#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hu1 h SER 13 N 0.00 0.00 0.00 1.45 4.64 -2.06 -3.34 113.55 114.24 3hu1 h SER 13 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hu1 h SER 13 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3hu1 h SER 13 CO 0.00 0.70 0.00 1.07 -0.87 0.00 0.00 176.83 177.73 3hu1 n THR 14 N -3.26 0.00 0.02 2.95 5.66 -1.26 -4.25 114.28 114.14 3hu1 n THR 14 Ca 0.01 0.00 0.16 0.00 -3.05 0.00 0.00 64.05 61.17 3hu1 n THR 14 Cb 0.82 -0.64 0.64 0.00 -1.55 0.00 0.00 70.33 69.59 3hu1 n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hu1 h ALA 15 N 2.49 2.30 0.00 1.79 0.00 -2.00 -1.80 119.26 122.03 3hu1 h ALA 15 Ca 0.00 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3hu1 h ALA 15 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3hu1 h ALA 15 CO 0.00 -0.42 -0.26 0.97 0.00 0.00 0.00 179.25 179.53 3hu1 h ILE 16 N 0.10 1.08 0.00 0.00 2.10 -1.92 -3.09 117.51 115.77 3hu1 h ILE 16 Ca 0.22 -0.94 -0.09 0.00 1.08 0.00 0.00 64.86 65.13 3hu1 h ILE 16 Cb 0.73 1.52 -0.01 0.00 -1.09 0.00 0.00 36.82 37.97 3hu1 h ILE 16 CO -0.02 0.26 -0.44 -0.07 -1.08 0.00 0.00 178.15 176.80 3hu1 h LEU 17 N 0.00 0.00 -9.69 2.19 3.38 -1.67 -3.46 115.31 106.06 3hu1 h LEU 17 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 3hu1 h LEU 17 Cb 0.50 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.35 3hu1 h LEU 17 CO 0.03 0.44 0.56 1.17 0.09 0.00 0.00 178.44 180.73 3hu1 n LYS 18 N -3.41 2.12 -0.07 1.13 4.81 -1.17 -4.95 118.16 116.62 3hu1 n LYS 18 Ca 0.01 0.75 -0.14 0.00 -0.87 0.00 0.00 58.31 58.05 3hu1 n LYS 18 Cb 0.60 -2.36 -0.02 0.00 0.02 0.00 0.00 35.03 33.26 3hu1 n LYS 18 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 3hu1 h GLN 19 N 3.28 0.83 -3.13 1.64 7.50 -1.91 -3.51 115.11 119.82 3hu1 h GLN 19 Ca -0.46 -0.52 0.00 0.00 0.50 0.00 0.00 58.65 58.17 3hu1 h GLN 19 Cb 1.28 0.06 0.00 0.00 0.05 0.00 0.00 27.48 28.87 3hu1 h GLN 19 CO 0.68 1.16 -0.70 1.63 -1.50 0.00 0.00 178.83 180.09 3hu1 n LYS 20 N -4.00 -3.92 -2.65 1.46 4.01 -1.26 -4.95 118.16 106.86 3hu1 n LYS 20 Ca -0.04 2.85 -0.42 0.00 -0.51 0.00 0.00 58.31 60.19 3hu1 n LYS 20 Cb 0.62 -3.08 -0.04 0.00 -0.51 0.00 0.00 35.03 32.03 3hu1 n LYS 20 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 3hu1 s ASN 21 N -1.38 7.36 0.08 4.39 0.01 -1.26 -5.01 114.94 119.12 3hu1 s ASN 21 Ca 0.00 1.82 0.03 0.00 -0.71 0.00 0.00 52.86 54.00 3hu1 s ASN 21 Cb 0.00 -2.58 -0.03 0.00 0.41 0.00 0.00 41.25 39.05 3hu1 s ASN 21 CO 0.00 -0.22 -0.09 -0.13 -1.51 0.00 0.00 177.10 175.15 3hu1 s ARG 22 N 0.49 0.73 0.31 -0.60 1.81 -1.26 -5.05 118.95 115.38 3hu1 s ARG 22 Ca 0.51 -1.04 0.07 0.00 -1.72 0.00 0.00 55.73 53.55 3hu1 s ARG 22 Cb -0.24 -0.39 0.87 0.00 -0.45 0.00 0.00 34.95 34.74 3hu1 s ARG 22 CO 0.30 0.05 1.66 -1.35 -0.68 0.00 0.00 175.30 175.28 3hu1 h PRO 23 N 3.80 0.29 -0.52 3.54 0.10 -2.00 -2.73 132.00 134.49 3hu1 h PRO 23 Ca -0.37 -0.02 0.00 0.00 0.10 0.00 0.00 66.00 65.72 3hu1 h PRO 23 Cb 1.19 -0.07 0.00 0.00 0.10 0.00 0.00 31.00 32.22 3hu1 h PRO 23 CO 0.50 0.19 0.00 0.27 0.10 0.00 0.00 178.00 179.07 3hu1 n ASN 24 N -5.12 3.27 -4.39 -2.05 6.94 -1.26 -4.79 115.26 107.86 3hu1 n ASN 24 Ca 0.26 -1.97 -0.44 0.00 -0.02 0.00 0.00 54.58 52.40 3hu1 n ASN 24 Cb 0.80 -0.34 -0.08 0.00 -2.36 0.00 0.00 39.78 37.80 3hu1 n ASN 24 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 3hu1 s ARG 25 N -1.32 2.97 0.12 -3.83 3.52 -1.03 -1.67 118.95 117.72 3hu1 s ARG 25 Ca 0.41 -1.34 0.10 0.00 -0.13 0.00 0.00 55.73 54.77 3hu1 s ARG 25 Cb 0.22 -4.12 -0.04 0.00 -1.56 0.00 0.00 34.95 29.45 3hu1 s ARG 25 CO 0.30 -1.01 -0.26 -0.51 -0.81 0.00 0.00 175.30 173.01 3hu1 s LEU 26 N 1.64 2.31 0.05 -0.88 1.43 -0.71 -4.68 118.68 117.85 3hu1 s LEU 26 Ca 0.04 -0.73 -0.26 0.00 -1.03 0.00 0.00 54.13 52.15 3hu1 s LEU 26 Cb -0.24 -1.15 -0.05 0.00 0.03 0.00 0.00 46.19 44.78 3hu1 s LEU 26 CO 0.07 0.15 0.79 -0.63 0.23 0.00 0.00 176.35 176.96 3hu1 s ILE 27 N -1.08 4.71 -0.05 -0.59 1.01 -0.99 -1.10 121.20 123.11 3hu1 s ILE 27 Ca 0.12 1.69 -0.30 0.00 0.00 0.00 0.00 60.65 62.16 3hu1 s ILE 27 Cb -0.10 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.20 3hu1 s ILE 27 CO 0.06 0.35 1.13 0.68 0.00 0.00 0.00 174.94 177.16 3hu1 s VAL 28 N -0.00 4.42 0.28 2.92 -7.23 -0.35 -1.21 120.40 119.23 3hu1 s VAL 28 Ca 0.40 1.73 0.12 0.00 -1.81 0.00 0.00 61.98 62.42 3hu1 s VAL 28 Cb -0.21 -4.11 -0.05 0.00 0.56 0.00 0.00 36.38 32.57 3hu1 s VAL 28 CO 0.24 0.03 -0.19 -0.62 -0.31 0.00 0.00 175.10 174.25 3hu1 s ASP 29 N 1.28 3.65 0.40 4.85 3.68 0.18 -1.97 116.67 128.74 3hu1 s ASP 29 Ca 0.54 -1.00 -0.27 0.00 2.13 0.00 0.00 52.55 53.95 3hu1 s ASP 29 Cb -0.23 -0.33 -0.09 0.00 -1.45 0.00 0.00 42.92 40.81 3hu1 s ASP 29 CO 0.22 0.04 1.36 -0.70 0.13 0.00 0.00 175.17 176.23 3hu1 s GLU 30 N -3.51 4.00 0.26 4.34 2.56 -1.26 -2.49 118.70 122.61 3hu1 s GLU 30 Ca 0.30 2.30 -0.25 0.00 0.00 0.00 0.00 54.97 57.32 3hu1 s GLU 30 Cb -0.05 -2.83 -0.09 0.00 2.00 0.00 0.00 34.13 33.16 3hu1 s GLU 30 CO 0.15 -0.52 0.87 0.00 -0.56 0.00 0.00 175.26 175.20 3hu1 s ALA 31 N -1.20 3.31 -0.09 6.30 0.00 -1.22 -4.50 121.76 124.37 3hu1 s ALA 31 Ca 0.56 0.43 -0.04 0.00 0.00 0.00 0.00 51.96 52.91 3hu1 s ALA 31 Cb -0.41 -3.07 -0.26 0.00 0.00 0.00 0.00 23.12 19.38 3hu1 s ALA 31 CO 0.54 0.23 0.50 -0.84 0.00 0.00 0.00 175.76 176.19 3hu1 h ILE 32 N 2.82 0.74 -3.24 0.00 3.07 -1.94 -3.44 117.51 115.52 3hu1 h ILE 32 Ca -0.47 -2.46 -0.61 0.00 1.55 0.00 0.00 64.86 62.87 3hu1 h ILE 32 Cb 1.20 2.55 -0.12 0.00 -0.27 0.00 0.00 36.82 40.17 3hu1 h ILE 32 CO 0.66 0.82 0.55 0.21 -1.05 0.00 0.00 178.15 179.33 3hu1 s ASN 33 N -6.90 6.35 -0.21 2.16 3.84 -1.26 -4.94 114.94 113.97 3hu1 s ASN 33 Ca -0.17 -0.33 0.03 0.00 0.21 0.00 0.00 52.86 52.60 3hu1 s ASN 33 Cb 0.07 -2.43 0.36 0.00 -0.55 0.00 0.00 41.25 38.70 3hu1 s ASN 33 CO 0.80 -1.20 1.41 -0.62 -2.79 0.00 0.00 177.10 174.70 3hu1 n GLU 34 N 7.39 1.91 -3.05 0.43 1.02 -1.26 -4.66 120.64 122.43 3hu1 n GLU 34 Ca 0.02 -1.57 -0.39 0.00 -0.02 0.00 0.00 57.16 55.20 3hu1 n GLU 34 Cb 0.47 -1.66 -0.05 0.00 -0.02 0.00 0.00 31.44 30.18 3hu1 n GLU 34 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3hu1 s ASP 35 N -0.23 7.21 0.59 1.62 2.15 -1.26 -4.97 116.67 121.79 3hu1 s ASP 35 Ca 0.29 1.44 0.28 0.00 0.43 0.00 0.00 52.55 55.00 3hu1 s ASP 35 Cb 0.24 -2.45 1.72 0.00 -0.30 0.00 0.00 42.92 42.13 3hu1 s ASP 35 CO 0.06 0.11 2.18 0.78 -0.17 0.00 0.00 175.17 178.14 3hu1 h ASN 36 N 5.15 0.00 0.00 -0.34 2.35 -1.94 -2.79 115.58 118.00 3hu1 h ASN 36 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3hu1 h ASN 36 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 3hu1 h ASN 36 CO 0.68 0.00 -0.06 -1.20 -1.65 0.00 0.00 177.43 175.21 3hu1 n SER 37 N -3.87 2.04 -4.43 5.81 7.64 -1.26 -4.70 113.62 114.84 3hu1 n SER 37 Ca -0.01 -1.63 -0.33 0.00 1.01 0.00 0.00 58.87 57.92 3hu1 n SER 37 Cb 0.19 0.05 -0.14 0.00 -1.01 0.00 0.00 64.21 63.30 3hu1 n SER 37 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3hu1 s VAL 38 N -2.08 3.01 0.01 0.44 0.11 -1.06 0.01 120.40 120.85 3hu1 s VAL 38 Ca 0.32 -0.72 0.06 0.00 -2.93 0.00 0.00 61.98 58.71 3hu1 s VAL 38 Cb 0.20 -2.20 -0.02 0.00 -1.53 0.00 0.00 36.38 32.83 3hu1 s VAL 38 CO 0.36 0.57 -0.19 0.68 -3.33 0.00 0.00 175.10 173.19 3hu1 s VAL 39 N -0.38 1.51 -0.08 2.04 -7.23 -0.76 -4.66 120.40 110.85 3hu1 s VAL 39 Ca 0.04 -0.98 0.01 0.00 -1.81 0.00 0.00 61.98 59.24 3hu1 s VAL 39 Cb -0.12 -1.29 -0.03 0.00 0.56 0.00 0.00 36.38 35.50 3hu1 s VAL 39 CO 0.02 0.29 -0.08 -0.44 -0.31 0.00 0.00 175.10 174.58 3hu1 s SER 40 N -0.81 4.54 0.08 4.85 0.01 -0.59 -1.48 113.70 120.31 3hu1 s SER 40 Ca 0.07 -0.07 0.04 0.00 1.31 0.00 0.00 55.95 57.29 3hu1 s SER 40 Cb -0.08 -1.21 -0.03 0.00 0.21 0.00 0.00 66.02 64.91 3hu1 s SER 40 CO 0.01 0.33 -0.10 -0.76 0.41 0.00 0.00 173.24 173.13 3hu1 s LEU 41 N -0.63 2.36 0.46 2.44 1.43 -0.63 -1.40 118.68 122.71 3hu1 s LEU 41 Ca 0.09 -0.74 -0.24 0.00 -1.03 0.00 0.00 54.13 52.22 3hu1 s LEU 41 Cb -0.11 -0.30 -0.07 0.00 0.03 0.00 0.00 46.19 45.73 3hu1 s LEU 41 CO 0.02 -0.23 1.22 -0.94 0.23 0.00 0.00 176.35 176.65 3hu1 s SER 42 N -2.19 6.08 0.26 2.29 1.04 -1.25 -0.21 113.70 119.72 3hu1 s SER 42 Ca 0.01 2.45 -0.04 0.00 0.48 0.00 0.00 55.95 58.86 3hu1 s SER 42 Cb -0.05 -2.62 0.36 0.00 0.10 0.00 0.00 66.02 63.81 3hu1 s SER 42 CO 0.00 -0.99 1.89 -0.61 0.98 0.00 0.00 173.24 174.51 3hu1 h GLN 43 N 2.13 1.14 -0.37 4.02 5.75 -1.91 -2.11 115.11 123.76 3hu1 h GLN 43 Ca -0.50 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 57.92 3hu1 h GLN 43 Cb 1.25 -0.26 -0.02 0.00 1.07 0.00 0.00 27.48 29.53 3hu1 h GLN 43 CO 0.60 0.76 0.18 -1.35 -2.65 0.00 0.00 178.83 176.37 3hu1 h PRO 44 N 1.18 0.51 -0.09 -2.39 0.11 -1.96 -2.80 132.00 126.55 3hu1 h PRO 44 Ca 0.41 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.32 3hu1 h PRO 44 Cb 0.09 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 3hu1 h PRO 44 CO -0.15 0.39 -0.57 -0.22 -0.21 0.00 0.00 178.00 177.24 3hu1 h LYS 45 N 0.51 0.29 -0.31 1.05 1.63 -1.67 -2.19 116.57 115.88 3hu1 h LYS 45 Ca 0.13 -0.19 -0.12 0.00 -0.85 0.00 0.00 60.65 59.63 3hu1 h LYS 45 Cb 0.05 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.69 3hu1 h LYS 45 CO -0.02 0.78 -0.29 0.52 -3.45 0.00 0.00 179.45 176.99 3hu1 h MET 46 N 0.22 0.64 -0.10 1.90 2.86 -1.25 -2.59 114.93 116.61 3hu1 h MET 46 Ca -0.00 -0.28 -0.14 0.00 -2.06 0.00 0.00 59.70 57.22 3hu1 h MET 46 Cb 1.07 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.70 3hu1 h MET 46 CO 0.09 0.86 -0.56 -0.44 1.06 0.00 0.00 176.91 177.92 3hu1 h ASP 47 N 0.55 0.34 0.27 1.22 3.45 -1.37 0.18 116.42 121.04 3hu1 h ASP 47 Ca 0.07 -0.18 -0.10 0.00 0.43 0.00 0.00 57.03 57.24 3hu1 h ASP 47 Cb 0.78 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.44 3hu1 h ASP 47 CO 0.06 0.83 -0.41 -0.08 -1.57 0.00 0.00 179.24 178.07 3hu1 h GLU 48 N 0.23 0.20 -0.53 3.56 4.81 -1.23 -3.14 114.58 118.48 3hu1 h GLU 48 Ca 0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3hu1 h GLU 48 Cb 1.06 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.43 3hu1 h GLU 48 CO 0.09 0.58 0.00 1.28 -0.73 0.00 0.00 179.01 180.23 3hu1 n LEU 49 N -4.03 3.67 -3.86 1.64 4.77 -0.99 -4.97 117.00 113.23 3hu1 n LEU 49 Ca -0.02 -1.70 -0.28 0.00 -0.03 0.00 0.00 56.01 53.99 3hu1 n LEU 49 Cb 0.47 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3hu1 n LEU 49 CO 0.41 0.84 -0.17 0.00 -1.33 0.00 0.00 177.39 177.14 3hu1 n GLN 50 N 1.56 -2.53 -3.86 3.23 6.02 -1.09 -4.93 117.38 115.78 3hu1 n GLN 50 Ca 0.21 0.41 -0.36 0.00 -0.01 0.00 0.00 57.00 57.26 3hu1 n GLN 50 Cb 0.62 -4.32 -0.13 0.00 1.02 0.00 0.00 30.24 27.43 3hu1 n GLN 50 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3hu1 s LEU 51 N -6.82 4.05 0.83 1.08 1.43 0.60 -5.04 118.68 114.80 3hu1 s LEU 51 Ca 0.18 -1.26 -0.12 0.00 -1.03 0.00 0.00 54.13 51.90 3hu1 s LEU 51 Cb -0.07 -1.76 0.09 0.00 0.03 0.00 0.00 46.19 44.48 3hu1 s LEU 51 CO 0.88 -0.29 1.10 -0.36 0.23 0.00 0.00 176.35 177.91 3hu1 s PHE 52 N 1.29 2.70 0.33 0.29 2.99 -1.26 -4.48 117.98 119.84 3hu1 s PHE 52 Ca -0.04 1.15 -0.29 0.00 0.00 0.00 0.00 56.93 57.76 3hu1 s PHE 52 Cb -0.20 -3.15 -0.10 0.00 0.00 0.00 0.00 43.02 39.57 3hu1 s PHE 52 CO -0.00 -1.95 1.26 0.50 -0.00 0.00 0.00 175.22 175.03 3hu1 s ARG 53 N -5.12 4.37 -1.20 0.44 3.52 -1.26 -3.39 118.95 116.31 3hu1 s ARG 53 Ca 0.62 2.12 0.00 0.00 -0.13 0.00 0.00 55.73 58.33 3hu1 s ARG 53 Cb -0.15 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.18 3hu1 s ARG 53 CO 0.55 -0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.31 3hu1 n GLY 54 N 0.85 1.25 3.79 8.12 0.00 0.12 -5.00 105.19 114.32 3hu1 n GLY 54 Ca 0.00 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.18 3hu1 n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu1 s ASP 55 N -2.86 7.05 -0.03 1.61 1.01 -1.22 -4.73 116.67 117.50 3hu1 s ASP 55 Ca 0.00 1.86 -0.30 0.00 0.71 0.00 0.00 52.55 54.82 3hu1 s ASP 55 Cb 0.00 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.32 3hu1 s ASP 55 CO 0.00 -0.28 1.13 0.42 0.21 0.00 0.00 175.17 176.64 3hu1 s THR 56 N -1.77 4.41 0.16 -1.27 -4.23 -1.26 -1.38 115.64 110.30 3hu1 s THR 56 Ca 0.56 1.72 0.10 0.00 -1.18 0.00 0.00 61.69 62.89 3hu1 s THR 56 Cb -0.17 -4.11 -0.04 0.00 1.34 0.00 0.00 72.50 69.52 3hu1 s THR 56 CO 0.22 0.06 -0.22 0.68 -0.54 0.00 0.00 174.62 174.82 3hu1 s VAL 57 N 1.69 2.04 -0.18 2.29 -7.23 0.16 -2.13 120.40 117.06 3hu1 s VAL 57 Ca 0.54 -1.88 -0.04 0.00 -1.81 0.00 0.00 61.98 58.79 3hu1 s VAL 57 Cb -0.24 -1.91 -0.03 0.00 0.56 0.00 0.00 36.38 34.76 3hu1 s VAL 57 CO 0.24 -0.16 -0.02 -0.22 -0.31 0.00 0.00 175.10 174.64 3hu1 s LEU 58 N -2.48 3.29 -0.06 1.32 2.96 0.20 -1.71 118.68 122.20 3hu1 s LEU 58 Ca 0.16 -0.14 0.03 0.00 -0.22 0.00 0.00 54.13 53.95 3hu1 s LEU 58 Cb -0.08 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 3hu1 s LEU 58 CO 0.07 0.13 -0.13 -0.76 -1.32 0.00 0.00 176.35 174.34 3hu1 s LEU 59 N 0.62 2.80 -0.13 -0.68 1.43 -0.27 -0.08 118.68 122.37 3hu1 s LEU 59 Ca -0.01 -0.18 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 3hu1 s LEU 59 Cb -0.14 -1.58 0.01 0.00 0.03 0.00 0.00 46.19 44.51 3hu1 s LEU 59 CO 0.02 0.34 -0.21 -0.54 0.23 0.00 0.00 176.35 176.19 3hu1 s LYS 60 N -0.68 2.85 0.00 1.70 1.02 -1.00 -1.94 119.74 121.69 3hu1 s LYS 60 Ca 0.10 -0.80 0.00 0.00 0.02 0.00 0.00 55.97 55.30 3hu1 s LYS 60 Cb -0.11 -2.31 0.00 0.00 -0.52 0.00 0.00 37.83 34.89 3hu1 s LYS 60 CO 0.01 -0.01 0.00 0.41 -0.92 0.00 0.00 175.35 174.84 3hu1 n GLY 61 N 4.05 2.81 3.94 -3.33 0.00 -0.22 -2.30 105.19 110.14 3hu1 n GLY 61 Ca -0.20 -1.67 -0.24 0.00 0.00 0.00 0.00 46.02 43.92 3hu1 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu1 s LYS 62 N 4.98 3.04 -1.59 1.61 1.02 -0.95 -4.61 119.74 123.24 3hu1 s LYS 62 Ca 0.00 -0.37 -0.12 0.00 0.02 0.00 0.00 55.97 55.50 3hu1 s LYS 62 Cb 0.00 -2.49 0.10 0.00 -0.52 0.00 0.00 37.83 34.92 3hu1 s LYS 62 CO 0.00 -0.37 0.69 1.63 -0.92 0.00 0.00 175.35 176.38 3hu1 n LYS 63 N -2.20 -3.51 -1.90 1.68 5.02 -1.26 -1.54 118.16 114.46 3hu1 n LYS 63 Ca 0.02 0.41 -0.19 0.00 -2.02 0.00 0.00 58.31 56.53 3hu1 n LYS 63 Cb 0.58 -4.96 -0.05 0.00 -0.02 0.00 0.00 35.03 30.58 3hu1 n LYS 63 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3hu1 n ARG 64 N -4.43 -1.41 -3.38 1.97 3.00 -1.26 -4.77 116.66 106.38 3hu1 n ARG 64 Ca -0.06 1.06 -0.33 0.00 -0.00 0.00 0.00 57.85 58.53 3hu1 n ARG 64 Cb 0.56 -5.48 -0.06 0.00 0.00 0.00 0.00 32.46 27.49 3hu1 n ARG 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3hu1 s ARG 65 N -4.19 3.86 0.05 -0.14 1.81 -0.59 -4.96 118.95 114.79 3hu1 s ARG 65 Ca 0.00 0.35 -0.00 0.00 -1.72 0.00 0.00 55.73 54.36 3hu1 s ARG 65 Cb 0.00 -2.68 -0.04 0.00 -0.45 0.00 0.00 34.95 31.79 3hu1 s ARG 65 CO 0.00 0.33 -0.04 -1.21 -0.68 0.00 0.00 175.30 173.70 3hu1 s GLU 66 N -2.67 0.59 -0.15 3.54 2.02 -1.26 -1.06 118.70 119.71 3hu1 s GLU 66 Ca 0.46 -1.09 -0.12 0.00 0.02 0.00 0.00 54.97 54.25 3hu1 s GLU 66 Cb -0.12 0.08 0.04 0.00 0.10 0.00 0.00 34.13 34.23 3hu1 s GLU 66 CO 0.20 -0.07 0.37 0.00 0.02 0.00 0.00 175.26 175.79 3hu1 s ALA 67 N -3.20 -0.93 -0.21 5.21 0.00 -0.82 -4.68 121.76 117.13 3hu1 s ALA 67 Ca 0.02 1.17 -0.08 0.00 0.00 0.00 0.00 51.96 53.07 3hu1 s ALA 67 Cb 0.03 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 3hu1 s ALA 67 CO -0.07 -0.20 0.08 0.14 0.00 0.00 0.00 175.76 175.72 3hu1 s VAL 68 N 0.55 4.73 0.20 0.00 -7.23 -1.26 -1.11 120.40 116.28 3hu1 s VAL 68 Ca -0.03 -0.04 0.03 0.00 -1.81 0.00 0.00 61.98 60.13 3hu1 s VAL 68 Cb -0.04 -3.17 -0.05 0.00 0.56 0.00 0.00 36.38 33.68 3hu1 s VAL 68 CO -0.03 0.41 -0.01 0.00 -0.31 0.00 0.00 175.10 175.15 3hu1 s ILE 70 N -3.52 4.58 -0.20 0.00 2.07 0.10 0.40 121.20 124.64 3hu1 s ILE 70 Ca 0.25 -0.11 -0.14 0.00 -1.41 0.00 0.00 60.65 59.24 3hu1 s ILE 70 Cb 0.05 -3.05 -0.04 0.00 0.13 0.00 0.00 42.46 39.55 3hu1 s ILE 70 CO 0.06 0.47 0.33 0.54 -1.91 0.00 0.00 174.94 174.43 3hu1 s VAL 71 N 0.37 5.25 0.23 4.00 0.11 -0.48 -1.82 120.40 128.05 3hu1 s VAL 71 Ca 0.01 0.58 0.10 0.00 -2.93 0.00 0.00 61.98 59.75 3hu1 s VAL 71 Cb -0.13 -3.67 -0.05 0.00 -1.53 0.00 0.00 36.38 31.01 3hu1 s VAL 71 CO 0.01 0.29 -0.19 -0.76 -3.33 0.00 0.00 175.10 171.12 3hu1 s LEU 72 N 1.12 2.53 -0.08 2.54 1.43 -0.55 0.13 118.68 125.80 3hu1 s LEU 72 Ca 0.16 -0.97 -0.20 0.00 -1.03 0.00 0.00 54.13 52.09 3hu1 s LEU 72 Cb -0.14 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.07 3hu1 s LEU 72 CO 0.07 -0.01 0.58 -0.94 0.23 0.00 0.00 176.35 176.28 3hu1 s SER 73 N -3.17 6.84 -0.01 2.29 1.04 -1.26 -1.60 113.70 117.83 3hu1 s SER 73 Ca 0.24 1.00 0.05 0.00 0.48 0.00 0.00 55.95 57.72 3hu1 s SER 73 Cb -0.05 -2.34 -0.01 0.00 0.10 0.00 0.00 66.02 63.72 3hu1 s SER 73 CO 0.11 -0.03 -0.15 -0.62 0.98 0.00 0.00 173.24 173.52 3hu1 s ASP 74 N 0.58 1.81 -0.12 7.02 2.15 0.71 -4.88 116.67 123.94 3hu1 s ASP 74 Ca 0.31 -0.28 0.08 0.00 0.43 0.00 0.00 52.55 53.09 3hu1 s ASP 74 Cb -0.16 -0.20 -0.24 0.00 -0.30 0.00 0.00 42.92 42.02 3hu1 s ASP 74 CO 0.14 0.19 0.38 0.47 -0.17 0.00 0.00 175.17 176.18 3hu1 n ASP 75 N 2.70 1.12 0.16 -0.34 8.00 -1.26 -3.75 116.55 123.18 3hu1 n ASP 75 Ca -0.14 0.22 0.13 0.00 0.71 0.00 0.00 54.79 55.71 3hu1 n ASP 75 Cb 0.55 -0.08 0.55 0.00 -0.02 0.00 0.00 41.12 42.12 3hu1 n ASP 75 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hu1 h THR 76 N 0.02 0.00 -3.62 -3.53 1.03 -1.97 -3.44 112.91 101.40 3hu1 h THR 76 Ca -0.40 -0.25 -0.51 0.00 -0.01 0.00 0.00 66.41 65.23 3hu1 h THR 76 Cb 2.06 1.01 -0.02 0.00 -1.07 0.00 0.00 68.15 70.13 3hu1 h THR 76 CO 0.05 0.00 0.36 0.00 -0.01 0.00 0.00 175.52 175.92 3hu1 s SER 78 N -0.33 4.50 0.15 0.00 0.01 -1.26 -4.47 113.70 112.29 3hu1 s SER 78 Ca 0.45 1.68 -0.18 0.00 1.31 0.00 0.00 55.95 59.22 3hu1 s SER 78 Cb -0.24 -2.42 0.04 0.00 0.21 0.00 0.00 66.02 63.61 3hu1 s SER 78 CO 0.30 -2.02 1.70 0.44 0.41 0.00 0.00 173.24 174.08 3hu1 h ASP 79 N -1.12 -0.17 -0.88 2.44 3.45 -1.97 -2.97 116.42 115.20 3hu1 h ASP 79 Ca -0.45 0.07 -0.45 0.00 0.43 0.00 0.00 57.03 56.64 3hu1 h ASP 79 Cb 1.24 0.14 -0.27 0.00 -0.56 0.00 0.00 39.33 39.88 3hu1 h ASP 79 CO 0.54 -0.05 0.57 -1.84 -1.57 0.00 0.00 179.24 176.89 3hu1 n GLU 80 N -5.19 2.19 -4.31 3.56 -0.00 -1.26 -4.64 120.64 110.99 3hu1 n GLU 80 Ca 0.00 -2.69 -0.24 0.00 -0.00 0.00 0.00 57.16 54.23 3hu1 n GLU 80 Cb 0.16 -2.06 -0.12 0.00 -0.00 0.00 0.00 31.44 29.42 3hu1 n GLU 80 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 3hu1 s LYS 81 N -2.93 1.19 -0.05 3.44 1.02 -1.12 -2.36 119.74 118.93 3hu1 s LYS 81 Ca 0.51 -1.24 0.05 0.00 0.02 0.00 0.00 55.97 55.31 3hu1 s LYS 81 Cb 0.43 -1.43 -0.01 0.00 -0.52 0.00 0.00 37.83 36.30 3hu1 s LYS 81 CO 0.10 0.32 -0.21 -1.50 -0.92 0.00 0.00 175.35 173.15 3hu1 s ILE 82 N -1.36 1.71 -0.20 2.17 2.07 -0.35 -4.50 121.20 120.75 3hu1 s ILE 82 Ca 0.09 -0.88 -0.08 0.00 -1.41 0.00 0.00 60.65 58.38 3hu1 s ILE 82 Cb -0.09 -1.45 -0.04 0.00 0.13 0.00 0.00 42.46 41.01 3hu1 s ILE 82 CO 0.05 0.48 0.07 -0.13 -1.91 0.00 0.00 174.94 173.50 3hu1 s ARG 83 N -0.09 3.92 -0.12 3.50 0.52 -0.50 0.50 118.95 126.68 3hu1 s ARG 83 Ca -0.03 -0.37 -0.19 0.00 -0.52 0.00 0.00 55.73 54.63 3hu1 s ARG 83 Cb -0.12 -3.26 0.05 0.00 0.52 0.00 0.00 34.95 32.14 3hu1 s ARG 83 CO 0.03 0.17 0.48 0.00 0.02 0.00 0.00 175.30 175.99 3hu1 s MET 84 N 0.66 0.67 0.80 3.54 0.23 -1.04 -1.54 119.30 122.64 3hu1 s MET 84 Ca 0.04 0.40 -0.14 0.00 -1.03 0.00 0.00 55.69 54.96 3hu1 s MET 84 Cb -0.13 0.32 0.19 0.00 -1.53 0.00 0.00 34.83 33.68 3hu1 s MET 84 CO 0.02 -0.14 1.01 0.27 -2.03 0.00 0.00 175.02 174.15 3hu1 n ASN 85 N 2.14 -0.30 -0.31 -1.18 0.23 -1.26 -3.40 115.26 111.17 3hu1 n ASN 85 Ca -0.16 -1.31 0.00 0.00 -0.53 0.00 0.00 54.58 52.58 3hu1 n ASN 85 Cb 0.56 -0.80 0.18 0.00 -2.08 0.00 0.00 39.78 37.65 3hu1 n ASN 85 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 3hu1 h ARG 86 N 0.00 1.15 -0.35 -3.83 3.08 -1.98 -2.15 114.38 110.29 3hu1 h ARG 86 Ca -0.33 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 59.65 3hu1 h ARG 86 Cb 0.94 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.71 3hu1 h ARG 86 CO 0.23 0.76 0.23 0.28 -1.07 0.00 0.00 179.97 180.40 3hu1 h VAL 87 N 1.18 1.08 -0.32 2.04 2.07 -1.93 0.42 116.25 120.80 3hu1 h VAL 87 Ca 0.35 -0.16 -0.05 0.00 0.82 0.00 0.00 66.70 67.66 3hu1 h VAL 87 Cb -0.05 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 3hu1 h VAL 87 CO -0.10 0.09 -0.01 0.58 0.02 0.00 0.00 177.57 178.15 3hu1 h VAL 88 N 0.47 1.26 -0.71 2.57 2.07 -1.81 -1.91 116.25 118.19 3hu1 h VAL 88 Ca 0.13 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.68 3hu1 h VAL 88 Cb -0.05 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3hu1 h VAL 88 CO -0.03 0.31 0.45 0.03 0.02 0.00 0.00 177.57 178.35 3hu1 h ARG 89 N 0.36 0.95 -0.09 1.57 3.08 -0.97 -0.09 114.38 119.19 3hu1 h ARG 89 Ca 0.09 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 60.09 3hu1 h ARG 89 Cb 0.45 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3hu1 h ARG 89 CO 0.02 0.66 -0.07 -0.91 -1.07 0.00 0.00 179.97 178.60 3hu1 h ASN 90 N 0.97 -0.22 -0.07 7.04 4.21 -0.08 -0.75 115.58 126.68 3hu1 h ASN 90 Ca 0.26 0.05 -0.01 0.00 1.21 0.00 0.00 56.30 57.80 3hu1 h ASN 90 Cb -0.07 0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.24 3hu1 h ASN 90 CO -0.05 -0.10 0.02 0.78 -1.29 0.00 0.00 177.43 176.79 3hu1 h ASN 91 N -0.08 0.15 0.30 5.81 -0.26 -0.92 -0.30 115.58 120.27 3hu1 h ASN 91 Ca 0.06 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 3hu1 h ASN 91 Cb 0.17 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.39 3hu1 h ASN 91 CO -0.14 0.17 -0.19 0.18 -1.06 0.00 0.00 177.43 176.39 3hu1 n LEU 92 N -4.46 0.76 -3.87 1.61 4.77 -0.08 -4.29 117.00 111.45 3hu1 n LEU 92 Ca -0.01 -0.13 -0.29 0.00 -0.03 0.00 0.00 56.01 55.55 3hu1 n LEU 92 Cb 0.13 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.10 3hu1 n LEU 92 CO 0.35 0.14 0.09 0.54 -1.33 0.00 0.00 177.39 177.19 3hu1 n ARG 93 N -0.79 -5.61 -4.36 3.23 5.12 -0.13 -2.24 116.66 111.88 3hu1 n ARG 93 Ca 0.13 0.61 -0.24 0.00 -1.93 0.00 0.00 57.85 56.43 3hu1 n ARG 93 Cb 0.32 -5.47 -0.11 0.00 -1.16 0.00 0.00 32.46 26.03 3hu1 n ARG 93 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3hu1 s VAL 94 N -3.36 2.00 0.42 1.55 -7.23 -0.55 -4.50 120.40 108.73 3hu1 s VAL 94 Ca 0.57 -1.94 0.07 0.00 -1.81 0.00 0.00 61.98 58.87 3hu1 s VAL 94 Cb -0.28 -1.92 -0.06 0.00 0.56 0.00 0.00 36.38 34.68 3hu1 s VAL 94 CO 0.82 -0.24 0.13 -0.83 -0.31 0.00 0.00 175.10 174.67 3hu1 s GLY 95 N -2.63 2.41 -0.02 2.32 0.00 -1.26 -4.39 107.32 103.75 3hu1 s GLY 95 Ca 0.17 -2.11 -0.35 0.00 0.00 0.00 0.00 44.72 42.42 3hu1 s GLY 95 CO 0.08 -1.98 1.71 1.04 0.00 0.00 0.00 173.10 173.94 3hu1 n LEU 96 N -1.16 2.97 0.00 0.66 4.32 -1.26 -2.06 117.00 120.46 3hu1 n LEU 96 Ca -0.03 1.04 0.00 0.00 -0.02 0.00 0.00 56.01 57.00 3hu1 n LEU 96 Cb 0.65 -1.33 0.00 0.00 -1.62 0.00 0.00 43.42 41.12 3hu1 n LEU 96 CO 0.47 -0.30 0.00 0.61 -1.22 0.00 0.00 177.39 176.95 3hu1 n GLY 97 N 3.86 1.84 3.76 -0.72 0.00 -0.83 -5.00 105.19 108.10 3hu1 n GLY 97 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 3hu1 n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu1 s ASP 98 N -0.71 5.33 0.24 1.61 1.01 -0.87 -4.58 116.67 118.69 3hu1 s ASP 98 Ca 0.00 2.25 -0.17 0.00 0.71 0.00 0.00 52.55 55.35 3hu1 s ASP 98 Cb 0.00 -2.58 -0.08 0.00 1.01 0.00 0.00 42.92 41.26 3hu1 s ASP 98 CO 0.00 -1.49 0.68 0.68 0.21 0.00 0.00 175.17 175.25 3hu1 s VAL 99 N -1.78 4.68 0.14 -1.27 -7.23 -1.26 -1.21 120.40 112.47 3hu1 s VAL 99 Ca 0.74 1.04 0.02 0.00 -1.81 0.00 0.00 61.98 61.97 3hu1 s VAL 99 Cb -0.26 -3.75 -0.04 0.00 0.56 0.00 0.00 36.38 32.89 3hu1 s VAL 99 CO 0.32 0.08 -0.05 0.27 -0.31 0.00 0.00 175.10 175.42 3hu1 s ILE 100 N -1.66 0.80 0.15 -0.62 -5.25 -0.26 -4.87 121.20 109.49 3hu1 s ILE 100 Ca 0.45 -1.98 -0.12 0.00 -0.99 0.00 0.00 60.65 58.02 3hu1 s ILE 100 Cb -0.14 -1.88 -0.07 0.00 2.95 0.00 0.00 42.46 43.32 3hu1 s ILE 100 CO 0.20 -0.70 0.51 -0.44 -1.79 0.00 0.00 174.94 172.71 3hu1 s SER 101 N -3.12 6.72 -0.08 4.36 0.01 -0.97 -1.74 113.70 118.88 3hu1 s SER 101 Ca 0.17 0.95 0.02 0.00 1.31 0.00 0.00 55.95 58.41 3hu1 s SER 101 Cb 0.05 -2.24 0.01 0.00 0.21 0.00 0.00 66.02 64.05 3hu1 s SER 101 CO -0.00 0.08 -0.13 -0.51 0.41 0.00 0.00 173.24 173.08 3hu1 s ILE 102 N -1.53 1.27 -0.02 1.44 2.07 -0.67 -2.39 121.20 121.37 3hu1 s ILE 102 Ca 0.39 -0.54 0.05 0.00 -1.41 0.00 0.00 60.65 59.14 3hu1 s ILE 102 Cb -0.14 -1.16 -0.01 0.00 0.13 0.00 0.00 42.46 41.28 3hu1 s ILE 102 CO 0.19 0.39 -0.16 -1.58 -1.91 0.00 0.00 174.94 171.87 3hu1 s GLN 103 N 0.77 1.34 0.63 3.50 0.74 0.89 -4.84 119.66 122.69 3hu1 s GLN 103 Ca -0.12 -0.56 -0.19 0.00 0.05 0.00 0.00 55.36 54.54 3hu1 s GLN 103 Cb -0.16 -1.27 -0.02 0.00 1.10 0.00 0.00 33.01 32.66 3hu1 s GLN 103 CO 0.02 0.32 1.30 -1.25 -0.55 0.00 0.00 175.29 175.14 3hu1 s PRO 104 N -0.30 2.64 -0.41 1.67 0.04 -1.26 -0.63 135.00 136.76 3hu1 s PRO 104 Ca 0.04 2.08 0.08 0.00 0.04 0.00 0.00 61.00 63.25 3hu1 s PRO 104 Cb -0.07 -1.90 0.27 0.00 0.04 0.00 0.00 34.50 32.83 3hu1 s PRO 104 CO -0.00 -1.53 0.65 0.00 0.04 0.00 0.00 177.00 176.15 3hu1 n PRO 106 N 1.24 1.50 0.18 0.00 -0.05 -1.26 -4.14 135.00 132.46 3hu1 n PRO 106 Ca 0.19 -0.75 0.05 0.00 -0.05 0.00 0.00 63.50 62.93 3hu1 n PRO 106 Cb 0.58 -1.34 0.28 0.00 -0.05 0.00 0.00 33.50 32.97 3hu1 n PRO 106 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 175.50 175.01 3hu1 h ASP 107 N 1.48 0.00 -1.94 3.54 3.45 -1.94 -3.47 116.42 117.54 3hu1 h ASP 107 Ca 0.00 0.00 -0.64 0.00 0.43 0.00 0.00 57.03 56.82 3hu1 h ASP 107 Cb 0.33 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 39.11 3hu1 h ASP 107 CO 0.00 0.41 1.08 0.52 -1.57 0.00 0.00 179.24 179.68 3hu1 n VAL 108 N -3.51 0.54 -2.21 -1.35 0.31 -1.26 -4.98 118.33 105.87 3hu1 n VAL 108 Ca -0.00 -0.10 -0.32 0.00 -0.01 0.00 0.00 64.34 63.91 3hu1 n VAL 108 Cb 0.55 -1.77 -0.01 0.00 -0.91 0.00 0.00 33.84 31.69 3hu1 n VAL 108 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3hu1 s LYS 109 N 4.06 3.70 0.23 5.55 1.02 -1.26 -4.84 119.74 128.20 3hu1 s LYS 109 Ca 0.94 0.99 -0.30 0.00 0.02 0.00 0.00 55.97 57.62 3hu1 s LYS 109 Cb -0.76 -2.10 -0.09 0.00 -0.52 0.00 0.00 37.83 34.37 3hu1 s LYS 109 CO 0.54 -0.48 1.32 0.71 -0.92 0.00 0.00 175.35 176.52 3hu1 s TYR 110 N -2.67 3.20 0.31 3.18 1.51 -1.26 -1.75 117.35 119.87 3hu1 s TYR 110 Ca 0.60 1.25 -0.29 0.00 -1.01 0.00 0.00 57.07 57.61 3hu1 s TYR 110 Cb -0.12 -3.63 -0.10 0.00 -0.11 0.00 0.00 41.96 38.00 3hu1 s TYR 110 CO 0.37 -1.92 1.25 0.20 -1.11 0.00 0.00 175.55 174.33 3hu1 s GLY 111 N 0.14 2.98 -0.11 0.71 0.00 0.10 -4.81 107.32 106.33 3hu1 s GLY 111 Ca 0.55 1.15 -0.08 0.00 0.00 0.00 0.00 44.72 46.34 3hu1 s GLY 111 CO 0.41 1.81 -0.16 1.17 0.00 0.00 0.00 173.10 176.34 3hu1 n LYS 112 N 1.04 0.33 -4.15 2.90 3.00 -1.26 -3.72 118.16 116.30 3hu1 n LYS 112 Ca 0.00 0.34 -0.16 0.00 -0.00 0.00 0.00 58.31 58.49 3hu1 n LYS 112 Cb 0.43 -1.31 -0.15 0.00 0.00 0.00 0.00 35.03 34.00 3hu1 n LYS 112 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3hu1 s ARG 113 N -2.01 0.47 0.08 1.64 0.52 -1.26 -1.97 118.95 116.41 3hu1 s ARG 113 Ca -0.13 -0.17 0.07 0.00 -0.52 0.00 0.00 55.73 54.98 3hu1 s ARG 113 Cb 0.02 -0.47 -0.03 0.00 0.52 0.00 0.00 34.95 34.99 3hu1 s ARG 113 CO 0.20 0.08 -0.18 0.96 0.02 0.00 0.00 175.30 176.38 3hu1 s ILE 114 N 0.06 1.44 -0.21 1.52 -4.36 -0.81 -0.45 121.20 118.39 3hu1 s ILE 114 Ca -0.00 -1.38 0.02 0.00 -0.26 0.00 0.00 60.65 59.03 3hu1 s ILE 114 Cb -0.04 -1.32 0.04 0.00 1.25 0.00 0.00 42.46 42.38 3hu1 s ILE 114 CO -0.00 -0.09 -0.15 -2.28 0.24 0.00 0.00 174.94 172.66 3hu1 s HIS 115 N -1.14 2.83 0.14 1.37 2.46 -0.99 -0.98 115.29 118.98 3hu1 s HIS 115 Ca 0.03 -1.84 0.10 0.00 0.47 0.00 0.00 55.06 53.82 3hu1 s HIS 115 Cb -0.10 -1.85 -0.04 0.00 -0.13 0.00 0.00 32.58 30.47 3hu1 s HIS 115 CO 0.03 -0.81 -0.24 0.14 -2.47 0.00 0.00 174.74 171.39 3hu1 s VAL 116 N 1.26 2.46 -0.04 0.89 -7.23 0.03 -0.15 120.40 117.63 3hu1 s VAL 116 Ca -0.01 -1.72 -0.03 0.00 -1.81 0.00 0.00 61.98 58.41 3hu1 s VAL 116 Cb -0.16 -2.11 0.01 0.00 0.56 0.00 0.00 36.38 34.68 3hu1 s VAL 116 CO -0.09 0.06 0.09 -0.76 -0.31 0.00 0.00 175.10 174.09 3hu1 s LEU 117 N -2.17 1.54 0.55 1.32 1.43 -0.72 -4.07 118.68 116.56 3hu1 s LEU 117 Ca 0.16 0.18 -0.17 0.00 -1.03 0.00 0.00 54.13 53.27 3hu1 s LEU 117 Cb -0.10 0.29 -0.06 0.00 0.03 0.00 0.00 46.19 46.36 3hu1 s LEU 117 CO 0.08 -0.05 1.04 -2.16 0.23 0.00 0.00 176.35 175.49 3hu1 s PRO 118 N 0.20 3.56 -0.20 1.29 0.04 -1.26 -0.64 135.00 138.00 3hu1 s PRO 118 Ca -0.01 1.21 -0.26 0.00 0.04 0.00 0.00 61.00 61.98 3hu1 s PRO 118 Cb -0.02 -2.07 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 3hu1 s PRO 118 CO -0.01 -0.61 0.88 0.42 0.04 0.00 0.00 177.00 177.72 3hu1 s ILE 119 N -2.34 4.83 0.25 0.56 1.09 0.68 -1.30 121.20 124.97 3hu1 s ILE 119 Ca 0.64 1.70 -0.12 0.00 -1.10 0.00 0.00 60.65 61.78 3hu1 s ILE 119 Cb -0.15 -4.17 0.35 0.00 -1.06 0.00 0.00 42.46 37.43 3hu1 s ILE 119 CO 0.31 -0.04 1.58 -2.24 -0.10 0.00 0.00 174.94 174.45 3hu1 h ASP 120 N 7.43 -0.91 0.99 3.58 2.03 -1.25 -1.63 116.42 126.67 3hu1 h ASP 120 Ca -0.26 0.27 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 3hu1 h ASP 120 Cb 1.11 0.57 0.00 0.00 -0.83 0.00 0.00 39.33 40.18 3hu1 h ASP 120 CO 0.87 -0.29 0.00 -2.24 -1.03 0.00 0.00 179.24 176.55 3hu1 h ASP 121 N -0.01 0.00 -0.50 4.15 2.03 -1.94 -2.15 116.42 118.00 3hu1 h ASP 121 Ca 0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.70 3hu1 h ASP 121 Cb 0.63 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.13 3hu1 h ASP 121 CO -0.89 0.00 0.00 0.35 -1.03 0.00 0.00 179.24 177.67 3hu1 n THR 122 N -2.81 1.83 -1.31 1.15 -2.24 -0.61 -4.39 114.28 105.90 3hu1 n THR 122 Ca 0.01 -1.03 0.00 0.00 -2.27 0.00 0.00 64.05 60.76 3hu1 n THR 122 Cb 0.30 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 3hu1 n THR 122 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 3hu1 n VAL 123 N 0.70 0.00 -2.35 2.28 3.14 -0.81 -4.56 118.33 116.73 3hu1 n VAL 123 Ca 0.22 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.17 3hu1 n VAL 123 Cb 0.87 0.84 -0.03 0.00 -1.06 0.00 0.00 33.84 34.47 3hu1 n VAL 123 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 3hu1 s GLU 124 N 0.00 4.36 0.00 1.45 2.02 -1.25 -4.73 118.70 120.56 3hu1 s GLU 124 Ca 0.00 1.83 0.00 0.00 0.02 0.00 0.00 54.97 56.82 3hu1 s GLU 124 Cb 0.00 -3.44 0.00 0.00 0.10 0.00 0.00 34.13 30.79 3hu1 s GLU 124 CO 0.00 -0.40 0.00 0.41 0.02 0.00 0.00 175.26 175.29 3hu1 n GLY 125 N 3.39 -1.43 2.20 -1.39 0.00 -1.26 -5.08 105.19 101.62 3hu1 n GLY 125 Ca 0.11 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.08 3hu1 n GLY 125 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3hu1 n ILE 126 N 1.08 -7.79 0.02 -0.61 0.13 -1.26 -5.01 119.36 105.91 3hu1 n ILE 126 Ca 0.00 1.84 -0.09 0.00 -1.10 0.00 0.00 62.75 63.40 3hu1 n ILE 126 Cb 0.00 -4.14 -0.07 0.00 -0.84 0.00 0.00 39.64 34.59 3hu1 n ILE 126 CO 0.00 0.00 0.00 0.74 2.80 0.00 0.00 176.55 180.09 3hu1 h THR 127 N 4.18 0.85 0.00 9.51 2.02 -1.98 -3.48 112.91 124.01 3hu1 h THR 127 Ca 0.00 -1.31 0.00 0.00 0.77 0.00 0.00 66.41 65.87 3hu1 h THR 127 Cb 0.00 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 3hu1 h THR 127 CO 0.00 0.25 0.00 0.61 0.37 0.00 0.00 175.52 176.75 3hu1 n GLY 128 N 0.97 0.23 3.58 2.16 0.00 -1.26 -3.70 105.19 107.17 