#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hu2 n SER 13 N 0.00 2.51 0.00 1.45 3.41 -1.26 -4.42 113.62 115.30 3hu2 n SER 13 Ca 0.00 -0.01 0.01 0.00 -0.26 0.00 0.00 58.87 58.61 3hu2 n SER 13 Cb 0.00 0.64 0.03 0.00 -0.26 0.00 0.00 64.21 64.62 3hu2 n SER 13 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 3hu2 n THR 14 N -2.44 0.97 -0.22 6.66 5.66 -1.26 -4.12 114.28 119.53 3hu2 n THR 14 Ca -0.18 0.24 0.22 0.00 -3.05 0.00 0.00 64.05 61.29 3hu2 n THR 14 Cb 0.83 -1.22 0.58 0.00 -1.55 0.00 0.00 70.33 68.97 3hu2 n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hu2 h ALA 15 N 2.06 2.41 0.00 1.79 0.00 -2.00 -0.70 119.26 122.82 3hu2 h ALA 15 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hu2 h ALA 15 Cb 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3hu2 h ALA 15 CO 0.00 -0.69 -0.01 0.97 0.00 0.00 0.00 179.25 179.52 3hu2 h ILE 16 N 0.26 0.11 0.00 0.00 2.10 -1.94 -2.83 117.51 115.22 3hu2 h ILE 16 Ca 0.45 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 66.27 3hu2 h ILE 16 Cb 1.34 1.11 0.00 0.00 -1.09 0.00 0.00 36.82 38.17 3hu2 h ILE 16 CO -0.12 0.01 -0.92 0.18 -1.08 0.00 0.00 178.15 176.22 3hu2 n LEU 17 N -3.22 0.64 -4.77 2.19 4.77 -0.27 -4.97 117.00 111.36 3hu2 n LEU 17 Ca -0.02 -0.06 -0.40 0.00 -0.03 0.00 0.00 56.01 55.50 3hu2 n LEU 17 Cb 0.12 -0.12 -0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3hu2 n LEU 17 CO 0.23 0.07 1.04 -0.75 -1.33 0.00 0.00 177.39 176.66 3hu2 s LYS 18 N -3.14 4.04 0.22 3.23 2.20 -1.07 -4.94 119.74 120.28 3hu2 s LYS 18 Ca 0.05 2.36 -0.08 0.00 -0.36 0.00 0.00 55.97 57.94 3hu2 s LYS 18 Cb 0.15 -2.87 0.30 0.00 -1.51 0.00 0.00 37.83 33.89 3hu2 s LYS 18 CO 0.79 -0.50 1.79 1.96 -0.36 0.00 0.00 175.35 179.02 3hu2 h GLN 19 N 2.87 0.60 -4.48 4.03 4.20 -1.93 -3.49 115.11 116.91 3hu2 h GLN 19 Ca -0.50 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.18 3hu2 h GLN 19 Cb 1.24 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.84 3hu2 h GLN 19 CO 0.63 0.39 -1.08 1.17 -0.67 0.00 0.00 178.83 179.28 3hu2 n LYS 20 N -4.85 -4.22 -2.05 1.46 3.00 -1.26 -4.92 118.16 105.31 3hu2 n LYS 20 Ca 0.10 3.18 -0.42 0.00 -0.00 0.00 0.00 58.31 61.17 3hu2 n LYS 20 Cb 0.24 -4.27 -0.03 0.00 0.00 0.00 0.00 35.03 30.97 3hu2 n LYS 20 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.40 176.60 3hu2 s ASN 21 N -0.54 6.71 0.10 3.14 0.01 -1.26 -4.99 114.94 118.11 3hu2 s ASN 21 Ca -0.11 2.38 0.05 0.00 -0.71 0.00 0.00 52.86 54.46 3hu2 s ASN 21 Cb 0.01 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 39.06 3hu2 s ASN 21 CO 0.30 -0.79 -0.12 -0.13 -1.51 0.00 0.00 177.10 174.86 3hu2 s ARG 22 N 2.01 0.87 0.26 -0.60 3.00 -1.26 -5.05 118.95 118.18 3hu2 s ARG 22 Ca 0.69 -1.11 0.02 0.00 0.00 0.00 0.00 55.73 55.32 3hu2 s ARG 22 Cb -0.38 -0.70 0.64 0.00 0.00 0.00 0.00 34.95 34.52 3hu2 s ARG 22 CO 0.30 0.13 1.31 -2.30 0.00 0.00 0.00 175.30 174.74 3hu2 n PRO 23 N 0.77 -0.07 0.03 3.54 -0.01 -1.26 -2.98 135.00 135.02 3hu2 n PRO 23 Ca -0.17 1.25 0.11 0.00 -0.01 0.00 0.00 63.50 64.68 3hu2 n PRO 23 Cb 0.56 -1.99 -0.03 0.00 -0.01 0.00 0.00 33.50 32.04 3hu2 n PRO 23 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 175.50 175.76 3hu2 n ASN 24 N -5.20 0.56 -4.61 2.55 6.94 -1.26 -4.85 115.26 109.39 3hu2 n