ud1 h GLU 29 Ca -0.48 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.37 1ud1 h GLU 29 Cb 1.20 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.33 1ud1 h GLU 29 CO 0.66 -0.00 -0.25 0.41 -0.73 0.00 0.00 179.01 179.10 1ud1 n GLY 30 N -1.50 5.64 0.00 1.92 0.00 -1.19 -4.83 105.19 105.23 1ud1 n GLY 30 Ca 0.11 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.20 1ud1 n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ud1 n GLY 31 N -0.94 -0.82 3.25 -0.02 0.00 -0.69 -1.87 105.19 104.10 1ud1 n GLY 31 Ca 0.41 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 45.37 1ud1 n GLY 31 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ud1 s LEU 32 N 0.00 0.93 -0.04 0.99 2.96 -0.66 -0.62 118.68 122.24 1ud1 s LEU 32 Ca 0.00 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.51 1ud1 s LEU 32 Cb 0.00 1.38 0.03 0.00 0.50 0.00 0.00 46.19 48.10 1ud1 s LEU 32 CO 0.00 -0.72 0.03 -0.63 -1.32 0.00 0.00 176.35 173.71 1ud1 s ILE 33 N -3.36 0.04 -0.05 6.68 1.01 -0.60 -1.16 121.20 123.76 1ud1 s ILE 33 Ca 0.01 0.27 0.06 0.00 0.00 0.00 0.00 60.65 60.99 1ud1 s ILE 33 Cb 0.02 -0.23 -0.02 0.00 0.01 0.00 0.00 42.46 42.24 1ud1 s ILE 33 CO -0.08 0.17 -0.22 -1.61 0.00 0.00 0.00 174.94 173.20 1ud1 s GLU 34 N 1.72 2.45 -0.03 2.79 2.02 -1.04 -0.54 118.70 126.07 1ud1 s GLU 34 Ca -0.00 -0.84 0.02 0.00 0.02 0.00 0.00 54.97 54.16 1ud1 s GLU 34 Cb -0.13 -2.21 0.01 0.00 0.10 0.00 0.00 34.13 31.90 1ud1 s GLU 34 CO -0.03 0.49 -0.08 0.95 0.02 0.00 0.00 175.26 176.61 1ud1 s THR 35 N -0.42 0.72 0.12 3.63 -4.23 -1.09 -0.14 115.64 114.23 1ud1 s THR 35 Ca 0.04 -0.30 -0.25 0.00 -1.18 0.00 0.00 61.69 60.01 1ud1 s THR 35 Cb -0.12 -0.66 -0.07 0.00 1.34 0.00 0.00 72.50 72.99 1ud1 s THR 35 CO 0.01 0.24 0.76 0.26 -0.54 0.00 0.00 174.62 175.35 1ud1 s TRP 36 N 0.39 3.85 -0.29 3.99 0.51 -0.44 -2.96 118.94 123.98 1ud1 s TRP 36 Ca -0.06 1.56 -0.29 0.00 -2.12 0.00 0.00 56.10 55.18 1ud1 s TRP 36 Cb -0.10 -2.76 -0.07 0.00 -0.81 0.00 0.00 33.47 29.73 1ud1 s TRP 36 CO 0.01 0.45 2.25 -1.71 -0.51 0.00 0.00 176.95 177.43 1ud1 n ASN 37 N 1.97 2.85 0.08 2.95 2.85 -1.26 -4.53 115.26 120.16 1ud1 n ASN 37 Ca -0.05 0.16 0.09 0.00 -0.11 0.00 0.00 54.58 54.67 1ud1 n ASN 37 Cb 0.49 -1.49 0.39 0.00 1.24 0.00 0.00 39.78 40.42 1ud1 n ASN 37 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1ud1 n PRO 38 N 8.67 0.10 -0.50 1.20 -0.04 -1.26 -3.03 135.00 140.14 1ud1 n PRO 38 Ca 0.34 0.39 0.07 0.00 -0.04 0.00 0.00 63.50 64.26 1ud1 n PRO 38 Cb 0.40 -1.71 0.28 0.00 -0.04 0.00 0.00 33.50 32.43 1ud1 n PRO 38 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ud1 n ASN 39 N -1.91 3.84 -4.81 3.54 3.02 -1.26 -3.98 115.26 113.70 1ud1 n ASN 39 Ca 0.02 -2.39 -0.34 0.00 -0.03 0.00 0.00 54.58 51.84 1ud1 n ASN 39 Cb 0.17 -0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.76 1ud1 n ASN 39 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1ud1 s ASN 40 N -0.76 6.89 0.11 6.41 0.02 -1.17 -4.88 114.94 121.56 1ud1 s ASN 40 Ca 0.39 1.79 -0.21 0.00 -1.02 0.00 0.00 52.86 53.81 1ud1 s ASN 40 Cb 0.26 -2.55 -0.10 0.00 0.02 0.00 0.00 41.25 38.87 1ud1 s ASN 40 CO 0.18 -0.39 1.75 0.50 0.02 0.00 0.00 177.10 179.15 1ud1 h LYS 41 N 2.13 0.16 -0.99 -0.60 3.64 -1.91 -0.16 116.57 118.83 1ud1 h LYS 41 Ca -0.49 -0.01 0.37 0.00 -1.27 0.00 0.00 60.65 59.25 1ud1 h LYS 41 Cb 1.19 -0.04 -0.17 0.00 -0.41 0.00 0.00 32.23 32.80 1ud1 h LYS 41 CO 0.61 0.12 0.46 -1.35 -2.27 0.00 0.00 179.45 177.02 1ud1 h PRO 42 N 0.15 0.07 0.07 1.90 0.11 -1.95 0.17 132.00 132.52 1ud1 h PRO 42 Ca 0.04 -0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.88 1ud1 h PRO 42 Cb -0.00 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.07 1ud1 h PRO 42 CO -0.01 0.05 -1.37 0.74 -0.21 0.00 0.00 178.00 177.20 1ud1 h PHE 43 N 0.07 0.26 -0.39 0.65 0.04 -1.73 -1.36 116.94 114.48 1ud1 h PHE 43 Ca 0.78 -0.19 -0.09 0.00 2.80 0.00 0.00 57.97 61.27 1ud1 h PHE 43 Cb 1.94 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 40.07 1ud1 h PHE 43 CO -0.09 1.20 -0.13 1.96 -0.60 0.00 0.00 178.31 180.65 1ud1 h GLN 44 N 0.04 0.70 -0.03 1.51 1.08 0.86 0.22 115.11 119.49 1ud1 h GLN 44 Ca -0.17 -0.23 -0.01 0.00 -1.45 0.00 0.00 58.65 56.79 1ud1 h GLN 44 Cb 1.94 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 29.31 1ud1 h GLN 44 CO 0.15 0.81 -0.01 0.00 -0.95 0.00 0.00 178.83 178.82 1ud1 h ALA 46 N 0.64 1.16 -3.07 0.00 0.00 -0.96 -3.47 119.26 113.55 1ud1 h ALA 46 Ca 0.01 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 1ud1 h ALA 46 Cb 0.40 -0.15 0.05 0.00 0.00 0.00 0.00 17.79 18.10 1ud1 h ALA 46 CO 0.00 0.53 -0.25 0.41 0.00 0.00 0.00 179.25 179.95 1ud1 n GLY 47 N -0.57 0.23 3.17 0.00 0.00 0.74 -4.94 105.19 103.83 1ud1 n GLY 47 Ca 0.01 -0.31 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 1ud1 n GLY 47 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ud1 s VAL 48 N -3.11 0.14 -0.22 1.61 -7.23 -1.21 -2.92 120.40 107.46 1ud1 s VAL 48 Ca 0.04 -1.18 0.01 0.00 -1.81 0.00 0.00 61.98 59.04 1ud1 s VAL 48 Cb -0.02 -1.20 0.05 0.00 0.56 0.00 0.00 36.38 35.78 1ud1 s VAL 48 CO 0.24 -0.65 -0.08 0.00 -0.31 0.00 0.00 175.10 174.29 1ud1 s ALA 49 N -3.39 2.04 -0.16 1.32 0.00 0.11 -4.84 121.76 116.85 1ud1 s ALA 49 Ca 0.01 -1.32 -0.09 0.00 0.00 0.00 0.00 51.96 50.56 1ud1 s ALA 49 Cb 0.03 -1.37 -0.05 0.00 0.00 0.00 0.00 23.12 21.73 1ud1 s ALA 49 CO -0.08 -1.00 0.14 -1.17 0.00 0.00 0.00 175.76 173.65 1ud1 s LEU 50 N 1.36 4.30 0.10 0.00 0.20 -1.26 -1.29 118.68 122.09 1ud1 s LEU 50 Ca -0.04 0.36 -0.09 0.00 0.69 0.00 0.00 54.13 55.05 1ud1 s LEU 50 Cb -0.18 -2.10 -0.00 0.00 -0.43 0.00 0.00 46.19 43.48 1ud1 s LEU 50 CO -0.07 0.28 0.20 -0.94 -0.29 0.00 0.00 176.35 175.53 1ud1 s SER 51 N -0.27 0.11 -0.27 3.68 1.04 -0.87 -1.33 113.70 115.80 1ud1 s SER 51 Ca 0.12 -0.69 -0.02 0.00 0.48 0.00 0.00 55.95 55.83 1ud1 s SER 51 Cb -0.12 0.35 0.09 0.00 0.10 0.00 0.00 66.02 66.44 1ud1 s SER 51 CO 0.01 -0.76 0.08 -0.60 0.98 0.00 0.00 173.24 172.96 1ud1 s ARG 52 N -3.88 0.58 0.26 4.02 3.52 0.80 -2.16 118.95 122.09 1ud1 s ARG 52 Ca 0.07 -0.73 -0.15 0.00 -0.13 0.00 0.00 55.73 54.79 1ud1 s ARG 52 Cb 0.05 -1.86 -0.08 0.00 -1.56 0.00 0.00 34.95 31.50 1ud1 s ARG 52 CO -0.09 -0.87 0.67 0.00 -0.81 0.00 0.00 175.30 174.19 1ud1 s THR 54 N -1.79 0.17 -0.27 0.00 -1.32 -0.31 -1.44 115.64 110.69 1ud1 s THR 54 Ca 0.48 -0.06 -0.16 0.00 -1.21 0.00 0.00 61.69 60.75 1ud1 s THR 54 Cb -0.12 -0.58 -0.03 0.00 -1.51 0.00 0.00 72.50 70.25 1ud1 s THR 54 CO 0.19 -0.02 0.41 -0.76 -2.21 0.00 0.00 174.62 172.23 1ud1 s LEU 55 N 2.03 4.06 0.00 9.08 1.43 0.29 -1.65 118.68 133.93 1ud1 s LEU 55 Ca 0.03 0.33 -0.12 0.00 -1.03 0.00 0.00 54.13 53.33 1ud1 s LEU 55 Cb -0.14 -2.49 0.18 0.00 0.03 0.00 0.00 46.19 43.77 1ud1 s LEU 55 CO -0.06 -0.22 1.12 0.59 0.23 0.00 0.00 176.35 178.00 1ud1 n ASN 56 N 5.40 0.30 -4.75 2.29 5.03 -0.78 -0.82 115.26 121.92 1ud1 n ASN 56 Ca -0.07 -1.54 -0.42 0.00 0.87 0.00 0.00 54.58 53.43 1ud1 n ASN 56 Cb 0.50 -0.84 -0.02 0.00 -1.02 0.00 0.00 39.78 38.41 1ud1 n ASN 56 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29 1ud1 n ARG 57 N -3.32 2.72 -1.04 3.52 0.63 -1.25 -2.20 116.66 115.72 1ud1 n ARG 57 Ca 0.15 0.97 -0.01 0.00 -0.92 0.00 0.00 57.85 58.03 1ud1 n ARG 57 Cb 0.51 -2.75 -0.01 0.00 0.45 0.00 0.00 32.46 30.66 1ud1 n ARG 57 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1ud1 n ASN 58 N 2.17 -5.30 -4.79 6.15 4.13 0.74 -4.86 115.26 113.50 1ud1 n ASN 58 Ca 0.08 0.03 -0.35 0.00 1.68 0.00 0.00 54.58 56.03 1ud1 n ASN 58 Cb 0.37 -2.91 -0.04 0.00 -1.54 0.00 0.00 39.78 35.66 1ud1 n ASN 58 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ud1 s ALA 59 N -1.33 2.98 0.03 5.41 0.00 -0.93 -1.29 121.76 126.62 1ud1 s ALA 59 Ca 0.00 0.62 0.08 0.00 0.00 0.00 0.00 51.96 52.66 1ud1 s ALA 59 Cb 0.00 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.85 1ud1 s ALA 59 CO 0.00 -0.22 -0.22 -1.17 0.00 0.00 0.00 175.76 174.14 1ud1 s LEU 60 N -3.10 2.13 -0.26 0.00 0.20 0.39 -1.35 118.68 116.69 1ud1 s LEU 60 Ca 0.63 -0.50 -0.04 0.00 0.69 0.00 0.00 54.13 54.90 1ud1 s LEU 60 Cb -0.18 -1.07 0.01 0.00 -0.43 0.00 0.00 46.19 44.51 1ud1 s LEU 60 CO 0.22 0.21 0.00 -0.60 -0.29 0.00 0.00 176.35 175.89 1ud1 s ARG 61 N -1.01 3.14 0.42 1.98 3.52 0.20 -0.42 118.95 126.78 1ud1 s ARG 61 Ca 0.09 -0.80 -0.26 0.00 -0.13 0.00 0.00 55.73 54.63 1ud1 s ARG 61 Cb -0.09 -3.15 -0.09 0.00 -1.56 0.00 0.00 34.95 30.05 1ud1 s ARG 61 CO 0.01 -0.34 1.44 1.03 -0.81 0.00 0.00 175.30 176.63 1ud1 s ARG 62 N 1.45 3.88 0.26 5.12 0.52 -0.75 -2.56 118.95 126.88 1ud1 s ARG 62 Ca 0.03 2.46 -0.31 0.00 -0.52 0.00 0.00 55.73 57.40 1ud1 s ARG 62 Cb -0.16 -2.79 -0.12 0.00 0.52 0.00 0.00 34.95 32.40 1ud1 s ARG 62 CO -0.01 -0.68 1.58 -2.30 0.02 0.00 0.00 175.30 173.91 1ud1 n PRO 63 N 0.10 2.53 -3.96 3.54 -0.02 -1.26 -4.83 135.00 131.11 1ud1 n PRO 63 Ca 0.03 0.90 -0.10 0.00 -2.02 0.00 0.00 63.50 62.32 1ud1 n PRO 63 Cb 0.41 -2.67 -0.06 0.00 -0.02 0.00 0.00 33.50 31.16 1ud1 n PRO 63 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ud1 s SER 64 N 0.61 -0.05 0.06 2.55 1.04 -1.10 -0.31 113.70 116.49 1ud1 s SER 64 Ca 0.68 -0.87 -0.24 0.00 0.48 0.00 0.00 55.95 56.01 1ud1 s SER 64 Cb -0.54 0.51 0.06 0.00 0.10 0.00 0.00 66.02 66.15 1ud1 s SER 64 CO 0.45 -1.01 0.55 -0.72 0.98 0.00 0.00 173.24 173.49 1ud1 s TYR 65 N -3.99 -0.47 0.21 5.02 -0.85 -0.73 -1.93 117.35 114.61 1ud1 s TYR 65 Ca 0.19 0.52 0.03 0.00 -0.52 0.00 0.00 57.07 57.30 1ud1 s TYR 65 Cb 0.01 0.39 -0.05 0.00 0.38 0.00 0.00 41.96 42.69 1ud1 s TYR 65 CO 0.04 -0.68 -0.01 0.95 -1.52 0.00 0.00 175.55 174.34 1ud1 s THR 66 N -2.53 0.93 -0.46 -3.49 -4.23 -1.26 -1.16 115.64 103.44 1ud1 s THR 66 Ca -0.05 -2.02 -0.06 0.00 -1.18 0.00 0.00 61.69 58.38 1ud1 s THR 66 Cb -0.01 -2.25 -0.16 0.00 1.34 0.00 0.00 72.50 71.43 1ud1 s THR 66 CO -0.02 -0.39 3.28 -0.46 -0.54 0.00 0.00 174.62 176.49 1ud1 n ASN 67 N -0.35 6.27 0.00 3.99 6.94 -1.26 -0.82 115.26 130.03 1ud1 n ASN 67 Ca -0.06 -2.66 0.00 0.00 -0.02 0.00 0.00 54.58 51.84 1ud1 n ASN 67 Cb 0.63 -1.41 0.00 0.00 -2.36 0.00 0.00 39.78 36.65 1ud1 n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ud1 n GLY 68 N 2.36 1.37 3.64 4.83 0.00 -1.26 -4.14 105.19 111.99 1ud1 n GLY 68 Ca 0.52 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1ud1 n GLY 68 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ud1 s PRO 69 N -2.00 4.03 0.22 1.61 0.02 -1.26 -4.28 135.00 133.34 1ud1 s PRO 69 Ca 0.00 1.43 0.05 0.00 0.02 0.00 0.00 61.00 62.50 1ud1 s PRO 69 Cb 0.00 -3.85 -0.03 0.00 0.02 0.00 0.00 34.50 30.64 1ud1 s PRO 69 CO 0.00 -0.98 0.29 -1.14 -0.33 0.00 0.00 177.00 174.85 1ud1 s GLN 70 N 3.95 3.29 -0.26 5.54 0.74 -1.03 -2.02 119.66 129.88 1ud1 s GLN 70 Ca 0.57 -0.79 -0.01 0.00 0.05 0.00 0.00 55.36 55.17 1ud1 s GLN 70 Cb -0.19 -2.82 0.13 0.00 1.10 0.00 0.00 33.01 31.23 1ud1 s GLN 70 CO 0.20 0.45 0.35 -2.00 -0.55 0.00 0.00 175.29 173.74 1ud1 s GLU 71 N -3.72 0.34 0.02 1.67 2.12 -1.06 -2.83 118.70 115.24 1ud1 s GLU 71 Ca 0.34 0.29 -0.10 0.00 0.36 0.00 0.00 54.97 55.85 1ud1 s GLU 71 Cb -0.09 -0.56 -0.05 0.00 0.26 0.00 0.00 34.13 33.68 1ud1 s GLU 71 CO 0.28 -0.80 0.35 0.42 -0.54 0.00 0.00 175.26 174.97 1ud1 s ILE 72 N 2.49 5.15 -0.06 -3.70 1.01 -0.23 -2.78 121.20 123.08 1ud1 s ILE 72 Ca 0.11 0.49 0.03 0.00 0.00 0.00 0.00 60.65 61.28 1ud1 s ILE 72 Cb -0.15 -3.63 0.01 0.00 0.01 0.00 0.00 42.46 38.70 1ud1 s ILE 72 CO -0.21 0.42 -0.15 -0.47 0.00 0.00 0.00 174.94 174.53 1ud1 s TYR 73 N -1.25 1.64 -0.49 3.97 5.04 0.94 -1.00 117.35 126.20 1ud1 s TYR 73 Ca 0.27 -0.58 -0.18 0.00 -2.44 0.00 0.00 57.07 54.14 1ud1 s TYR 73 Cb -0.14 -1.16 0.06 0.00 0.35 0.00 0.00 41.96 41.07 1ud1 s TYR 73 CO 0.15 -0.27 0.54 0.42 -1.34 0.00 0.00 175.55 175.06 1ud1 s ILE 74 N 0.47 5.00 0.05 3.14 1.09 -0.45 0.00 121.20 130.50 1ud1 s ILE 74 Ca -0.13 -0.65 -0.24 0.00 -1.10 0.00 0.00 60.65 58.54 1ud1 s ILE 74 Cb -0.15 -4.23 -0.17 0.00 -1.06 0.00 0.00 42.46 36.85 1ud1 