3hu1 n GLY 128 Ca -0.07 0.64 -0.04 0.00 0.00 0.00 0.00 46.02 46.55 3hu1 n GLY 128 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hu1 s ASN 129 N -4.00 -0.96 0.22 1.61 3.84 -1.26 -5.08 114.94 109.32 3hu1 s ASN 129 Ca 0.00 1.46 0.00 0.00 0.21 0.00 0.00 52.86 54.53 3hu1 s ASN 129 Cb 0.00 1.84 0.21 0.00 -0.55 0.00 0.00 41.25 42.76 3hu1 s ASN 129 CO 0.00 -0.23 1.57 -0.07 -2.79 0.00 0.00 177.10 175.58 3hu1 h LEU 130 N 7.67 0.50 -0.25 3.21 3.38 -1.97 -1.74 115.31 126.12 3hu1 h LEU 130 Ca -0.22 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.42 3hu1 h LEU 130 Cb 1.14 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 3hu1 h LEU 130 CO 0.13 0.91 -0.15 0.15 0.09 0.00 0.00 178.44 179.57 3hu1 h PHE 131 N 0.36 0.63 0.03 1.13 3.04 -1.96 -2.70 116.94 117.46 3hu1 h PHE 131 Ca 0.02 -0.17 -0.00 0.00 3.98 0.00 0.00 57.97 61.80 3hu1 h PHE 131 Cb 1.00 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 39.37 3hu1 h PHE 131 CO 0.03 0.82 -0.01 1.49 -2.02 0.00 0.00 178.31 178.62 3hu1 h GLU 132 N 0.26 -0.03 -0.21 1.11 4.57 -1.96 0.13 114.58 118.45 3hu1 h GLU 132 Ca 0.05 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 58.04 3hu1 h GLU 132 Cb 0.67 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.27 3hu1 h GLU 132 CO 0.04 0.48 -0.61 0.28 -1.18 0.00 0.00 179.01 178.02 3hu1 h VAL 133 N -0.57 1.29 0.00 0.32 2.07 -1.47 -3.41 116.25 114.49 3hu1 h VAL 133 Ca -0.00 -1.82 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 3hu1 h VAL 133 Cb 0.53 1.85 -0.00 0.00 -1.52 0.00 0.00 31.29 32.15 3hu1 h VAL 133 CO 0.01 0.58 -0.58 -1.22 0.02 0.00 0.00 177.57 176.38 3hu1 n TYR 134 N -4.04 0.00 -0.00 1.57 4.01 -1.04 -4.70 117.16 112.96 3hu1 n TYR 134 Ca -0.06 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.51 3hu1 n TYR 134 Cb 0.66 -0.27 -0.11 0.00 -0.31 0.00 0.00 39.34 39.31 3hu1 n TYR 134 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3hu1 h LEU 135 N -0.53 0.54 -0.20 7.72 3.38 -1.26 -3.01 115.31 121.95 3hu1 h LEU 135 Ca -0.01 -0.74 0.02 0.00 0.09 0.00 0.00 57.88 57.24 3hu1 h LEU 135 Cb 0.56 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 3hu1 h LEU 135 CO -0.01 1.21 0.06 0.50 0.09 0.00 0.00 178.44 180.29 3hu1 h LYS 136 N -0.07 0.15 0.00 1.13 3.64 -0.99 -1.51 116.57 118.92 3hu1 h LYS 136 Ca -0.07 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 3hu1 h LYS 136 Cb 1.28 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 3hu1 h LYS 136 CO 0.12 0.10 -0.08 -1.00 -2.27 0.00 0.00 179.45 176.31 3hu1 h PRO 137 N 0.15 0.00 -0.03 1.90 0.13 -1.79 -0.68 132.00 131.68 3hu1 h PRO 137 Ca 0.09 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.05 3hu1 h PRO 137 Cb 0.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.18 3hu1 h PRO 137 CO -0.10 0.08 -0.74 -0.92 -0.23 0.00 0.00 178.00 176.10 3hu1 h TYR 138 N 0.00 0.28 0.00 1.56 3.20 -1.27 -3.38 116.97 117.36 3hu1 h TYR 138 Ca -0.00 -0.13 -0.37 0.00 3.14 0.00 0.00 58.73 61.37 3hu1 h TYR 138 Cb 0.45 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.61 3hu1 h TYR 138 CO 0.00 0.87 -2.41 1.19 -1.64 0.00 0.00 178.16 176.17 3hu1 n PHE 139 N -3.76 0.00 -1.71 -3.82 3.72 -0.62 -4.86 117.46 106.41 3hu1 n PHE 139 Ca -0.03 0.00 -0.59 0.00 -0.05 0.00 0.00 57.45 56.78 3hu1 n PHE 139 Cb 0.71 -0.98 -0.08 0.00 -0.94 0.00 0.00 39.48 38.19 3hu1 n PHE 139 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3hu1 n LEU 140 N -3.01 2.15 -0.07 4.37 7.94 -0.29 -1.49 117.00 126.60 3hu1 n LEU 140 Ca -0.39 1.07 -0.01 0.00 -1.11 0.00 0.00 56.01 55.57 3hu1 n LEU 140 Cb 1.06 -1.09 -0.00 0.00 0.53 0.00 0.00 43.42 43.91 3hu1 n LEU 140 CO 0.33 -0.51 -0.01 -0.62 -1.11 0.00 0.00 177.39 175.47 3hu1 n GLU 141 N 5.27 -1.84 0.08 1.96 -0.58 -1.26 -4.81 120.64 119.46 3hu1 n GLU 141 Ca 0.28 0.50 0.02 0.00 -0.42 0.00 0.00 57.16 57.55 3hu1 n GLU 141 Cb 0.09 -4.90 -0.04 0.00 -0.57 0.00 0.00 31.44 26.03 3hu1 n GLU 141 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hu1 h ALA 142 N 0.00 0.65 -6.43 0.62 0.00 -1.55 -3.49 119.26 109.05 3hu1 h ALA 142 Ca -0.02 -0.61 -0.48 0.00 0.00 0.00 0.00 54.91 53.80 3hu1 h ALA 142 Cb 0.95 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 3hu1 h ALA 142 CO 0.03 0.70 -0.91 0.66 0.00 0.00 0.00 179.25 179.73 3hu1 n TYR 143 N -2.97 -1.71 -2.46 0.00 4.01 -1.22 -4.92 117.16 107.89 3hu1 n TYR 143 Ca -0.05 0.63 -0.42 0.00 -0.16 0.00 0.00 57.90 57.91 3hu1 n TYR 143 Cb 0.77 -3.63 -0.03 0.00 -0.31 0.00 0.00 39.34 36.13 3hu1 n TYR 143 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3hu1 s ARG 144 N -6.43 4.49 -0.17 -0.72 0.52 -1.23 -4.66 118.95 110.75 3hu1 s ARG 144 Ca 0.15 1.75 -0.27 0.00 -0.52 0.00 0.00 55.73 56.84 3hu1 s ARG 144 Cb -0.06 -3.32 -0.01 0.00 0.52 0.00 0.00 34.95 32.08 3hu1 s ARG 144 CO 0.88 -0.14 0.91 -2.14 0.02 0.00 0.00 175.30 174.84 3hu1 s PRO 145 N 0.53 4.31 0.04 3.54 0.02 -1.26 -0.14 135.00 142.04 3hu1 s PRO 145 Ca 0.55 1.16 0.06 0.00 0.02 0.00 0.00 61.00 62.79 3hu1 s PRO 145 Cb -0.29 -3.59 -0.02 0.00 0.02 0.00 0.00 34.50 30.62 3hu1 s PRO 145 CO 0.31 -0.40 -0.18 0.96 -0.33 0.00 0.00 177.00 177.37 3hu1 s ILE 146 N 2.38 1.43 0.03 2.83 -4.36 -0.83 -4.72 121.20 117.96 3hu1 s ILE 146 Ca 0.41 -1.12 0.04 0.00 -0.26 0.00 0.00 60.65 59.73 3hu1 s ILE 146 Cb -0.17 -1.26 -0.04 0.00 1.25 0.00 0.00 42.46 42.25 3hu1 s ILE 146 CO 0.12 0.11 -0.08 -0.60 0.24 0.00 0.00 174.94 174.74 3hu1 s ARG 147 N -1.17 2.43 0.19 0.37 3.52 -1.26 -2.29 118.95 120.74 3hu1 s ARG 147 Ca 0.05 -0.81 -0.33 0.00 -0.13 0.00 0.00 55.73 54.51 3hu1 s ARG 147 Cb -0.08 -2.44 -0.15 0.00 -1.56 0.00 0.00 34.95 30.72 3hu1 s ARG 147 CO 0.02 0.57 1.29 1.17 -0.81 0.00 0.00 175.30 177.53 3hu1 n LYS 148 N 1.29 1.51 -0.72 5.12 4.81 -0.51 -2.16 118.16 127.50 3hu1 n LYS 148 Ca -0.15 0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.83 3hu1 n LYS 148 Cb 0.52 -2.12 0.00 0.00 0.02 0.00 0.00 35.03 33.45 3hu1 n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hu1 n GLY 149 N 2.19 0.95 3.73 3.14 0.00 0.11 -5.01 105.19 110.31 3hu1 n GLY 149 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3hu1 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu1 s ASP 150 N -3.03 6.58 -0.23 1.61 1.01 -0.92 -4.79 116.67 116.90 3hu1 s ASP 150 Ca 0.00 2.69 -0.06 0.00 0.71 0.00 0.00 52.55 55.89 3hu1 s ASP 150 Cb 0.00 -2.61 -0.02 0.00 1.01 0.00 0.00 42.92 41.30 3hu1 s ASP 150 CO 0.00 -0.78 0.02 -0.63 0.21 0.00 0.00 175.17 173.99 3hu1 s ILE 151 N 0.46 3.94 0.05 0.77 1.09 -1.26 -0.43 121.20 125.83 3hu1 s ILE 151 Ca 0.64 -0.30 0.05 0.00 -1.10 0.00 0.00 60.65 59.94 3hu1 s ILE 151 Cb -0.44 -2.82 -0.02 0.00 -1.06 0.00 0.00 42.46 38.12 3hu1 s ILE 151 CO 0.39 0.38 -0.14 0.72 -0.10 0.00 0.00 174.94 176.19 3hu1 s PHE 152 N 1.49 1.21 -0.13 3.97 -0.71 0.58 -4.81 117.98 119.58 3hu1 s PHE 152 Ca 0.06 -0.40 -0.11 0.00 -1.04 0.00 0.00 56.93 55.44 3hu1 s PHE 152 Cb -0.15 -0.70 -0.05 0.00 -1.21 0.00 0.00 43.02 40.91 3hu1 s PHE 152 CO 0.01 0.04 0.23 -1.17 -1.34 0.00 0.00 175.22 172.99 3hu1 s LEU 153 N -1.38 4.32 -0.07 -1.99 2.96 -1.26 -0.09 118.68 121.16 3hu1 s LEU 153 Ca -0.00 0.51 0.01 0.00 -0.22 0.00 0.00 54.13 54.43 3hu1 s LEU 153 Cb -0.09 -2.25 0.02 0.00 0.50 0.00 0.00 46.19 44.37 3hu1 s LEU 153 CO 0.02 0.25 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.52 3hu1 s VAL 154 N -0.26 0.93 0.09 1.68 1.01 -0.26 -4.97 120.40 118.63 3hu1 s VAL 154 Ca 0.15 -0.32 -0.23 0.00 0.00 0.00 0.00 61.98 61.59 3hu1 s VAL 154 Cb -0.13 -0.91 -0.07 0.00 0.00 0.00 0.00 36.38 35.28 3hu1 s VAL 154 CO 0.04 0.32 0.70 -0.13 0.00 0.00 0.00 175.10 176.03 3hu1 s ARG 155 N 1.07 4.42 -0.46 2.72 0.52 -1.26 -0.54 118.95 125.42 3hu1 s ARG 155 Ca -0.08 0.97 0.07 0.00 -0.52 0.00 0.00 55.73 56.18 3hu1 s ARG 155 Cb -0.14 -3.29 0.23 0.00 0.52 0.00 0.00 34.95 32.27 3hu1 s ARG 155 CO -0.01 0.50 0.53 0.41 0.02 0.00 0.00 175.30 176.76 3hu1 n GLY 156 N 1.91 3.18 5.96 -3.53 0.00 -0.70 -4.93 105.19 107.07 3hu1 n GLY 156 Ca -0.06 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.15 3hu1 n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hu1 n GLY 157 N 1.56 0.69 0.39 -0.02 0.00 -1.26 -4.15 105.19 102.40 3hu1 n GLY 157 Ca 0.24 0.51 -0.08 0.00 0.00 0.00 0.00 46.02 46.69 3hu1 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu1 h MET 158 N 0.00 -0.20 0.00 1.61 -0.00 -2.02 -3.46 114.93 110.86 3hu1 h MET 158 Ca 0.00 0.01 -0.07 0.00 -0.00 0.00 0.00 59.70 59.64 3hu1 h MET 158 Cb 0.00 0.05 -0.01 0.00 -0.00 0.00 0.00 31.60 31.64 3hu1 h MET 158 CO 0.00 -0.13 0.11 2.89 -0.00 0.00 0.00 176.91 179.78 3hu1 n ARG 159 N -5.40 0.73 -4.90 -0.10 1.85 -1.26 -5.17 116.66 102.40 3hu1 n ARG 159 Ca 0.02 -1.72 -0.33 0.00 -1.00 0.00 0.00 57.85 54.82 3hu1 n ARG 159 Cb 0.35 1.99 -0.15 0.00 -1.05 0.00 0.00 32.46 33.60 3hu1 n ARG 159 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3hu1 s ALA 160 N -1.97 2.51 -0.11 2.89 0.00 -1.26 -1.71 121.76 122.11 3hu1 s ALA 160 Ca 0.14 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.21 3hu1 s ALA 160 Cb -0.03 -1.09 -0.00 0.00 0.00 0.00 0.00 23.12 22.00 3hu1 s ALA 160 CO 0.10 0.29 -0.21 0.08 0.00 0.00 0.00 175.76 176.03 3hu1 s VAL 161 N 0.25 2.37 -0.06 0.00 1.01 0.29 -4.92 120.40 119.34 3hu1 s VAL 161 Ca -0.11 -0.91 -0.21 0.00 0.00 0.00 0.00 61.98 60.75 3hu1 s VAL 161 Cb -0.16 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.24 3hu1 s VAL 161 CO 0.06 0.55 0.61 -1.61 0.00 0.00 0.00 175.10 174.71 3hu1 s GLU 162 N 0.34 4.38 0.11 2.72 2.02 -1.26 -1.10 118.70 125.90 3hu1 s GLU 162 Ca -0.16 0.73 0.10 0.00 0.02 0.00 0.00 54.97 55.66 3hu1 s GLU 162 Cb -0.17 -3.41 -0.04 0.00 0.10 0.00 0.00 34.13 30.61 3hu1 s GLU 162 CO 0.08 0.18 -0.24 -0.06 0.02 0.00 0.00 175.26 175.25 3hu1 s PHE 163 N 0.44 2.40 -0.13 1.61 0.08 0.87 -0.23 117.98 123.02 3hu1 s PHE 163 Ca 0.33 -0.34 -0.00 0.00 0.12 0.00 0.00 56.93 57.03 3hu1 s PHE 163 Cb -0.17 -1.31 -0.02 0.00 -0.57 0.00 0.00 43.02 40.95 3hu1 s PHE 163 CO 0.16 0.32 -0.13 0.21 -0.10 0.00 0.00 175.22 175.68 3hu1 s LYS 164 N -1.95 3.37 -0.61 0.44 2.20 0.18 -0.31 119.74 123.07 3hu1 s LYS 164 Ca 0.15 -0.68 -0.28 0.00 -0.36 0.00 0.00 55.97 54.80 3hu1 s LYS 164 Cb -0.10 -2.63 0.02 0.00 -1.51 0.00 0.00 37.83 33.60 3hu1 s LYS 164 CO 0.07 0.23 1.37 0.08 -0.36 0.00 0.00 175.35 176.73 3hu1 s VAL 165 N 0.31 3.79 -0.03 4.02 1.01 0.43 -1.75 120.40 128.18 3hu1 s VAL 165 Ca -0.10 0.63 -0.15 0.00 0.00 0.00 0.00 61.98 62.36 3hu1 s VAL 165 Cb -0.16 -4.57 -0.32 0.00 0.00 0.00 0.00 36.38 31.33 3hu1 s VAL 165 CO 0.05 -1.34 0.79 0.58 0.00 0.00 0.00 175.10 175.18 3hu1 h VAL 166 N 6.28 1.16 -4.06 2.92 2.07 -0.87 0.31 116.25 124.07 3hu1 h VAL 166 Ca -0.27 -2.55 -0.17 0.00 0.82 0.00 0.00 66.70 64.53 3hu1 h VAL 166 Cb 1.08 2.92 -0.18 0.00 -1.52 0.00 0.00 31.29 33.59 3hu1 h VAL 166 CO 1.20 0.79 -0.70 -0.70 0.02 0.00 0.00 177.57 178.19 3hu1 s GLU 167 N -2.54 0.52 -0.03 1.57 2.56 -1.08 -4.70 118.70 115.01 3hu1 s GLU 167 Ca -0.14 -0.96 -0.01 0.00 0.00 0.00 0.00 54.97 53.86 3hu1 s GLU 167 Cb 0.04 0.06 0.02 0.00 2.00 0.00 0.00 34.13 36.25 3hu1 s GLU 167 CO 0.86 -0.06 0.06 0.99 -0.56 0.00 0.00 175.26 176.55 3hu1 s THR 168 N -2.68 -0.03 0.06 -1.70 2.01 -1.26 -2.35 115.64 109.68 3hu1 s THR 168 Ca -0.03 0.11 -0.12 0.00 0.31 0.00 0.00 61.69 61.96 3hu1 s THR 168 Cb -0.01 -0.10 -0.31 0.00 0.01 0.00 0.00 72.50 72.09 3hu1 s THR 168 CO -0.05 0.04 1.09 -0.78 -0.69 0.00 0.00 174.62 174.23 3hu1 h ASP 169 N 6.71 0.72 -3.28 3.53 3.58 -1.15 -3.41 116.42 123.13 3hu1 h ASP 169 Ca -0.35 -0.73 -0.53 0.00 0.42 0.00 0.00 57.03 55.83 3hu1 h ASP 169 Cb 1.16 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 41.98 3hu1 h ASP 169 CO 0.47 1.56 0.50 -2.84 -2.88 0.00 0.00 179.24 176.05 3hu1 s PRO 170 N -2.76 4.48 0.00 0.28 0.02 -1.26 -4.94 135.00 130.81 3hu1 s PRO 170 Ca -0.07 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.61 3hu1 s PRO 170 Cb 0.06 -3.37 0.00 0.00 0.02 0.00 0.00 34.50 31.20 3hu1 s PRO 170 CO 0.92 -0.18 0.05 0.43 -0.33 0.00 0.00 177.00 177.89 3hu1 n SER 171 N 3.82 0.00 -0.12 2.53 7.64 -1.26 -3.89 113.62 122.34 3hu1 n SER 171 Ca 0.08 0.05 -0.21 0.00 1.01 0.00 0.00 58.87 59.80 3hu1 n SER 171 Cb 0.48 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.56 3hu1 n SER 171 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3hu1 n PRO 172 N -0.31 0.65 -4.20 1.43 -0.04 -1.26 -4.65 135.00 126.61 3hu1 n PRO 172 Ca 0.00 0.20 -0.17 0.00 -0.04 0.00 0.00 63.50 63.49 3hu1 n PRO 172 Cb 0.00 -1.54 -0.11 0.00 -0.04 0.00 0.00 33.50 31.80 3hu1 n PRO 172 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3hu1 s TYR 173 N -2.52 1.25 0.18 0.54 -0.85 -1.25 -1.42 117.35 113.28 3hu1 s TYR 173 Ca -0.34 -0.56 -0.15 0.00 -0.52 0.00 0.00 57.07 55.51 3hu1 s TYR 173 Cb 0.10 -0.67 0.02 0.00 0.38 0.00 0.00 41.96 41.78 3hu1 s TYR 173 CO 0.60 0.08 0.44 0.00 -1.52 0.00 0.00 175.55 175.15 3hu1 s ILE 175 N -3.89 5.16 -0.87 0.00 1.01 -0.72 -1.96 121.20 119.93 3hu1 s ILE 175 Ca 0.10 0.97 -0.22 0.00 0.00 0.00 0.00 60.65 61.51 3hu1 s ILE 175 Cb 0.01 -3.82 0.08 0.00 0.01 0.00 0.00 42.46 38.74 3hu1 s ILE 175 CO -0.03 0.35 1.19 -0.69 0.00 0.00 0.00 174.94 175.75 3hu1 s VAL 176 N 0.47 4.32 0.61 2.92 1.01 0.81 0.03 120.40 130.57 3hu1 s VAL 176 Ca 0.26 -0.87 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 3hu1 s VAL 176 Cb -0.15 -4.84 0.02 0.00 0.00 0.00 0.00 36.38 31.40 3hu1 s VAL 176 CO 0.11 -1.65 0.92 0.00 0.00 0.00 0.00 175.10 174.48 3hu1 s ALA 177 N 3.93 3.32 0.50 5.51 0.00 -1.26 -3.44 121.76 130.32 3hu1 s ALA 177 Ca 0.34 -0.81 0.33 0.00 0.00 0.00 0.00 51.96 51.82 3hu1 s ALA 177 Cb -0.07 -2.55 1.45 0.00 0.00 0.00 0.00 23.12 21.95 3hu1 s ALA 177 CO -0.02 -0.92 1.77 -1.35 0.00 0.00 0.00 175.76 175.24 3hu1 h PRO 178 N -0.25 0.10 -0.60 0.00 0.10 -1.95 -2.27 132.00 127.12 3hu1 h PRO 178 Ca -0.45 -0.01 0.02 0.00 0.10 0.00 0.00 66.00 65.66 3hu1 h PRO 178 Cb 1.27 -0.02 -0.03 0.00 0.10 0.00 0.00 31.00 32.32 3hu1 h PRO 178 CO 0.60 0.06 0.40 -0.44 0.10 0.00 0.00 178.00 178.72 3hu1 h ASP 179 N 0.10 0.65 -2.59 -2.05 5.19 -1.94 -3.44 116.42 112.34 3hu1 h ASP 179 Ca 0.62 -0.01 -0.56 0.00 -0.62 0.00 0.00 57.03 56.46 3hu1 h ASP 179 Cb 2.21 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 41.56 3hu1 h ASP 179 CO -0.11 0.46 1.15 -0.89 -3.12 0.00 0.00 179.24 176.74 3hu1 s THR 180 N -5.66 3.52 -0.18 0.35 2.01 -0.86 -4.94 115.64 109.88 3hu1 s THR 180 Ca -0.10 0.60 -0.29 0.00 0.31 0.00 0.00 61.69 62.22 3hu1 s THR 180 Cb 0.18 -3.46 0.00 0.00 0.01 0.00 0.00 72.50 69.23 3hu1 s THR 180 CO 0.76 -0.13 1.03 -0.69 -0.69 0.00 0.00 174.62 174.89 3hu1 s VAL 181 N 4.87 4.72 -0.39 3.82 1.01 -0.83 -4.92 120.40 128.68 3hu1 s VAL 181 Ca 0.77 2.03 -0.14 0.00 0.00 0.00 0.00 61.98 64.64 3hu1 s VAL 181 Cb -0.31 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 31.77 3hu1 s VAL 181 CO 0.31 -0.11 0.27 -0.63 0.00 0.00 0.00 175.10 174.94 3hu1 s ILE 182 N 2.74 5.15 -0.13 2.22 1.01 -1.26 -1.92 121.20 129.01 3hu1 s ILE 182 Ca 0.46 -0.60 -0.09 0.00 0.00 0.00 0.00 60.65 60.42 3hu1 s ILE 182 Cb -0.16 -3.82 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 3hu1 s ILE 182 CO 0.11 -0.24 0.17 -1.00 0.00 0.00 0.00 174.94 173.98 3hu1 s HIS 183 N 1.67 3.57 -0.38 3.97 3.76 -0.15 -5.02 115.29 122.71 3hu1 s HIS 183 Ca 0.05 0.53 0.12 0.00 -0.15 0.00 0.00 55.06 55.61 3hu1 s HIS 183 Cb -0.19 -2.03 0.35 0.00 1.11 0.00 0.00 32.58 31.82 3hu1 s HIS 183 CO 0.10 0.62 0.73 0.00 -0.85 0.00 0.00 174.74 175.34 3hu1 h GLU 185 N 3.02 -0.27 0.00 0.00 5.08 -1.96 -3.48 114.58 116.97 3hu1 h GLU 185 Ca 0.10 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 3hu1 h GLU 185 Cb 0.95 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.26 3hu1 h GLU 185 CO 0.51 -0.18 0.00 0.41 -1.00 0.00 0.00 179.01 178.75 3hu1 n GLY 186 N 0.74 -2.72 3.78 -3.84 0.00 -1.26 -5.01 105.19 96.88 3hu1 n GLY 186 Ca -0.04 -1.36 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 3hu1 n GLY 186 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hu1 s GLU 187 N -1.62 3.54 0.16 1.61 2.02 -1.26 -4.99 118.70 118.15 3hu1 s GLU 187 Ca 0.00 1.57 -0.31 0.00 0.02 0.00 0.00 54.97 56.25 3hu1 s GLU 187 Cb 0.00 -2.09 -0.10 0.00 0.10 0.00 0.00 34.13 32.03 3hu1 s GLU 187 CO 0.00 -0.69 1.68 -2.14 0.02 0.00 0.00 175.26 174.13 3hu1 s PRO 188 N -3.17 4.17 0.17 0.39 0.02 -1.26 -4.87 135.00 130.44 3hu1 s PRO 188 Ca 0.70 2.49 -0.32 0.00 0.02 0.00 0.00 61.00 63.89 3hu1 s PRO 188 Cb -0.23 -3.28 -0.11 0.00 0.02 0.00 0.00 34.50 30.90 3hu1 s PRO 188 CO 0.26 -0.72 1.75 0.42 -0.33 0.00 0.00 177.00 178.38 3hu1 s ILE 189 N 1.70 2.28 0.32 2.83 -1.09 -0.42 -4.67 121.20 122.16 3hu1 s ILE 189 Ca 0.74 0.07 -0.29 0.00 -2.23 0.00 0.00 60.65 58.94 3hu1 s ILE 189 Cb -0.46 -3.04 -0.10 0.00 -1.58 0.00 0.00 42.46 37.28 3hu1 s ILE 189 CO 0.33 0.00 1.25 -0.54 -1.23 0.00 0.00 174.94 174.75 3hu1 s LYS 190 N 1.81 4.41 0.12 2.79 1.02 -1.26 -0.82 119.74 127.81 3hu1 s LYS 190 Ca 0.77 2.10 -0.22 0.00 0.02 0.00 0.00 55.97 58.64 3hu1 s LYS 190 Cb -0.48 -3.08 -0.05 0.00 -0.52 0.00 0.00 37.83 33.71 3hu1 s LYS 190 CO 0.34 -0.10 1.69 -0.09 -0.92 0.00 0.00 175.35 176.27 3hu1 h ARG 191 N 3.45 -0.11 -0.52 1.68 9.65 -1.94 -2.81 114.38 123.78 3hu1 h ARG 191 Ca -0.48 0.01 0.07 0.00 -1.10 0.00 0.00 59.98 58.47 3hu1 h ARG 191 Cb 1.22 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.80 3hu1 h ARG 191 CO 0.66 -0.07 0.35 0.93 2.80 0.00 0.00 179.97 184.63 3hu1 h GLU 192 N -0.12 0.41 -0.22 0.20 5.08 -1.98 -0.88 114.58 117.07 3hu1 h GLU 192 Ca 0.08 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3hu1 h GLU 192 Cb 0.23 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 3hu1 h GLU 192 CO -0.18 0.27 0.10 -0.44 -1.00 0.00 0.00 179.01 177.76 3hu1 h ASP 193 N 0.42 0.29 1.01 1.42 3.45 -1.90 0.90 116.42 122.01 3hu1 h ASP 193 Ca 0.23 -0.14 -0.11 0.00 0.43 0.00 0.00 57.03 57.44 3hu1 h ASP 193 Cb 0.36 -0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 39.04 3hu1 h ASP 193 CO -0.06 0.35 -0.52 -0.33 -1.57 0.00 0.00 179.24 177.12 3hu1 h GLU 194 N 0.22 0.00 0.01 3.56 4.39 -1.28 -1.60 114.58 119.87 3hu1 h GLU 194 Ca 0.07 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.58 3hu1 h GLU 194 Cb 0.14 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 3hu1 h GLU 194 CO -0.01 0.52 -0.90 0.93 -1.16 0.00 0.00 179.01 178.39 3hu1 h GLU 195 N 0.00 0.05 0.00 2.33 4.39 -1.09 -1.76 114.58 118.50 3hu1 h GLU 195 Ca -0.01 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.63 3hu1 h GLU 195 Cb 1.16 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 3hu1 h GLU 195 CO 0.07 0.91 0.00 -1.91 -1.16 0.00 0.00 179.01 176.92 3hu1 n GLU 196 N -3.52 0.09 0.04 2.33 2.13 0.30 -1.16 120.64 120.85 3hu1 n GLU 196 Ca -0.01 0.15 -0.18 0.00 0.66 0.00 0.00 57.16 57.78 3hu1 n GLU 196 Cb 0.85 -1.62 -0.14 0.00 0.27 0.00 0.00 31.44 30.79 3hu1 n GLU 196 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3hu1 h SER 197 N 0.00 0.38 -0.29 4.31 0.87 -1.10 -3.28 113.55 114.43 3hu1 h SER 197 Ca 0.00 -0.64 -0.11 0.00 -1.23 0.00 0.00 61.79 59.82 3hu1 h SER 197 Cb 0.51 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 3hu1 h SER 197 CO 0.00 1.55 -0.18 -0.07 -0.53 0.00 0.00 176.83 177.60 3hu1 h LEU 198 N 0.07 0.75 -1.90 2.23 3.38 -1.21 -3.16 115.31 115.46 3hu1 h LEU 198 Ca -0.31 -0.25 0.27 0.00 0.09 0.00 0.00 57.88 57.68 3hu1 h LEU 198 Cb 2.04 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 42.53 3hu1 h LEU 198 CO 0.13 0.93 0.69 0.78 0.09 0.00 0.00 178.44 181.07 3hu1 h ASN 199 N 0.66 0.07 -1.60 -0.43 2.35 -1.24 -3.45 115.58 111.95 3hu1 h ASN 199 Ca 0.10 0.01 -0.69 0.00 -0.55 0.00 0.00 56.30 55.17 3hu1 h ASN 199 Cb 0.68 -0.00 0.06 0.00 0.05 0.00 0.00 38.32 39.10 3hu1 h ASN 199 CO 0.05 0.02 0.34 -0.62 -1.65 0.00 0.00 177.43 175.57 3hu1 n GLU 200 N -4.30 0.94 -2.55 0.81 1.02 -1.20 -4.87 120.64 110.49 3hu1 n GLU 200 Ca 0.21 0.34 -0.42 0.00 -0.02 0.00 0.00 57.16 57.26 3hu1 n GLU 200 Cb 1.00 -1.92 -0.03 0.00 -0.02 0.00 0.00 31.44 30.46 3hu1 n GLU 200 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3hu1 s VAL 201 N 0.27 4.41 0.50 2.62 1.01 -1.26 -5.06 120.40 122.89 3hu1 s VAL 201 Ca 0.83 1.73 0.01 0.00 0.00 0.00 0.00 61.98 64.56 3hu1 s VAL 201 Cb -0.99 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 31.28 3hu1 s VAL 201 CO 0.49 0.13 0.05 -0.83 0.00 0.00 0.00 175.10 174.94 3hu1 s GLY 202 N 1.06 3.01 0.65 4.51 0.00 -1.26 -4.07 107.32 111.22 3hu1 s GLY 202 Ca 0.56 -0.34 0.39 0.00 0.00 0.00 0.00 44.72 45.32 3hu1 s GLY 202 CO 0.28 -2.10 2.25 -0.97 0.00 0.00 0.00 173.10 172.56 3hu1 h TYR 203 N 1.40 0.00 0.00 1.90 0.99 -1.96 0.26 116.97 119.57 3hu1 h TYR 203 Ca -0.41 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.31 3hu1 h TYR 203 Cb 1.31 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 39.04 3hu1 h TYR 203 CO 1.70 0.00 -0.04 -0.44 -0.00 0.00 0.00 178.16 179.38 3hu1 h ASP 204 N 0.00 0.00 -0.28 3.88 5.19 -2.00 -3.00 116.42 120.21 3hu1 h ASP 204 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 3hu1 h ASP 204 Cb 0.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.69 3hu1 h ASP 204 CO -0.00 0.04 0.00 0.47 -3.12 0.00 0.00 179.24 176.63 3hu1 n ASP 205 N -3.17 2.30 -4.20 6.45 9.92 0.92 -4.79 116.55 123.97 3hu1 n ASP 205 Ca -0.00 -1.84 -0.34 0.00 -0.53 0.00 0.00 54.79 52.08 3hu1 n ASP 205 Cb 0.29 -0.18 -0.15 0.00 -0.64 0.00 0.00 41.12 40.44 3hu1 n ASP 205 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 3hu1 s ILE 206 N -1.64 2.60 0.11 0.53 1.10 -1.14 -5.00 121.20 117.76 3hu1 s ILE 206 Ca 0.34 -0.76 0.05 0.00 -0.51 0.00 0.00 60.65 59.77 3hu1 s ILE 206 Cb 0.19 -2.13 -0.04 0.00 0.15 0.00 0.00 42.46 40.62 3hu1 s ILE 206 CO 0.27 0.49 0.01 -0.83 -2.11 0.00 0.00 174.94 172.77 3hu1 s GLY 207 N 1.34 1.87 -1.51 1.50 0.00 -1.26 -4.66 107.32 104.59 3hu1 s GLY 207 Ca 0.05 -1.17 -0.13 0.00 0.00 0.00 0.00 44.72 43.47 3hu1 s GLY 207 CO -0.09 -1.16 1.02 0.61 0.00 0.00 0.00 173.10 173.49 3hu1 n GLY 208 N 0.38 -0.51 0.42 0.20 0.00 -1.26 -4.80 105.19 99.63 3hu1 n GLY 208 Ca -0.10 0.21 0.02 0.00 0.00 0.00 0.00 46.02 46.14 3hu1 n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu1 h ARG 210 N 0.00 0.03 -0.82 0.00 3.08 -1.91 0.38 114.38 115.15 3hu1 h ARG 210 Ca 0.00 -0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.09 3hu1 h ARG 210 Cb 1.33 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.32 3hu1 h ARG 210 CO 0.00 0.02 0.53 -0.22 -1.07 0.00 0.00 179.97 179.23 3hu1 h LYS 211 N 0.03 0.94 0.12 0.04 3.64 -2.00 -1.34 116.57 118.00 3hu1 h LYS 211 Ca 0.21 -0.06 -0.28 0.00 -1.27 0.00 0.00 60.65 59.25 3hu1 h LYS 211 Cb 0.31 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3hu1 h LYS 211 CO -0.41 0.62 -1.32 1.96 -2.27 0.00 0.00 179.45 178.02 3hu1 h GLN 212 N 0.97 0.26 -0.40 1.90 7.50 -1.47 -2.58 115.11 121.29 3hu1 h GLN 212 Ca 0.33 -0.45 -0.07 0.00 0.50 0.00 0.00 58.65 58.96 3hu1 h GLN 212 Cb 0.10 0.17 -0.02 0.00 0.05 0.00 0.00 27.48 27.78 3hu1 h GLN 212 CO -0.11 1.18 -0.05 -0.07 -1.50 0.00 0.00 178.83 178.29 3hu1 h LEU 213 N 0.07 0.64 -0.33 1.46 3.38 -0.58 -0.96 115.31 119.00 3hu1 h LEU 213 Ca -0.16 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.67 3hu1 h LEU 213 Cb 1.98 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.54 3hu1 h LEU 213 CO 0.19 0.75 0.18 0.00 0.09 0.00 0.00 178.44 179.65 3hu1 h ALA 214 N 1.32 0.41 -0.72 1.53 0.00 -1.22 -1.84 119.26 118.75 3hu1 h ALA 214 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3hu1 h ALA 214 Cb 0.46 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.14 3hu1 h ALA 214 CO 0.02 -0.18 0.46 1.96 0.00 0.00 0.00 179.25 181.50 3hu1 h GLN 215 N 0.37 0.97 -0.56 0.00 4.20 -1.04 -2.01 115.11 117.05 3hu1 h GLN 215 Ca 0.14 -0.08 -0.07 0.00 0.06 0.00 0.00 58.65 58.70 3hu1 h GLN 215 Cb 0.03 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.57 3hu1 h GLN 215 CO -0.08 0.67 0.09 0.82 -0.67 0.00 0.00 178.83 179.66 3hu1 h ILE 216 N 0.99 1.25 -0.05 2.54 2.04 -0.88 -0.75 117.51 122.65 3hu1 h ILE 216 Ca 0.26 -0.97 -0.08 0.00 1.00 0.00 0.00 64.86 65.08 3hu1 h ILE 216 Cb -0.07 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 3hu1 h ILE 216 CO -0.05 0.35 -0.34 0.11 0.00 0.00 0.00 178.15 178.22 3hu1 h LYS 217 N 0.83 0.10 -0.26 2.37 1.57 -1.08 0.39 116.57 120.48 3hu1 h LYS 217 Ca 0.17 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 3hu1 h LYS 217 Cb 0.41 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 3hu1 h LYS 217 CO 0.01 0.43 -0.11 0.93 -0.57 0.00 0.00 179.45 180.14 3hu1 h GLU 218 N 0.09 0.54 0.00 3.15 5.08 -0.78 0.36 114.58 123.02 3hu1 h GLU 218 Ca 0.01 -0.23 -0.23 0.00 -1.00 0.00 0.00 59.36 57.92 3hu1 h GLU 218 Cb 0.64 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 3hu1 h GLU 218 CO 0.05 0.78 -1.70 -1.33 -1.00 0.00 0.00 179.01 175.81 3hu1 n MET 219 N -4.48 0.64 -0.03 2.33 2.81 -0.34 -4.27 117.12 113.78 3hu1 n MET 219 Ca -0.04 0.18 -0.07 0.00 -1.81 0.00 0.00 57.70 55.95 3hu1 n MET 219 Cb 0.34 -1.73 -0.02 0.00 -0.71 0.00 0.00 33.22 31.09 3hu1 n MET 219 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3hu1 n VAL 220 N -2.86 1.17 -0.03 2.03 0.31 0.13 -4.67 118.33 114.41 3hu1 n VAL 220 Ca -0.15 0.14 -0.13 0.00 -0.01 0.00 0.00 64.34 64.18 3hu1 n VAL 220 Cb 0.94 -1.87 -0.09 0.00 -0.91 0.00 0.00 33.84 31.90 3hu1 n VAL 220 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hu1 h GLU 221 N -0.48 0.10 -0.70 5.55 4.57 -1.44 -3.25 114.58 118.93 3hu1 h GLU 221 Ca -0.10 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.02 3hu1 h GLU 221 Cb 0.73 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.29 3hu1 h GLU 221 CO -0.06 0.61 0.46 1.25 -1.18 0.00 0.00 179.01 180.09 3hu1 h LEU 222 N -0.39 0.80 -0.94 1.64 5.85 -0.48 -1.42 115.31 120.36 3hu1 h LEU 222 Ca 0.00 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 3hu1 h LEU 222 Cb 0.60 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 3hu1 h LEU 222 CO 0.01 0.57 -0.22 -0.65 -0.34 0.00 0.00 178.44 177.81 3hu1 h PRO 223 N 0.94 0.00 0.15 5.25 0.11 -1.74 -0.90 132.00 135.81 3hu1 h PRO 223 Ca 0.26 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.04 3hu1 h PRO 223 Cb -0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.02 3hu1 h PRO 223 CO -0.06 0.22 -1.62 -0.07 -0.21 0.00 0.00 178.00 176.26 3hu1 h LEU 224 N 0.00 0.51 0.15 2.35 3.38 -1.52 -2.82 115.31 117.35 3hu1 h LEU 224 Ca -0.00 -0.72 -0.29 0.00 0.09 0.00 0.00 57.88 56.96 3hu1 h LEU 224 Cb 0.82 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.41 3hu1 h LEU 224 CO 0.03 1.60 -1.32 0.03 0.09 0.00 0.00 178.44 178.86 3hu1 h ARG 225 N 0.09 0.31 -2.15 1.13 2.47 -1.34 -3.41 114.38 111.47 3hu1 h ARG 225 Ca -0.29 -0.52 -0.55 0.00 -1.26 0.00 0.00 59.98 57.36 3hu1 h ARG 225 Cb 2.06 0.20 -0.41 0.00 -1.65 0.00 0.00 29.97 30.16 3hu1 h ARG 225 CO 0.17 1.24 -0.86 0.72 0.56 0.00 0.00 179.97 181.80 3hu1 n HIS 226 N -3.55 2.32 0.29 3.04 8.25 -0.34 -4.92 115.22 120.31 3hu1 n HIS 226 Ca -0.11 -3.92 0.15 0.00 -0.26 0.00 0.00 57.72 53.58 3hu1 n HIS 226 Cb 1.04 -0.46 0.88 0.00 1.12 0.00 0.00 29.99 32.57 3hu1 n HIS 226 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3hu1 h PRO 227 N 3.22 0.00 -0.98 -0.41 0.13 -1.67 -2.32 132.00 129.97 3hu1 h PRO 227 Ca 0.12 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 65.38 3hu1 h PRO 227 Cb 0.71 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.75 3hu1 h PRO 227 CO 0.68 0.03 0.61 0.00 -0.23 0.00 0.00 178.00 179.09 3hu1 h ALA 228 N 1.97 1.50 -0.04 -0.56 0.00 -1.91 -1.69 119.26 118.54 3hu1 h ALA 228 Ca -0.00 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.97 3hu1 h ALA 228 Cb 0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3hu1 h ALA 228 CO 0.00 0.15 -0.13 -0.07 0.00 0.00 0.00 179.25 179.21 3hu1 h LEU 229 N 0.92 -0.38 -0.37 0.00 3.38 -1.80 0.26 115.31 117.33 3hu1 h LEU 229 Ca 0.50 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 58.43 3hu1 h LEU 229 Cb 0.56 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3hu1 h LEU 229 CO -0.29 -0.18 -0.20 -0.26 0.09 0.00 0.00 178.44 177.60 3hu1 h PHE 230 N -0.20 0.91 -0.71 1.13 -1.00 -1.64 -0.90 116.94 114.52 3hu1 h PHE 230 Ca 0.06 -0.23 -0.06 0.00 2.81 0.00 0.00 57.97 60.55 3hu1 h PHE 230 Cb 0.28 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.60 3hu1 h PHE 230 CO -0.21 0.98 0.23 -0.22 -1.61 0.00 0.00 178.31 177.48 3hu1 h LYS 231 N 0.57 1.10 -0.24 1.51 3.11 -1.18 -0.63 116.57 120.81 3hu1 h LYS 231 Ca 0.08 -0.23 -0.04 0.00 -2.81 0.00 0.00 60.65 57.64 3hu1 h LYS 231 Cb 0.76 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 31.82 3hu1 h LYS 231 CO 0.06 0.94 -0.02 0.00 -2.81 0.00 0.00 179.45 177.63 3hu1 h ALA 232 N 1.11 0.33 0.00 5.00 0.00 -0.31 -3.03 119.26 122.36 3hu1 h ALA 232 Ca 0.23 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3hu1 h ALA 232 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3hu1 h ALA 232 CO -0.01 0.08 -0.38 0.97 0.00 0.00 0.00 179.25 179.91 3hu1 h ILE 233 N 0.20 1.20 0.00 0.00 2.10 -1.11 -3.47 117.51 116.42 3hu1 h ILE 233 Ca 0.07 -1.32 0.00 0.00 1.08 0.00 0.00 64.86 64.69 3hu1 h ILE 233 Cb 0.44 1.72 0.00 0.00 -1.09 0.00 0.00 36.82 37.90 3hu1 h ILE 233 CO 0.02 0.37 0.00 0.61 -1.08 0.00 0.00 178.15 178.06 3hu1 n GLY 234 N -0.36 1.04 2.89 8.18 0.00 -0.74 -5.10 105.19 111.09 3hu1 n GLY 234 Ca -0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.83 3hu1 n GLY 234 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hu1 s VAL 235 N -2.00 0.34 0.19 1.61 1.01 -0.32 -5.04 120.40 116.19 3hu1 s VAL 235 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 3hu1 s VAL 235 Cb 0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 36.38 35.94 3hu1 s VAL 235 CO 0.00 0.15 0.97 -0.54 0.00 0.00 0.00 175.10 175.68 3hu1 s LYS 236 N 0.55 4.77 0.13 2.72 1.02 -1.26 -4.04 119.74 123.63 3hu1 s LYS 236 Ca -0.06 1.52 -0.30 0.00 0.02 0.00 0.00 55.97 57.15 3hu1 s LYS 236 Cb -0.09 -3.31 -0.07 0.00 -0.52 0.00 0.00 37.83 33.84 3hu1 s LYS 236 CO -0.01 0.35 1.07 -1.25 -0.92 0.00 0.00 175.35 174.60 3hu1 s PRO 237 N -0.72 4.59 0.36 -1.68 0.04 -1.26 -5.00 135.00 131.34 3hu1 s PRO 237 Ca 0.44 1.64 -0.28 0.00 0.04 0.00 0.00 61.00 62.84 3hu1 s PRO 237 Cb -0.26 -3.32 -0.11 0.00 0.04 0.00 0.00 34.50 30.85 3hu1 s PRO 237 CO 0.32 0.05 1.51 -2.14 0.04 0.00 0.00 177.00 176.78 3hu1 s PRO 238 N 0.03 4.11 0.00 0.56 0.02 -1.26 -4.93 135.00 133.52 3hu1 s PRO 238 Ca 0.50 2.58 0.08 0.00 0.02 0.00 0.00 61.00 64.18 3hu1 s PRO 238 Cb -0.27 -2.97 0.12 0.00 0.02 0.00 0.00 34.50 31.40 3hu1 s PRO 238 CO 0.32 -0.56 0.92 2.89 -0.33 0.00 0.00 177.00 180.25 3hu1 n ARG 239 N 0.74 1.23 -3.63 5.54 1.85 -1.26 -4.95 116.66 116.18 3hu1 n ARG 239 Ca 0.02 -1.34 -0.15 0.00 -1.00 0.00 0.00 57.85 55.38 3hu1 n ARG 239 Cb 0.39 -1.17 -0.14 0.00 -1.05 0.00 0.00 32.46 30.49 3hu1 n ARG 239 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 3hu1 s GLY 240 N -0.79 -0.05 -0.09 2.89 0.00 -1.08 -1.59 107.32 106.61 3hu1 s GLY 240 Ca 0.12 0.72 0.05 0.00 0.00 0.00 0.00 44.72 45.61 3hu1 s GLY 240 CO 0.10 1.92 -0.24 -0.42 0.00 0.00 0.00 173.10 174.46 3hu1 s ILE 241 N 2.37 2.05 -0.17 0.90 -1.09 0.07 -2.47 121.20 122.85 3hu1 s ILE 241 Ca 0.03 -1.03 0.01 0.00 -2.23 0.00 0.00 60.65 57.43 3hu1 s ILE 241 Cb -0.13 -1.76 0.02 0.00 -1.58 0.00 0.00 42.46 39.02 3hu1 s ILE 241 CO -0.08 0.56 -0.20 -0.22 -1.23 0.00 0.00 174.94 173.76 3hu1 s LEU 242 N 0.17 2.13 -0.19 2.97 2.96 