s ILE 74 CO 0.04 -0.71 1.55 -0.61 -0.10 0.00 0.00 174.94 175.11 1ud1 h GLN 75 N 8.90 -0.04 -3.34 2.79 4.15 -0.31 0.39 115.11 127.66 1ud1 h GLN 75 Ca -0.28 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.06 1ud1 h GLN 75 Cb 1.10 0.01 -0.16 0.00 0.21 0.00 0.00 27.48 28.64 1ud1 h GLN 75 CO 0.92 0.15 -0.22 1.14 -1.93 0.00 0.00 178.83 178.90 1ud1 s GLN 76 N -5.44 0.87 0.00 1.69 -2.07 -1.11 -4.52 119.66 109.08 1ud1 s GLN 76 Ca -0.14 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 52.83 1ud1 s GLN 76 Cb 0.04 0.37 0.00 0.00 -1.09 0.00 0.00 33.01 32.34 1ud1 s GLN 76 CO 0.66 -0.29 0.00 0.41 -1.32 0.00 0.00 175.29 174.75 1ud1 n GLY 77 N 0.38 0.99 3.15 2.60 0.00 -1.26 -1.00 105.19 110.05 1ud1 n GLY 77 Ca -0.18 -2.26 -0.11 0.00 0.00 0.00 0.00 46.02 43.46 1ud1 n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ud1 s LYS 78 N -1.14 0.58 0.00 1.61 1.02 -1.26 -0.71 119.74 119.84 1ud1 s LYS 78 Ca 0.00 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.56 1ud1 s LYS 78 Cb 0.00 0.24 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 1ud1 s LYS 78 CO 0.00 -0.15 0.00 0.41 -0.92 0.00 0.00 175.35 174.69 1ud1 n GLY 79 N 1.20 -1.15 3.09 -3.33 0.00 -0.71 -4.30 105.19 99.99 1ud1 n GLY 79 Ca -0.21 -1.03 -0.22 0.00 0.00 0.00 0.00 46.02 44.56 1ud1 n GLY 79 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ud1 s ILE 80 N -3.00 1.05 0.11 -0.61 -4.36 -0.68 -0.62 121.20 113.09 1ud1 s ILE 80 Ca 0.00 -0.56 0.09 0.00 -0.26 0.00 0.00 60.65 59.92 1ud1 s ILE 80 Cb 0.00 -0.89 -0.04 0.00 1.25 0.00 0.00 42.46 42.79 1ud1 s ILE 80 CO 0.00 0.30 -0.24 0.72 0.24 0.00 0.00 174.94 175.96 1ud1 s PHE 81 N -0.24 2.03 -0.03 1.37 -0.71 -0.04 -1.38 117.98 118.99 1ud1 s PHE 81 Ca 0.04 -0.40 0.02 0.00 -1.04 0.00 0.00 56.93 55.55 1ud1 s PHE 81 Cb -0.06 -1.12 0.01 0.00 -1.21 0.00 0.00 43.02 40.64 1ud1 s PHE 81 CO -0.00 0.25 -0.08 0.20 -1.34 0.00 0.00 175.22 174.24 1ud1 s GLY 82 N -1.88 0.53 -0.16 1.99 0.00 -0.66 -1.67 107.32 105.46 1ud1 s GLY 82 Ca 0.10 -0.29 0.01 0.00 0.00 0.00 0.00 44.72 44.53 1ud1 s GLY 82 CO 0.05 0.00 -0.17 1.06 0.00 0.00 0.00 173.10 174.03 1ud1 s MET 83 N 0.32 3.13 -1.21 2.90 -1.94 -1.26 -1.46 119.30 119.78 1ud1 s MET 83 Ca -0.05 -0.78 -0.12 0.00 -1.71 0.00 0.00 55.69 53.02 1ud1 s MET 83 Cb -0.10 -2.59 0.18 0.00 2.01 0.00 0.00 34.83 34.34 1ud1 s MET 83 CO 0.01 -0.05 1.47 -0.89 -0.01 0.00 0.00 175.02 175.55 1ud1 n ILE 84 N 4.21 4.32 -2.31 2.53 5.41 0.06 -4.77 119.36 128.81 1ud1 n ILE 84 Ca -0.20 -4.77 -0.41 0.00 1.00 0.00 0.00 62.75 58.38 1ud1 n ILE 84 Cb 0.51 -2.45 -0.03 0.00 -0.71 0.00 0.00 39.64 36.96 1ud1 n ILE 84 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 1ud1 s TYR 85 N 1.05 3.34 -0.19 1.39 6.14 -1.26 -4.16 117.35 123.66 1ud1 s TYR 85 Ca 0.41 1.48 -0.27 0.00 0.64 0.00 0.00 57.07 59.33 1ud1 s TYR 85 Cb -0.02 -3.48 -0.32 0.00 0.42 0.00 0.00 41.96 38.56 1ud1 s TYR 85 CO -0.00 -1.28 1.58 -2.30 0.64 0.00 0.00 175.55 174.19 1ud1 n PRO 86 N 1.57 0.02 0.00 4.97 -0.02 -1.26 -5.11 135.00 135.16 1ud1 n PRO 86 Ca 0.01 -1.03 0.00 0.00 -2.02 0.00 0.00 63.50 60.47 1ud1 n PRO 86 Cb 0.44 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.31 1ud1 n PRO 86 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ud1 n ARG 110 N 7.61 0.00 -3.86 -0.52 5.12 -1.26 -5.22 116.66 118.53 1ud1 n ARG 110 Ca 0.41 0.00 0.02 0.00 -1.93 0.00 0.00 57.85 56.35 1ud1 n ARG 110 Cb 0.42 0.00 0.01 0.00 -1.16 0.00 0.00 32.46 31.72 1ud1 n ARG 110 CO 0.00 0.00 0.00 -3.38 -1.93 0.00 0.00 177.63 172.32 1ud1 s HIS 111 N -0.92 0.01 0.86 -1.55 -3.43 -1.26 -5.19 115.29 103.81 1ud1 s HIS 111 Ca 0.00 -0.13 -0.13 0.00 -0.80 0.00 0.00 55.06 53.99 1ud1 s HIS 111 Cb 0.00 0.56 0.12 0.00 -1.43 0.00 0.00 32.58 31.83 1ud1 s HIS 111 CO 0.00 -0.31 1.21 -0.65 -2.00 0.00 0.00 174.74 173.00 1ud1 s GLN 112 N -2.16 1.54 -0.10 -0.38 -0.21 -1.26 -5.01 119.66 112.08 1ud1 s GLN 112 Ca 0.24 -0.02 -0.29 0.00 0.02 0.00 0.00 55.36 55.31 1ud1 s GLN 112 Cb 0.01 -1.91 -0.05 0.00 1.00 0.00 0.00 33.01 32.06 1ud1 s GLN 112 CO -0.01 -1.87 1.69 0.21 -2.12 0.00 0.00 175.29 173.19 1ud1 s LYS 113 N -5.64 4.02 0.03 2.91 2.36 -1.26 -5.00 119.74 117.15 1ud1 s LYS 113 Ca 0.65 2.06 -0.09 0.00 -2.55 0.00 0.00 55.97 56.04 1ud1 s LYS 113 Cb -0.09 -4.03 -0.05 0.00 -1.05 0.00 0.00 37.83 32.61 1ud1 s LYS 113 CO 0.50 -1.04 0.34 0.42 1.55 0.00 0.00 175.35 177.12 1ud1 s ILE 114 N 4.59 5.18 0.03 5.43 1.01 -1.26 -4.34 121.20 131.85 1ud1 s ILE 114 Ca 0.75 0.39 0.08 0.00 0.00 0.00 0.00 60.65 61.88 1ud1 s ILE 114 Cb -0.32 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.52 1ud1 s ILE 114 CO 0.30 0.38 -0.24 -0.31 0.00 0.00 0.00 174.94 175.07 1ud1 s TYR 115 N -1.29 2.38 -0.19 3.97 1.51 -0.67 -5.01 117.35 118.06 1ud1 s TYR 115 Ca 0.28 -0.38 -0.11 0.00 -1.01 0.00 0.00 57.07 55.85 1ud1 s TYR 115 Cb -0.14 -1.43 -0.05 0.00 -0.11 0.00 0.00 41.96 40.23 1ud1 s TYR 115 CO 0.16 0.12 0.19 -0.80 -1.11 0.00 0.00 175.55 174.11 1ud1 s ASN 116 N -1.14 6.29 0.24 2.29 -0.87 -1.26 -0.86 114.94 119.63 1ud1 s ASN 116 Ca 0.12 0.33 0.10 0.00 -1.57 0.00 0.00 52.86 51.84 1ud1 s ASN 116 Cb -0.10 -2.13 -0.04 0.00 -0.02 0.00 0.00 41.25 38.96 1ud1 s ASN 116 CO 0.02 0.15 -0.06 0.72 -2.57 0.00 0.00 177.10 175.36 1ud1 s PHE 117 N 0.42 2.62 0.24 2.20 -0.12 0.21 -4.98 117.98 118.57 1ud1 s PHE 117 Ca 0.11 -0.24 0.01 0.00 -0.05 0.00 0.00 56.93 56.76 1ud1 s PHE 117 Cb -0.12 -1.19 -0.04 0.00 -0.63 0.00 0.00 43.02 41.04 1ud1 s PHE 117 CO 0.00 0.60 0.13 1.03 -0.05 0.00 0.00 175.22 176.94 1ud1 s ARG 118 N -3.39 1.34 0.53 1.99 3.00 -1.26 -1.73 118.95 119.43 1ud1 s ARG 118 Ca 0.29 -1.73 -0.21 0.00 0.00 0.00 0.00 55.73 54.09 1ud1 s ARG 118 Cb -0.07 0.07 -0.05 0.00 0.00 0.00 0.00 34.95 34.90 1ud1 s ARG 118 CO 0.18 -0.39 1.22 -1.83 0.00 0.00 0.00 175.30 174.49 1ud1 s GLU 119 N -4.04 3.30 0.00 3.54 -1.05 0.11 -2.64 118.70 117.92 1ud1 s GLU 119 Ca 0.38 1.89 0.00 0.00 -0.15 0.00 0.00 54.97 57.10 1ud1 s GLU 119 Cb 0.07 -2.17 0.00 0.00 -0.44 0.00 0.00 34.13 31.59 1ud1 s GLU 119 CO 0.14 -0.96 0.00 0.41 0.95 0.00 0.00 175.26 175.80 1ud1 n GLY 120 N 0.52 0.75 3.84 -3.83 0.00 0.13 -4.78 105.19 101.81 1ud1 n GLY 120 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1ud1 n GLY 120 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ud1 s ASP 121 N -2.56 6.80 -0.17 1.61 1.01 -1.08 -0.57 116.67 121.71 1ud1 s ASP 121 Ca 0.00 1.32 0.01 0.00 0.71 0.00 0.00 52.55 54.59 1ud1 s ASP 121 Cb 0.00 -2.39 0.01 0.00 1.01 0.00 0.00 42.92 41.56 1ud1 s ASP 121 CO 0.00 -0.21 -0.20 -0.22 0.21 0.00 0.00 175.17 174.76 1ud1 s LEU 122 N -2.95 2.18 -0.14 1.23 2.96 0.98 -1.35 118.68 121.60 1ud1 s LEU 122 Ca 0.54 -0.61 -0.03 0.00 -0.22 0.00 0.00 54.13 53.81 1ud1 s LEU 122 Cb -0.10 -1.49 -0.03 0.00 0.50 0.00 0.00 46.19 45.07 1ud1 s LEU 122 CO 0.17 0.03 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.55 1ud1 s ILE 123 N 1.13 3.78 -0.23 6.68 1.01 -0.17 -1.56 121.20 131.83 1ud1 s ILE 123 Ca 0.01 -0.41 -0.09 0.00 0.00 0.00 0.00 60.65 60.17 1ud1 s ILE 123 Cb -0.14 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 1ud1 s ILE 123 CO -0.09 0.51 0.11 0.00 0.00 0.00 0.00 174.94 175.47 1ud1 s ALA 124 N 0.22 3.40 -0.30 9.38 0.00 -0.36 -1.06 121.76 133.03 1ud1 s ALA 124 Ca -0.03 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.01 1ud1 s ALA 124 Cb -0.14 -2.14 0.07 0.00 0.00 0.00 0.00 23.12 20.91 1ud1 s ALA 124 CO 0.03 -0.20 -0.01 0.08 0.00 0.00 0.00 175.76 175.66 1ud1 s VAL 125 N 1.08 2.51 0.65 0.00 1.01 -1.13 -4.88 120.40 119.65 1ud1 s VAL 125 Ca 0.05 -1.78 -0.17 0.00 0.00 0.00 0.00 61.98 60.08 1ud1 s VAL 125 Cb -0.14 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.60 1ud1 s VAL 125 CO 0.04 -0.25 0.57 -2.65 0.00 0.00 0.00 175.10 172.81 1ud1 n PRO 126 N 4.45 0.45 -1.68 2.72 -0.02 -1.26 -2.45 135.00 137.21 1ud1 n PRO 126 Ca -0.08 0.19 -0.42 0.00 -2.02 0.00 0.00 63.50 61.16 1ud1 n PRO 126 Cb 0.42 -1.81 -0.03 0.00 -0.02 0.00 0.00 33.50 32.06 1ud1 n PRO 126 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1ud1 n THR 127 N -2.04 0.51 0.00 3.45 -1.04 -1.26 -2.25 114.28 111.65 1ud1 n THR 127 Ca 0.11 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1ud1 n THR 127 Cb 0.49 -2.19 0.00 0.00 -1.82 0.00 0.00 70.33 66.80 1ud1 n THR 127 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ud1 n GLY 128 N 4.35 3.21 3.76 3.41 0.00 -0.00 -4.90 105.19 115.01 1ud1 n GLY 128 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1ud1 n GLY 128 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ud1 s VAL 129 N -1.92 2.60 0.20 1.61 1.01 -0.95 -4.68 120.40 118.27 1ud1 s VAL 129 Ca 0.00 0.56 -0.18 0.00 0.00 0.00 0.00 61.98 62.36 1ud1 s VAL 129 Cb 0.00 -3.36 -0.08 0.00 0.00 0.00 0.00 36.38 32.95 1ud1 s VAL 129 CO 0.00 0.11 0.66 0.00 0.00 0.00 0.00 175.10 175.87 1ud1 s ALA 130 N -0.60 3.47 0.01 5.51 0.00 -1.26 -4.52 121.76 124.37 1ud1 s ALA 130 Ca 0.54 0.06 -0.12 0.00 0.00 0.00 0.00 51.96 52.44 1ud1 s ALA 130 Cb -0.42 -2.71 0.01 0.00 0.00 0.00 0.00 23.12 20.00 1ud1 s ALA 130 CO 0.50 0.37 0.24 1.67 0.00 0.00 0.00 175.76 178.54 1ud1 s TRP 131 N -1.51 -0.06 0.09 0.00 1.48 -0.81 -0.76 118.94 117.38 1ud1 s TRP 131 Ca 0.41 -0.01 0.07 0.00 -1.06 0.00 0.00 56.10 55.51 1ud1 s TRP 131 Cb -0.16 0.03 -0.03 0.00 -1.16 0.00 0.00 33.47 32.15 1ud1 s TRP 131 CO 0.20 -0.39 -0.18 1.67 -4.06 0.00 0.00 176.95 174.19 1ud1 s TRP 132 N -1.85 1.55 -0.04 1.66 1.48 -0.53 -2.72 118.94 118.50 1ud1 s TRP 132 Ca -0.10 -0.44 0.03 0.00 -1.06 0.00 0.00 56.10 54.52 1ud1 s TRP 132 Cb -0.04 -0.85 0.01 0.00 -1.16 0.00 0.00 33.47 31.42 1ud1 s TRP 132 CO 0.00 0.15 -0.10 1.41 -4.06 0.00 0.00 176.95 174.35 1ud1 s MET 133 N -1.93 1.20 -0.03 3.25 1.75 -1.06 -1.66 119.30 120.82 1ud1 s MET 133 Ca 0.04 -0.35 0.04 0.00 -1.25 0.00 0.00 55.69 54.17 1ud1 s MET 133 Cb -0.09 -1.08 -0.00 0.00 2.84 0.00 0.00 34.83 36.50 1ud1 s MET 133 CO 0.04 0.10 -0.13 -0.47 -0.65 0.00 0.00 175.02 173.90 1ud1 s TYR 134 N 0.32 1.31 -0.17 4.11 5.04 -0.48 0.61 117.35 128.09 1ud1 s TYR 134 Ca -0.06 -0.32 -0.02 0.00 -2.44 0.00 0.00 57.07 54.23 1ud1 s TYR 134 Cb -0.11 -0.89 -0.01 0.00 0.35 0.00 0.00 41.96 41.31 1ud1 s TYR 134 CO 0.01 -0.10 -0.10 1.21 -1.34 0.00 0.00 175.55 175.23 1ud1 s ASN 135 N -0.02 4.04 -0.13 4.32 2.47 -0.46 -1.69 114.94 123.47 1ud1 s ASN 135 Ca -0.01 -0.39 0.13 0.00 0.42 0.00 0.00 52.86 53.01 1ud1 s ASN 135 Cb -0.09 -1.65 -0.18 0.00 -1.45 0.00 0.00 41.25 37.88 1ud1 s ASN 135 CO 0.01 0.07 0.07 -3.20 -3.72 0.00 0.00 177.10 170.32 1ud1 n ASN 136 N 4.20 1.50 -4.71 -4.21 5.15 -1.26 -0.19 115.26 115.75 1ud1 n ASN 136 Ca -0.18 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.49 1ud1 n ASN 136 Cb 0.52 0.91 0.14 0.00 -0.53 0.00 0.00 39.78 40.81 1ud1 n ASN 136 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 1ud1 s GLU 137 N -2.39 1.41 0.31 1.20 0.41 -1.26 -4.07 118.70 114.31 1ud1 s GLU 137 Ca -0.07 1.22 0.02 0.00 -0.41 0.00 0.00 54.97 55.74 1ud1 s GLU 137 Cb 0.05 -1.80 0.52 0.00 -1.78 0.00 0.00 34.13 31.12 1ud1 s GLU 137 CO 0.58 -2.25 1.84 -0.44 -0.49 0.00 0.00 175.26 174.50 1ud1 h ASP 138 N -1.58 0.57 -2.52 -0.19 3.32 -1.96 -3.33 116.42 110.74 1ud1 h ASP 138 Ca -0.46 -0.12 -0.53 0.00 0.02 0.00 0.00 57.03 55.95 1ud1 h ASP 138 Cb 1.26 -0.15 0.04 0.00 0.22 0.00 0.00 39.33 40.70 1ud1 h ASP 138 CO 0.48 0.64 1.11 0.41 -1.72 0.00 0.00 179.24 180.16 1ud1 n THR 139 N -4.26 0.33 -2.34 0.35 -1.04 -1.26 -4.09 114.28 101.96 1ud1 n THR 139 Ca 0.02 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.05 61.56 1ud1 n THR 139 Cb 0.26 -2.13 -0.03 0.00 -1.82 0.00 0.00 70.33 66.61 1ud1 n THR 139 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1ud1 s PRO 140 N 2.57 4.46 -0.09 -2.82 0.04 -1.26 -4.62 135.00 133.27 1ud1 s PRO 140 Ca 0.81 1.90 -0.25 0.00 0.04 0.00 0.00 61.00 63.50 1ud1 s PRO 140 Cb -0.48 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 30.79 1ud1 s PRO 140 CO 0.36 -0.15 0.78 0.08 0.04 0.00 0.00 177.00 178.11 1ud1 s VAL 141 N 0.18 4.97 -0.11 -0.36 1.01 0.00 -4.30 120.40 121.79 1ud1 s VAL 141 Ca 0.55 1.58 0.02 0.00 0.00 0.00 0.00 61.98 64.12 1ud1 s VAL 141 Cb -0.33 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 31.94 1ud1 s VAL 141 CO 0.36 0.16 -0.19 -0.69 0.00 0.00 0.00 175.10 174.74 1ud1 s VAL 142 N 1.30 2.52 -0.02 2.92 1.01 -0.17 -0.55 120.40 127.40 1ud1 s VAL 142 Ca 0.39 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1ud1 s VAL 142 Cb -0.18 -2.01 0.03 0.00 0.00 0.00 0.00 36.38 34.22 1ud1 s VAL 142 CO 0.17 0.54 0.01 0.00 0.00 0.00 0.00 175.10 175.83 1ud1 s ALA 143 N 0.32 0.19 -0.13 5.51 0.00 -0.52 0.48 121.76 127.62 1ud1 s ALA 143 Ca -0.15 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1ud1 s ALA 143 Cb -0.17 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 1ud1 s ALA 143 CO 0.07 -0.08 -0.15 0.54 0.00 0.00 0.00 175.76 176.14 1ud1 s VAL 144 N 0.98 2.83 0.03 0.00 0.11 0.10 -1.44 120.40 123.02 1ud1 s VAL 144 Ca -0.09 -0.73 -0.01 0.00 -2.93 0.00 0.00 61.98 58.21 1ud1 s VAL 144 Cb -0.13 -2.18 -0.03 0.00 -1.53 0.00 0.00 36.38 32.52 1ud1 s VAL 144 CO -0.02 0.52 -0.01 -0.94 -3.33 0.00 0.00 175.10 171.33 1ud1 s SER 145 N 0.50 0.32 0.20 3.54 1.04 -0.92 -0.04 113.70 118.34 1ud1 s SER 145 Ca -0.10 -0.68 0.11 0.00 0.48 0.00 0.00 55.95 55.76 1ud1 s SER 145 Cb -0.16 0.16 -0.04 0.00 0.10 0.00 0.00 66.02 66.07 1ud1 s SER 145 CO 0.04 -0.44 -0.21 0.27 0.98 0.00 0.00 173.24 173.88 1ud1 s ILE 146 N -2.53 2.51 -0.15 -1.02 -4.36 -1.12 -2.04 121.20 112.50 1ud1 s ILE 146 Ca -0.06 -2.03 0.01 0.00 -0.26 0.00 0.00 60.65 58.31 1ud1 s ILE 146 Cb -0.02 -2.23 0.02 0.00 1.25 0.00 0.00 42.46 41.48 1ud1 s ILE 146 CO -0.05 -0.16 -0.16 -0.63 0.24 0.00 0.00 174.94 174.19 1ud1 s ILE 147 N -1.80 1.66 -1.00 8.37 1.01 -0.41 -2.57 121.20 126.46 1ud1 s ILE 147 Ca 0.23 -0.70 -0.21 0.00 0.00 0.00 0.00 60.65 59.98 1ud1 s ILE 147 Cb -0.08 -1.54 0.09 0.00 0.01 0.00 0.00 42.46 40.94 1ud1 s ILE 147 CO 0.11 0.47 1.32 -0.62 0.00 0.00 0.00 174.94 176.23 1ud1 s ASP 148 N 1.38 6.59 0.37 3.58 2.15 -0.86 -0.71 116.67 129.18 1ud1 s ASP 148 Ca 0.03 -1.81 0.27 0.00 0.43 0.00 0.00 52.55 51.48 1ud1 s ASP 148 Cb -0.13 -2.49 1.19 0.00 -0.30 0.00 0.00 42.92 41.19 1ud1 s ASP 148 CO -0.10 -1.27 1.82 0.71 -0.17 0.00 0.00 175.17 176.16 1ud1 h THR 149 N 6.24 0.00 -0.51 1.71 1.35 -1.87 -2.49 112.91 117.35 1ud1 h THR 149 Ca 0.20 -0.28 -0.09 0.00 -0.55 0.00 0.00 66.41 65.69 1ud1 h THR 149 Cb 1.01 1.07 -0.06 0.00 -1.73 0.00 0.00 68.15 68.44 1ud1 h THR 149 CO 1.28 0.00 0.12 -3.20 -0.25 0.00 0.00 175.52 173.47 1ud1 n ASN 150 N -2.53 4.33 -4.70 5.36 5.15 -1.15 -4.74 115.26 116.97 1ud1 n ASN 150 Ca 0.01 -2.82 -0.29 0.00 -0.60 0.00 0.00 54.58 50.87 1ud1 n ASN 150 Cb 0.22 -0.67 0.15 0.00 -0.53 0.00 0.00 39.78 38.95 1ud1 n ASN 150 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1ud1 s SER 151 N -0.61 3.23 0.26 1.20 0.15 -0.94 -4.94 113.70 112.04 1ud1 s SER 151 Ca 0.41 1.43 0.21 0.00 0.70 0.00 0.00 55.95 58.71 1ud1 s SER 151 Cb 0.32 -2.11 0.09 0.00 -1.71 0.00 0.00 66.02 62.61 1ud1 s SER 151 CO 0.11 -2.79 1.23 0.25 1.20 0.00 0.00 173.24 173.25 1ud1 h LEU 152 N -1.65 0.00 0.00 3.45 5.85 -1.92 -3.24 115.31 117.80 1ud1 h LEU 152 Ca -0.51 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1ud1 h LEU 152 Cb 1.29 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1ud1 h LEU 152 CO 0.55 0.15 -0.23 -0.33 -0.34 0.00 0.00 178.44 178.24 1ud1 h GLU 153 N 0.00 0.00 -5.29 1.25 4.39 -1.93 -3.42 114.58 109.59 1ud1 h GLU 153 Ca -0.02 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 59.01 1ud1 h GLU 153 Cb 1.14 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 29.63 1ud1 h GLU 153 CO 0.02 0.00 0.97 1.21 -1.16 0.00 0.00 179.01 180.04 1ud1 s ASN 154 N -4.67 6.58 0.00 1.42 2.47 -1.22 -4.77 114.94 114.74 1ud1 s ASN 154 Ca 0.08 -1.86 0.30 0.00 0.42 0.00 0.00 52.86 51.81 1ud1 s ASN 154 Cb 0.12 -2.44 1.52 0.00 -1.45 0.00 0.00 41.25 39.00 1ud1 s ASN 154 CO 0.65 -1.18 2.03 0.00 -3.72 0.00 0.00 177.10 174.88 1ud1 n GLN 155 N 7.12 0.75 0.00 0.43 6.02 -1.26 -4.68 117.38 125.76 1ud1 n GLN 155 Ca 0.25 -0.13 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1ud1 n GLN 155 Cb 0.49 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.26 1ud1 n GLN 155 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1ud1 n LEU 156 N -1.01 0.00 0.00 1.08 4.77 -1.26 -5.11 117.00 115.46 1ud1 n LEU 156 Ca 0.18 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 56.01 1ud1 n LEU 156 Cb 0.22 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 1ud1 n LEU 156 CO 0.21 0.00 -0.08 -0.90 -1.33 0.00 0.00 177.39 175.30 1ud1 n ASP 157 N 0.00 -0.49 -0.27 -1.43 5.68 -1.26 -5.04 116.55 113.73 1ud1 n ASP 157 Ca 0.00 -2.66 0.00 0.00 -0.50 0.00 0.00 54.79 51.63 1ud1 n ASP 157 Cb 0.00 1.26 0.00 0.00 -1.14 0.00 0.00 41.12 41.24 1ud1 n ASP 157 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ud1 n GLN 158 N -0.49 0.41 -3.21 0.11 10.64 -1.26 -4.75 117.38 118.83 1ud1 n GLN 158 Ca 0.06 0.00 -0.39 0.00 -1.83 0.00 0.00 57.00 54.84 1ud1 n GLN 158 Cb 0.46 -1.11 -0.06 0.00 -0.86 0.00 0.00 30.24 28.67 1ud1 n GLN 158 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1ud1 s MET 159 N -1.45 4.31 0.31 2.61 -1.94 -1.26 -5.02 119.30 116.84 1ud1 s MET 159 Ca 0.00 0.74 -0.27 0.00 -1.71 0.00 0.00 55.69 54.45 1ud1 s MET 159 Cb 0.00 -3.33 -0.09 0.00 2.01 0.00 0.00 34.83 33.41 1ud1 s MET 159 CO 0.00 0.40 0.97 -2.14 -0.01 0.00 0.00 175.02 174.24 1ud1 s PRO 160 N -0.30 4.61 -0.28 2.03 0.02 -1.26 -5.02 135.00 134.80 1ud1 s PRO 160 Ca 0.31 1.45 -0.17 0.00 0.02 0.00 0.00 61.00 62.61 1ud1 s PRO 160 Cb -0.18 -2.94 0.09 0.00 0.02 0.00 0.00 34.50 31.49 1ud1 s PRO 160 CO 0.17 0.28 0.75 -0.98 -0.33 0.00 0.00 177.00 176.90 1ud1 s ARG 161 N -1.81 0.65 0.08 5.54 1.70 -1.26 -4.77 118.95 119.08 1ud1 s ARG 161 Ca 0.48 1.10 0.03 0.00 -0.47 0.00 0.00 55.73 56.86 1ud1 s ARG 161 Cb -0.22 0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.26 1ud1 s ARG 161 CO 0.28 -0.13 0.11 0.50 -1.08 0.00 0.00 175.30 174.98 1ud1 s ARG 162 N 1.51 2.99 -0.35 3.89 3.52 -1.26 -4.50 118.95 124.75 1ud1 s ARG 162 Ca -0.09 -0.65 0.03 0.00 -0.13 0.00 0.00 55.73 54.88 1ud1 s ARG 162 Cb -0.05 -2.78 0.10 0.00 -1.56 0.00 0.00 34.95 30.66 1ud1 s ARG 162 CO -0.18 0.57 0.07 -0.06 -0.81 0.00 0.00 175.30 174.89 1ud1 s PHE 163 N -1.43 3.70 -0.23 5.12 0.40 -0.31 -4.92 117.98 120.31 1ud1 s PHE 163 Ca 0.30 -2.84 -0.25 0.00 -0.60 0.00 0.00 56.93 53.55 1ud1 s PHE 163 Cb -0.12 -2.91 -0.01 0.00 0.51 0.00 0.00 43.02 40.49 1ud1 s PHE 163 CO 0.23 -0.95 0.83 0.71 0.70 0.00 0.00 175.22 176.75 1ud1 s TYR 164 N 0.96 3.32 0.31 0.36 2.02 -1.26 -1.77 117.35 121.29 1ud1 s TYR 164 Ca 0.09 1.15 0.02 0.00 -0.37 0.00 0.00 57.07 57.96 1ud1 s TYR 164 Cb -0.20 -3.05 0.58 0.00 -0.40 0.00 0.00 41.96 38.89 1ud1 s TYR 164 CO -0.07 -0.38 1.90 -0.07 -1.57 0.00 0.00 175.55 175.36 1ud1 h LEU 165 N 9.10 0.87 -8.51 -1.29 4.07 -0.99 -1.72 115.31 116.83 1ud1 h LEU 165 Ca -0.24 0.01 -0.22 0.00 0.08 0.00 0.00 57.88 57.52 1ud1 h LEU 165 Cb 1.10 -0.17 -0.15 0.00 1.08 0.00 0.00 40.66 42.52 1ud1 h LEU 165 CO 0.87 0.54 -0.64 0.00 -1.08 0.00 0.00 178.44 178.13 1ud1 s ALA 166 N -5.87 1.03 0.00 1.53 0.00 -1.26 -3.87 121.76 113.32 1ud1 s ALA 166 Ca -0.11 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.29 1ud1 s ALA 166 Cb 0.20 0.97 0.00 0.00 0.00 0.00 0.00 23.12 24.29 1ud1 s ALA 166 CO 0.80 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.47 1ud1 n GLY 167 N -0.17 -0.35 3.18 0.00 0.00 -1.26 -4.63 105.19 101.96 1ud1 n GLY 167 Ca -0.03 -1.73 -0.37 0.00 0.00 0.00 0.00 46.02 43.89 1ud1 n GLY 167 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ud1 s ASN 168 N -2.53 5.20 -0.25 1.61 0.01 -1.26 -0.80 114.94 116.92 1ud1 s ASN 168 Ca 0.00 -1.57 -0.27 0.00 -0.71 0.00 0.00 52.86 50.31 1ud1 s ASN 168 Cb 0.00 -1.82 0.13 0.00 0.41 0.00 0.00 41.25 39.97 1ud1 s ASN 168 CO 0.00 -0.41 1.06 0.00 -1.51 0.00 0.00 177.10 176.24 1ud1 s GLN 169 N 1.26 0.49 -0.12 -0.60 0.00 -1.26 -4.83 119.66 114.59 1ud1 s GLN 169 Ca 0.02 0.41 -0.27 0.00 -0.00 0.00 0.00 55.36 55.52 1ud1 s GLN 169 Cb -0.21 0.23 -0.02 0.00 0.00 0.00 0.00 33.01 33.01 1ud1 s GLN 169 CO -0.01 -0.09 0.89 -1.83 0.00 0.00 0.00 175.29 174.24 1ud1 s GLU 170 N -0.20 4.38 0.28 9.60 -1.05 -1.26 -3.44 118.70 127.02 1ud1 s GLU 170 Ca 0.02 1.16 -0.30 0.00 -0.15 0.00 0.00 54.97 55.70 1ud1 s GLU 170 Cb -0.04 -3.54 -0.13 0.00 -0.44 0.00 0.00 34.13 29.99 1ud1 s GLU 170 CO -0.05 -0.25 1.40 0.94 0.95 0.00 0.00 175.26 178.26 1ud1 n GLN 171 N 4.84 2.19 -0.29 -4.83 7.27 -1.26 -4.89 117.38 120.41 1ud1 n GLN 171 Ca 0.05 0.77 0.05 0.00 0.07 0.00 0.00 57.00 57.94 1ud1 n GLN 171 Cb 0.49 -2.43 0.11 0.00 2.41 0.00 0.00 30.24 30.82 1ud1 n GLN 171 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1ud1 n GLU 172 N 1.54 -0.07 -0.02 3.69 4.71 -1.26 -1.40 120.64 127.83 1ud1 n GLU 172 Ca 0.09 1.24 0.13 0.00 -0.01 0.00 0.00 57.16 58.60 1ud1 n GLU 172 Cb 0.34 -1.85 0.61 0.00 -1.01 0.00 0.00 31.44 29.53 1ud1 n GLU 172 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1ud1 n PHE 173 N -5.29 0.04 -0.20 -0.32 3.72 -1.26 -4.12 117.46 110.03 1ud1 n PHE 173 Ca 0.13 -0.02 0.14 0.00 -0.05 0.00 0.00 57.45 57.65 1ud1 n PHE 173 Cb 0.40 0.00 0.47 0.00 -0.94 0.00 0.00 39.48 39.40 1ud1 n PHE 173 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1ud1 h LEU 174 N 1.38 0.47 -0.52 4.37 7.12 -1.55 -0.84 115.31 125.74 1ud1 h LEU 174 Ca 0.00 0.03 0.10 0.00 0.13 0.00 0.00 57.88 58.14 1ud1 h LEU 174 Cb 0.30 -0.07 -0.09 0.00 -0.53 0.00 0.00 40.66 40.27 1ud1 h LEU 174 CO 0.00 0.24 -0.01 0.50 -0.13 0.00 0.00 178.44 179.04 1ud1 h LYS 175 N 0.50 0.10 0.00 1.25 3.64 -1.79 -0.21 116.57 120.07 1ud1 h LYS 175 Ca 0.39 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.71 1ud1 h LYS 175 Cb 0.82 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 1ud1 h LYS 175 CO -0.14 0.07 -0.30 1.88 -2.27 0.00 0.00 179.45 178.69 1ud1 h TYR 176 N 0.11 0.00 -0.32 1.91 0.05 -1.47 -2.46 116.97 114.78 1ud1 h TYR 176 Ca 0.26 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.87 1ud1 h TYR 176 Cb 0.40 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.14 1ud1 h TYR 176 CO -0.33 0.30 -0.45 0.37 -1.05 0.00 0.00 178.16 176.99 1ud1 h GLN 177 N 0.00 0.88 0.00 4.88 4.15 -0.72 -3.50 115.11 120.80 1ud1 h GLN 177 Ca -0.00 -0.51 0.00 0.00 0.77 0.00 0.00 58.65 58.90 1ud1 h GLN 177 Cb 0.80 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.53 1ud1 h GLN 177 CO 0.04 1.15 0.00 0.00 -1.93 0.00 0.00 178.83 178.09 1ud1 n GLN 178 N -4.06 0.00 0.00 1.69 10.64 -0.25 -5.10 117.38 120.30 1ud1 n GLN 178 Ca -0.04 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.13 1ud1 n GLN 178 Cb 0.58 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.96 1ud1 n GLN 178 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ud1 n GLY 198 N 3.60 -0.87 0.00 2.61 0.00 -1.26 -5.06 105.19 104.21 1ud1 n GLY 198 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1ud1 n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ud1 n GLY 199 N 0.00 -0.53 3.99 -0.02 0.00 -1.22 -4.63 105.19 102.78 1ud1 n GLY 199 Ca 0.00 -1.41 -0.24 0.00 0.00 0.00 0.00 46.02 44.37 1ud1 n GLY 199 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ud1 s SER 200 N -4.00 4.27 0.37 1.61 1.04 0.02 -4.55 113.70 112.46 1ud1 s SER 200 Ca 0.00 -0.30 0.19 0.00 0.48 0.00 0.00 55.95 56.32 1ud1 s SER 200 Cb 0.00 -0.06 0.62 0.00 0.10 0.00 0.00 66.02 66.68 1ud1 s SER 200 CO 0.00 -1.92 1.70 0.16 0.98 0.00 0.00 173.24 174.16 1ud1 h ILE 201 N -0.60 0.83 0.02 -1.02 3.07 -1.48 -3.05 117.51 115.27 1ud1 h ILE 201 Ca -0.37 -1.57 -0.21 0.00 1.55 0.00 0.00 64.86 64.25 1ud1 h ILE 201 Cb 1.27 1.98 -0.02 0.00 -0.27 0.00 0.00 36.82 39.78 1ud1 h ILE 201 CO 0.40 0.37 -1.00 -0.07 -1.05 0.00 0.00 178.15 176.80 1ud1 h LEU 202 N 0.00 0.09 0.00 0.16 4.07 -1.80 -3.27 115.31 114.56 1ud1 h LEU 202 Ca -0.00 -0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.87 1ud1 h LEU 202 Cb 0.95 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.67 1ud1 h LEU 202 CO 0.05 1.03 0.00 -1.54 -1.08 0.00 0.00 178.44 176.90 1ud1 n SER 203 N -3.44 0.00 0.06 -0.43 3.41 -1.15 -2.65 113.62 109.42 1ud1 n SER 203 Ca -0.02 -0.32 0.07 0.00 -0.26 0.00 0.00 58.87 58.34 1ud1 n SER 203 Cb 0.92 -0.18 -0.05 0.00 -0.26 0.00 0.00 64.21 64.65 1ud1 n SER 203 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ud1 n GLY 204 N 0.64 -1.32 3.81 5.00 0.00 -1.23 -4.85 105.19 107.24 1ud1 n GLY 204 Ca 0.14 -0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.64 1ud1 n GLY 204 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ud1 s PHE 205 N -3.20 3.01 0.43 1.61 0.08 -1.08 -5.06 117.98 113.78 1ud1 s PHE 205 Ca -0.02 1.35 -0.22 0.00 0.12 0.00 0.00 56.93 58.16 1ud1 s PHE 205 Cb 0.09 -2.96 -0.10 0.00 -0.57 0.00 0.00 43.02 39.49 1ud1 s PHE 205 CO 0.81 -1.41 0.99 0.99 -0.10 0.00 0.00 175.22 176.49 1ud1 s THR 206 N -3.07 4.12 0.14 0.64 2.01 -1.26 -4.92 115.64 113.29 1ud1 s THR 206 Ca 0.59 1.39 -0.18 0.00 0.31 0.00 0.00 61.69 63.79 1ud1 s THR 206 Cb -0.14 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 1ud1 s THR 206 CO 0.55 -0.22 1.77 -0.07 -0.69 0.00 0.00 174.62 175.95 1ud1 h LEU 207 N 1.97 0.19 -1.44 4.42 -0.00 -1.97 0.06 115.31 118.55 1ud1 h LEU 207 Ca -0.49 0.01 -0.02 0.00 -0.00 0.00 0.00 57.88 57.39 1ud1 h LEU 207 Cb 1.20 -0.02 -0.00 0.00 -0.00 0.00 0.00 40.66 41.83 1ud1 h LEU 207 CO 0.61 0.14 -0.08 1.05 -0.00 0.00 0.00 178.44 180.17 1ud1 h GLU 208 N 0.27 0.00 -0.02 1.13 9.09 -1.98 0.25 114.58 123.33 1ud1 h GLU 208 Ca 0.11 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.33 1ud1 h GLU 208 Cb 0.04 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.15 1ud1 h GLU 208 CO -0.08 0.08 -0.75 0.74 0.05 0.00 0.00 179.01 179.05 1ud1 h PHE 209 N 0.00 0.79 -0.43 2.06 -1.00 -1.82 -1.62 116.94 114.92 1ud1 h PHE 209 Ca -0.00 -0.42 -0.11 0.00 2.81 0.00 0.00 57.97 60.25 1ud1 h PHE 209 Cb 0.55 -0.10 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 1ud1 h PHE 209 CO 0.00 1.24 -0.15 -0.07 -1.61 0.00 0.00 178.31 177.72 1ud1 h LEU 210 N 0.12 0.87 -0.67 1.54 4.07 -0.56 0.14 115.31 120.82 1ud1 h LEU 210 Ca -0.09 -0.38 -0.10 0.00 0.08 0.00 0.00 57.88 57.39 1ud1 h LEU 210 Cb 1.43 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.91 1ud1 h LEU 210 CO 0.15 1.06 -0.03 -0.33 -1.08 0.00 0.00 178.44 178.21 1ud1 h GLU 211 N 0.68 1.01 -0.14 1.13 5.08 -0.56 -0.54 114.58 121.24 1ud1 h GLU 211 Ca 0.10 -0.32 -0.19 0.00 -1.00 0.00 0.00 59.36 57.95 1ud1 h GLU 211 Cb 0.70 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1ud1 h GLU 211 CO 0.05 1.00 -0.69 1.25 -1.00 0.00 0.00 179.01 179.62 1ud1 h HIS 212 N 0.92 0.80 0.59 4.33 2.76 -1.15 -0.17 115.15 123.23 1ud1 h HIS 212 Ca 0.16 -0.33 -0.03 0.00 -2.20 0.00 0.00 60.37 57.97 1ud1 h HIS 212 Cb 0.57 -0.13 0.01 0.00 1.55 0.00 0.00 27.41 29.40 1ud1 h HIS 212 CO 0.04 1.12 -0.28 0.00 -1.30 0.00 0.00 177.93 177.50 1ud1 h ALA 213 N 0.80 -1.03 0.00 5.26 0.00 -0.41 -3.24 119.26 120.65 1ud1 h ALA 213 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1ud1 h ALA 213 Cb 1.28 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1ud1 h ALA 213 CO 0.13 -0.97 0.00 1.19 0.00 0.00 0.00 179.25 179.60 1ud1 n PHE 214 N -4.50 0.09 -3.49 0.00 3.72 -0.24 -4.92 117.46 108.12 1ud1 n PHE 214 Ca -0.10 0.03 -0.19 0.00 -0.05 0.00 0.00 57.45 57.14 1ud1 n PHE 214 Cb 0.31 -0.54 0.08 0.00 -0.94 0.00 0.00 39.48 38.39 1ud1 n PHE 214 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ud1 n SER 215 N -1.57 -2.49 -4.52 4.37 2.88 -0.12 -5.02 113.62 107.15 1ud1 n SER 215 Ca 0.06 -0.64 -0.24 0.00 -1.33 0.00 0.00 58.87 56.72 1ud1 n SER 215 Cb 0.31 -4.96 -0.11 0.00 -0.75 0.00 0.00 64.21 58.70 1ud1 n SER 215 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1ud1 s VAL 216 N -3.39 1.58 0.64 2.46 -7.23 -0.96 -5.04 120.40 108.46 1ud1 s VAL 216 Ca 0.08 -2.02 -0.14 0.00 -1.81 0.00 0.00 61.98 58.10 1ud1 s VAL 216 Cb -0.04 -2.85 -0.01 0.00 0.56 0.00 0.00 36.38 34.04 1ud1 s VAL 216 CO 0.74 -0.03 1.06 1.51 -0.31 0.00 0.00 175.10 178.07 1ud1 s ASP 217 N -3.58 5.55 0.06 4.85 -4.77 -1.26 -4.65 116.67 112.88 1ud1 s ASP 217 Ca 0.35 1.74 0.08 0.00 -3.30 0.00 0.00 52.55 51.42 1ud1 s ASP 217 Cb 0.09 -2.52 0.36 0.00 -1.09 0.00 0.00 42.92 39.76 1ud1 s ASP 217 CO 0.16 -1.32 1.24 1.17 0.70 0.00 0.00 175.17 177.12 1ud1 n LYS 218 N -2.54 0.03 0.02 2.11 4.81 -1.26 -2.30 118.16 119.04 1ud1 n LYS 218 Ca 0.08 0.46 -0.19 0.00 -0.87 0.00 0.00 58.31 57.80 1ud1 n LYS 218 Cb 0.53 -1.59 -0.14 0.00 0.02 0.00 0.00 35.03 33.85 1ud1 n LYS 218 CO 0.00 0.00 0.00 0.37 1.17 0.00 0.00 177.40 178.94 1ud1 h GLN 219 N 0.00 0.23 0.00 1.64 4.15 -2.00 -3.13 115.11 116.00 1ud1 h GLN 219 Ca 0.00 -0.40 0.00 0.00 0.77 0.00 0.00 58.65 59.02 1ud1 h GLN 219 Cb 0.07 0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.91 1ud1 h GLN 219 CO 0.00 1.19 -0.50 0.44 -1.93 0.00 0.00 178.83 178.04 1ud1 n ILE 220 N -4.21 0.33 0.04 2.39 -5.35 -1.06 -3.45 119.36 108.06 1ud1 n ILE 220 Ca -0.14 -0.23 -0.11 0.00 -0.27 0.00 0.00 62.75 62.00 1ud1 n ILE 220 Cb 0.76 -0.16 0.01 0.00 -1.74 0.00 0.00 39.64 38.51 1ud1 n ILE 220 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ud1 h ALA 221 N 2.60 0.54 0.00 -1.28 0.00 -1.59 -2.71 119.26 116.82 1ud1 h ALA 221 Ca 0.00 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 1ud1 h ALA 221 Cb 0.70 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1ud1 h ALA 221 CO 0.00 0.76 -0.05 -0.22 0.00 0.00 0.00 179.25 179.74 1ud1 h LYS 222 N 0.31 0.00 0.08 0.00 3.64 -1.57 0.26 116.57 119.29 1ud1 h LYS 222 Ca -0.04 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.22 1ud1 h LYS 222 Cb 1.34 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.17 1ud1 h LYS 222 CO 0.13 0.05 -0.53 -0.91 -2.27 0.00 0.00 179.45 175.92 1ud1 h ASN 223 N 0.00 0.33 -0.10 4.20 4.21 -1.61 -2.80 115.58 119.81 1ud1 h ASN 223 Ca -0.00 -0.93 -0.01 0.00 1.21 0.00 0.00 56.30 56.57 1ud1 h ASN 223 Cb 0.35 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.44 1ud1 h ASN 223 CO 0.01 1.23 0.04 0.25 -1.29 0.00 0.00 177.43 177.67 1ud1 h LEU 224 N -0.53 0.17 -3.11 1.61 5.85 -1.13 -2.78 115.31 115.40 1ud1 h LEU 224 Ca -0.09 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 1ud1 h LEU 224 Cb 1.38 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.34 1ud1 h LEU 224 CO 0.10 0.18 0.07 1.67 -0.34 0.00 0.00 178.44 180.12 1ud1 n GLN 225 N -4.46 1.17 0.00 1.25 7.27 0.88 -4.53 117.38 118.96 1ud1 n GLN 225 Ca -0.01 -0.31 0.00 0.00 0.07 0.00 0.00 57.00 56.75 1ud1 n GLN 225 Cb 0.12 -1.13 0.00 0.00 2.41 0.00 0.00 30.24 31.64 1ud1 n GLN 225 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ud1 n GLY 226 N 1.31 2.56 3.28 1.69 0.00 -1.13 -4.33 105.19 108.57 1ud1 n GLY 226 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1ud1 n GLY 226 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ud1 s GLU 227 N 0.00 2.76 0.02 1.61 0.41 -1.06 -4.33 118.70 118.11 1ud1 s GLU 227 Ca 0.00 -1.64 0.00 0.00 -0.41 0.00 0.00 54.97 52.92 1ud1 s GLU 227 Cb 0.00 -4.07 0.00 0.00 -1.78 0.00 0.00 34.13 28.28 1ud1 s GLU 227 CO 0.00 -1.18 0.00 0.36 -0.49 0.00 0.00 175.26 173.95 1ud1 n LYS 233 N 5.08 -1.76 0.00 1.61 2.85 -1.26 -4.55 118.16 120.13 1ud1 n LYS 233 Ca -0.11 1.61 0.00 0.00 -1.05 0.00 0.00 58.31 58.76 1ud1 n LYS 233 Cb 0.41 -1.81 0.00 0.00 -0.65 0.00 0.00 35.03 32.98 1ud1 n LYS 233 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ud1 n GLY 234 N 0.62 0.60 0.17 2.58 0.00 -1.26 -4.78 105.19 103.12 1ud1 n GLY 234 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1ud1 n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ud1 h ALA 235 N -1.84 -0.02 -3.03 4.61 0.00 -1.94 -3.43 119.26 113.61 1ud1 h ALA 235 Ca 0.00 -0.78 -0.62 0.00 0.00 0.00 0.00 54.91 53.52 1ud1 h ALA 235 Cb 0.00 0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.77 1ud1 h ALA 235 CO 0.00 0.69 -0.44 0.42 0.00 0.00 0.00 179.25 179.92 1ud1 s ILE 236 N -2.97 5.32 -0.10 0.00 1.01 -1.26 -1.80 121.20 121.39 1ud1 s ILE 236 Ca -0.09 0.29 -0.00 0.00 0.00 0.00 0.00 60.65 60.85 1ud1 s ILE 236 Cb 0.05 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 39.00 1ud1 s ILE 236 CO 0.94 0.32 -0.06 -0.69 0.00 0.00 0.00 174.94 175.44 1ud1 s VAL 237 N 1.12 0.92 -0.02 2.92 1.01 0.43 -3.15 120.40 123.64 1ud1 s VAL 237 Ca 0.10 -0.23 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 1ud1 s VAL 237 Cb -0.14 -0.96 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 1ud1 s VAL 237 CO 0.05 0.35 1.32 0.42 0.00 0.00 0.00 175.10 177.25 1ud1 s THR 238 N 1.72 3.91 -0.81 3.92 -4.23 -1.26 -0.46 115.64 118.43 1ud1 s THR 238 Ca 0.04 1.28 -0.22 0.00 -1.18 0.00 0.00 61.69 61.61 1ud1 s THR 238 Cb -0.13 -3.82 0.09 0.00 1.34 0.00 0.00 72.50 69.98 1ud1 s THR 238 CO -0.07 -0.00 1.11 -0.69 -0.54 0.00 0.00 174.62 174.43 1ud1 s VAL 239 N 2.30 4.37 0.04 2.29 1.01 -0.41 -4.97 120.40 125.03 1ud1 s VAL 239 Ca 0.61 -0.78 -0.08 0.00 0.00 0.00 0.00 61.98 61.73 1ud1 s VAL 239 Cb -0.29 -4.79 -0.02 0.00 0.00 0.00 0.00 36.38 31.29 1ud1 s VAL 239 CO 0.25 -1.57 0.70 1.17 0.00 0.00 0.00 175.10 175.65 1ud1 n LYS 240 N 7.58 -0.11 0.09 2.72 0.00 -1.26 -0.85 118.16 126.33 1ud1 n LYS 240 Ca 0.11 0.70 -0.14 0.00 0.00 0.00 0.00 58.31 58.98 1ud1 n LYS 240 Cb 0.48 -1.03 -0.11 0.00 0.00 0.00 0.00 35.03 34.37 1ud1 n LYS 240 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1ud1 h GLY 241 N 0.00 0.30 0.00 3.14 0.00 -1.97 -3.50 103.07 101.04 1ud1 h GLY 241 Ca 0.04 -0.70 0.00 0.00 0.00 0.00 0.00 47.33 46.67 1ud1 h GLY 241 CO -0.23 0.61 0.00 0.61 0.00 0.00 0.00 176.54 177.53 1ud1 n GLY 242 N 1.34 2.31 3.72 4.60 0.00 -0.03 -5.04 105.19 112.10 1ud1 n GLY 242 Ca -0.07 -1.71 -0.38 0.00 0.00 0.00 0.00 46.02 43.86 1ud1 n GLY 242 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ud1 n LEU 243 N 0.00 5.53 -0.93 0.99 4.32 -1.26 -4.92 117.00 120.72 1ud1 n LEU 243 Ca 0.00 0.91 0.11 0.00 -0.02 0.00 0.00 56.01 57.01 1ud1 n LEU 243 Cb 0.00 -1.55 0.10 0.00 -1.62 0.00 0.00 43.42 40.35 1ud1 n LEU 243 CO 0.00 -0.86 0.62 -0.24 -1.22 0.00 0.00 177.39 175.69 1ud1 n SER 244 N -1.29 2.95 -4.71 -1.43 2.88 -1.26 -4.94 113.62 105.82 1ud1 n SER 244 Ca 0.13 -1.96 -0.42 0.00 -1.33 0.00 0.00 58.87 55.29 1ud1 n SER 244 Cb 0.46 -0.02 -0.03 0.00 -0.75 0.00 0.00 64.21 63.87 1ud1 n SER 244 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1ud1 s VAL 245 N -1.87 3.89 0.98 2.46 1.01 -1.26 -4.96 120.40 120.65 1ud1 s VAL 245 Ca 0.28 1.34 -0.12 0.00 0.00 0.00 0.00 61.98 63.48 1ud1 s VAL 245 Cb 0.19 -3.86 0.12 0.00 0.00 0.00 0.00 36.38 32.83 1ud1 s VAL 245 CO 0.29 0.09 0.77 0.00 0.00 0.00 0.00 175.10 176.24 1ud1 n ILE 246 N 4.05 0.00 -3.93 2.22 0.13 -1.26 -5.04 119.36 115.53 1ud1 n ILE 246 Ca 0.10 -0.15 -0.30 0.00 -1.10 0.00 0.00 62.75 61.30 1ud1 n ILE 246 Cb 0.45 -0.83 -0.14 0.00 -0.84 0.00 0.00 39.64 38.28 1ud1 n ILE 246 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 1ud1 s LYS 247 N -4.15 1.58 0.00 9.51 2.36 -1.26 -4.99 119.74 122.79 1ud1 s LYS 247 Ca 0.63 -2.11 0.00 0.00 -2.55 0.00 0.00 55.97 51.93 1ud1 s LYS 247 Cb -0.22 -3.03 0.00 0.00 -1.05 0.00 0.00 37.83 33.53 1ud1 s LYS 247 CO 0.63 -1.04 0.00 -2.30 1.55 0.00 0.00 175.35 174.19 1ud1 n PRO 248 N 3.77 0.00 -0.30 4.03 -0.02 -1.26 -5.16 135.00 136.06 1ud1 n PRO 248 Ca 0.04 0.00 0.29 0.00 -2.02 0.00 0.00 63.50 61.82 1ud1 n PRO 248 Cb 0.37 0.00 0.45 0.00 -0.02 0.00 0.00 33.50 34.30 1ud1 n PRO 248 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1ud1 n ILE 297 N 0.00 0.00 0.12 4.25 0.13 -1.26 -5.08 119.36 117.53 1ud1 n ILE 297 Ca 0.00 1.10 0.00 0.00 -1.10 0.00 0.00 62.75 62.75 1ud1 n ILE 297 Cb 0.00 -1.93 0.05 0.00 -0.84 0.00 0.00 39.64 36.92 1ud1 n ILE 297 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1ud1 n THR 299 N -3.35 0.79 -2.69 0.00 -2.24 -1.26 -4.98 