0.62 -1.33 118.68 126.01 3hu1 s LEU 242 Ca -0.14 -0.64 -0.16 0.00 -0.22 0.00 0.00 54.13 52.98 3hu1 s LEU 242 Cb -0.17 -1.48 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 3hu1 s LEU 242 CO 0.07 0.02 0.39 -0.76 -1.32 0.00 0.00 176.35 174.75 3hu1 s LEU 243 N 1.19 4.17 0.13 -0.68 1.43 0.16 0.13 118.68 125.21 3hu1 s LEU 243 Ca 0.02 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.68 3hu1 s LEU 243 Cb -0.14 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 43.54 3hu1 s LEU 243 CO -0.10 -0.05 -0.06 -0.72 0.23 0.00 0.00 176.35 175.65 3hu1 s TYR 244 N 1.16 1.07 0.00 0.29 -0.85 -0.89 -0.66 117.35 117.47 3hu1 s TYR 244 Ca 0.19 -0.90 0.00 0.00 -0.52 0.00 0.00 57.07 55.84 3hu1 s TYR 244 Cb -0.15 -0.60 0.00 0.00 0.38 0.00 0.00 41.96 41.60 3hu1 s TYR 244 CO 0.08 -0.10 0.00 0.41 -1.52 0.00 0.00 175.55 174.41 3hu1 n GLY 245 N -0.14 2.88 3.45 5.49 0.00 -1.19 -0.31 105.19 115.37 3hu1 n GLY 245 Ca -0.10 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.57 3hu1 n GLY 245 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hu1 n PRO 246 N -1.11 -1.03 -1.70 1.61 -0.02 -1.26 -4.21 135.00 127.28 3hu1 n PRO 246 Ca 0.00 -0.26 -0.43 0.00 -2.02 0.00 0.00 63.50 60.79 3hu1 n PRO 246 Cb 0.00 -1.98 -0.01 0.00 -0.02 0.00 0.00 33.50 31.49 3hu1 n PRO 246 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3hu1 n PRO 247 N -2.91 2.17 -1.81 0.52 -0.02 -1.26 -3.58 135.00 128.11 3hu1 n PRO 247 Ca 0.06 0.76 -0.08 0.00 -2.02 0.00 0.00 63.50 62.22 3hu1 n PRO 247 Cb 0.55 -2.38 -0.01 0.00 -0.02 0.00 0.00 33.50 31.64 3hu1 n PRO 247 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hu1 n GLY 248 N 1.13 0.39 0.11 -1.23 0.00 -1.26 -4.93 105.19 99.39 3hu1 n GLY 248 Ca 0.06 -0.61 0.09 0.00 0.00 0.00 0.00 46.02 45.57 3hu1 n GLY 248 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hu1 n THR 249 N -3.56 0.70 0.00 2.61 -2.24 -1.24 -1.61 114.28 108.95 3hu1 n THR 249 Ca -0.09 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 3hu1 n THR 249 Cb 0.46 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 3hu1 n THR 249 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hu1 n GLY 250 N 1.22 1.53 0.21 3.38 0.00 -1.26 -4.66 105.19 105.62 3hu1 n GLY 250 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 3hu1 n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hu1 h LYS 251 N 0.00 -0.45 -0.65 1.61 1.57 -1.94 0.98 116.57 117.69 3hu1 h LYS 251 Ca 0.00 0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 3hu1 h LYS 251 Cb 0.00 0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 3hu1 h LYS 251 CO 0.00 -0.16 0.20 1.15 -0.57 0.00 0.00 179.45 180.07 3hu1 h THR 252 N -0.71 1.24 -0.55 -0.16 2.02 -1.98 0.16 112.91 112.92 3hu1 h THR 252 Ca -0.05 -0.83 0.01 0.00 0.77 0.00 0.00 66.41 66.31 3hu1 h THR 252 Cb 0.49 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 3hu1 h THR 252 CO 0.08 0.32 0.35 0.25 0.37 0.00 0.00 175.52 176.89 3hu1 h LEU 253 N 0.96 0.59 -0.47 2.58 5.85 -1.95 0.85 115.31 123.72 3hu1 h LEU 253 Ca 0.21 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.92 3hu1 h LEU 253 Cb 0.27 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3hu1 h LEU 253 CO -0.01 0.42 0.29 0.40 -0.34 0.00 0.00 178.44 179.20 3hu1 h ILE 254 N 0.71 1.15 -0.68 4.05 2.04 0.14 -0.90 117.51 124.02 3hu1 h ILE 254 Ca 0.21 -0.33 0.13 0.00 1.00 0.00 0.00 64.86 65.87 3hu1 h ILE 254 Cb -0.04 0.51 -0.09 0.00 -0.74 0.00 0.00 36.82 36.46 3hu1 h ILE 254 CO -0.07 0.15 0.21 0.00 0.00 0.00 0.00 178.15 178.44 3hu1 h ALA 255 N 1.14 0.88 -0.30 1.87 0.00 -0.29 0.18 119.26 122.74 3hu1 h ALA 255 Ca 0.17 0.13 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 3hu1 h ALA 255 Cb -0.01 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3hu1 h ALA 255 CO -0.03 -0.27 -0.32 0.00 0.00 0.00 0.00 179.25 178.64 3hu1 h ARG 256 N 0.34 0.64 -0.01 0.00 2.47 -0.62 -2.17 114.38 115.04 3hu1 h ARG 256 Ca 0.37 -0.29 -0.00 0.00 -1.26 0.00 0.00 59.98 58.79 3hu1 h ARG 256 Cb 0.55 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.86 3hu1 h ARG 256 CO -0.41 0.88 0.00 0.00 0.56 0.00 0.00 179.97 181.00 3hu1 h ALA 257 N 1.10 0.01 -0.17 0.04 0.00 0.47 -1.84 119.26 118.88 3hu1 h ALA 257 Ca 0.06 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3hu1 h ALA 257 Cb 0.81 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 3hu1 h ALA 257 CO 0.07 -0.35 -0.06 0.28 0.00 0.00 0.00 179.25 179.19 3hu1 h VAL 258 N -0.24 0.79 -0.88 0.00 2.07 -0.75 0.25 116.25 117.49 3hu1 h VAL 258 Ca 0.00 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.74 3hu1 h VAL 258 Cb 0.26 0.79 -0.12 0.00 -1.52 0.00 0.00 31.29 30.70 3hu1 h VAL 258 CO 0.00 0.00 0.35 0.00 0.02 0.00 0.00 177.57 177.94 3hu1 h ALA 259 N 1.14 1.36 0.00 1.67 0.00 -1.25 0.59 119.26 122.76 3hu1 h ALA 259 Ca 0.09 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3hu1 h ALA 259 Cb 0.16 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hu1 h ALA 259 CO -0.19 -0.36 -0.66 -0.91 0.00 0.00 0.00 179.25 177.13 3hu1 h ASN 260 N 0.36 0.00 0.00 0.00 -0.26 0.14 -3.38 115.58 112.45 3hu1 h ASN 260 Ca 0.54 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 56.25 3hu1 h ASN 260 Cb 1.03 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.29 3hu1 h ASN 260 CO -0.54 0.02 -1.02 -0.62 -1.06 0.00 0.00 177.43 174.20 3hu1 n GLU 261 N -2.68 1.62 -3.49 0.81 -0.58 0.58 -4.02 120.64 112.87 3hu1 n GLU 261 Ca 0.02 -0.05 -0.30 0.00 -0.42 0.00 0.00 57.16 56.41 3hu1 n GLU 261 Cb 0.52 -1.24 -0.04 0.00 -0.57 0.00 0.00 31.44 30.11 3hu1 n GLU 261 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3hu1 s THR 262 N -2.59 5.05 0.23 2.62 -4.23 -0.21 -4.57 115.64 111.94 3hu1 s THR 262 Ca 0.02 0.14 0.25 0.00 -1.18 0.00 0.00 61.69 60.92 3hu1 s THR 262 Cb 0.10 -3.67 0.25 0.00 1.34 0.00 0.00 72.50 70.53 3hu1 s THR 262 CO 0.60 -0.13 1.91 1.23 -0.54 0.00 0.00 174.62 177.69 3hu1 h GLY 263 N 2.31 0.00 -1.89 3.99 0.00 -1.95 -3.45 103.07 102.08 3hu1 h GLY 263 Ca -0.47 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.37 3hu1 h GLY 263 CO 0.69 0.00 0.39 0.00 0.00 0.00 0.00 176.54 177.62 3hu1 s ALA 264 N -3.82 2.69 0.12 3.60 0.00 -1.26 -5.01 121.76 118.07 3hu1 s ALA 264 Ca -0.01 0.59 -0.31 0.00 0.00 0.00 0.00 51.96 52.24 3hu1 s ALA 264 Cb 0.11 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.86 3hu1 s ALA 264 CO 0.62 -0.82 1.36 0.12 0.00 0.00 0.00 175.76 177.04 3hu1 s PHE 265 N -2.14 3.26 -0.08 0.00 5.36 -0.98 -4.87 117.98 118.53 3hu1 s PHE 265 Ca 0.68 1.02 0.01 0.00 -0.96 0.00 0.00 56.93 57.67 3hu1 s PHE 265 Cb -0.19 -3.65 -0.03 0.00 -0.34 0.00 0.00 43.02 38.81 3hu1 s PHE 265 CO 0.32 -2.23 -0.10 0.12 -1.46 0.00 0.00 175.22 171.87 3hu1 s PHE 266 N 0.96 2.84 -0.15 10.12 5.36 -1.26 -0.36 117.98 135.49 3hu1 s PHE 266 Ca 0.63 -0.17 -0.01 0.00 -0.96 0.00 0.00 56.93 56.42 3hu1 s PHE 266 Cb -0.36 -1.73 0.04 0.00 -0.34 0.00 0.00 43.02 40.63 3hu1 s PHE 266 CO 0.31 0.16 -0.03 0.12 -1.46 0.00 0.00 175.22 174.32 3hu1 s PHE 267 N -0.49 1.40 0.01 10.12 2.19 0.63 -4.96 117.98 126.88 3hu1 s PHE 267 Ca 0.07 -0.87 -0.18 0.00 0.33 0.00 0.00 56.93 56.28 3hu1 s PHE 267 Cb -0.12 -1.18 -0.06 0.00 -1.31 0.00 0.00 43.02 40.36 3hu1 s PHE 267 CO 0.02 -0.56 0.51 -1.17 1.83 0.00 0.00 175.22 175.85 3hu1 s LEU 268 N 1.73 4.46 -0.11 6.12 2.96 -1.26 -0.18 118.68 132.41 3hu1 s LEU 268 Ca 0.01 1.09 -0.01 0.00 -0.22 0.00 0.00 54.13 55.01 3hu1 s LEU 268 Cb -0.15 -2.77 0.03 0.00 0.50 0.00 0.00 46.19 43.80 3hu1 s LEU 268 CO -0.07 0.23 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.49 3hu1 s ILE 269 N -0.71 0.93 -0.21 6.68 1.01 0.12 -4.93 121.20 124.08 3hu1 s ILE 269 Ca 0.27 -0.23 -0.15 0.00 0.00 0.00 0.00 60.65 60.54 3hu1 s ILE 269 Cb -0.18 -0.97 -0.04 0.00 0.01 0.00 0.00 42.46 41.28 3hu1 s ILE 269 CO 0.16 0.35 0.38 0.20 0.00 0.00 0.00 174.94 176.03 3hu1 s ASN 270 N 1.74 6.39 0.14 3.58 0.01 -1.26 -0.13 114.94 125.40 3hu1 s ASN 270 Ca 0.05 0.46 -0.29 0.00 -0.71 0.00 0.00 52.86 52.37 3hu1 s ASN 270 Cb -0.13 -2.22 -0.07 0.00 0.41 0.00 0.00 41.25 39.25 3hu1 s ASN 270 CO -0.08 -0.08 1.49 1.23 -1.51 0.00 0.00 177.10 178.15 3hu1 h GLY 271 N 7.76 -1.03 1.70 0.66 0.00 -0.25 -1.10 103.07 110.80 3hu1 h GLY 271 Ca -0.36 0.82 -0.01 0.00 0.00 0.00 0.00 47.33 47.78 3hu1 h GLY 271 CO 0.70 -0.07 0.13 -2.55 0.00 0.00 0.00 176.54 174.76 3hu1 h PRO 272 N -0.06 0.40 -0.27 4.80 0.11 -1.84 -2.01 132.00 133.14 3hu1 h PRO 272 Ca 0.13 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.16 3hu1 h PRO 272 Cb 0.40 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 3hu1 h PRO 272 CO -0.80 0.32 -0.02 1.49 -0.21 0.00 0.00 178.00 178.78 3hu1 h GLU 273 N 0.40 0.40 -0.00 1.05 4.22 -1.63 -1.82 114.58 117.20 3hu1 h GLU 273 Ca 0.10 -0.08 -0.03 0.00 0.08 0.00 0.00 59.36 59.43 3hu1 h GLU 273 Cb 0.06 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hu1 h GLU 273 CO -0.01 0.45 -0.13 0.82 -2.18 0.00 0.00 179.01 177.95 3hu1 h ILE 274 N 0.39 1.58 0.00 2.32 1.08 -0.66 -3.31 117.51 118.91 3hu1 h ILE 274 Ca 0.09 -1.89 0.00 0.00 -0.39 0.00 0.00 64.86 62.67 3hu1 h ILE 274 Cb 0.29 2.81 0.00 0.00 -3.07 0.00 0.00 36.82 36.85 3hu1 h ILE 274 CO 0.01 0.51 0.00 0.23 -0.69 0.00 0.00 178.15 178.20 3hu1 n MET 275 N -4.61 0.12 0.05 2.37 2.81 -0.82 -1.78 117.12 115.28 3hu1 n MET 275 Ca -0.10 0.21 0.12 0.00 -1.81 0.00 0.00 57.70 56.12 3hu1 n MET 275 Cb 0.45 -1.50 0.23 0.00 -0.71 0.00 0.00 33.22 31.69 3hu1 n MET 275 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3hu1 n SER 276 N -1.34 0.65 -4.89 7.83 3.41 -0.72 -4.93 113.62 113.62 3hu1 n SER 276 Ca 0.05 0.14 -0.29 0.00 -0.26 0.00 0.00 58.87 58.51 3hu1 n SER 276 Cb 0.11 0.03 -0.02 0.00 -0.26 0.00 0.00 64.21 64.07 3hu1 n SER 276 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3hu1 s LYS 277 N -3.13 3.65 0.66 4.33 1.02 -0.73 -5.06 119.74 120.48 3hu1 s LYS 277 Ca 0.08 0.27 -0.17 0.00 0.02 0.00 0.00 55.97 56.16 3hu1 s LYS 277 Cb 0.14 -2.43 -0.05 0.00 -0.52 0.00 0.00 37.83 34.98 3hu1 s LYS 277 CO 0.69 -0.07 0.69 1.28 -0.92 0.00 0.00 175.35 177.02 3hu1 n LEU 278 N -1.68 1.86 -4.68 3.17 4.77 -1.26 -4.68 117.00 114.50 3hu1 n LEU 278 Ca 0.01 0.68 -0.48 0.00 -0.03 0.00 0.00 56.01 56.19 3hu1 n LEU 278 Cb 0.55 -1.27 -0.05 0.00 -2.33 0.00 0.00 43.42 40.32 3hu1 n LEU 278 CO 0.50 -2.67 1.45 0.00 -1.33 0.00 0.00 177.39 175.34 3hu1 n ALA 279 N -2.10 0.88 0.00 -1.18 0.00 -1.26 -2.07 120.51 114.78 3hu1 n ALA 279 Ca 0.12 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.86 3hu1 n ALA 279 Cb 0.49 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.47 3hu1 n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hu1 n GLY 280 N 4.28 2.68 0.27 0.00 0.00 -1.26 -4.74 105.19 106.42 3hu1 n GLY 280 Ca 0.22 -0.65 0.13 0.00 0.00 0.00 0.00 46.02 45.72 3hu1 n GLY 280 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hu1 h GLU 281 N 0.00 0.00 -0.05 1.61 4.81 -1.83 0.66 114.58 119.79 3hu1 h GLU 281 Ca 0.00 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 3hu1 h GLU 281 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3hu1 h GLU 281 CO 0.00 0.08 -0.28 0.66 -0.73 0.00 0.00 179.01 178.74 3hu1 h SER 282 N 0.00 0.33 -0.63 1.04 4.64 -1.69 -2.81 113.55 114.43 3hu1 h SER 282 Ca -0.00 -0.67 0.06 0.00 -0.47 0.00 0.00 61.79 60.70 3hu1 h SER 282 Cb 0.21 -0.10 -0.04 0.00 -0.31 0.00 0.00 62.40 62.17 3hu1 h SER 282 CO 0.01 0.95 0.42 -0.33 -0.87 0.00 0.00 176.83 177.01 3hu1 h GLU 283 N -0.27 0.63 -0.53 4.77 3.07 -1.67 -2.00 114.58 118.59 3hu1 h GLU 283 Ca -0.02 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 58.74 3hu1 h GLU 283 Cb 0.95 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.70 3hu1 h GLU 283 CO 0.06 0.41 0.08 1.03 -1.40 0.00 0.00 179.01 179.20 3hu1 h SER 284 N 0.64 0.84 -0.18 1.42 0.87 -0.96 -1.67 113.55 114.51 3hu1 h SER 284 Ca 0.27 -0.26 -0.09 0.00 -1.23 0.00 0.00 61.79 60.48 3hu1 h SER 284 Cb 0.24 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 3hu1 h SER 284 CO -0.08 0.89 -0.17 0.78 -0.53 0.00 0.00 176.83 177.71 3hu1 h ASN 285 N 0.76 0.60 -0.32 6.23 -0.26 -1.11 -0.52 115.58 120.96 3hu1 h ASN 285 Ca 0.16 -0.18 -0.01 0.00 -0.56 0.00 0.00 56.30 55.71 3hu1 h ASN 285 Cb 0.41 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.49 3hu1 h ASN 285 CO 0.01 0.78 0.17 -0.07 -1.06 0.00 0.00 177.43 177.26 3hu1 h LEU 286 N 0.54 0.40 -0.37 1.61 3.38 -1.19 -1.20 115.31 118.47 3hu1 h LEU 286 Ca 0.09 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3hu1 h LEU 286 Cb 0.61 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3hu1 h LEU 286 CO 0.04 0.37 0.11 0.03 0.09 0.00 0.00 178.44 179.08 3hu1 h ARG 287 N 0.39 0.58 -0.27 1.13 3.08 -1.20 -2.77 114.38 115.31 3hu1 h ARG 287 Ca 0.11 -0.13 0.04 0.00 0.07 0.00 0.00 59.98 60.07 3hu1 h ARG 287 Cb 0.07 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 3hu1 h ARG 287 CO -0.02 0.60 0.18 -0.22 -1.07 0.00 0.00 179.97 179.44 3hu1 h LYS 288 N 0.44 0.20 -0.13 0.04 1.63 -0.96 0.22 116.57 118.01 3hu1 h LYS 288 Ca 0.12 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.87 3hu1 h LYS 288 Cb 0.27 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 31.85 3hu1 h LYS 288 CO -0.00 0.13 -0.07 0.00 -3.45 0.00 0.00 179.45 176.06 3hu1 h ALA 289 N 1.85 0.18 -0.11 5.00 0.00 -1.00 -1.16 119.26 124.02 3hu1 h ALA 289 Ca 0.11 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 3hu1 h ALA 289 Cb 0.21 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3hu1 h ALA 289 CO -0.02 -0.02 -0.18 0.74 0.00 0.00 0.00 179.25 179.77 3hu1 h PHE 290 N -0.08 0.39 -0.79 0.00 -1.00 -0.99 -1.30 116.94 113.18 3hu1 h PHE 290 Ca 0.03 -0.14 0.09 0.00 2.81 0.00 0.00 57.97 60.77 3hu1 h PHE 290 Cb 0.54 -0.08 -0.07 0.00 3.61 0.00 0.00 35.95 39.96 3hu1 h PHE 290 CO 0.07 0.78 0.44 0.93 -1.61 0.00 0.00 178.31 178.92 3hu1 h GLU 291 N -0.11 0.72 -0.05 1.51 5.08 -1.05 0.16 114.58 120.84 3hu1 h GLU 291 Ca 0.01 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3hu1 h GLU 291 Cb 0.75 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 3hu1 h GLU 291 CO 0.04 0.47 0.01 1.49 -1.00 0.00 0.00 179.01 180.03 3hu1 h GLU 292 N 0.74 0.08 -0.72 2.33 4.57 -1.16 -1.01 114.58 119.41 3hu1 h GLU 292 Ca 0.38 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.53 3hu1 h GLU 292 Cb 0.36 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.90 3hu1 h GLU 292 CO -0.25 0.28 0.41 0.00 -1.18 0.00 0.00 179.01 178.27 3hu1 h ALA 293 N 0.79 0.92 -1.01 2.92 0.00 -0.94 -1.33 119.26 120.62 3hu1 h ALA 293 Ca 0.02 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.86 3hu1 h ALA 293 Cb 0.24 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 3hu1 h ALA 293 CO 0.00 0.42 0.66 0.93 0.00 0.00 0.00 179.25 181.26 3hu1 h GLU 294 N 0.99 1.22 -0.21 0.00 5.08 -0.61 -2.97 114.58 118.08 3hu1 h GLU 294 Ca 0.26 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.40 3hu1 h GLU 294 Cb 0.01 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 28.98 3hu1 h GLU 294 CO -0.04 0.81 -0.45 -0.22 -1.00 0.00 0.00 179.01 178.11 3hu1 h LYS 295 N 1.26 0.52 -4.23 2.33 3.64 -0.25 -3.41 116.57 116.43 3hu1 h LYS 295 Ca 0.41 -0.28 -0.74 0.00 -1.27 0.00 0.00 60.65 58.77 3hu1 h LYS 295 Cb 0.03 0.01 -0.27 0.00 -0.41 0.00 0.00 32.23 31.60 3hu1 h LYS 295 CO -0.13 0.87 -0.32 -0.80 -2.27 0.00 0.00 179.45 176.79 3hu1 s ASN 296 N -6.87 5.93 0.61 4.20 -0.87 -0.59 -5.03 114.94 112.31 3hu1 s ASN 296 Ca -0.07 -1.78 0.00 0.00 -1.57 0.00 0.00 52.86 49.44 3hu1 s ASN 296 Cb 0.12 -2.10 0.00 0.00 -0.02 0.00 0.00 41.25 39.25 3hu1 s ASN 296 CO 0.82 -0.74 0.00 0.00 -2.57 0.00 0.00 177.10 174.61 3hu1 n ALA 297 N 5.07 -1.02 -1.64 0.60 0.00 -1.26 -4.12 120.51 118.14 3hu1 n ALA 297 Ca -0.11 0.11 -0.46 