114.28 100.55 1ud1 n THR 299 Ca 0.01 -0.90 -0.42 0.00 -2.27 0.00 0.00 64.05 60.48 1ud1 n THR 299 Cb 0.75 0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 69.63 1ud1 n THR 299 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1ud1 s MET 300 N -1.11 4.60 -0.13 -0.78 0.00 -1.22 -5.00 119.30 115.66 1ud1 s MET 300 Ca 0.34 1.46 -0.29 0.00 0.00 0.00 0.00 55.69 57.20 1ud1 s MET 300 Cb 0.19 -3.42 -0.03 0.00 0.00 0.00 0.00 34.83 31.57 1ud1 s MET 300 CO 0.25 0.02 1.44 0.50 0.00 0.00 0.00 175.02 177.23 1ud1 s ARG 301 N 0.64 4.18 -0.30 4.11 3.52 -1.26 -4.91 118.95 124.93 1ud1 s ARG 301 Ca 0.51 1.86 0.07 0.00 -0.13 0.00 0.00 55.73 58.03 1ud1 s ARG 301 Cb -0.23 -3.87 0.46 0.00 -1.56 0.00 0.00 34.95 29.75 1ud1 s ARG 301 CO 0.29 -0.81 1.22 1.47 -0.81 0.00 0.00 175.30 176.66 1ud1 n LEU 302 N 6.95 4.88 -3.67 -0.88 -0.00 -1.26 -4.31 117.00 118.70 1ud1 n LEU 302 Ca 0.15 -4.68 -0.09 0.00 -0.00 0.00 0.00 56.01 51.40 1ud1 n LEU 302 Cb 0.44 -0.37 -0.09 0.00 -0.00 0.00 0.00 43.42 43.40 1ud1 n LEU 302 CO 0.59 2.04 0.15 -0.60 -0.00 0.00 0.00 177.39 179.57 1ud1 s ARG 303 N -3.58 0.49 -0.02 1.47 3.52 -1.26 -1.22 118.95 118.34 1ud1 s ARG 303 Ca 0.51 0.97 -0.06 0.00 -0.13 0.00 0.00 55.73 57.02 1ud1 s ARG 303 Cb 0.41 0.10 0.01 0.00 -1.56 0.00 0.00 34.95 33.91 1ud1 s ARG 303 CO 0.03 -0.17 0.13 -1.58 -0.81 0.00 0.00 175.30 172.90 1ud1 s HIS 304 N 1.67 -0.04 -0.22 5.12 2.46 -0.60 -4.97 115.29 118.70 1ud1 s HIS 304 Ca -0.09 0.10 -0.09 0.00 0.47 0.00 0.00 55.06 55.45 1ud1 s HIS 304 Cb -0.08 -0.01 -0.04 0.00 -0.13 0.00 0.00 32.58 32.32 1ud1 s HIS 304 CO -0.15 -0.17 0.12 1.21 -2.47 0.00 0.00 174.74 173.27 1ud1 s ASN 305 N -0.66 5.85 -0.16 9.88 3.84 -1.26 -0.01 114.94 132.42 1ud1 s ASN 305 Ca -0.07 0.07 0.14 0.00 0.21 0.00 0.00 52.86 53.20 1ud1 s ASN 305 Cb -0.04 -2.04 0.39 0.00 -0.55 0.00 0.00 41.25 39.01 1ud1 s ASN 305 CO 0.01 0.09 1.20 2.30 -2.79 0.00 0.00 177.10 177.90 1ud1 n ILE 306 N 4.11 1.77 -1.89 -5.21 -5.35 0.26 -4.75 119.36 108.30 1ud1 n ILE 306 Ca -0.16 -2.68 -0.29 0.00 -0.27 0.00 0.00 62.75 59.35 1ud1 n ILE 306 Cb 0.52 -0.04 0.15 0.00 -1.74 0.00 0.00 39.64 38.53 1ud1 n ILE 306 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ud1 s GLY 307 N -2.94 1.69 0.57 3.28 0.00 -1.13 -4.51 107.32 104.28 1ud1 s GLY 307 Ca 0.35 -0.95 0.28 0.00 0.00 0.00 0.00 44.72 44.40 1ud1 s GLY 307 CO -0.07 -0.30 2.00 1.46 0.00 0.00 0.00 173.10 176.19 1ud1 h GLN 308 N -1.42 0.00 -0.93 2.90 4.20 -1.94 -0.75 115.11 117.17 1ud1 h GLN 308 Ca -0.45 0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.30 1ud1 h GLN 308 Cb 1.28 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 29.00 1ud1 h GLN 308 CO 0.50 0.00 0.60 1.15 -0.67 0.00 0.00 178.83 180.41 1ud1 h THR 309 N 0.00 1.13 -4.01 -0.54 2.02 -1.96 -3.44 112.91 106.12 1ud1 h THR 309 Ca 0.17 -0.39 -0.50 0.00 0.77 0.00 0.00 66.41 66.46 1ud1 h THR 309 Cb 0.88 -0.11 0.06 0.00 -1.74 0.00 0.00 68.15 67.23 1ud1 h THR 309 CO -0.00 0.21 0.47 -0.55 0.37 0.00 0.00 175.52 176.01 1ud1 s SER 310 N -5.92 6.19 0.05 4.18 0.15 -0.29 -4.99 113.70 113.07 1ud1 s SER 310 Ca -0.13 2.24 -0.31 0.00 0.70 0.00 0.00 55.95 58.46 1ud1 s SER 310 Cb 0.18 -2.60 -0.06 0.00 -1.71 0.00 0.00 66.02 61.83 1ud1 s SER 310 CO 0.80 -0.90 1.39 -0.94 1.20 0.00 0.00 173.24 174.79 1ud1 s SER 311 N -1.46 6.85 0.60 5.45 1.04 -1.26 -4.89 113.70 120.03 1ud1 s SER 311 Ca 0.64 2.19 -0.08 0.00 0.48 0.00 0.00 55.95 59.18 1ud1 s SER 311 Cb -0.27 -2.57 -0.01 0.00 0.10 0.00 0.00 66.02 63.27 1ud1 s SER 311 CO 0.32 -0.68 0.95 -2.16 0.98 0.00 0.00 173.24 172.65 1ud1 s PRO 312 N 1.88 3.16 -0.03 4.02 0.04 -1.26 -4.94 135.00 137.87 1ud1 s PRO 312 Ca 0.64 0.29 -0.17 0.00 0.04 0.00 0.00 61.00 61.80 1ud1 s PRO 312 Cb -0.33 -2.20 -0.32 0.00 0.04 0.00 0.00 34.50 31.69 1ud1 s PRO 312 CO 0.28 -0.65 0.85 -0.44 0.04 0.00 0.00 177.00 177.08 1ud1 h ASP 313 N -0.24 0.62 -3.87 6.66 5.19 -1.14 -3.45 116.42 120.19 1ud1 h ASP 313 Ca -0.45 -0.92 -0.61 0.00 -0.62 0.00 0.00 57.03 54.43 1ud1 h ASP 313 Cb 1.23 -0.20 -0.32 0.00 0.18 0.00 0.00 39.33 40.23 1ud1 h ASP 313 CO 0.62 1.60 -0.85 -0.63 -3.12 0.00 0.00 179.24 176.86 1ud1 s ILE 314 N -2.52 1.64 -0.15 0.35 1.01 -0.42 -4.97 121.20 116.15 1ud1 s ILE 314 Ca -0.13 -0.83 -0.04 0.00 0.00 0.00 0.00 60.65 59.65 1ud1 s ILE 314 Cb 0.03 -1.41 0.07 0.00 0.01 0.00 0.00 42.46 41.17 1ud1 s ILE 314 CO 0.87 0.47 0.21 -0.47 0.00 0.00 0.00 174.94 176.01 1ud1 s TYR 315 N 0.03 -0.27 -0.18 3.97 5.04 -1.26 -0.89 117.35 123.78 1ud1 s TYR 315 Ca -0.05 0.51 0.00 0.00 -2.44 0.00 0.00 57.07 55.09 1ud1 s TYR 315 Cb -0.13 -0.26 0.04 0.00 0.35 0.00 0.00 41.96 41.96 1ud1 s TYR 315 CO 0.03 -0.44 -0.09 1.21 -1.34 0.00 0.00 175.55 174.92 1ud1 s ASN 316 N 2.34 3.11 0.67 4.32 3.84 0.16 -5.00 114.94 124.37 1ud1 s ASN 316 Ca 0.04 -0.76 0.42 0.00 0.21 0.00 0.00 52.86 52.77 1ud1 s ASN 316 Cb -0.14 -1.13 2.26 0.00 -0.55 0.00 0.00 41.25 41.70 1ud1 s ASN 316 CO -0.09 -0.14 2.27 1.55 -2.79 0.00 0.00 177.10 177.90 1ud1 h PRO 317 N 8.03 0.00 0.00 0.43 0.13 -2.01 0.19 132.00 138.77 1ud1 h PRO 317 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1ud1 h PRO 317 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1ud1 h PRO 317 CO 0.46 0.00 -1.15 1.04 -0.23 0.00 0.00 178.00 178.12 1ud1 n GLN 318 N -3.03 1.47 -0.07 0.86 6.02 -1.26 -4.79 117.38 116.59 1ud1 n GLN 318 Ca -0.03 -0.07 -0.14 0.00 -0.01 0.00 0.00 57.00 56.75 1ud1 n GLN 318 Cb 0.13 -1.23 -0.05 0.00 1.02 0.00 0.00 30.24 30.12 1ud1 n GLN 318 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ud1 n ALA 319 N -1.66 1.93 0.00 -1.58 0.00 -0.11 -4.30 120.51 114.79 1ud1 n ALA 319 Ca -0.00 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.84 1ud1 n ALA 319 Cb 0.28 0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1ud1 n ALA 319 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ud1 n GLY 320 N 2.08 -0.47 3.57 0.00 0.00 0.46 -0.17 105.19 110.66 1ud1 n GLY 320 Ca -0.26 -0.34 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 1ud1 n GLY 320 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ud1 s SER 321 N -4.00 -0.33 -0.06 1.61 1.04 -0.87 -0.67 113.70 110.42 1ud1 s SER 321 Ca 0.00 0.27 -0.00 0.00 0.48 0.00 0.00 55.95 56.70 1ud1 s SER 321 Cb 0.00 0.29 0.02 0.00 0.10 0.00 0.00 66.02 66.43 1ud1 s SER 321 CO 0.00 -0.37 -0.03 -0.69 0.98 0.00 0.00 173.24 173.13 1ud1 s VAL 322 N -1.60 0.53 -0.12 5.02 1.01 -0.07 -1.94 120.40 123.22 1ud1 s VAL 322 Ca 0.01 -0.05 0.03 0.00 0.00 0.00 0.00 61.98 61.98 1ud1 s VAL 322 Cb -0.01 -0.60 0.01 0.00 0.00 0.00 0.00 36.38 35.78 1ud1 s VAL 322 CO -0.02 0.25 -0.23 -0.89 0.00 0.00 0.00 175.10 174.22 1ud1 s THR 323 N 1.40 2.05 -0.02 3.92 2.01 -0.69 -0.47 115.64 123.84 1ud1 s THR 323 Ca -0.03 -1.00 0.06 0.00 0.31 0.00 0.00 61.69 61.03 1ud1 s THR 323 Cb -0.13 -1.79 -0.01 0.00 0.01 0.00 0.00 72.50 70.57 1ud1 s THR 323 CO -0.03 0.55 -0.19 0.42 -0.69 0.00 0.00 174.62 174.68 1ud1 s THR 324 N 0.58 1.53 -0.34 -0.82 -4.23 -1.26 -0.92 115.64 110.17 1ud1 s THR 324 Ca -0.13 -0.82 -0.10 0.00 -1.18 0.00 0.00 61.69 59.46 1ud1 s THR 324 Cb -0.17 -1.27 0.01 0.00 1.34 0.00 0.00 72.50 72.41 1ud1 s THR 324 CO 0.03 0.43 0.18 0.00 -0.54 0.00 0.00 174.62 174.73 1ud1 s ALA 325 N -0.40 3.28 0.54 3.99 0.00 -0.56 -5.00 121.76 123.61 1ud1 s ALA 325 Ca 0.06 -1.54 0.03 0.00 0.00 0.00 0.00 51.96 50.51 1ud1 s ALA 325 Cb -0.08 -2.48 0.03 0.00 0.00 0.00 0.00 23.12 20.59 1ud1 s ALA 325 CO -0.00 -1.13 0.25 0.25 0.00 0.00 0.00 175.76 175.13 1ud1 n THR 326 N 4.99 0.00 0.97 0.00 -2.24 -1.26 -3.33 114.28 113.40 1ud1 n THR 326 Ca -0.13 -2.29 0.10 0.00 -2.27 0.00 0.00 64.05 59.46 1ud1 n THR 326 Cb 0.48 0.18 0.52 0.00 -2.10 0.00 0.00 70.33 69.40 1ud1 n THR 326 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ud1 n SER 327 N -1.63 0.00 0.05 3.42 3.41 -0.28 -0.79 113.62 117.80 1ud1 n SER 327 Ca -0.10 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.32 1ud1 n SER 327 Cb 0.64 -0.29 -0.14 0.00 -0.26 0.00 0.00 64.21 64.16 1ud1 n SER 327 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1ud1 h LEU 328 N 0.00 0.47 0.00 1.04 -0.00 -1.94 -3.26 115.31 111.62 1ud1 h LEU 328 Ca 0.00 -0.94 0.00 0.00 -0.00 0.00 0.00 57.88 56.94 1ud1 h LEU 328 Cb 0.20 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 40.70 1ud1 h LEU 328 CO 0.00 1.38 -1.03 -0.90 -0.00 0.00 0.00 178.44 177.89 1ud1 n ASP 329 N -4.13 0.62 -3.44 -0.43 5.68 -1.13 -4.64 116.55 109.08 1ud1 n ASP 329 Ca -0.14 -0.27 -0.28 0.00 -0.50 0.00 0.00 54.79 53.60 1ud1 n ASP 329 Cb 0.81 0.83 -0.11 0.00 -1.14 0.00 0.00 41.12 41.51 1ud1 n ASP 329 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 1ud1 s PHE 330 N -3.18 0.95 0.24 2.11 5.36 0.03 -4.97 117.98 118.53 1ud1 s PHE 330 Ca 0.04 -1.99 0.33 0.00 -0.96 0.00 0.00 56.93 54.36 1ud1 s PHE 330 Cb 0.15 -0.96 1.50 0.00 -0.34 0.00 0.00 43.02 43.37 1ud1 s PHE 330 CO 0.81 -0.82 2.04 -1.00 -1.46 0.00 0.00 175.22 174.78 1ud1 h PRO 331 N 6.36 0.00 0.00 10.12 0.13 -1.77 -2.87 132.00 143.97 1ud1 h PRO 331 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1ud1 h PRO 331 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1ud1 h PRO 331 CO 0.32 0.05 0.00 0.00 -0.23 0.00 0.00 178.00 178.14 1ud1 n ALA 332 N -2.13 1.62 0.25 -0.56 0.00 -1.26 -2.41 120.51 116.02 1ud1 n ALA 332 Ca -0.00 0.06 0.14 0.00 0.00 0.00 0.00 53.44 53.64 1ud1 n ALA 332 Cb 0.27 -1.35 0.58 0.00 0.00 0.00 0.00 19.45 18.96 1ud1 n ALA 332 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ud1 h LEU 333 N 0.00 0.00 0.00 0.00 5.85 -1.82 -2.59 115.31 116.74 1ud1 h LEU 333 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ud1 h LEU 333 Cb 0.32 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1ud1 h LEU 333 CO 0.00 0.11 0.00 -1.54 -0.34 0.00 0.00 178.44 176.67 1ud1 n SER 334 N -3.27 0.00 -0.12 1.25 3.41 -1.01 -0.44 113.62 113.44 1ud1 n SER 334 Ca 0.00 -0.72 -0.20 0.00 -0.26 0.00 0.00 58.87 57.69 1ud1 n SER 334 Cb 0.36 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.19 1ud1 n SER 334 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1ud1 n TRP 335 N -0.91 0.15 0.31 7.33 7.02 -0.98 -4.41 117.44 125.96 1ud1 n TRP 335 Ca 0.12 0.04 0.12 0.00 -1.02 0.00 0.00 57.50 56.75 1ud1 n TRP 335 Cb 0.05 -1.02 0.17 0.00 -2.42 0.00 0.00 31.31 28.10 1ud1 n TRP 335 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1ud1 h LEU 336 N -0.12 0.00 2.34 -0.99 3.38 -1.38 -3.47 115.31 115.07 1ud1 h LEU 336 Ca -0.57 -0.03 -0.33 0.00 0.09 0.00 0.00 57.88 57.04 1ud1 h LEU 336 Cb 1.87 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.61 1ud1 h LEU 336 CO -0.11 0.01 -0.44 -1.14 0.09 0.00 0.00 178.44 176.85 1ud1 n ARG 337 N -2.73 -2.48 -4.48 1.13 3.00 0.42 -4.80 116.66 106.73 1ud1 n ARG 337 Ca 0.03 0.76 -0.23 0.00 -0.00 0.00 0.00 57.85 58.41 1ud1 n ARG 337 Cb 0.51 -5.42 -0.11 0.00 0.00 0.00 0.00 32.46 27.44 1ud1 n ARG 337 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1ud1 s LEU 338 N -5.96 2.33 0.13 6.15 1.43 -1.24 -1.89 118.68 119.63 1ud1 s LEU 338 Ca 0.07 -1.36 -0.26 0.00 -1.03 0.00 0.00 54.13 51.56 1ud1 s LEU 338 Cb -0.04 -0.50 0.07 0.00 0.03 0.00 0.00 46.19 45.76 1ud1 s LEU 338 CO 0.09 -0.56 1.02 -0.94 0.23 0.00 0.00 176.35 176.20 1ud1 s SER 339 N -3.52 -0.13 0.15 2.29 1.04 -0.77 -3.63 113.70 109.11 1ud1 s SER 339 Ca 0.36 -0.39 -0.04 0.00 0.48 0.00 0.00 55.95 56.35 1ud1 s SER 339 Cb 0.09 0.44 -0.03 0.00 0.10 0.00 0.00 66.02 66.61 1ud1 s SER 339 CO 0.16 -0.81 0.15 0.00 0.98 0.00 0.00 173.24 173.71 1ud1 s ALA 340 N -3.02 0.57 -0.10 5.32 0.00 -1.21 -1.42 121.76 121.90 1ud1 s ALA 340 Ca 0.14 -1.28 -0.04 0.00 0.00 0.00 0.00 51.96 50.79 1ud1 s ALA 340 Cb -0.00 0.91 0.05 0.00 0.00 0.00 0.00 23.12 24.08 1ud1 s ALA 340 CO 0.02 -0.56 0.18 -2.00 0.00 0.00 0.00 175.76 173.40 1ud1 s GLU 341 N -4.03 0.06 0.01 0.00 2.12 0.11 -1.50 118.70 115.48 1ud1 s GLU 341 Ca 0.23 0.54 -0.08 0.00 0.36 0.00 0.00 54.97 56.03 1ud1 s GLU 341 Cb 0.06 -0.36 -0.05 0.00 0.26 0.00 0.00 34.13 34.04 1ud1 s GLU 341 CO 0.02 -0.34 0.29 0.12 -0.54 0.00 0.00 175.26 174.81 1ud1 s PHE 342 N 2.31 3.59 -0.08 5.30 5.36 -0.10 -0.71 117.98 133.65 1ud1 s PHE 342 Ca 0.03 0.63 -0.06 0.00 -0.96 0.00 0.00 56.93 56.57 1ud1 s PHE 342 Cb -0.12 -2.03 0.03 0.00 -0.34 0.00 0.00 43.02 40.56 1ud1 s PHE 342 CO -0.07 0.61 0.21 0.20 -1.46 0.00 0.00 175.22 174.71 1ud1 s GLY 343 N -1.64 -0.13 -0.10 13.12 0.00 -0.54 -1.70 107.32 116.32 1ud1 s GLY 343 Ca 0.28 0.74 0.03 0.00 0.00 0.00 0.00 44.72 45.76 1ud1 s GLY 343 CO 0.16 0.82 -0.20 -0.45 0.00 0.00 0.00 173.10 173.42 1ud1 s SER 344 N 0.64 2.76 -0.10 1.64 0.15 -0.82 -0.93 113.70 117.04 1ud1 s SER 344 Ca -0.04 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.11 1ud1 s SER 344 Cb -0.06 -1.26 0.02 0.00 -1.71 0.00 0.00 66.02 63.01 1ud1 s SER 344 CO -0.04 0.11 -0.07 -0.76 1.20 0.00 0.00 173.24 173.68 1ud1 s LEU 345 N 0.55 1.21 0.69 3.45 1.02 -0.21 -2.05 118.68 123.33 1ud1 s LEU 345 Ca -0.15 -0.26 -0.17 0.00 0.02 0.00 0.00 54.13 53.57 1ud1 s LEU 345 Cb -0.17 -0.77 0.01 0.00 0.02 0.00 0.00 46.19 45.28 1ud1 s LEU 345 CO 0.05 -0.10 1.16 0.54 0.02 0.00 0.00 176.35 178.03 1ud1 n ARG 346 N 4.71 0.78 -1.62 1.70 5.12 0.76 -1.89 116.66 126.22 1ud1 n ARG 346 Ca -0.15 0.33 -0.44 0.00 -1.93 0.00 0.00 57.85 55.66 1ud1 n ARG 346 Cb 0.50 -2.40 -0.01 0.00 -1.16 0.00 0.00 32.46 29.39 1ud1 n ARG 346 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 1ud1 n LYS 347 N -2.03 1.53 -0.68 5.56 4.81 -0.77 -2.45 118.16 124.11 1ud1 n LYS 347 Ca 0.15 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 58.12 1ud1 n LYS 347 Cb 0.49 -1.97 0.00 0.00 0.02 0.00 0.00 35.03 33.57 1ud1 n LYS 347 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1ud1 n ASN 348 N 1.05 -2.03 -4.09 3.14 5.03 -0.05 -4.69 115.26 113.63 1ud1 n ASN 348 Ca 0.08 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.24 1ud1 n ASN 348 Cb 0.34 -2.75 0.19 0.00 -1.02 0.00 0.00 39.78 36.53 1ud1 n ASN 348 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ud1 s ALA 349 N -1.08 2.15 0.03 5.41 0.00 -1.03 -4.07 121.76 123.18 1ud1 s ALA 349 Ca 0.00 -1.22 -0.27 0.00 0.00 0.00 0.00 51.96 50.47 1ud1 s ALA 349 Cb 0.00 -2.77 0.07 0.00 0.00 0.00 0.00 23.12 20.42 1ud1 s ALA 349 CO 0.00 -2.52 0.63 0.00 0.00 0.00 0.00 175.76 173.87 1ud1 s MET 350 N -5.89 1.13 -0.20 0.00 0.00 -0.80 -1.42 119.30 112.13 1ud1 s MET 350 Ca 0.74 -0.05 -0.09 0.00 0.00 0.00 0.00 55.69 56.29 1ud1 s MET 350 Cb -0.04 0.53 -0.05 0.00 0.00 0.00 0.00 34.83 35.27 1ud1 s MET 350 CO 0.53 -0.42 0.11 -0.59 0.00 0.00 0.00 175.02 174.66 1ud1 s PHE 351 N -2.23 3.34 0.81 3.16 -0.12 -0.87 -1.54 117.98 120.54 1ud1 s PHE 351 Ca -0.06 0.22 -0.15 0.00 -0.05 0.00 0.00 56.93 56.89 1ud1 s PHE 351 Cb -0.00 -2.15 -0.02 0.00 -0.63 0.00 0.00 43.02 40.22 1ud1 s PHE 351 CO 0.01 0.21 0.40 1.33 -0.05 0.00 0.00 175.22 177.11 1ud1 n VAL 352 N 3.64 1.05 -1.67 -2.49 0.24 -0.75 -2.92 118.33 115.43 1ud1 n VAL 352 Ca -0.16 -0.34 -0.46 0.00 -2.04 0.00 0.00 64.34 61.35 1ud1 n VAL 352 Cb 0.52 -0.64 -0.04 0.00 -1.47 0.00 0.00 33.84 32.21 1ud1 n VAL 352 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1ud1 n PRO 353 N -0.83 2.21 -3.89 7.34 -0.04 -1.24 -4.55 135.00 134.01 1ud1 n PRO 353 Ca 0.08 0.80 -0.08 0.00 -0.04 0.00 0.00 63.50 64.26 1ud1 n PRO 353 Cb 0.51 -2.58 -0.03 0.00 -0.04 0.00 0.00 33.50 31.36 1ud1 n PRO 353 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1ud1 s HIS 354 N 1.27 0.02 0.03 0.54 -3.43 -0.33 -0.19 115.29 113.21 1ud1 s HIS 354 Ca 0.80 -0.43 -0.00 0.00 -0.80 0.00 0.00 55.06 54.63 1ud1 s HIS 354 Cb -0.66 0.47 -0.02 0.00 -1.43 0.00 0.00 32.58 30.93 1ud1 s HIS 354 CO 0.39 -1.10 -0.02 1.52 -2.00 0.00 0.00 174.74 173.53 1ud1 s TYR 355 N -3.95 0.31 -0.24 0.38 -0.85 -0.13 -1.04 117.35 111.84 1ud1 s TYR 355 Ca 0.15 -0.64 -0.18 0.00 -0.52 0.00 0.00 57.07 55.88 1ud1 s TYR 355 Cb -0.03 -0.23 -0.03 0.00 0.38 0.00 0.00 41.96 42.05 1ud1 s TYR 355 CO 0.06 -0.24 0.54 -0.80 -1.52 0.00 0.00 175.55 173.59 1ud1 s ASN 356 N -1.78 6.51 0.05 -0.18 0.01 -1.23 -0.78 114.94 117.54 1ud1 s ASN 356 Ca -0.11 0.61 -0.24 0.00 -0.71 0.00 0.00 52.86 52.41 1ud1 s ASN 356 Cb -0.06 -2.29 -0.17 0.00 0.41 0.00 0.00 41.25 39.14 1ud1 s ASN 356 CO -0.03 -0.26 1.57 -0.07 -1.51 0.00 0.00 177.10 176.80 1ud1 h LEU 357 N 8.49 -0.04 -4.16 0.60 4.07 -1.08 -3.37 115.31 119.83 1ud1 h LEU 357 Ca -0.30 -0.16 -0.60 0.00 0.08 0.00 0.00 57.88 56.90 1ud1 h LEU 357 Cb 1.14 0.01 -0.40 0.00 1.08 0.00 0.00 40.66 42.50 1ud1 h LEU 357 CO 0.73 0.14 -0.42 -0.46 -1.08 0.00 0.00 178.44 177.35 1ud1 n ASN 358 N -5.03 5.41 -3.63 -0.43 6.94 -1.26 -4.75 115.26 112.51 1ud1 n ASN 358 Ca -0.08 -3.75 -0.07 0.00 -0.02 0.00 0.00 54.58 50.66 1ud1 n ASN 358 Cb 0.12 -0.52 -0.06 0.00 -2.36 0.00 0.00 39.78 36.96 1ud1 n ASN 358 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ud1 s ALA 359 N -3.65 -2.06 0.42 -2.53 0.00 -1.26 -4.62 121.76 108.06 1ud1 s ALA 359 Ca 0.52 1.76 -0.12 0.00 0.00 0.00 0.00 51.96 54.12 1ud1 s ALA 359 Cb 0.42 -1.43 -0.07 0.00 0.00 0.00 0.00 23.12 22.04 1ud1 s ALA 359 CO -0.09 -0.21 0.81 -0.80 0.00 0.00 0.00 175.76 175.48 1ud1 s ASN 360 N -0.22 6.56 0.01 0.00 0.01 -1.26 -4.20 114.94 115.84 1ud1 s ASN 360 Ca 0.04 1.24 0.05 0.00 -0.71 0.00 0.00 52.86 53.48 1ud1 s ASN 360 Cb -0.04 -2.37 -0.02 0.00 0.41 0.00 0.00 41.25 39.24 1ud1 s ASN 360 CO -0.08 -0.42 -0.16 -0.44 -1.51 0.00 0.00 177.10 174.49 1ud1 s SER 361 N -3.07 1.86 -0.42 -1.22 0.01 -0.77 -1.07 113.70 109.03 1ud1 s SER 361 Ca 0.53 -0.36 0.03 0.00 1.31 0.00 0.00 55.95 57.46 1ud1 s SER 361 Cb -0.10 -0.18 0.12 0.00 0.21 0.00 0.00 66.02 66.07 1ud1 s SER 361 CO 0.30 0.14 0.19 -0.63 0.41 0.00 0.00 173.24 173.65 1ud1 s ILE 362 N -0.55 1.81 -0.22 1.44 1.09 0.16 -1.51 121.20 123.42 1ud1 s ILE 362 Ca 0.05 -2.55 -0.29 0.00 -1.10 0.00 0.00 60.65 56.76 1ud1 s ILE 362 Cb -0.07 -2.29 -0.00 0.00 -1.06 0.00 0.00 42.46 39.04 1ud1 s ILE 362 CO 0.00 -0.78 1.20 -0.63 -0.10 0.00 0.00 174.94 174.63 1ud1 s ILE 363 N 0.47 4.37 -0.22 2.92 1.01 -0.39 -1.43 121.20 127.92 1ud1 s ILE 363 Ca 0.15 1.63 -0.05 0.00 0.00 0.00 0.00 60.65 62.39 1ud1 s ILE 363 Cb -0.23 -4.14 -0.01 0.00 0.01 0.00 0.00 42.46 38.09 1ud1 s ILE 363 CO -0.05 -0.24 -0.02 -0.47 0.00 0.00 0.00 174.94 174.16 1ud1 s TYR 364 N 3.60 2.99 -0.57 3.97 5.04 0.32 -0.93 117.35 131.77 1ud1 s TYR 364 Ca 0.52 -0.80 -0.26 0.00 -2.44 0.00 0.00 57.07 54.09 1ud1 s TYR 364 Cb -0.18 -2.13 0.04 0.00 0.35 0.00 0.00 41.96 40.03 1ud1 s TYR 364 CO 0.14 -0.49 1.05 0.00 -1.34 0.00 0.00 175.55 174.91 1ud1 s ALA 365 N 1.47 3.08 -0.02 3.97 0.00 -0.72 -1.17 121.76 128.37 1ud1 s ALA 365 Ca 0.06 -1.08 -0.10 0.00 0.00 0.00 0.00 51.96 50.83 1ud1 s ALA 365 Cb -0.14 -3.87 -0.06 0.00 0.00 0.00 0.00 23.12 19.05 1ud1 s ALA 365 CO -0.01 -2.52 0.56 -0.07 0.00 0.00 0.00 175.76 173.72 1ud1 h LEU 366 N 11.41 -0.31 -8.73 0.00 3.38 -0.47 -0.47 115.31 120.12 1ud1 h LEU 366 Ca -0.26 0.01 -0.47 0.00 0.09 0.00 0.00 57.88 57.25 1ud1 h LEU 366 Cb 1.07 0.08 -0.18 0.00 0.09 0.00 0.00 40.66 41.72 1ud1 h LEU 366 CO 1.13 -0.03 -0.77 0.21 0.09 0.00 0.00 178.44 179.07 1ud1 s ASN 367 N -4.11 2.36 0.34 -0.43 2.47 -0.52 -4.29 114.94 110.76 1ud1 s ASN 367 Ca -0.05 -0.84 0.00 0.00 0.42 0.00 0.00 52.86 52.38 1ud1 s ASN 367 Cb 0.01 -0.11 0.00 0.00 -1.45 0.00 0.00 41.25 39.69 1ud1 s ASN 367 CO 0.16 -0.09 0.00 0.61 -3.72 0.00 0.00 177.10 174.06 1ud1 n GLY 368 N 0.38 -1.17 3.10 1.21 0.00 -1.25 -0.23 105.19 107.23 1ud1 n GLY 368 Ca -0.14 -1.21 -0.09 0.00 0.00 0.00 0.00 46.02 44.58 1ud1 n GLY 368 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ud1 s ARG 369 N 0.00 0.57 0.34 1.61 3.52 -1.26 -2.13 118.95 121.60 1ud1 s ARG 369 Ca 0.00 -0.87 0.06 0.00 -0.13 0.00 0.00 55.73 54.80 1ud1 s ARG 369 Cb 0.00 0.22 -0.02 0.00 -1.56 0.00 0.00 34.95 33.58 1ud1 s ARG 369 CO 0.00 -0.13 0.32 0.00 -0.81 0.00 0.00 175.30 174.68 1ud1 s ALA 370 N -2.87 1.73 -0.28 6.12 0.00 -0.50 -1.41 121.76 124.55 1ud1 s ALA 370 Ca -0.03 -2.02 -0.01 0.00 0.00 0.00 0.00 51.96 49.91 1ud1 s ALA 370 Cb 0.00 1.43 0.09 0.00 0.00 0.00 0.00 23.12 24.64 1ud1 s ALA 370 CO -0.06 -0.69 0.06 -1.17 0.00 0.00 0.00 175.76 173.91 1ud1 s LEU 371 N -3.36 2.22 0.15 0.00 0.20 0.09 -2.85 118.68 115.13 1ud1 s LEU 371 Ca 0.39 -1.46 0.04 0.00 0.69 0.00 0.00 54.13 53.80 1ud1 s LEU 371 Cb 0.02 -0.90 -0.04 0.00 -0.43 0.00 0.00 46.19 44.84 1ud1 s LEU 371 CO 0.27 -0.37 0.15 -0.63 -0.29 0.00 0.00 176.35 175.49 1ud1 s ILE 372 N 1.60 4.63 -0.08 6.68 1.01 -0.67 -0.79 121.20 133.57 1ud1 s ILE 372 Ca 0.06 -0.97 -0.03 0.00 0.00 0.00 0.00 60.65 59.71 1ud1 s ILE 372 Cb -0.17 -3.35 0.04 0.00 0.01 0.00 0.00 42.46 38.98 1ud1 s ILE 372 CO -0.19 -0.07 0.05 -1.10 0.00 0.00 0.00 174.94 173.63 1ud1 s GLN 373 N -3.03 0.13 -0.09 2.79 -0.21 -0.04 -2.40 119.66 116.82 1ud1 s GLN 373 Ca 0.31 0.17 0.02 0.00 0.02 0.00 0.00 55.36 55.88 1ud1 s GLN 373 Cb -0.10 -1.00 0.01 0.00 1.00 0.00 0.00 33.01 32.92 1ud1 s GLN 373 CO 0.24 -0.42 -0.13 0.54 -2.12 0.00 0.00 175.29 173.40 1ud1 s VAL 374 N 2.10 1.30 0.02 1.09 0.11 -0.77 -1.95 120.40 122.29 1ud1 s VAL 374 Ca 0.04 -0.54 0.07 0.00 -2.93 0.00 0.00 61.98 58.62 1ud1 s VAL 374 Cb -0.13 -1.19 -0.03 0.00 -1.53 0.00 0.00 36.38 33.49 1ud1 s VAL 374 CO -0.05 0.40 -0.21 0.54 -3.33 0.00 0.00 175.10 172.44 1ud1 s VAL 375 N 0.89 2.50 0.00 2.04 0.11 -0.85 -0.53 120.40 124.57 1ud1 s VAL 375 Ca -0.10 -1.16 0.00 0.00 -2.93 0.00 0.00 61.98 57.79 1ud1 s VAL 375 Cb -0.15 -1.99 0.00 0.00 -1.53 0.00 0.00 36.38 32.71 1ud1 s VAL 375 CO 0.01 0.43 0.00 -0.46 -3.33 0.00 0.00 175.10 171.74 1ud1 n ASN 376 N 1.89 0.00 0.19 3.54 0.23 -0.66 -1.57 115.26 118.88 1ud1 n ASN 376 Ca -0.16 -0.46 0.04 0.00 -0.53 0.00 0.00 54.58 53.47 1ud1 n ASN 376 Cb 0.52 0.00 0.39 0.00 -2.08 0.00 0.00 39.78 38.61 1ud1 n ASN 376 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ud1 n ASN 378 N -3.91 1.17 0.00 0.00 4.13 -1.26 -4.88 115.26 110.52 1ud1 n ASN 378 Ca -0.02 -1.74 0.00 0.00 1.68 0.00 0.00 54.58 54.51 1ud1 n ASN 378 Cb 0.42 -0.10 0.00 0.00 -1.54 0.00 0.00 39.78 38.56 1ud1 n ASN 378 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ud1 n GLY 379 N 0.97 1.06 3.71 7.41 0.00 -1.09 -5.00 105.19 112.25 1ud1 n GLY 379 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1ud1 n GLY 379 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ud1 s GLU 380 N -0.08 4.50 -0.84 1.61 2.02 -1.26 -4.80 118.70 119.86 1ud1 s GLU 380 Ca 0.00 1.58 -0.24 0.00 0.02 0.00 0.00 54.97 56.32 1ud1 s GLU 380 Cb 0.00 -3.41 0.05 0.00 0.10 0.00 0.00 34.13 30.87 1ud1 s GLU 380 CO 0.00 -0.15 1.28 0.50 0.02 0.00 0.00 175.26 176.91 1ud1 s ARG 381 N 1.07 3.34 0.00 1.61 3.52 -1.26 -1.66 118.95 125.57 1ud1 s ARG 381 Ca 0.55 -0.74 0.22 0.00 -0.13 0.00 0.00 55.73 55.64 1ud1 s ARG 381 Cb -0.25 -4.63 1.33 0.00 -1.56 0.00 0.00 34.95 29.84 1ud1 s ARG 381 CO 0.28 -2.09 1.73 1.33 -0.81 0.00 0.00 175.30 175.74 1ud1 n VAL 382 N 6.41 0.00 -3.55 7.11 0.24 0.31 -4.69 118.33 124.16 1ud1 n VAL 382 Ca 0.14 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.43 1ud1 n VAL 382 Cb 0.49 -0.55 -0.05 0.00 -1.47 0.00 0.00 33.84 32.26 1ud1 n VAL 382 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1ud1 s PHE 383 N -2.00 -0.95 -0.27 6.34 5.36 -1.01 -0.82 117.98 124.64 1ud1 s PHE 383 Ca 0.33 1.69 -0.03 0.00 -0.96 0.00 0.00 56.93 57.96 1ud1 s PHE 383 Cb 0.15 0.57 0.11 0.00 -0.34 0.00 0.00 43.02 43.51 1ud1 s PHE 383 CO 0.26 -0.47 0.19 0.34 -1.46 0.00 0.00 175.22 174.08 1ud1 s ASP 384 N 2.38 2.54 0.00 6.13 -1.08 -1.26 -1.85 116.67 123.53 1ud1 s ASP 384 Ca -0.05 -0.91 0.00 0.00 -0.52 0.00 0.00 52.55 51.06 1ud1 s ASP 384 Cb -0.08 0.03 0.00 0.00 -1.46 0.00 0.00 42.92 41.42 1ud1 s ASP 384 CO -0.18 -0.40 0.00 0.61 0.52 0.00 0.00 175.17 175.72 1ud1 n GLY 385 N 5.28 -0.74 2.99 2.66 0.00 -1.01 -5.05 105.19 109.33 1ud1 n GLY 385 Ca -0.05 -0.34 -0.20 0.00 0.00 0.00 0.00 46.02 45.43 1ud1 n GLY 385 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ud1 