0.00 0.00 0.00 0.00 53.44 52.97 3hu1 n ALA 297 Cb 0.41 -0.34 -0.03 0.00 0.00 0.00 0.00 19.45 19.49 3hu1 n ALA 297 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hu1 n PRO 298 N -2.08 1.78 -4.02 0.00 -0.01 -1.26 -4.87 135.00 124.53 3hu1 n PRO 298 Ca 0.00 0.63 -0.09 0.00 -0.01 0.00 0.00 63.50 64.04 3hu1 n PRO 298 Cb 0.15 -2.26 -0.11 0.00 -0.01 0.00 0.00 33.50 31.28 3hu1 n PRO 298 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 3hu1 s ALA 299 N 0.03 0.29 -0.13 3.55 0.00 -0.83 -2.31 121.76 122.35 3hu1 s ALA 299 Ca 0.71 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.87 3hu1 s ALA 299 Cb -0.72 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 3hu1 s ALA 299 CO 0.49 -0.22 -0.16 0.42 0.00 0.00 0.00 175.76 176.29 3hu1 s ILE 300 N -2.28 2.70 -0.25 0.00 1.01 0.51 -2.23 121.20 120.67 3hu1 s ILE 300 Ca -0.08 -0.78 -0.09 0.00 0.00 0.00 0.00 60.65 59.71 3hu1 s ILE 300 Cb -0.04 -2.12 -0.04 0.00 0.01 0.00 0.00 42.46 40.28 3hu1 s ILE 300 CO -0.04 0.53 0.11 -0.63 0.00 0.00 0.00 174.94 174.91 3hu1 s ILE 301 N 0.51 4.72 -0.28 2.92 1.01 -0.57 -0.27 121.20 129.25 3hu1 s ILE 301 Ca -0.11 -0.04 -0.07 0.00 0.00 0.00 0.00 60.65 60.44 3hu1 s ILE 301 Cb -0.16 -3.21 -0.00 0.00 0.01 0.00 0.00 42.46 39.10 3hu1 s ILE 301 CO 0.04 0.33 0.07 0.12 0.00 0.00 0.00 174.94 175.51 3hu1 s PHE 302 N 1.44 3.12 -0.55 3.97 5.36 0.75 0.36 117.98 132.43 3hu1 s PHE 302 Ca 0.06 -0.83 -0.16 0.00 -0.96 0.00 0.00 56.93 55.04 3hu1 s PHE 302 Cb -0.15 -2.24 0.13 0.00 -0.34 0.00 0.00 43.02 40.42 3hu1 s PHE 302 CO 0.05 -0.52 0.51 0.42 -1.46 0.00 0.00 175.22 174.23 3hu1 s ILE 303 N 1.53 5.22 0.04 3.12 1.01 0.34 0.13 121.20 132.58 3hu1 s ILE 303 Ca 0.04 -1.55 -0.24 0.00 0.00 0.00 0.00 60.65 58.90 3hu1 s ILE 303 Cb -0.16 -4.34 -0.05 0.00 0.01 0.00 0.00 42.46 37.91 3hu1 s ILE 303 CO 0.02 -0.88 0.73 -0.62 0.00 0.00 0.00 174.94 174.20 3hu1 s ASP 304 N 3.52 7.16 -0.97 3.58 2.15 0.81 -1.88 116.67 131.05 3hu1 s ASP 304 Ca 0.04 1.39 -0.02 0.00 0.43 0.00 0.00 52.55 54.38 3hu1 s ASP 304 Cb -0.29 -2.45 -0.03 0.00 -0.30 0.00 0.00 42.92 39.86 3hu1 s ASP 304 CO 0.02 0.03 0.83 -0.62 -0.17 0.00 0.00 175.17 175.27 3hu1 n GLU 305 N 2.78 -4.00 -0.34 4.34 1.02 -0.38 0.39 120.64 124.44 3hu1 n GLU 305 Ca -0.03 0.74 0.13 0.00 -0.02 0.00 0.00 57.16 57.98 3hu1 n GLU 305 Cb 0.50 -5.33 0.33 0.00 -0.02 0.00 0.00 31.44 26.93 3hu1 n GLU 305 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3hu1 h LEU 306 N -1.32 0.76 -2.10 -4.62 5.85 -1.51 -1.74 115.31 110.64 3hu1 h LEU 306 Ca -0.52 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.34 3hu1 h LEU 306 Cb 1.28 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 3hu1 h LEU 306 CO 0.41 0.28 0.32 -2.24 -0.34 0.00 0.00 178.44 176.87 3hu1 h ASP 307 N 0.75 0.00 0.18 1.25 3.04 -1.86 0.89 116.42 120.66 3hu1 h ASP 307 Ca 0.57 0.00 -0.16 0.00 -3.24 0.00 0.00 57.03 54.20 3hu1 h ASP 307 Cb 0.90 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.18 3hu1 h ASP 307 CO -0.36 0.00 -0.59 0.00 -2.04 0.00 0.00 179.24 176.25 3hu1 h ALA 308 N 1.51 0.74 0.00 4.15 0.00 -1.68 -3.30 119.26 120.67 3hu1 h ALA 308 Ca 0.08 -0.53 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 3hu1 h ALA 308 Cb 0.73 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 3hu1 h ALA 308 CO -0.00 0.71 -2.11 0.44 0.00 0.00 0.00 179.25 178.29 3hu1 n ILE 309 N -3.91 0.60 -2.99 0.00 -5.35 -0.14 -4.72 119.36 102.84 3hu1 n ILE 309 Ca -0.03 -0.63 -0.25 0.00 -0.27 0.00 0.00 62.75 61.57 3hu1 n ILE 309 Cb 0.62 -0.21 -0.04 0.00 -1.74 0.00 0.00 39.64 38.28 3hu1 n ILE 309 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hu1 n ALA 310 N -2.44 4.08 -1.91 -1.28 0.00 0.12 -4.16 120.51 114.92 3hu1 n ALA 310 Ca -0.16 -4.41 -0.29 0.00 0.00 0.00 0.00 53.44 48.58 3hu1 n ALA 310 Cb 0.80 -0.77 0.11 0.00 0.00 0.00 0.00 19.45 19.59 3hu1 n ALA 310 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hu1 s PRO 311 N -3.24 1.64 -0.33 0.00 0.04 -1.24 -2.38 135.00 129.49 3hu1 s PRO 311 Ca 0.47 -0.01 -0.27 0.00 0.04 0.00 0.00 61.00 61.22 3hu1 s PRO 311 Cb 0.30 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.86 3hu1 s PRO 311 CO -0.13 -1.80 2.26 0.15 0.04 0.00 0.00 177.00 177.53 3hu1 s LYS 312 N -5.65 2.75 0.43 4.56 1.02 -0.87 -3.98 119.74 118.00 3hu1 s LYS 312 Ca 0.65 1.75 0.31 0.00 0.02 0.00 0.00 55.97 58.69 3hu1 s LYS 312 Cb -0.09 -4.44 1.47 0.00 -0.52 0.00 0.00 37.83 34.25 3hu1 s LYS 312 CO 0.50 -2.54 1.57 0.54 -0.92 0.00 0.00 175.35 174.50 3hu1 n ARG 313 N 8.85 -0.04 -0.17 1.68 1.74 -1.26 -0.00 116.66 127.46 3hu1 n ARG 313 Ca 0.32 1.28 0.04 0.00 -0.77 0.00 0.00 57.85 58.72 3hu1 n ARG 313 Cb 0.49 -2.48 0.33 0.00 -1.02 0.00 0.00 32.46 29.78 3hu1 n ARG 313 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 3hu1 h GLU 314 N 0.00 0.78 -2.38 5.56 4.11 -2.02 -3.30 114.58 117.32 3hu1 h GLU 314 Ca 0.88 -0.05 -0.60 0.00 0.07 0.00 0.00 59.36 59.66 3hu1 h GLU 314 Cb 2.75 -0.18 -0.41 0.00 0.50 0.00 0.00 28.75 31.41 3hu1 h GLU 314 CO -0.52 0.51 -0.68 1.17 0.07 0.00 0.00 179.01 179.57 3hu1 n LYS 315 N -4.46 2.00 -3.65 1.06 4.81 1.00 -5.01 118.16 113.91 3hu1 n LYS 315 Ca 0.09 -4.36 -0.06 0.00 -0.87 0.00 0.00 58.31 53.11 3hu1 n LYS 315 Cb 0.15 -2.09 -0.07 0.00 0.02 0.00 0.00 35.03 33.04 3hu1 n LYS 315 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 3hu1 s THR 316 N -1.94 -0.40 -0.06 3.15 -1.32 -1.23 -4.58 115.64 109.26 3hu1 s THR 316 Ca 0.35 0.03 -0.27 0.00 -1.21 0.00 0.00 61.69 60.60 3hu1 s THR 316 Cb 0.10 -0.91 -0.22 0.00 -1.51 0.00 0.00 72.50 69.96 3hu1 s THR 316 CO -0.07 0.01 1.12 0.45 -2.21 0.00 0.00 174.62 173.93 3hu1 h HIS 317 N 7.47 -0.00 -4.00 9.09 3.86 -1.95 -3.46 115.15 126.16 3hu1 h HIS 317 Ca -0.25 -0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.48 3hu1 h HIS 317 Cb 1.17 0.00 0.02 0.00 1.06 0.00 0.00 27.41 29.66 3hu1 h HIS 317 CO 0.14 0.63 0.40 0.20 0.86 0.00 0.00 177.93 180.15 3hu1 s GLY 318 N -3.47 2.64 0.09 2.45 0.00 -1.26 -4.98 107.32 102.79 3hu1 s GLY 318 Ca -0.17 0.65 -0.15 0.00 0.00 0.00 0.00 44.72 45.05 3hu1 s GLY 318 CO 0.68 1.03 1.42 0.83 0.00 0.00 0.00 173.10 177.06 3hu1 h GLU 319 N 2.18 0.66 -0.92 2.90 5.08 -2.00 -2.82 114.58 119.67 3hu1 h GLU 319 Ca -0.49 -0.34 0.06 0.00 -1.00 0.00 0.00 59.36 57.59 3hu1 h GLU 319 Cb 1.21 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.42 3hu1 h GLU 319 CO 0.61 0.95 0.60 0.28 -1.00 0.00 0.00 179.01 180.45 3hu1 h VAL 320 N 0.39 1.09 -0.53 3.13 2.07 -1.98 0.28 116.25 120.69 3hu1 h VAL 320 Ca 0.05 -0.37 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 3hu1 h VAL 320 Cb 0.82 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 3hu1 h VAL 320 CO 0.07 0.19 -0.02 -0.33 0.02 0.00 0.00 177.57 177.50 3hu1 h GLU 321 N 1.07 0.93 -0.12 1.57 5.08 -1.94 -0.81 114.58 120.35 3hu1 h GLU 321 Ca 0.39 -0.28 -0.15 0.00 -1.00 0.00 0.00 59.36 58.32 3hu1 h GLU 321 Cb 0.15 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3hu1 h GLU 321 CO -0.14 0.93 -0.57 0.00 -1.00 0.00 0.00 179.01 178.23 3hu1 h ARG 322 N 0.85 0.38 -0.09 2.33 3.08 -1.12 -3.16 114.38 116.64 3hu1 h ARG 322 Ca 0.15 -0.24 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 3hu1 h ARG 322 Cb 0.53 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.60 3hu1 h ARG 322 CO 0.03 0.84 -0.39 -0.09 -1.07 0.00 0.00 179.97 179.29 3hu1 h ARG 323 N 0.29 0.19 -0.20 0.04 2.43 -0.31 -2.84 114.38 113.97 3hu1 h ARG 323 Ca 0.00 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 3hu1 h ARG 323 Cb 1.08 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 3hu1 h ARG 323 CO 0.10 0.55 0.02 0.82 -1.51 0.00 0.00 179.97 179.95 3hu1 h ILE 324 N 0.16 1.23 -0.86 1.20 5.03 -1.14 -0.71 117.51 122.43 3hu1 h ILE 324 Ca 0.02 -0.78 0.04 0.00 -0.12 0.00 0.00 64.86 64.02 3hu1 h ILE 324 Cb 0.76 1.36 -0.05 0.00 -3.03 0.00 0.00 36.82 35.86 3hu1 h ILE 324 CO 0.06 0.24 0.55 0.58 -0.68 0.00 0.00 178.15 178.89 3hu1 h VAL 325 N 0.12 1.11 -0.46 1.67 2.07 -1.53 -0.57 116.25 118.66 3hu1 h VAL 325 Ca 0.06 -0.36 -0.11 0.00 0.82 0.00 0.00 66.70 67.11 3hu1 h VAL 325 Cb 0.34 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 3hu1 h VAL 325 CO 0.01 0.19 -0.16 0.28 0.02 0.00 0.00 177.57 177.91 3hu1 h SER 326 N 1.05 0.89 -0.59 0.57 0.02 -1.45 -2.22 113.55 111.82 3hu1 h SER 326 Ca 0.35 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 3hu1 h SER 326 Cb 0.05 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 3hu1 h SER 326 CO -0.13 1.04 0.35 -0.61 -1.14 0.00 0.00 176.83 176.34 3hu1 h GLN 327 N 0.78 0.81 0.12 3.45 5.75 -0.38 -2.33 115.11 123.33 3hu1 h GLN 327 Ca 0.12 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 3hu1 h GLN 327 Cb 0.69 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 29.07 3hu1 h GLN 327 CO 0.05 0.58 -0.06 1.25 -2.65 0.00 0.00 178.83 178.00 3hu1 h LEU 328 N 0.83 -0.14 -0.88 -2.39 5.85 -0.88 -2.99 115.31 114.70 3hu1 h LEU 328 Ca 0.22 -0.40 0.13 0.00 0.84 0.00 0.00 57.88 58.67 3hu1 h LEU 328 Cb -0.02 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 40.96 3hu1 h LEU 328 CO -0.04 0.38 0.49 -0.07 -0.34 0.00 0.00 178.44 178.86 3hu1 h LEU 329 N -0.72 0.65 -0.63 2.25 3.38 -1.28 -0.22 115.31 118.75 3hu1 h LEU 329 Ca -0.02 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 3hu1 h LEU 329 Cb 0.53 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3hu1 h LEU 329 CO 0.03 0.31 0.28 0.74 0.09 0.00 0.00 178.44 179.89 3hu1 h THR 330 N 0.73 1.23 -0.48 0.22 2.02 -1.48 -2.34 112.91 112.81 3hu1 h THR 330 Ca 0.46 -0.67 -0.12 0.00 0.77 0.00 0.00 66.41 66.86 3hu1 h THR 330 Cb 0.58 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.47 3hu1 h THR 330 CO -0.32 0.27 -0.16 -0.07 0.37 0.00 0.00 175.52 175.61 3hu1 h LEU 331 N 0.88 0.97 -1.19 2.58 3.38 -0.96 0.54 115.31 121.50 3hu1 h LEU 331 Ca 0.21 -0.38 0.10 0.00 0.09 0.00 0.00 57.88 57.91 3hu1 h LEU 331 Cb 0.16 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.57 3hu1 h LEU 331 CO -0.02 1.13 0.58 0.24 0.09 0.00 0.00 178.44 180.45 3hu1 h MET 332 N 0.81 0.85 0.00 1.13 2.86 -0.85 -1.35 114.93 118.38 3hu1 h MET 332 Ca 0.12 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 3hu1 h MET 332 Cb 0.72 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.19 3hu1 h MET 332 CO 0.06 0.56 -0.71 -0.44 1.06 0.00 0.00 176.91 177.44 3hu1 h ASP 333 N 0.88 0.00 0.40 1.22 3.32 -1.18 -3.35 116.42 117.71 3hu1 h ASP 333 Ca 0.42 -0.21 -0.11 0.00 0.02 0.00 0.00 57.03 57.15 3hu1 h ASP 333 Cb 0.43 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3hu1 h ASP 333 CO -0.18 0.10 -0.48 1.23 -1.72 0.00 0.00 179.24 178.19 3hu1 h GLY 334 N 4.45 0.11 -6.06 2.75 0.00 0.28 -3.41 103.07 101.18 3hu1 h GLY 334 Ca 0.00 -0.11 -0.57 0.00 0.00 0.00 0.00 47.33 46.65 3hu1 h GLY 334 CO 0.00 0.10 1.08 1.08 0.00 0.00 0.00 176.54 178.80 3hu1 s LEU 335 N -8.01 3.87 0.90 3.11 1.43 -1.10 -5.02 118.68 113.87 3hu1 s LEU 335 Ca -0.03 1.47 -0.12 0.00 -1.03 0.00 0.00 54.13 54.42 3hu1 s LEU 335 Cb 0.13 -3.53 0.13 0.00 0.03 0.00 0.00 46.19 42.95 3hu1 s LEU 335 CO 0.76 -1.22 1.11 -0.54 0.23 0.00 0.00 176.35 176.69 3hu1 s LYS 336 N 4.55 1.20 0.15 1.70 1.02 -1.26 -4.99 119.74 122.10 3hu1 s LYS 336 Ca 0.67 0.54 -0.23 0.00 0.02 0.00 0.00 55.97 56.96 3hu1 s LYS 336 Cb -0.22 -1.83 0.02 0.00 -0.52 0.00 0.00 37.83 35.28 3hu1 s LYS 336 CO 0.27 -2.21 1.63 1.96 -0.92 0.00 0.00 175.35 176.09 3hu1 h GLN 337 N -1.52 -0.25 0.00 1.68 1.08 -1.98 -2.95 115.11 111.18 3hu1 h GLN 337 Ca -0.51 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.71 3hu1 h GLN 337 Cb 1.31 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.79 3hu1 h GLN 337 CO 0.59 -0.17 0.00 2.89 -0.95 0.00 0.00 178.83 181.19 3hu1 n ARG 338 N -5.37 0.35 0.07 1.46 -4.01 -1.26 -2.71 116.66 105.19 3hu1 n ARG 338 Ca -0.01 0.00 -0.05 0.00 -1.04 0.00 0.00 57.85 56.74 3hu1 n ARG 338 Cb 0.29 -1.17 0.13 0.00 -3.04 0.00 0.00 32.46 28.66 3hu1 n ARG 338 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 3hu1 h ALA 339 N 2.04 0.87 -5.91 2.89 0.00 -1.90 -3.48 119.26 113.76 3hu1 h ALA 339 Ca 0.00 -0.52 -0.37 0.00 0.00 0.00 0.00 54.91 54.02 3hu1 h ALA 339 Cb 0.00 -0.09 0.11 0.00 0.00 0.00 0.00 17.79 17.81 3hu1 h ALA 339 CO 0.00 0.70 -0.85 0.72 0.00 0.00 0.00 179.25 179.82 3hu1 n HIS 340 N -3.91 -2.08 -4.06 0.00 8.25 -1.10 -4.79 115.22 107.54 3hu1 n HIS 340 Ca -0.02 0.77 -0.27 0.00 -0.26 0.00 0.00 57.72 57.94 3hu1 n HIS 340 Cb 0.59 -4.21 -0.17 0.00 1.12 0.00 0.00 29.99 27.33 3hu1 n HIS 340 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3hu1 s VAL 341 N -3.52 1.15 -0.13 1.59 1.01 -1.26 -1.97 120.40 117.26 3hu1 s VAL 341 Ca 0.21 -0.39 -0.04 0.00 0.00 0.00 0.00 61.98 61.76 3hu1 s VAL 341 Cb -0.05 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3hu1 s VAL 341 CO 0.80 0.38 0.03 -0.63 0.00 0.00 0.00 175.10 175.68 3hu1 s ILE 342 N 1.47 4.53 -0.23 2.22 -1.09 -0.94 -4.92 121.20 122.24 3hu1 s ILE 342 Ca 0.01 -0.15 -0.06 0.00 -2.23 0.00 0.00 60.65 58.22 3hu1 s ILE 342 Cb -0.13 -2.97 -0.03 0.00 -1.58 0.00 0.00 42.46 37.75 3hu1 s ILE 342 CO -0.06 0.55 0.04 -0.69 -1.23 0.00 0.00 174.94 173.54 3hu1 s VAL 343 N -0.35 4.11 0.05 2.92 1.01 -0.62 -1.52 120.40 126.01 3hu1 s VAL 343 Ca 0.08 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 61.84 3hu1 s VAL 343 Cb -0.12 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 3hu1 s VAL 343 CO 0.02 0.38 0.05 -0.04 0.00 0.00 0.00 175.10 175.50 3hu1 s MET 344 N 1.41 2.84 0.02 2.72 -1.94 0.16 -0.75 119.30 123.75 3hu1 s MET 344 Ca 0.05 -0.66 -0.10 0.00 -1.71 0.00 0.00 55.69 53.27 3hu1 s MET 344 Cb -0.15 -2.71 0.01 0.00 2.01 0.00 0.00 34.83 33.99 3hu1 s MET 344 CO 0.02 0.59 0.21 0.00 -0.01 0.00 0.00 175.02 175.82 3hu1 s ALA 345 N -1.28 -0.43 -0.01 3.03 0.00 -0.44 -0.51 121.76 122.12 3hu1 s ALA 345 Ca 0.25 -0.15 0.02 0.00 0.00 0.00 0.00 51.96 52.09 3hu1 s ALA 345 Cb -0.12 0.22 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 3hu1 s ALA 345 CO 0.17 -0.32 -0.08 0.00 0.00 0.00 0.00 175.76 175.54 3hu1 s ALA 346 N -2.14 0.72 0.02 0.00 0.00 -0.79 0.36 121.76 119.94 3hu1 s ALA 346 Ca -0.08 -0.33 -0.18 0.00 0.00 0.00 0.00 51.96 51.37 3hu1 s ALA 346 Cb -0.03 -0.22 0.03 0.00 0.00 0.00 0.00 23.12 22.90 3hu1 s ALA 346 CO -0.01 0.15 0.39 -0.08 0.00 0.00 0.00 175.76 176.21 3hu1 s THR 347 N -0.05 0.06 -2.25 0.00 -1.32 0.17 -1.25 115.64 110.98 3hu1 s THR 347 Ca 0.01 -0.46 0.18 0.00 -1.21 0.00 0.00 61.69 60.21 3hu1 s THR 347 Cb -0.05 -0.88 0.18 0.00 -1.51 0.00 0.00 72.50 70.24 3hu1 s THR 347 CO -0.00 -0.26 1.12 -0.46 -2.21 0.00 0.00 174.62 172.81 3hu1 n ASN 348 N 0.71 2.64 -3.30 8.08 0.23 -1.26 -3.20 115.26 119.15 3hu1 n ASN 348 Ca -0.19 -1.79 -0.25 0.00 -0.53 0.00 0.00 54.58 51.81 3hu1 n ASN 348 Cb 0.59 -0.03 -0.08 0.00 -2.08 0.00 0.00 39.78 38.17 3hu1 n ASN 348 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 3hu1 n ARG 349 N 1.06 0.92 0.28 -3.83 1.85 -1.26 -4.72 116.66 110.95 3hu1 n ARG 349 Ca 0.12 -3.49 0.12 0.00 -1.00 0.00 0.00 57.85 53.60 3hu1 n ARG 349 Cb 0.47 -1.51 0.78 0.00 -1.05 0.00 0.00 32.46 31.15 3hu1 n ARG 349 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 3hu1 h PRO 350 N 4.44 0.00 0.00 2.89 0.13 -1.95 -2.04 132.00 135.47 3hu1 h PRO 350 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3hu1 h PRO 350 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3hu1 h PRO 350 CO 0.51 0.04 0.00 0.09 -0.23 0.00 0.00 178.00 178.41 3hu1 n ASN 351 N -4.00 0.00 -0.79 1.44 3.02 -1.26 -2.52 115.26 111.15 3hu1 n ASN 351 Ca -0.03 -0.40 0.10 0.00 -0.03 0.00 0.00 54.58 54.22 3hu1 n ASN 351 Cb 0.13 -0.17 0.08 0.00 -0.61 0.00 0.00 39.78 39.21 3hu1 n ASN 351 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3hu1 n SER 352 N -1.17 