s GLU 386 N -0.89 0.99 -0.38 1.61 -1.05 -1.26 -1.66 118.70 116.05 1ud1 s GLU 386 Ca 0.00 -0.28 -0.14 0.00 -0.15 0.00 0.00 54.97 54.40 1ud1 s GLU 386 Cb 0.00 -0.92 0.01 0.00 -0.44 0.00 0.00 34.13 32.78 1ud1 s GLU 386 CO 0.00 0.08 0.27 -1.17 0.95 0.00 0.00 175.26 175.39 1ud1 s LEU 387 N 0.32 4.83 0.56 1.83 2.96 -1.13 -4.82 118.68 123.22 1ud1 s LEU 387 Ca -0.05 -0.73 0.07 0.00 -0.22 0.00 0.00 54.13 53.20 1ud1 s LEU 387 Cb -0.10 -2.13 0.06 0.00 0.50 0.00 0.00 46.19 44.52 1ud1 s LEU 387 CO 0.01 -0.36 0.58 0.00 -1.32 0.00 0.00 176.35 175.26 1ud1 s GLN 388 N 1.68 2.28 0.58 1.98 -2.07 -1.26 -1.41 119.66 121.43 1ud1 s GLN 388 Ca 0.05 -1.86 -0.18 0.00 -1.82 0.00 0.00 55.36 51.56 1ud1 s GLN 388 Cb -0.18 -2.34 -0.09 0.00 -1.09 0.00 0.00 33.01 29.31 1ud1 s GLN 388 CO 0.10 -0.73 0.50 0.39 -1.32 0.00 0.00 175.29 174.23 1ud1 n GLU 389 N -1.98 0.48 -0.83 9.60 1.02 -0.91 -2.58 120.64 125.44 1ud1 n GLU 389 Ca 0.06 0.19 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 1ud1 n GLU 389 Cb 0.63 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1ud1 n GLU 389 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ud1 n GLY 390 N 1.80 0.05 3.78 0.62 0.00 -0.18 -4.97 105.19 106.30 1ud1 n GLY 390 Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 1ud1 n GLY 390 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ud1 s ARG 391 N -1.52 2.60 -0.01 1.61 3.52 -1.06 -4.78 118.95 119.31 1ud1 s ARG 391 Ca 0.00 -1.33 0.06 0.00 -0.13 0.00 0.00 55.73 54.33 1ud1 s ARG 391 Cb 0.00 -2.36 -0.02 0.00 -1.56 0.00 0.00 34.95 31.01 1ud1 s ARG 391 CO 0.00 0.21 -0.20 0.54 -0.81 0.00 0.00 175.30 175.04 1ud1 s VAL 392 N -2.31 1.56 -0.11 7.11 0.11 0.10 -1.76 120.40 125.11 1ud1 s VAL 392 Ca 0.37 -0.86 0.02 0.00 -2.93 0.00 0.00 61.98 58.57 1ud1 s VAL 392 Cb -0.05 -1.30 0.01 0.00 -1.53 0.00 0.00 36.38 33.51 1ud1 s VAL 392 CO 0.24 0.43 -0.15 -0.22 -3.33 0.00 0.00 175.10 172.06 1ud1 s LEU 393 N -0.50 1.72 -0.21 2.54 2.96 -0.10 -0.64 118.68 124.44 1ud1 s LEU 393 Ca 0.08 -0.43 -0.09 0.00 -0.22 0.00 0.00 54.13 53.46 1ud1 s LEU 393 Cb -0.08 -1.10 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 1ud1 s LEU 393 CO -0.01 0.01 0.11 -0.63 -1.32 0.00 0.00 176.35 174.52 1ud1 s ILE 394 N 1.01 5.07 -0.30 6.68 1.01 -1.26 -1.26 121.20 132.15 1ud1 s ILE 394 Ca -0.06 0.07 0.02 0.00 0.00 0.00 0.00 60.65 60.68 1ud1 s ILE 394 Cb -0.15 -3.33 0.09 0.00 0.01 0.00 0.00 42.46 39.08 1ud1 s ILE 394 CO -0.02 0.40 0.02 -0.69 0.00 0.00 0.00 174.94 174.65 1ud1 s VAL 395 N 0.73 1.72 0.00 2.92 1.01 -0.57 -5.01 120.40 121.19 1ud1 s VAL 395 Ca 0.06 -1.74 0.00 0.00 0.00 0.00 0.00 61.98 60.29 1ud1 s VAL 395 Cb -0.13 -2.16 0.00 0.00 0.00 0.00 0.00 36.38 34.10 1ud1 s VAL 395 CO 0.02 -0.43 0.00 -2.65 0.00 0.00 0.00 175.10 172.03 1ud1 n PRO 396 N 4.53 0.64 0.00 2.72 -0.02 -1.26 -1.84 135.00 139.77 1ud1 n PRO 396 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 1ud1 n PRO 396 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.91 1ud1 n PRO 396 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1ud1 n GLN 397 N -0.68 0.00 -0.46 -0.52 7.27 -1.26 -4.15 117.38 117.58 1ud1 n GLN 397 Ca 0.00 0.41 0.08 0.00 0.07 0.00 0.00 57.00 57.55 1ud1 n GLN 397 Cb 0.00 -1.23 0.28 0.00 2.41 0.00 0.00 30.24 31.70 1ud1 n GLN 397 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1ud1 n ASN 398 N -1.72 3.76 -4.74 1.69 5.03 -1.26 -3.51 115.26 114.51 1ud1 n ASN 398 Ca 0.00 -2.28 -0.41 0.00 0.87 0.00 0.00 54.58 52.75 1ud1 n ASN 398 Cb 0.00 -0.49 -0.03 0.00 -1.02 0.00 0.00 39.78 38.24 1ud1 n ASN 398 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1ud1 s PHE 399 N -1.67 3.15 -0.12 3.10 0.40 -1.26 -4.86 117.98 116.73 1ud1 s PHE 399 Ca 0.41 1.18 -0.19 0.00 -0.60 0.00 0.00 56.93 57.73 1ud1 s PHE 399 Cb 0.25 -3.68 -0.04 0.00 0.51 0.00 0.00 43.02 40.06 1ud1 s PHE 399 CO 0.21 -2.14 0.53 0.08 0.70 0.00 0.00 175.22 174.61 1ud1 s VAL 400 N -0.10 5.15 0.17 -0.44 1.01 -0.61 -4.52 120.40 121.05 1ud1 s VAL 400 Ca 0.56 1.06 0.09 0.00 0.00 0.00 0.00 61.98 63.70 1ud1 s VAL 400 Cb -0.39 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 1ud1 s VAL 400 CO 0.42 0.29 -0.14 0.68 0.00 0.00 0.00 175.10 176.34 1ud1 s VAL 401 N 0.79 2.95 -0.17 2.92 -7.23 -0.21 -2.01 120.40 117.45 1ud1 s VAL 401 Ca 0.28 -1.70 -0.15 0.00 -1.81 0.00 0.00 61.98 58.60 1ud1 s VAL 401 Cb -0.16 -2.43 0.05 0.00 0.56 0.00 0.00 36.38 34.40 1ud1 s VAL 401 CO 0.12 -0.07 0.45 0.00 -0.31 0.00 0.00 175.10 175.29 1ud1 s ALA 402 N -1.58 -1.12 -0.02 1.32 0.00 -0.82 -1.18 121.76 118.36 1ud1 s ALA 402 Ca 0.23 1.31 -0.01 0.00 0.00 0.00 0.00 51.96 53.48 1ud1 s ALA 402 Cb -0.09 -0.76 0.01 0.00 0.00 0.00 0.00 23.12 22.28 1ud1 s ALA 402 CO 0.13 -0.22 0.04 0.00 0.00 0.00 0.00 175.76 175.71 1ud1 s ALA 403 N 0.36 -0.08 -0.17 0.00 0.00 -1.15 -0.86 121.76 119.86 1ud1 s ALA 403 Ca -0.01 0.16 -0.03 0.00 0.00 0.00 0.00 51.96 52.08 1ud1 s ALA 403 Cb -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.96 1ud1 s ALA 403 CO -0.01 -0.04 -0.06 0.50 0.00 0.00 0.00 175.76 176.15 1ud1 s ARG 404 N 0.22 3.51 -0.05 0.00 3.52 0.02 -2.05 118.95 124.13 1ud1 s ARG 404 Ca -0.02 -0.60 -0.30 0.00 -0.13 0.00 0.00 55.73 54.69 1ud1 s ARG 404 Cb -0.03 -2.86 -0.05 0.00 -1.56 0.00 0.00 34.95 30.45 1ud1 s ARG 404 CO -0.01 0.11 1.49 0.45 -0.81 0.00 0.00 175.30 176.53 1ud1 s SER 405 N 0.68 6.78 -0.01 -2.12 0.15 -0.51 -0.73 113.70 117.94 1ud1 s SER 405 Ca -0.03 2.10 0.20 0.00 0.70 0.00 0.00 55.95 58.92 1ud1 s SER 405 Cb -0.15 -2.55 0.60 0.00 -1.71 0.00 0.00 66.02 62.21 1ud1 s SER 405 CO 0.02 -0.82 1.50 0.00 1.20 0.00 0.00 173.24 175.14 1ud1 n GLN 406 N 6.31 2.66 -3.80 5.44 6.02 -0.50 -0.87 117.38 132.64 1ud1 n GLN 406 Ca 0.15 -2.42 -0.10 0.00 -0.01 0.00 0.00 57.00 54.62 1ud1 n GLN 406 Cb 0.43 -1.56 -0.06 0.00 1.02 0.00 0.00 30.24 30.08 1ud1 n GLN 406 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1ud1 s SER 407 N -0.98 -0.09 -0.71 1.08 0.01 -1.23 -4.83 113.70 106.95 1ud1 s SER 407 Ca 0.45 -0.59 -0.10 0.00 1.31 0.00 0.00 55.95 57.02 1ud1 s SER 407 Cb 0.24 0.46 0.18 0.00 0.21 0.00 0.00 66.02 67.12 1ud1 s SER 407 CO 0.29 -0.89 0.61 -1.81 0.41 0.00 0.00 173.24 171.85 1ud1 s ASP 408 N -2.88 6.15 0.16 2.44 1.01 -1.26 -1.85 116.67 120.44 1ud1 s ASP 408 Ca 0.09 -2.59 0.09 0.00 0.71 0.00 0.00 52.55 50.85 1ud1 s ASP 408 Cb 0.02 -2.08 -0.04 0.00 1.01 0.00 0.00 42.92 41.83 1ud1 s ASP 408 CO -0.06 -0.55 -0.20 0.20 0.21 0.00 0.00 175.17 174.78 1ud1 s ASN 409 N 1.89 2.77 -0.14 0.27 0.01 -1.26 -4.93 114.94 113.55 1ud1 s ASN 409 Ca 0.15 -0.83 -0.24 0.00 -0.71 0.00 0.00 52.86 51.24 1ud1 s ASN 409 Cb -0.16 -0.17 -0.03 0.00 0.41 0.00 0.00 41.25 41.30 1ud1 s ASN 409 CO -0.05 0.01 0.74 0.12 -1.51 0.00 0.00 177.10 176.40 1ud1 s PHE 410 N -1.81 3.47 -0.05 2.20 5.36 -0.79 -3.96 117.98 122.40 1ud1 s PHE 410 Ca 0.15 1.18 0.05 0.00 -0.96 0.00 0.00 56.93 57.35 1ud1 s PHE 410 Cb -0.07 -2.89 -0.01 0.00 -0.34 0.00 0.00 43.02 39.71 1ud1 s PHE 410 CO 0.07 -0.10 -0.21 -1.21 -1.46 0.00 0.00 175.22 172.31 1ud1 s GLU 411 N 1.59 2.09 0.24 10.12 2.02 0.68 -1.05 118.70 134.39 1ud1 s GLU 411 Ca 0.36 -0.74 0.01 0.00 0.02 0.00 0.00 54.97 54.62 1ud1 s GLU 411 Cb -0.17 -1.81 -0.05 0.00 0.10 0.00 0.00 34.13 32.21 1ud1 s GLU 411 CO 0.14 0.31 0.10 1.52 0.02 0.00 0.00 175.26 177.35 1ud1 s TYR 412 N -0.07 1.41 -0.10 1.61 -0.85 -0.11 0.32 117.35 119.55 1ud1 s TYR 412 Ca -0.03 -1.23 -0.01 0.00 -0.52 0.00 0.00 57.07 55.28 1ud1 s TYR 412 Cb -0.12 -0.79 0.03 0.00 0.38 0.00 0.00 41.96 41.45 1ud1 s TYR 412 CO 0.03 -0.41 -0.05 0.08 -1.52 0.00 0.00 175.55 173.68 1ud1 s VAL 413 N -3.86 0.79 -0.25 -3.49 1.01 -0.32 -1.46 120.40 112.81 1ud1 s VAL 413 Ca 0.37 -0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.14 1ud1 s VAL 413 Cb 0.08 -0.88 0.00 0.00 0.00 0.00 0.00 36.38 35.58 1ud1 s VAL 413 CO 0.13 0.31 0.00 -0.55 0.00 0.00 0.00 175.10 174.98 1ud1 s SER 414 N 1.80 4.63 -0.48 3.32 0.15 0.11 -0.52 113.70 122.71 1ud1 s SER 414 Ca 0.05 -0.57 -0.21 0.00 0.70 0.00 0.00 55.95 55.92 1ud1 s SER 414 Cb -0.13 -1.78 0.04 0.00 -1.71 0.00 0.00 66.02 62.44 1ud1 s SER 414 CO -0.07 -0.10 0.69 -0.36 1.20 0.00 0.00 173.24 174.60 1ud1 s PHE 415 N 1.47 3.01 0.03 3.44 0.08 -0.52 -0.71 117.98 124.78 1ud1 s PHE 415 Ca 0.04 -0.24 -0.14 0.00 0.12 0.00 0.00 56.93 56.71 1ud1 s PHE 415 Cb -0.16 -3.55 -0.06 0.00 -0.57 0.00 0.00 43.02 38.69 1ud1 s PHE 415 CO -0.01 -1.02 0.42 0.15 -0.10 0.00 0.00 175.22 174.66 1ud1 s LYS 416 N 2.94 3.88 -1.10 0.44 -0.14 -0.50 -0.67 119.74 124.59 1ud1 s LYS 416 Ca 0.21 0.36 -0.05 0.00 -1.36 0.00 0.00 55.97 55.13 1ud1 s LYS 416 Cb -0.16 -3.15 0.29 0.00 -1.68 0.00 0.00 37.83 33.14 1ud1 s LYS 416 CO 0.16 0.65 1.47 0.25 -0.76 0.00 0.00 175.35 177.12 1ud1 n THR 417 N 1.53 5.17 0.00 2.17 -2.24 -0.23 -1.85 114.28 118.83 1ud1 n THR 417 Ca -0.12 -5.74 0.00 0.00 -2.27 0.00 0.00 64.05 55.92 1ud1 n THR 417 Cb 0.52 -2.16 0.00 0.00 -2.10 0.00 0.00 70.33 66.59 1ud1 n THR 417 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ud1 n ASN 418 N 1.73 0.00 0.29 3.42 2.85 -0.79 -4.35 115.26 118.40 1ud1 n ASN 418 Ca 0.27 0.00 0.18 0.00 -0.11 0.00 0.00 54.58 54.92 1ud1 n ASN 418 Cb 0.34 0.00 0.80 0.00 1.24 0.00 0.00 39.78 42.16 1ud1 n ASN 418 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 1ud1 h ASP 419 N 0.00 0.00 -2.25 1.20 2.03 -1.61 -3.28 116.42 112.51 1ud1 h ASP 419 Ca 0.00 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 55.72 1ud1 h ASP 419 Cb 0.00 0.00 -0.39 0.00 -0.83 0.00 0.00 39.33 38.11 1ud1 h ASP 419 CO 0.00 0.00 -0.94 0.35 -1.03 0.00 0.00 179.24 177.62 1ud1 n THR 420 N -3.07 -0.23 -1.94 1.15 -2.24 -1.26 -1.13 114.28 105.56 1ud1 n THR 420 Ca -0.00 -4.06 -0.39 0.00 -2.27 0.00 0.00 64.05 57.33 1ud1 n THR 420 Cb 0.25 -1.90 0.01 0.00 -2.10 0.00 0.00 70.33 66.60 1ud1 n THR 420 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1ud1 s PRO 421 N -0.98 3.59 -0.12 -0.78 0.04 -1.24 -4.97 135.00 130.54 1ud1 s PRO 421 Ca 0.34 2.17 0.02 0.00 0.04 0.00 0.00 61.00 63.57 1ud1 s PRO 421 Cb 0.10 -2.51 -0.00 0.00 0.04 0.00 0.00 34.50 32.14 1ud1 s PRO 421 CO -0.13 -0.81 -0.20 -1.64 0.04 0.00 0.00 177.00 174.26 1ud1 s MET 422 N -2.59 3.14 0.07 4.56 -1.94 -1.26 -5.03 119.30 116.25 1ud1 s MET 422 Ca 0.64 -0.82 0.07 0.00 -1.71 0.00 0.00 55.69 53.87 1ud1 s MET 422 Cb -0.38 -2.44 -0.04 0.00 2.01 0.00 0.00 34.83 33.98 1ud1 s MET 422 CO 0.48 0.12 -0.15 0.96 -0.01 0.00 0.00 175.02 176.42 1ud1 s ILE 423 N 0.51 3.02 -0.42 2.53 -4.36 -1.26 -0.56 121.20 120.66 1ud1 s ILE 423 Ca -0.13 -1.25 0.03 0.00 -0.26 0.00 0.00 60.65 59.04 1ud1 s ILE 423 Cb -0.17 -2.34 0.12 0.00 1.25 0.00 0.00 42.46 41.32 1ud1 s ILE 423 CO 0.05 0.22 0.16 -0.83 0.24 0.00 0.00 174.94 174.79 1ud1 s GLY 424 N -1.81 2.02 0.04 6.27 0.00 0.04 -4.93 107.32 108.96 1ud1 s GLY 424 Ca 0.17 -2.76 -0.30 0.00 0.00 0.00 0.00 44.72 41.83 1ud1 s GLY 424 CO 0.09 1.11 1.19 -1.08 0.00 0.00 0.00 173.10 174.41 1ud1 s THR 425 N 0.42 4.10 -0.38 0.90 -1.32 -1.26 -0.95 115.64 117.15 1ud1 s THR 425 Ca 0.14 1.50 0.23 0.00 -1.21 0.00 0.00 61.69 62.35 1ud1 s THR 425 Cb -0.22 -3.96 0.16 0.00 -1.51 0.00 0.00 72.50 66.97 1ud1 s THR 425 CO -0.05 0.10 1.34 -0.07 -2.21 0.00 0.00 174.62 173.72 1ud1 h LEU 426 N 7.03 0.00 -7.57 9.08 -0.00 -0.91 -2.33 115.31 120.60 1ud1 h LEU 426 Ca -0.40 -0.02 -0.31 0.00 -0.00 0.00 0.00 57.88 57.15 1ud1 h LEU 426 Cb 1.21 0.00 -0.34 0.00 -0.00 0.00 0.00 40.66 41.53 1ud1 h LEU 426 CO 0.82 0.01 -0.73 0.00 -0.00 0.00 0.00 178.44 178.53 1ud1 s ALA 427 N -3.27 0.15 0.00 1.53 0.00 -1.25 -4.33 121.76 114.59 1ud1 s ALA 427 Ca 0.04 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.24 1ud1 s ALA 427 Cb 0.08 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.95 1ud1 s ALA 427 CO 0.72 -0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.81 1ud1 n GLY 428 N 4.08 -0.61 0.19 0.00 0.00 -1.26 -4.69 105.19 102.90 1ud1 n GLY 428 Ca -0.27 -1.61 0.04 0.00 0.00 0.00 0.00 46.02 44.18 1ud1 n GLY 428 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ud1 h ALA 429 N 0.00 1.23 0.01 4.61 0.00 -1.63 -3.24 119.26 120.24 1ud1 h ALA 429 Ca 0.00 -0.35 -0.33 0.00 0.00 0.00 0.00 54.91 54.23 1ud1 h ALA 429 Cb 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1ud1 h ALA 429 CO 0.00 0.48 -2.01 0.27 0.00 0.00 0.00 179.25 178.00 1ud1 n ASN 430 N -3.89 0.75 -1.61 0.00 6.94 -1.26 -5.00 115.26 111.20 1ud1 n ASN 430 Ca -0.01 0.23 -0.15 0.00 -0.02 0.00 0.00 54.58 54.63 1ud1 n ASN 430 Cb 0.44 0.20 0.01 0.00 -2.36 0.00 0.00 39.78 38.08 1ud1 n ASN 430 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1ud1 n SER 431 N -3.00 -2.34 -0.15 0.53 3.41 -1.23 -4.74 113.62 106.10 1ud1 n SER 431 Ca -0.25 0.09 -0.09 0.00 -0.26 0.00 0.00 58.87 58.36 1ud1 n SER 431 Cb 1.08 -0.31 -0.00 0.00 -0.26 0.00 0.00 64.21 64.73 1ud1 n SER 431 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1ud1 h LEU 432 N -0.37 0.63 -1.38 1.04 4.07 -1.64 -2.73 115.31 114.94 1ud1 h LEU 432 Ca -0.18 -0.19 -0.03 0.00 0.08 0.00 0.00 57.88 57.56 1ud1 h LEU 432 Cb 0.53 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 42.08 1ud1 h LEU 432 CO 0.10 0.66 0.10 -0.07 -1.08 0.00 0.00 178.44 178.14 1ud1 h LEU 433 N 0.57 0.47 -1.19 1.67 3.38 -1.85 -2.44 115.31 115.92 1ud1 h LEU 433 Ca 0.14 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1ud1 h LEU 433 Cb 0.24 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1ud1 h LEU 433 CO -0.01 0.47 0.40 0.78 0.09 0.00 0.00 178.44 180.17 1ud1 h ASN 434 N 0.51 0.84 1.30 -0.43 -0.26 -1.81 -1.39 115.58 114.34 1ud1 h ASN 434 Ca 0.12 -0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.81 1ud1 h ASN 434 Cb 0.18 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.23 1ud1 h ASN 434 CO -0.01 0.67 -0.02 0.00 -1.06 0.00 0.00 177.43 177.01 1ud1 n ALA 435 N -2.43 2.33 -2.59 -0.83 0.00 -0.94 -4.74 120.51 111.30 1ud1 n ALA 435 Ca 0.07 -0.06 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 1ud1 n ALA 435 Cb 0.09 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.05 1ud1 n ALA 435 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ud1 s LEU 436 N -4.01 4.33 0.27 0.00 1.43 -0.53 -5.02 118.68 115.15 1ud1 s LEU 436 Ca 0.12 1.74 -0.26 0.00 -1.03 0.00 0.00 54.13 54.69 1ud1 s LEU 436 Cb 0.15 -3.57 -0.16 0.00 0.03 0.00 0.00 46.19 42.64 1ud1 s LEU 436 CO 0.58 -0.41 0.55 -2.65 0.23 0.00 0.00 176.35 174.65 1ud1 n PRO 437 N 4.38 0.31 -0.06 1.29 -0.02 -1.26 -4.78 135.00 134.85 1ud1 n PRO 437 Ca 0.08 0.11 0.04 0.00 -2.02 0.00 0.00 63.50 61.71 1ud1 n PRO 437 Cb 0.49 -1.21 0.40 0.00 -0.02 0.00 0.00 33.50 33.16 1ud1 n PRO 437 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ud1 h GLU 438 N 1.05 0.61 -0.08 -0.52 4.81 -1.94 -0.45 114.58 118.06 1ud1 h GLU 438 Ca -0.33 -0.04 -0.24 0.00 -0.13 0.00 0.00 59.36 58.63 1ud1 h GLU 438 Cb 1.42 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 30.67 1ud1 h GLU 438 CO 0.55 0.41 -0.89 1.49 -0.73 0.00 0.00 179.01 179.85 1ud1 h GLU 439 N 0.63 0.70 0.00 1.92 4.81 -1.97 -1.50 114.58 119.18 1ud1 h GLU 439 Ca 0.20 -0.64 -0.08 0.00 -0.13 0.00 0.00 59.36 58.71 1ud1 h GLU 439 Cb 0.02 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1ud1 h GLU 439 CO -0.05 1.25 -0.38 -0.39 -0.73 0.00 0.00 179.01 178.71 1ud1 h VAL 440 N 0.44 0.75 0.00 0.32 -1.51 -1.78 -2.04 116.25 112.43 1ud1 h VAL 440 Ca -0.08 -1.71 -0.19 0.00 -1.23 0.00 0.00 66.70 63.49 1ud1 h VAL 440 Cb 1.52 2.12 -0.01 0.00 -2.13 0.00 0.00 31.29 32.78 1ud1 h VAL 440 CO 0.17 0.37 -0.85 -0.29 -1.23 0.00 0.00 177.57 175.74 1ud1 h ILE 441 N 0.00 1.51 0.18 7.19 2.10 -1.07 -1.48 117.51 125.93 1ud1 h ILE 441 Ca -0.00 -2.63 -0.01 0.00 1.08 0.00 0.00 64.86 63.30 1ud1 h ILE 441 Cb 1.09 2.46 -0.00 0.00 -1.09 0.00 0.00 36.82 39.27 1ud1 h ILE 441 CO 0.05 0.76 -0.10 1.56 -1.08 0.00 0.00 178.15 179.34 1ud1 h GLN 442 N 0.09 -0.25 0.00 2.19 4.20 -0.70 -2.11 115.11 118.53 1ud1 h GLN 442 Ca -0.04 0.02 -0.07 0.00 0.06 0.00 0.00 58.65 58.62 1ud1 h GLN 442 Cb 1.48 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.30 1ud1 h GLN 442 CO 0.13 -0.17 -0.34 0.45 -0.67 0.00 0.00 178.83 178.23 1ud1 h HIS 443 N -0.26 0.00 0.00 2.96 3.86 -1.31 0.25 115.15 120.65 1ud1 h HIS 443 Ca -0.02 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.12 1ud1 h HIS 443 Cb 0.21 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.67 1ud1 h HIS 443 CO -0.08 0.34 -0.65 1.79 0.86 0.00 0.00 177.93 180.19 1ud1 h THR 444 N 0.00 0.41 -0.33 2.45 1.35 -1.06 -3.34 112.91 112.39 1ud1 h THR 444 Ca -0.00 -1.64 0.00 0.00 -0.55 0.00 0.00 66.41 64.22 1ud1 h THR 444 Cb 0.72 2.07 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 1ud1 h THR 444 CO 0.04 0.23 0.00 0.49 -0.25 0.00 0.00 175.52 176.04 1ud1 n PHE 445 N -3.02 0.50 -3.50 4.73 3.72 -0.81 -5.01 117.46 114.07 1ud1 n PHE 445 Ca -0.00 -0.54 -0.15 0.00 -0.05 0.00 0.00 57.45 56.70 1ud1 n PHE 445 Cb 0.67 -0.06 0.00 0.00 -0.94 0.00 0.00 39.48 39.16 1ud1 n PHE 445 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1ud1 n ASN 446 N 0.39 -6.06 -4.13 4.37 5.15 0.75 -5.01 115.26 110.72 1ud1 n ASN 446 Ca 0.12 -0.62 -0.09 0.00 -0.60 0.00 0.00 54.58 53.40 1ud1 n ASN 446 Cb 0.47 -3.24 -0.10 0.00 -0.53 0.00 0.00 39.78 36.38 1ud1 n ASN 446 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ud1 s LEU 447 N -4.70 2.38 0.38 1.20 1.43 -0.50 -5.05 118.68 113.82 1ud1 s LEU 447 Ca 0.04 -1.04 -0.06 0.00 -1.03 0.00 0.00 54.13 52.03 1ud1 s LEU 447 Cb -0.01 0.11 -0.05 0.00 0.03 0.00 0.00 46.19 46.26 1ud1 s LEU 447 CO 0.84 -0.57 0.68 -0.54 0.23 0.00 0.00 176.35 176.99 1ud1 s LYS 448 N -3.91 3.65 0.20 1.70 1.02 -1.26 -4.64 119.74 116.50 1ud1 s LYS 448 Ca 0.12 0.18 -0.15 0.00 0.02 0.00 0.00 55.97 56.13 1ud1 s LYS 448 Cb 0.07 -2.50 0.20 0.00 -0.52 0.00 0.00 37.83 35.09 1ud1 s LYS 448 CO -0.06 0.02 1.62 1.03 -0.92 0.00 0.00 175.35 177.04 1ud1 h SER 449 N 1.10 -0.68 0.12 2.83 0.87 -1.98 -0.09 113.55 115.72 1ud1 h SER 449 Ca -0.47 0.19 -0.02 0.00 -1.23 0.00 0.00 61.79 60.26 1ud1 h SER 449 Cb 1.20 0.41 -0.00 0.00 -0.44 0.00 0.00 62.40 63.57 1ud1 h SER 449 CO 0.64 -0.23 -0.10 -0.61 -0.53 0.00 0.00 176.83 176.01 1ud1 h GLN 450 N -0.04 0.00 0.00 2.24 -0.00 -1.98 -0.98 115.11 114.35 1ud1 h GLN 450 Ca 0.28 0.00 -0.20 0.00 -0.00 0.00 0.00 58.65 58.73 1ud1 h GLN 450 Cb 0.47 0.00 -0.03 0.00 0.00 0.00 0.00 27.48 27.92 1ud1 h GLN 450 CO -0.63 0.10 -1.02 1.96 0.00 0.00 0.00 178.83 179.23 1ud1 h GLN 451 N 0.00 0.00 -0.54 1.69 4.20 -1.53 -3.26 115.11 115.67 1ud1 h GLN 451 Ca -0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 1ud1 h GLN 451 Cb 0.18 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 1ud1 h GLN 451 CO 0.01 0.78 0.06 0.00 -0.67 0.00 0.00 178.83 179.01 1ud1 h ALA 452 N 1.13 0.72 -0.42 3.87 0.00 0.13 -2.37 119.26 122.33 1ud1 h ALA 452 Ca -0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1ud1 h ALA 452 Cb 1.71 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1ud1 h ALA 452 CO 0.10 0.48 0.19 0.00 0.00 0.00 0.00 179.25 180.02 1ud1 h ARG 453 N 0.79 0.58 -0.70 0.00 3.08 -1.29 -1.43 114.38 115.41 1ud1 h ARG 453 Ca 0.16 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1ud1 h ARG 453 Cb 0.44 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 1ud1 h ARG 453 CO 0.01 0.46 0.46 1.96 -1.07 0.00 0.00 179.97 181.79 1ud1 h GLN 454 N 0.58 0.93 -0.56 0.04 4.20 -1.48 0.13 115.11 118.96 1ud1 h GLN 454 Ca 0.15 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 1ud1 h GLN 454 Cb 0.08 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 1ud1 h GLN 454 CO -0.02 0.63 0.05 0.82 -0.67 0.00 0.00 178.83 179.64 1ud1 h ILE 455 N 0.95 1.26 0.00 2.54 2.04 -0.98 -0.48 117.51 122.84 1ud1 h ILE 455 Ca 0.26 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1ud1 h ILE 455 Cb -0.09 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 1ud1 h ILE 455 CO -0.05 0.37 0.00 0.29 0.00 0.00 0.00 178.15 178.76 1ud1 n LYS 456 N -4.31 0.03 0.00 2.37 5.02 -0.84 -4.51 118.16 115.92 1ud1 n LYS 456 Ca 0.02 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1ud1 n LYS 456 Cb 0.30 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 1ud1 n LYS 456 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ud1 n ASN 457 N -1.48 0.62 0.08 4.39 3.02 -0.01 -4.90 115.26 116.98 1ud1 n ASN 457 Ca 0.07 -0.04 -0.13 0.00 -0.03 0.00 0.00 54.58 54.45 1ud1 n ASN 457 Cb 0.33 0.21 -0.06 0.00 -0.61 0.00 0.00 39.78 39.64 1ud1 n ASN 457 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1ud1 h ASN 458 N 0.00 -1.15 -3.30 6.41 4.21 -1.28 -3.36 115.58 117.10 1ud1 h ASN 458 Ca 0.00 0.14 -0.61 0.00 1.21 0.00 0.00 56.30 57.04 1ud1 h ASN 458 Cb 0.00 0.45 -0.12 0.00 -1.12 0.00 0.00 38.32 37.52 1ud1 h ASN 458 CO 0.00 -0.45 0.54 0.21 -1.29 0.00 0.00 177.43 176.44 1ud1 s ASN 459 N -4.77 6.37 -0.01 5.81 2.47 -1.26 -4.92 114.94 118.62 1ud1 s ASN 459 Ca -0.16 -0.28 0.16 0.00 0.42 0.00 0.00 52.86 53.01 1ud1 s ASN 459 Cb 0.08 -2.43 0.49 0.00 -1.45 0.00 0.00 41.25 37.94 1ud1 s ASN 459 CO 0.64 -1.17 1.40 -0.81 -3.72 0.00 0.00 177.10 173.44 1ud1 n PRO 460 N 7.33 2.36 -3.95 0.43 -0.04 -1.26 -4.30 135.00 135.57 1ud1 n PRO 460 Ca 0.02 -1.98 -0.33 0.00 -0.04 0.00 0.00 63.50 61.17 1ud1 n PRO 460 Cb 0.48 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 1ud1 n PRO 460 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1ud1 s PHE 461 N -1.34 3.49 -0.22 0.54 0.08 -1.26 -4.59 117.98 114.69 1ud1 s PHE 461 Ca 0.37 0.33 -0.21 0.00 0.12 0.00 0.00 56.93 57.54 1ud1 s PHE 461 Cb 0.20 -1.81 -0.02 0.00 -0.57 0.00 0.00 43.02 40.81 1ud1 s PHE 461 CO 0.24 0.63 0.63 0.21 -0.10 0.00 0.00 175.22 176.83 1ud1 s LYS 462 N -1.86 4.17 0.00 0.44 2.36 -1.26 -2.22 119.74 121.37 1ud1 s LYS 462 Ca 0.26 0.60 0.00 0.00 -2.55 0.00 0.00 55.97 54.28 1ud1 s LYS 462 Cb -0.12 -3.61 0.00 0.00 -1.05 0.00 0.00 37.83 33.05 1ud1 s LYS 462 CO 0.17 -0.32 0.00 0.34 1.55 0.00 0.00 175.35 177.09 1ud1 n PHE 463 N 5.34 0.00 -4.98 4.03 7.35 -1.26 -4.84 117.46 123.10 1ud1 n PHE 463 Ca -0.01 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.36 1ud1 n PHE 463 Cb 0.49 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 40.18 1ud1 n PHE 463 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1ud1 s LEU 464 N 0.00 2.55 -0.09 -2.13 1.02 -1.26 -1.81 118.68 116.95 1ud1 s LEU 464 Ca 0.00 -0.30 0.03 0.00 0.02 0.00 0.00 54.13 53.88 1ud1 s LEU 464 Cb 0.00 -1.51 0.01 0.00 0.02 0.00 0.00 46.19 44.71 1ud1 s LEU 464 CO 0.00 0.30 -0.19 0.54 0.02 0.00 0.00 176.35 177.02 1ud1 s VAL 465 N -0.46 1.67 1.10 -1.59 0.11 -0.59 -4.68 120.40 115.96 1ud1 s VAL 465 Ca 0.06 -0.78 -0.18 0.00 -2.93 0.00 0.00 61.98 58.15 1ud1 s VAL 465 Cb -0.12 -1.48 0.10 0.00 -1.53 0.00 0.00 36.38 33.36 1ud1 s VAL 465 CO 0.02 0.47 0.10 -2.65 -3.33 0.00 0.00 175.10 169.71 1ud1 n PRO 466 N 3.75 -1.47 -1.55 1.54 -0.02 -1.26 -1.90 135.00 134.09 1ud1 n PRO 466 Ca -0.20 -0.41 -0.35 0.00 -2.02 0.00 0.00 63.50 60.52 1ud1 n PRO 466 Cb 0.52 -1.74 0.08 0.00 -0.02 0.00 0.00 33.50 32.35 1ud1 n PRO 466 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1ud1 s PRO 467 N -3.51 2.30 0.57 0.52 0.02 -1.26 -4.58 135.00 129.06 1ud1 s PRO 467 Ca 0.57 1.82 0.34 0.00 0.02 0.00 0.00 61.00 63.75 1ud1 s PRO 467 Cb -0.14 -1.84 1.43 0.00 0.02 0.00 0.00 34.50 33.97 1ud1 s PRO 467 CO 0.66 -1.73 1.72 0.37 -0.33 0.00 0.00 177.00 177.69 1ud1 h GLN 468 N -0.02 0.00 -3.99 5.54 4.15 -1.92 -3.46 115.11 115.42 1ud1 h GLN 468 Ca -0.49 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1ud1 h GLN 468 Cb 1.30 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.97 1ud1 h GLN 468 CO 0.51 0.00 -0.58 0.39 -1.93 0.00 0.00 178.83 177.22 1ud1 n GLU 469 N -3.84 -1.87 0.00 1.69 4.71 -1.26 -5.23 120.64 114.84 1ud1 n GLU 469 Ca 0.21 1.72 0.03 0.00 -0.01 0.00 0.00 57.16 59.11 1ud1 n GLU 469 Cb 1.19 -3.04 0.02 0.00 -1.01 0.00 0.00 31.44 28.61 1ud1 n GLU 469 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65