2.64 -4.77 6.41 3.41 -0.77 -4.95 113.62 114.43 3hu1 n SER 352 Ca 0.16 -1.82 -0.40 0.00 -0.26 0.00 0.00 58.87 56.55 3hu1 n SER 352 Cb 0.17 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.05 3hu1 n SER 352 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hu1 s ILE 353 N -1.62 4.47 -0.17 -1.33 1.01 -1.05 -2.05 121.20 120.46 3hu1 s ILE 353 Ca 0.23 1.69 -0.40 0.00 0.00 0.00 0.00 60.65 62.17 3hu1 s ILE 353 Cb 0.16 -4.13 -0.17 0.00 0.01 0.00 0.00 42.46 38.33 3hu1 s ILE 353 CO 0.25 0.48 1.57 -0.67 0.00 0.00 0.00 174.94 176.57 3hu1 n ASP 354 N 1.96 1.94 0.28 3.58 -0.08 -1.00 -4.66 116.55 118.57 3hu1 n ASP 354 Ca -0.05 1.10 0.13 0.00 -1.51 0.00 0.00 54.79 54.46 3hu1 n ASP 354 Cb 0.49 -1.12 0.80 0.00 2.34 0.00 0.00 41.12 43.63 3hu1 n ASP 354 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hu1 h PRO 355 N 6.00 0.00 -0.82 -0.67 0.11 -1.94 -2.40 132.00 132.29 3hu1 h PRO 355 Ca -0.47 0.00 0.17 0.00 0.11 0.00 0.00 66.00 65.82 3hu1 h PRO 355 Cb 1.33 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.39 3hu1 h PRO 355 CO 0.89 0.04 0.55 0.00 -0.21 0.00 0.00 178.00 179.27 3hu1 h ALA 356 N 1.96 2.18 0.00 -0.75 0.00 -2.00 0.27 119.26 120.92 3hu1 h ALA 356 Ca -0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3hu1 h ALA 356 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3hu1 h ALA 356 CO 0.01 -0.42 0.00 -0.07 0.00 0.00 0.00 179.25 178.77 3hu1 h LEU 357 N 0.39 0.00 -3.01 0.00 3.38 -1.81 -3.03 115.31 111.24 3hu1 h LEU 357 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3hu1 h LEU 357 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3hu1 h LEU 357 CO -0.14 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.93 3hu1 n ARG 358 N -2.38 3.15 -1.85 1.13 1.74 0.08 -1.22 116.66 117.31 3hu1 n ARG 358 Ca 0.04 -2.56 -0.29 0.00 -0.77 0.00 0.00 57.85 54.27 3hu1 n ARG 358 Cb 0.38 -1.62 0.10 0.00 -1.02 0.00 0.00 32.46 30.30 3hu1 n ARG 358 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3hu1 s ARG 359 N -1.57 1.82 0.11 5.56 3.00 -1.15 -4.43 118.95 122.29 3hu1 s ARG 359 Ca 0.40 0.12 -0.34 0.00 0.00 0.00 0.00 55.73 55.91 3hu1 s ARG 359 Cb 0.25 -1.93 -0.13 0.00 0.00 0.00 0.00 34.95 33.13 3hu1 s ARG 359 CO 0.21 -1.70 1.64 0.34 0.00 0.00 0.00 175.30 175.78 3hu1 n PHE 360 N -3.39 2.27 0.00 -0.53 7.35 -1.26 -2.01 117.46 119.88 3hu1 n PHE 360 Ca 0.08 0.22 0.00 0.00 -0.76 0.00 0.00 57.45 56.99 3hu1 n PHE 360 Cb 0.61 -2.56 0.00 0.00 0.35 0.00 0.00 39.48 37.87 3hu1 n PHE 360 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3hu1 n GLY 361 N 3.60 0.84 0.00 7.13 0.00 -1.26 -4.98 105.19 110.52 3hu1 n GLY 361 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3hu1 n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu1 n ARG 362 N -2.00 0.00 -2.62 1.61 1.74 -0.85 -4.80 116.66 109.73 3hu1 n ARG 362 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 3hu1 n ARG 362 Cb 0.00 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.45 3hu1 n ARG 362 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3hu1 n PHE 363 N 0.00 2.57 0.25 -1.55 3.72 -0.36 -2.64 117.46 119.45 3hu1 n PHE 363 Ca 0.00 -2.67 0.06 0.00 -0.05 0.00 0.00 57.45 54.79 3hu1 n PHE 363 Cb 0.00 -1.58 0.22 0.00 -0.94 0.00 0.00 39.48 37.18 3hu1 n PHE 363 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3hu1 n ASP 364 N 2.31 3.06 -3.91 4.37 3.85 -1.12 -4.49 116.55 120.62 3hu1 n ASP 364 Ca 0.36 -2.23 -0.15 0.00 -0.71 0.00 0.00 54.79 52.05 3hu1 n ASP 364 Cb 0.33 -0.43 -0.15 0.00 -1.35 0.00 0.00 41.12 39.52 3hu1 n ASP 364 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 3hu1 s ARG 365 N -1.67 0.33 -0.05 0.11 1.81 -1.03 -5.00 118.95 113.44 3hu1 s ARG 365 Ca 0.32 -0.09 0.03 0.00 -1.72 0.00 0.00 55.73 54.27 3hu1 s ARG 365 Cb 0.20 -0.36 0.01 0.00 -0.45 0.00 0.00 34.95 34.35 3hu1 s ARG 365 CO 0.16 0.03 -0.13 -1.21 -0.68 0.00 0.00 175.30 173.47 3hu1 s GLU 366 N 0.20 1.66 -0.19 3.54 2.02 -1.26 -0.28 118.70 124.39 3hu1 s GLU 366 Ca -0.02 -0.47 0.01 0.00 0.02 0.00 0.00 54.97 54.52 3hu1 s GLU 366 Cb -0.05 -1.40 0.02 0.00 0.10 0.00 0.00 34.13 32.80 3hu1 s GLU 366 CO -0.00 0.10 -0.19 0.08 0.02 0.00 0.00 175.26 175.27 3hu1 s VAL 367 N 0.42 2.13 -0.63 2.63 1.01 0.12 -4.92 120.40 121.16 3hu1 s VAL 367 Ca -0.10 -0.95 -0.23 0.00 0.00 0.00 0.00 61.98 60.70 3hu1 s VAL 367 Cb -0.14 -1.91 0.06 0.00 0.00 0.00 0.00 36.38 34.39 3hu1 s VAL 367 CO 0.03 0.51 0.97 -0.62 0.00 0.00 0.00 175.10 175.99 3hu1 s ASP 368 N 1.29 6.22 -1.13 3.32 2.15 -1.26 -2.10 116.67 125.17 3hu1 s ASP 368 Ca 0.04 -0.75 -0.17 0.00 0.43 0.00 0.00 52.55 52.10 3hu1 s ASP 368 Cb -0.13 -2.43 0.12 0.00 -0.30 0.00 0.00 42.92 40.17 3hu1 s ASP 368 CO -0.12 -1.39 1.42 -0.63 -0.17 0.00 0.00 175.17 174.28 3hu1 s ILE 369 N 4.13 4.57 0.00 4.11 -1.09 0.58 -4.96 121.20 128.54 3hu1 s ILE 369 Ca 0.25 -1.90 0.00 0.00 -2.23 0.00 0.00 60.65 56.77 3hu1 s ILE 369 Cb -0.15 -4.96 0.00 0.00 -1.58 0.00 0.00 42.46 35.77 3hu1 s ILE 369 CO 0.13 -1.73 0.00 0.61 -1.23 0.00 0.00 174.94 172.72 3hu1 n GLY 370 N 5.20 -0.82 3.71 6.18 0.00 -1.26 -4.28 105.19 113.93 3hu1 n GLY 370 Ca 0.35 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 3hu1 n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hu1 s ILE 371 N -0.37 4.56 0.48 -0.61 1.09 -1.26 -4.89 121.20 120.21 3hu1 s ILE 371 Ca 0.00 1.89 -0.23 0.00 -1.10 0.00 0.00 60.65 61.20 3hu1 s ILE 371 Cb 0.00 -4.21 -0.07 0.00 -1.06 0.00 0.00 42.46 37.13 3hu1 s ILE 371 CO 0.00 0.17 1.28 -2.16 -0.10 0.00 0.00 174.94 174.13 3hu1 s PRO 372 N 0.83 3.56 1.01 2.79 0.04 -1.26 -5.04 135.00 136.93 3hu1 s PRO 372 Ca 0.53 2.06 -0.17 0.00 0.04 0.00 0.00 61.00 63.46 3hu1 s PRO 372 Cb -0.24 -2.44 0.23 0.00 0.04 0.00 0.00 34.50 32.09 3hu1 s PRO 372 CO 0.29 -0.80 1.32 0.16 0.04 0.00 0.00 177.00 178.02 3hu1 s ASP 373 N -1.03 2.71 0.24 6.66 -4.77 -1.26 -4.81 116.67 114.42 3hu1 s ASP 373 Ca 0.65 0.22 -0.04 0.00 -3.30 0.00 0.00 52.55 50.08 3hu1 s ASP 373 Cb -0.36 -0.22 0.40 0.00 -1.09 0.00 0.00 42.92 41.65 3hu1 s ASP 373 CO 0.44 -2.98 1.81 0.00 0.70 0.00 0.00 175.17 175.14 3hu1 h ALA 374 N -1.81 1.17 -0.49 2.11 0.00 -1.96 -0.99 119.26 117.29 3hu1 h ALA 374 Ca -0.44 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3hu1 h ALA 374 Cb 1.23 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3hu1 h ALA 374 CO 0.34 0.09 0.31 1.15 0.00 0.00 0.00 179.25 181.15 3hu1 h THR 375 N 0.79 1.13 -0.78 0.00 2.02 -1.95 -2.25 112.91 111.86 3hu1 h THR 375 Ca 0.40 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.31 3hu1 h THR 375 Cb 0.36 0.43 -0.04 0.00 -1.74 0.00 0.00 68.15 67.17 3hu1 h THR 375 CO -0.25 0.13 0.45 1.23 0.37 0.00 0.00 175.52 177.45 3hu1 h GLY 376 N 0.66 1.15 1.22 2.16 0.00 -1.75 -2.86 103.07 103.64 3hu1 h GLY 376 Ca 0.18 -0.49 -0.13 0.00 0.00 0.00 0.00 47.33 46.89 3hu1 h GLY 376 CO -0.04 0.48 -0.23 3.21 0.00 0.00 0.00 176.54 179.96 3hu1 h ARG 377 N 1.09 0.89 -0.35 4.80 3.08 -0.74 -2.40 114.38 120.75 3hu1 h ARG 377 Ca 0.28 -0.37 0.04 0.00 0.07 0.00 0.00 59.98 60.00 3hu1 h ARG 377 Cb -0.01 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 29.97 3hu1 h ARG 377 CO -0.05 1.02 0.10 1.25 -1.07 0.00 0.00 179.97 181.22 3hu1 h LEU 378 N 0.77 0.08 -0.16 3.04 5.85 -1.28 -1.60 115.31 122.01 3hu1 h LEU 378 Ca 0.10 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.92 3hu1 h LEU 378 Cb 0.77 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 3hu1 h LEU 378 CO 0.06 0.08 -0.19 -0.33 -0.34 0.00 0.00 178.44 177.73 3hu1 h GLU 379 N 0.23 -0.21 -0.98 1.25 5.08 -1.27 -1.32 114.58 117.36 3hu1 h GLU 379 Ca 0.16 0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.62 3hu1 h GLU 379 Cb 0.16 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.38 3hu1 h GLU 379 CO -0.19 -0.14 0.63 0.82 -1.00 0.00 0.00 179.01 179.13 3hu1 h ILE 380 N -0.22 1.03 -0.14 3.13 2.04 -1.26 -0.86 117.51 121.23 3hu1 h ILE 380 Ca 0.11 -0.37 -0.13 0.00 1.00 0.00 0.00 64.86 65.46 3hu1 h ILE 380 Cb 0.38 -0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.29 3hu1 h ILE 380 CO -0.29 0.20 -0.48 -0.07 0.00 0.00 0.00 178.15 177.50 3hu1 h LEU 381 N 1.09 0.40 -0.42 1.44 3.38 -0.76 -0.09 115.31 120.36 3hu1 h LEU 381 Ca 0.44 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 58.13 3hu1 h LEU 381 Cb 0.26 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3hu1 h LEU 381 CO -0.20 0.82 -0.08 1.56 0.09 0.00 0.00 178.44 180.64 3hu1 h GLN 382 N 0.29 0.79 -0.35 1.13 4.20 -0.65 -1.64 115.11 118.88 3hu1 h GLN 382 Ca 0.02 -0.29 -0.05 0.00 0.06 0.00 0.00 58.65 58.39 3hu1 h GLN 382 Cb 0.96 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.68 3hu1 h GLN 382 CO 0.08 0.90 0.03 0.82 -0.67 0.00 0.00 178.83 180.00 3hu1 h ILE 383 N 0.62 1.25 -0.44 2.54 2.04 -0.90 -2.84 117.51 119.78 3hu1 h ILE 383 Ca 0.11 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 64.99 3hu1 h ILE 383 Cb 0.60 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 3hu1 h ILE 383 CO 0.04 0.30 -0.05 0.45 0.00 0.00 0.00 178.15 178.89 3hu1 h HIS 384 N 0.43 0.80 -0.39 1.37 3.86 -0.95 -3.19 115.15 117.08 3hu1 h HIS 384 Ca 0.10 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3hu1 h HIS 384 Cb 0.40 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 28.66 3hu1 h HIS 384 CO 0.03 0.78 0.00 0.25 0.86 0.00 0.00 177.93 179.85 3hu1 n THR 385 N -4.20 0.50 0.24 2.45 -2.24 -0.63 -4.32 114.28 106.09 3hu1 n THR 385 Ca 0.02 -0.67 0.17 0.00 -2.27 0.00 0.00 64.05 61.30 3hu1 n THR 385 Cb 0.32 0.73 0.88 0.00 -2.10 0.00 0.00 70.33 70.16 3hu1 n THR 385 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3hu1 h LYS 386 N 3.81 0.00 -0.01 -0.78 2.10 -1.49 0.79 116.57 120.99 3hu1 h LYS 386 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3hu1 h LYS 386 Cb 0.85 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.18 3hu1 h LYS 386 CO 0.00 0.00 -0.31 0.09 -2.00 0.00 0.00 179.45 177.23 3hu1 n ASN 387 N -3.66 1.35 -4.81 7.07 3.02 -1.26 -4.99 115.26 111.98 3hu1 n ASN 387 Ca 0.00 -1.18 -0.35 0.00 -0.03 0.00 0.00 54.58 53.02 3hu1 n ASN 387 Cb 0.28 0.53 -0.06 0.00 -0.61 0.00 0.00 39.78 39.92 3hu1 n ASN 387 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3hu1 s MET 388 N -1.72 4.30 -0.38 3.52 -1.94 0.27 -5.03 119.30 118.31 3hu1 s MET 388 Ca 0.10 0.99 -0.23 0.00 -1.71 0.00 0.00 55.69 54.84 3hu1 s MET 388 Cb 0.11 -2.72 0.01 0.00 2.01 0.00 0.00 34.83 34.24 3hu1 s MET 388 CO 0.36 0.29 0.80 0.15 -0.01 0.00 0.00 175.02 176.61 3hu1 s LYS 389 N -2.26 3.70 0.17 2.03 -0.14 -1.26 -5.00 119.74 116.96 3hu1 s LYS 389 Ca 0.48 0.26 0.08 0.00 -1.36 0.00 0.00 55.97 55.43 3hu1 s LYS 389 Cb -0.15 -3.83 -0.04 0.00 -1.68 0.00 0.00 37.83 32.12 3hu1 s LYS 389 CO 0.20 -0.91 -0.05 -0.51 -0.76 0.00 0.00 175.35 173.32 3hu1 s LEU 390 N 3.19 3.17 0.47 3.17 1.43 -1.26 -0.51 118.68 128.32 3hu1 s LEU 390 Ca 0.32 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.95 3hu1 s LEU 390 Cb -0.13 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 3hu1 s LEU 390 CO 0.18 0.11 0.72 0.00 0.23 0.00 0.00 176.35 177.59 3hu1 s ALA 391 N -1.65 3.60 0.27 4.21 0.00 -0.49 -4.79 121.76 122.91 3hu1 s ALA 391 Ca 0.26 -0.87 -0.00 0.00 0.00 0.00 0.00 51.96 51.34 3hu1 s ALA 391 Cb -0.09 -2.30 0.60 0.00 0.00 0.00 0.00 23.12 21.32 3hu1 s ALA 391 CO 0.17 -0.41 1.70 -0.44 0.00 0.00 0.00 175.76 176.78 3hu1 h ASP 392 N 0.31 0.22 0.86 0.00 5.19 -2.01 -2.96 116.42 118.02 3hu1 h ASP 392 Ca -0.47 0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 3hu1 h ASP 392 Cb 1.24 0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.90 3hu1 h ASP 392 CO 0.59 0.01 0.00 -0.90 -3.12 0.00 0.00 179.24 175.82 3hu1 n ASP 393 N -5.07 0.16 -4.62 6.45 5.75 -1.26 -4.72 116.55 113.24 3hu1 n ASP 393 Ca 0.18 0.52 -0.43 0.00 -0.01 0.00 0.00 54.79 55.06 3hu1 n ASP 393 Cb 0.55 -0.56 -0.03 0.00 -1.03 0.00 0.00 41.12 40.05 3hu1 n ASP 393 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3hu1 s VAL 394 N -3.04 3.54 -0.43 2.12 1.01 -1.12 -4.61 120.40 117.86 3hu1 s VAL 394 Ca 0.10 0.59 -0.07 0.00 0.00 0.00 0.00 61.98 62.60 3hu1 s VAL 394 Cb 0.14 -3.60 0.10 0.00 0.00 0.00 0.00 36.38 33.02 3hu1 s VAL 394 CO 0.44 -0.29 0.27 -0.62 0.00 0.00 0.00 175.10 174.89 3hu1 s ASP 395 N 5.11 5.55 0.34 3.32 2.15 -1.26 -4.96 116.67 126.92 3hu1 s ASP 395 Ca 0.77 -1.77 0.08 0.00 0.43 0.00 0.00 52.55 52.06 3hu1 s ASP 395 Cb -0.26 -1.95 0.61 0.00 -0.30 0.00 0.00 42.92 41.02 3hu1 s ASP 395 CO 0.32 -0.59 1.80 -0.07 -0.17 0.00 0.00 175.17 176.46 3hu1 h LEU 396 N 8.33 0.22 -1.00 -1.34 3.38 -1.99 -2.65 115.31 120.26 3hu1 h LEU 396 Ca -0.20 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.74 3hu1 h LEU 396 Cb 1.07 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 3hu1 h LEU 396 CO 0.78 0.51 0.65 -0.33 0.09 0.00 0.00 178.44 180.14 3hu1 h GLU 397 N 0.19 1.22 -0.17 1.13 5.08 -1.95 0.17 114.58 120.26 3hu1 h GLU 397 Ca 0.03 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3hu1 h GLU 397 Cb 0.62 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3hu1 h GLU 397 CO 0.04 0.81 0.06 0.37 -1.00 0.00 0.00 179.01 179.29 3hu1 h GLN 398 N 1.26 0.27 -0.66 2.33 5.75 -1.94 -2.26 115.11 119.85 3hu1 h GLN 398 Ca 0.40 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.81 3hu1 h GLN 398 Cb 0.01 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.49 3hu1 h GLN 398 CO -0.13 0.37 0.29 0.28 -2.65 0.00 0.00 178.83 177.00 3hu1 h VAL 399 N 0.11 1.22 -0.29 2.39 2.07 -1.12 -1.66 116.25 118.97 3hu1 h VAL 399 Ca 0.06 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 66.94 3hu1 h VAL 399 Cb 0.22 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.36 3hu1 h VAL 399 CO -0.00 0.27 0.12 0.00 0.02 0.00 0.00 177.57 177.98 3hu1 h ALA 400 N 1.37 0.34 -0.43 1.67 0.00 -0.50 -2.76 119.26 118.95 3hu1 h ALA 400 Ca 0.23 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 3hu1 h ALA 400 Cb 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3hu1 h ALA 400 CO -0.03 -0.27 -0.26 -0.91 0.00 0.00 0.00 179.25 177.79 3hu1 h ASN 401 N 0.27 0.93 0.53 0.00 2.35 -0.94 -2.88 115.58 115.85 3hu1 h ASN 401 Ca 0.12 -0.36 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 3hu1 h ASN 401 Cb 0.06 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.17 3hu1 h ASN 401 CO -0.10 1.13 0.00 -0.62 -1.65 0.00 0.00 177.43 176.19 3hu1 n GLU 402 N -4.10 0.26 -3.02 0.81 1.02 -0.67 -4.48 120.64 110.47 3hu1 n GLU 402 Ca -0.00 0.07 -0.43 0.00 -0.02 0.00 0.00 57.16 56.77 3hu1 n GLU 402 Cb 0.47 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.40 3hu1 n GLU 402 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3hu1 n THR 403 N -1.34 5.19 -0.27 2.62 -2.24 -1.05 -4.92 114.28 112.27 3hu1 n THR 403 Ca 0.10 -5.78 -0.06 0.00 -2.27 0.00 0.00 64.05 56.04 3hu1 n THR 403 Cb 0.21 -2.16 0.06 0.00 -2.10 0.00 0.00 70.33 66.33 3hu1 n THR 403 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 3hu1 h HIS 404 N 5.63 1.08 -0.01 4.78 3.86 -1.83 -2.72 115.15 125.93 3hu1 h HIS 404 Ca 0.21 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 3hu1 h HIS 404 Cb 0.65 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 28.79 3hu1 h HIS 404 CO 0.99 0.80 0.00 0.41 0.86 0.00 0.00 177.93 181.00 3hu1 n GLY 405 N -0.94 4.14 3.74 2.45 0.00 -1.26 -5.03 105.19 108.29 3hu1 n GLY 405 Ca 0.06 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 3hu1 n GLY 405 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hu1 s HIS 406 N -2.16 3.58 0.55 1.61 4.02 -1.03 -4.47 115.29 117.40 3hu1 s HIS 406 Ca 0.20 1.61 0.09 0.00 1.02 0.00 0.00 55.06 57.98 3hu1 s HIS 406 Cb 0.18 -3.29 0.07 0.00 -1.02 0.00 0.00 32.58 28.52 3hu1 s HIS 406 CO 0.02 -0.63 0.68 0.14 1.02 0.00 0.00 174.74 175.97 3hu1 s VAL 407 N -0.42 2.17 0.19 -0.90 -7.23 -1.26 -4.45 120.40 108.51 3hu1 s VAL 407 Ca 0.49 -1.10 -0.12 0.00 -1.81 0.00 0.00 61.98 59.44 3hu1 s VAL 407 Cb -0.30 -2.28 0.11 0.00 0.56 0.00 0.00 36.38 34.48 3hu1 s VAL 407 CO 0.36 0.00 1.73 1.23 -0.31 0.00 0.00 175.10 178.11 3hu1 h GLY 408 N 0.37 0.69 0.92 2.32 0.00 -1.80 -1.84 103.07 103.72 3hu1 h GLY 408 Ca -0.33 -0.07 0.03 0.00 0.00 0.00 0.00 47.33 46.96 3hu1 h GLY 408 CO 0.45 -0.03 0.58 0.00 0.00 0.00 0.00 176.54 177.53 3hu1 h ALA 409 N 1.38 1.16 -0.66 3.60 0.00 -1.66 0.42 119.26 123.50 3hu1 h ALA 409 Ca 0.26 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3hu1 h ALA 409 Cb 0.32 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hu1 h ALA 409 CO -0.30 0.46 0.21 -0.44 0.00 0.00 0.00 179.25 179.18 3hu1 h ASP 410 N 1.15 0.94 -0.28 0.00 3.32 -1.74 -1.48 116.42 118.33 3hu1 h ASP 410 Ca 0.35 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 57.16 3hu1 h ASP 410 Cb -0.04 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 3hu1 h ASP 410 CO -0.10 0.88 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.13 3hu1 h LEU 411 N 0.98 0.58 -0.60 1.55 3.38 -0.90 -0.01 115.31 120.29 3hu1 h LEU 411 Ca 0.22 -0.39 0.08 0.00 0.09 0.00 0.00 57.88 57.88 3hu1 h LEU 411 Cb 0.28 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 3hu1 h LEU 411 CO -0.01 0.84 0.25 0.00 0.09 0.00 0.00 178.44 179.61 3hu1 h ALA 412 N 0.76 0.78 -0.46 1.53 0.00 -0.81 -1.90 119.26 119.15 3hu1 h ALA 412 Ca 0.07 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 3hu1 h ALA 412 Cb 0.60 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3hu1 h ALA 412 CO 0.03 -0.14 -0.11 0.00 0.00 0.00 0.00 179.25 179.03 3hu1 h ALA 413 N 1.38 0.64 -0.75 0.00 0.00 -1.11 -1.68 119.26 117.74 3hu1 h ALA 413 Ca 0.29 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.93 3hu1 h ALA 413 Cb 0.32 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 3hu1 h ALA 413 CO -0.26 0.54 0.43 1.25 0.00 0.00 0.00 179.25 181.21 3hu1 h LEU 414 N 0.74 0.65 -0.62 0.00 5.85 -0.69 -1.26 115.31 119.99 3hu1 h LEU 414 Ca 0.12 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.76 3hu1 h LEU 414 Cb 0.66 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 3hu1 h LEU 414 CO 0.05 0.41 -0.08 0.00 -0.34 0.00 0.00 178.44 178.48 3hu1 h SER 416 N 0.91 0.64 0.55 0.00 0.87 -0.49 -2.48 113.55 113.55 3hu1 h SER 416 Ca 0.15 -0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.53 3hu1 h SER 416 Cb 0.63 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.43 3hu1 h SER 416 CO 0.04 0.45 -0.77 -0.33 -0.53 0.00 0.00 176.83 175.69 3hu1 h GLU 417 N 0.77 0.17 -0.52 2.24 4.39 -0.85 -1.15 114.58 119.63 3hu1 h GLU 417 Ca 0.24 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 3hu1 h GLU 417 Cb -0.02 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 3hu1 h GLU 417 CO -0.08 0.86 0.32 0.00 -1.16 0.00 0.00 179.01 178.95 3hu1 h ALA 418 N 1.09 0.67 -0.37 3.43 0.00 -1.03 -2.02 119.26 121.02 3hu1 h ALA 418 Ca -0.03 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 3hu1 h ALA 418 Cb 1.36 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3hu1 h ALA 418 CO 0.12 0.15 -0.23 0.00 0.00 0.00 0.00 179.25 179.28 3hu1 h ALA 419 N 1.16 0.89 -0.56 0.00 0.00 -1.11 -2.30 119.26 117.33 3hu1 h ALA 419 Ca 0.19 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 3hu1 h ALA 419 Cb -0.02 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3hu1 h ALA 419 CO -0.04 0.63 0.14 1.25 0.00 0.00 0.00 179.25 181.23 3hu1 h LEU 420 N 0.65 0.80 -0.64 0.00 6.46 -1.08 -0.93 115.31 120.57 3hu1 h LEU 420 Ca 0.09 -0.14 -0.03 0.00 -0.12 0.00 0.00 57.88 57.68 3hu1 h LEU 420 Cb 0.74 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 40.43 3hu1 h LEU 420 CO 0.06 0.78 0.28 -0.61 -0.62 0.00 0.00 178.44 178.33 3hu1 h GLN 421 N 0.83 0.94 -0.45 1.25 5.75 -0.88 0.06 115.11 122.60 3hu1 h GLN 421 Ca 0.18 -0.15 -0.04 0.00 -0.15 0.00 0.00 58.65 58.49 3hu1 h GLN 421 Cb 0.29 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.66 3hu1 h GLN 421 CO -0.00 0.77 0.10 0.00 -2.65 0.00 0.00 178.83 177.05 3hu1 h ALA 422 N 1.12 1.34 -0.68 3.38 0.00 -0.78 0.04 119.26 123.67 3hu1 h ALA 422 Ca 0.22 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3hu1 h ALA 422 Cb 0.16 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3hu1 h ALA 422 CO -0.02 0.47 0.20 0.82 0.00 0.00 0.00 179.25 180.72 3hu1 h ILE 423 N 0.66 1.26 -0.43 0.00 2.04 -0.85 -2.94 117.51 117.24 3hu1 h ILE 423 Ca 0.15 -0.89 -0.07 0.00 1.00 0.00 0.00 64.86 65.04 3hu1 h ILE 423 Cb 0.26 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 3hu1 h ILE 423 CO -0.00 0.34 -0.04 0.03 0.00 0.00 0.00 178.15 178.49 3hu1 h ARG 424 N 1.00 0.73 0.00 2.37 3.08 0.32 -2.20 114.38 119.66 3hu1 h ARG 424 Ca 0.22 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.05 3hu1 h ARG 424 Cb 0.32 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.28 3hu1 h ARG 424 CO -0.00 0.76 -0.08 0.87 -1.07 0.00 0.00 179.97 180.45 3hu1 h LYS 425 N 0.68 0.00 -0.53 0.04 1.57 -0.89 -2.10 116.57 115.34 3hu1 h LYS 425 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3hu1 h LYS 425 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 3hu1 h LYS 425 CO 0.02 0.08 0.00 1.17 -0.57 0.00 0.00 179.45 180.15 3hu1 n LYS 426 N -3.40 3.19 -0.21 3.15 3.00 -0.86 -4.74 118.16 118.29 3hu1 n LYS 426 Ca -0.01 -2.60 -0.06 0.00 -0.00 0.00 0.00 58.31 55.63 3hu1 n LYS 426 Cb 0.24 -1.64 0.03 0.00 0.00 0.00 0.00 35.03 33.66 3hu1 n LYS 426 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.40 177.92 3hu1 h MET 427 N 3.26 0.80 0.00 1.64 2.86 -1.04 -2.92 114.93 119.53 3hu1 h MET 427 Ca 0.00 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3hu1 h MET 427 Cb 1.15 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.64 3hu1 h MET 427 CO 0.12 0.56 0.00 0.38 1.06 0.00 0.00 176.91 179.03 3hu1 h ASP 428 N 0.80 0.00 -0.08 1.22 2.03 -1.85 -0.85 116.42 117.69 3hu1 h ASP 428 Ca 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 3hu1 h ASP 428 Cb -0.04 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.46 3hu1 h ASP 428 CO -0.04 0.00 0.00 0.18 -1.03 0.00 0.00 179.24 178.35 3hu1 n LEU 429 N -2.93 1.92 -4.30 0.15 4.32 -1.10 -4.89 117.00 110.17 3hu1 n LEU 429 Ca -0.01 -0.69 -0.28 0.00 -0.02 0.00 0.00 56.01 55.01 3hu1 n LEU 429 Cb 0.20 -0.04 -0.14 0.00 -1.62 0.00 0.00 43.42 41.81 3hu1 n LEU 429 CO 0.23 0.35 -0.54 -0.63 -1.22 0.00 0.00 177.39 175.57 3hu1 s ILE 430 N -1.92 1.90 0.01 -0.08 1.01 -0.33 -4.81 121.20 116.99 3hu1 s ILE 430 Ca 0.35 -1.31 -0.00 0.00 0.00 0.00 0.00 60.65 59.68 3hu1 s ILE 430 Cb 0.20 -1.64 -0.01 0.00 0.01 0.00 0.00 42.46 41.02 3hu1 s ILE 430 CO 0.31 0.27 -0.00 -0.62 0.00 0.00 0.00 174.94 174.90 3hu1 s ASP 431 N -1.25 0.09 0.06 3.58 2.15 -1.26 -4.89 116.67 115.15 3hu1 s ASP 431 Ca 0.10 -0.19 0.11 0.00 0.43 0.00 0.00 52.55 52.99 3hu1 s ASP 431 Cb -0.09 0.06 0.49 0.00 -0.30 0.00 0.00 42.92 43.07 3hu1 s ASP 431 CO 0.02 -0.13 1.34 -0.11 -0.17 0.00 0.00 175.17 176.12 3hu1 n LEU 432 N 2.44 0.13 -0.09 -1.34 7.94 -1.26 -3.73 117.00 121.10 3hu1 n LEU 432 Ca -0.17 0.55 -0.20 0.00 -1.11 0.00 0.00 56.01 55.08 3hu1 n LEU 432 Cb 0.58 -0.54 -0.13 0.00 0.53 0.00 0.00 43.42 43.86 3hu1 n LEU 432 CO 0.23 -0.45 -1.16 -0.62 -1.11 0.00 0.00 177.39 174.28 3hu1 n GLU 433 N -1.66 0.68 -1.82 1.96 -0.58 -1.26 -4.95 120.64 113.01 3hu1 n GLU 433 Ca 0.02 0.20 -0.38 0.00 -0.42 0.00 0.00 57.16 56.57 3hu1 n GLU 433 Cb 0.10 -1.59 0.03 0.00 -0.57 0.00 0.00 31.44 29.42 3hu1 n GLU 433 CO 0.00 0.00 0.00 0.16 -0.48 0.00 0.00 177.13 176.81 3hu1 s ASP 434 N -6.74 5.41 0.09 1.62 -4.77 -1.24 -4.97 116.67 106.06 3hu1 s ASP 434 Ca -0.31 2.75 -0.26 0.00 -3.30 0.00 0.00 52.55 51.43 3hu1 s ASP 434 Cb 0.08 -2.64 -0.15 0.00 -1.09 0.00 0.00 42.92 39.13 3hu1 s ASP 434 CO 0.65 -1.47 1.70 -0.08 0.70 0.00 0.00 175.17 176.67 3hu1 h GLU 435 N 1.61 -0.27 -6.59 2.11 4.81 -1.92 -3.45 114.58 110.88 3hu1 h GLU 435 Ca -0.51 0.02 -0.64 0.00 -0.13 0.00 0.00 59.36 58.10 3hu1 h GLU 435 Cb 1.29 0.06 -0.20 0.00 0.63 0.00 0.00 28.75 30.53 3hu1 h GLU 435 CO 0.58 -0.18 -0.84 0.95 -0.73 0.00 0.00 179.01 178.80 3hu1 s THR 436 N -6.15 2.19 0.11 0.32 -4.23 -1.26 -5.14 115.64 101.48 3hu1 s THR 436 Ca -0.14 -1.87 -0.22 0.00 -1.18 0.00 0.00 61.69 58.28 3hu1 s THR 436 Cb 0.06 -1.98 -0.07 0.00 1.34 0.00 0.00 72.50 71.84 3hu1 s THR 436 CO 0.65 -0.06 0.66 -0.63 -0.54 0.00 0.00 174.62 174.70 3hu1 s ILE 437 N -1.44 4.58 0.22 2.99 -1.09 -1.26 -5.03 121.20 120.17 3hu1 s ILE 437 Ca 0.16 1.43 -0.32 0.00 -2.23 0.00 0.00 60.65 59.69 3hu1 s ILE 437 Cb -0.09 -4.00 -0.14 0.00 -1.58 0.00 0.00 42.46 36.65 3hu1 s ILE 437 CO 0.07 0.54 1.43 -0.67 -1.23 0.00 0.00 174.94 175.08 3hu1 n ASP 438 N 1.67 2.72 -0.35 3.58 -0.08 -1.26 -4.94 116.55 117.89 3hu1 n ASP 438 Ca -0.08 1.13 -0.03 0.00 -1.51 0.00 0.00 54.79 54.30 3hu1 n ASP 438 Cb 0.50 -1.41 0.10 0.00 2.34 0.00 0.00 41.12 42.64 3hu1 n ASP 438 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hu1 h ALA 439 N 4.52 1.19 -0.52 -1.67 0.00 -2.00 -2.72 119.26 118.05 3hu1 h ALA 439 Ca -0.45 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 3hu1 h ALA 439 Cb 1.28 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 3hu1 h ALA 439 CO 0.78 0.59 0.25 1.49 0.00 0.00 0.00 179.25 182.36 3hu1 h GLU 440 N 1.27 0.75 -0.99 0.00 4.57 -2.00 -2.90 114.58 115.27 3hu1 h GLU 440 Ca 0.34 -0.11 0.02 0.00 -1.18 0.00 0.00 59.36 58.43 3hu1 h GLU 440 Cb -0.13 -0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 28.27 3hu1 h GLU 440 CO -0.07 0.63 0.66 0.28 -1.18 0.00 0.00 179.01 179.32 3hu1 h VAL 441 N 0.69 1.23 -0.39 0.32 2.07 -1.90 -1.84 116.25 116.43 3hu1 h VAL 441 Ca 0.18 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 3hu1 h VAL 441 Cb 0.13 -0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.67 3hu1 h VAL 441 CO -0.02 0.24 0.21 -0.03 0.02 0.00 0.00 177.57 177.99 3hu1 h MET 442 N 1.32 0.54 -0.23 1.57 1.85 -1.34 -3.11 114.93 115.54 3hu1 h MET 442 Ca 0.38 -0.06 -0.18 0.00 -0.61 0.00 0.00 59.70 59.22 3hu1 h MET 442 Cb -0.10 -0.11 0.00 0.00 0.43 0.00 0.00 31.60 31.83 3hu1 h MET 442 CO -0.10 0.44 -0.57 -0.91 -0.40 0.00 0.00 176.91 175.37 3hu1 h ASN 443 N 0.50 0.90 0.37 1.39 2.35 -1.30 -3.10 115.58 116.68 3hu1 h ASN 443 Ca 0.14 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 3hu1 h ASN 443 Cb 0.06 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.17 3hu1 h ASN 443 CO -0.02 1.30 0.00 -1.54 -1.65 0.00 0.00 177.43 175.52 3hu1 n SER 444 N -4.05 0.40 -4.58 5.81 3.41 -0.71 -4.72 113.62 109.17 3hu1 n SER 444 Ca -0.06 0.63 -0.41 0.00 -0.26 0.00 0.00 58.87 58.78 3hu1 n SER 444 Cb 0.64 -0.71 -0.03 0.00 -0.26 0.00 0.00 64.21 63.85 3hu1 n SER 444 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hu1 s LEU 445 N -3.96 3.43 -0.01 1.04 1.43 -1.17 -4.95 118.68 114.48 3hu1 s LEU 445 Ca 0.02 1.47 0.02 0.00 -1.03 0.00 0.00 54.13 54.62 3hu1 s LEU 445 Cb 0.07 -3.20 -0.00 0.00 0.03 0.00 0.00 46.19 43.09 3hu1 s LEU 445 CO 0.25 -2.17 -0.08 0.00 0.23 0.00 0.00 176.35 174.57 3hu1 s ALA 446 N 9.08 0.71 -0.24 4.21 0.00 -1.26 -4.78 121.76 129.49 3hu1 s ALA 446 Ca 0.94 -0.33 -0.23 0.00 0.00 0.00 0.00 51.96 52.34 3hu1 s ALA 446 Cb -0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 3hu1 s ALA 446 CO 0.32 0.15 0.76 0.08 0.00 0.00 0.00 175.76 177.06 3hu1 s VAL 447 N -0.04 4.90 0.53 0.00 1.01 0.33 -4.90 120.40 122.23 3hu1 s VAL 447 Ca 0.01 1.42 -0.00 0.00 0.00 0.00 0.00 61.98 63.40 3hu1 s VAL 447 Cb -0.05 -4.05 0.02 0.00 0.00 0.00 0.00 36.38 32.30 3hu1 s VAL 447 CO -0.00 -0.02 0.77 0.42 0.00 0.00 0.00 175.10 176.27 3hu1 s THR 448 N 2.62 3.21 0.30 3.92 -4.23 -1.26 -1.39 115.64 118.80 3hu1 s THR 448 Ca 0.32 -0.50 -0.01 0.00 -1.18 0.00 0.00 61.69 60.32 3hu1 s THR 448 Cb -0.15 -3.22 0.21 0.00 1.34 0.00 0.00 72.50 70.68 3hu1 s THR 448 CO 0.08 -0.17 1.91 -0.03 -0.54 0.00 0.00 174.62 175.87 3hu1 h MET 449 N 0.11 0.90 -0.94 3.99 4.05 -1.92 -2.87 114.93 118.25 3hu1 h MET 449 Ca -0.44 -0.11 0.05 0.00 -0.28 0.00 0.00 59.70 58.91 3hu1 h MET 449 Cb 1.28 -0.17 -0.06 0.00 -0.80 0.00 0.00 31.60 31.85 3hu1 h MET 449 CO 0.55 0.70 0.61 0.22 0.23 0.00 0.00 176.91 179.22 3hu1 h ASP 450 N 0.90 1.00 -0.53 1.39 3.58 -1.95 -0.75 116.42 120.06 3hu1 h ASP 450 Ca 0.22 -0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.72 3hu1 h ASP 450 Cb 0.09 -0.22 -0.05 0.00 1.72 0.00 0.00 39.33 40.87 3hu1 h ASP 450 CO -0.03 0.67 0.26 0.44 -2.88 0.00 0.00 179.24 177.70 3hu1 h ASP 451 N 1.16 0.37 -0.60 2.28 3.32 -1.83 -1.67 116.42 119.45 3hu1 h ASP 451 Ca 0.39 0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.42 3hu1 h ASP 451 Cb 0.06 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 39.55 3hu1 h ASP 451 CO -0.14 0.25 0.17 -0.26 -1.72 0.00 0.00 179.24 177.54 3hu1 h PHE 452 N 0.51 1.01 0.00 4.55 -1.00 -1.22 -0.76 116.94 120.03 3hu1 h PHE 452 Ca 0.24 -0.10 -0.05 0.00 2.81 0.00 0.00 57.97 60.87 3hu1 h PHE 452 Cb 0.16 -0.29 -0.01 0.00 3.61 0.00 0.00 35.95 39.42 3hu1 h PHE 452 CO -0.11 0.83 -0.24 0.00 -1.61 0.00 0.00 178.31 177.18 3hu1 h ARG 453 N 0.94 0.00 -0.16 1.51 3.08 -0.78 0.13 114.38 119.10 3hu1 h ARG 453 Ca 0.20 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.04 3hu1 h ARG 453 Cb 0.31 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.37 3hu1 h ARG 453 CO -0.00 0.24 -0.75 2.35 -1.07 0.00 0.00 179.97 180.74 3hu1 h TRP 454 N 0.00 1.03 -0.58 3.04 7.01 -0.58 -2.39 115.95 123.49 3hu1 h TRP 454 Ca -0.00 -0.44 -0.06 0.00 2.11 0.00 0.00 58.89 60.50 3hu1 h TRP 454 Cb 0.47 -0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.34 3hu1 h TRP 454 CO 0.00 1.27 0.14 0.00 -2.79 0.00 0.00 178.44 177.06 3hu1 h ALA 455 N 0.61 0.76 -0.56 2.65 0.00 -0.73 -3.05 119.26 118.94 3hu1 h ALA 455 Ca -0.04 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 3hu1 h ALA 455 Cb 1.37 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 3hu1 h ALA 455 CO 0.15 0.47 0.13 -0.07 0.00 0.00 0.00 179.25 179.92 3hu1 h LEU 456 N 0.83 0.81 -2.08 0.00 3.38 -0.75 -1.99 115.31 115.52 3hu1 h LEU 456 Ca 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3hu1 h LEU 456 Cb 0.34 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 3hu1 h LEU 456 CO 0.00 0.80 -0.07 0.77 0.09 0.00 0.00 178.44 180.04 3hu1 h SER 457 N 0.83 0.00 0.41 -0.43 4.64 -1.32 -3.05 113.55 114.64 3hu1 h SER 457 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 3hu1 h SER 457 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3hu1 h SER 457 CO 0.00 0.07 -1.37 0.00 -0.87 0.00 0.00 176.83 174.66 3hu1 n GLN 458 N -4.00 0.50 -0.70 4.77 1.13 -0.80 -5.03 117.38 113.25 3hu1 n GLN 458 Ca -0.03 -0.04 -0.29 0.00 -1.94 0.00 0.00 57.00 54.70 3hu1 n GLN 458 Cb 0.16 -1.63 0.21 0.00 0.11 0.00 0.00 30.24 29.08 3hu1 n GLN 458 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3hu1 s SER 459 N -4.50 2.02 -0.12 1.08 0.15 -0.91 -5.08 113.70 106.33 3hu1 s SER 459 Ca -0.02 1.75 -0.07 0.00 0.70 0.00 0.00 55.95 58.31 3hu1 s SER 459 Cb 0.13 -2.38 0.04 0.00 -1.71 0.00 0.00 66.02 62.11 3hu1 s SER 459 CO 0.84 -3.59 0.29 0.21 1.20 0.00 0.00 173.24 172.19 3hu1 s ASN 460 N -2.71 -0.33 0.59 5.45 3.84 -1.26 -5.08 114.94 115.44 3hu1 s ASN 460 Ca 0.67 0.62 -0.14 0.00 0.21 0.00 0.00 52.86 54.21 3hu1 s ASN 460 Cb -0.23 0.54 -0.04 0.00 -0.55 0.00 0.00 41.25 40.97 3hu1 s ASN 460 CO 0.61 -0.15 1.03 -2.16 -2.79 0.00 0.00 177.10 173.64 3hu1 s PRO 461 N 0.95 3.46 0.00 0.43 0.04 -1.26 -4.96 135.00 133.66 3hu1 s PRO 461 Ca -0.07 1.03 0.00 0.00 0.04 0.00 0.00 61.00 62.00 3hu1 s PRO 461 Cb -0.07 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.41 3hu1 s PRO 461 CO -0.07 -0.68 0.00 -1.13 0.04 0.00 0.00 177.00 175.16