ASN 24 Ca 0.20 -0.17 -0.43 0.00 -0.02 0.00 0.00 54.58 54.16 3hu2 n ASN 24 Cb 0.65 0.99 -0.02 0.00 -2.36 0.00 0.00 39.78 39.04 3hu2 n ASN 24 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 3hu2 s ARG 25 N -3.26 3.61 0.05 -3.83 3.52 -1.16 -2.66 118.95 115.21 3hu2 s ARG 25 Ca 0.01 1.10 0.04 0.00 -0.13 0.00 0.00 55.73 56.76 3hu2 s ARG 25 Cb 0.14 -4.03 -0.02 0.00 -1.56 0.00 0.00 34.95 29.48 3hu2 s ARG 25 CO 0.83 -1.52 -0.13 -0.51 -0.81 0.00 0.00 175.30 173.16 3hu2 s LEU 26 N 5.45 2.20 0.01 -0.88 1.43 -0.67 -4.69 118.68 121.54 3hu2 s LEU 26 Ca 0.64 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.94 3hu2 s LEU 26 Cb -0.16 -0.50 -0.03 0.00 0.03 0.00 0.00 46.19 45.52 3hu2 s LEU 26 CO 0.31 -0.03 0.98 -0.63 0.23 0.00 0.00 176.35 177.21 3hu2 s ILE 27 N -1.00 4.82 -0.35 -0.59 1.01 -0.77 -1.53 121.20 122.79 3hu2 s ILE 27 Ca -0.01 2.06 -0.29 0.00 0.00 0.00 0.00 60.65 62.41 3hu2 s ILE 27 Cb -0.08 -4.32 0.00 0.00 0.01 0.00 0.00 42.46 38.07 3hu2 s ILE 27 CO 0.01 0.18 1.34 0.68 0.00 0.00 0.00 174.94 177.15 3hu2 s VAL 28 N 0.87 4.05 0.22 2.92 -7.23 -0.20 -0.54 120.40 120.49 3hu2 s VAL 28 Ca 0.51 1.15 0.07 0.00 -1.81 0.00 0.00 61.98 61.90 3hu2 s VAL 28 Cb -0.21 -4.19 -0.04 0.00 0.56 0.00 0.00 36.38 32.50 3hu2 s VAL 28 CO 0.28 -0.59 0.14 -0.62 -0.31 0.00 0.00 175.10 174.00 3hu2 s ASP 29 N 3.19 5.37 0.31 4.85 3.68 0.31 -0.27 116.67 134.12 3hu2 s ASP 29 Ca 0.58 -0.26 -0.29 0.00 2.13 0.00 0.00 52.55 54.71 3hu2 s ASP 29 Cb -0.15 -1.33 -0.10 0.00 -1.45 0.00 0.00 42.92 39.88 3hu2 s ASP 29 CO 0.27 0.01 1.41 -0.70 0.13 0.00 0.00 175.17 176.29 3hu2 s GLU 30 N -3.52 4.25 0.23 4.34 2.56 -1.26 -1.47 118.70 123.84 3hu2 s GLU 30 Ca 0.32 2.35 -0.30 0.00 0.00 0.00 0.00 54.97 57.34 3hu2 s GLU 30 Cb -0.09 -3.05 -0.09 0.00 2.00 0.00 0.00 34.13 32.90 3hu2 s GLU 30 CO 0.23 -0.37 0.99 0.00 -0.56 0.00 0.00 175.26 175.55 3hu2 s ALA 31 N -0.70 3.35 -0.03 6.30 0.00 -1.22 -4.50 121.76 124.96 3hu2 s ALA 31 Ca 0.54 0.69 0.08 0.00 0.00 0.00 0.00 51.96 53.28 3hu2 s ALA 31 Cb -0.43 -3.25 -0.24 0.00 0.00 0.00 0.00 23.12 19.20 3hu2 s ALA 31 CO 0.52 0.07 0.71 -0.84 0.00 0.00 0.00 175.76 176.22 3hu2 h ILE 32 N 3.25 0.94 -3.03 0.00 3.07 -1.94 -3.44 117.51 116.36 3hu2 h ILE 32 Ca -0.45 -2.74 -0.60 0.00 1.55 0.00 0.00 64.86 62.61 3hu2 h ILE 32 Cb 1.20 2.51 -0.12 0.00 -0.27 0.00 0.00 36.82 40.14 3hu2 h ILE 32 CO 0.68 0.62 0.64 0.21 -1.05 0.00 0.00 178.15 179.25 3hu2 s ASN 33 N -6.36 6.30 0.00 2.16 3.84 -1.26 -4.92 114.94 114.70 3hu2 s ASN 33 Ca -0.07 -0.44 0.28 0.00 0.21 0.00 0.00 52.86 52.85 3hu2 s ASN 33 Cb 0.08 -2.45 1.44 0.00 -0.55 0.00 0.00 41.25 39.76 3hu2 s ASN 33 CO 0.82 -1.34 1.98 1.21 -2.79 0.00 0.00 177.10 176.98 3hu2 n GLU 34 N 7.74 0.41 -2.31 0.43 4.07 -1.26 -4.68 120.64 125.05 3hu2 n GLU 34 Ca 0.01 0.02 -0.41 0.00 -0.06 0.00 0.00 57.16 56.72 3hu2 n GLU 34 Cb 0.47 -1.50 -0.03 0.00 -0.06 0.00 0.00 31.44 30.32 3hu2 n GLU 34 CO 0.00 0.00 0.00 0.34 -0.06 0.00 0.00 177.13 177.41 3hu2 s ASP 35 N -2.56 7.03 0.51 4.31 2.15 -1.26 -4.89 116.67 121.96 3hu2 s ASP 35 Ca 0.27 2.43 0.18 0.00 0.43 0.00 0.00 52.55 55.86 3hu2 s ASP 35 Cb 0.19 -2.63 1.27 0.00 -0.30 0.00 0.00 42.92 41.45 3hu2 s ASP 35 CO 0.43 -0.35 2.08 0.78 -0.17 0.00 0.00 175.17 177.95 3hu2 h ASN 36 N 4.01 0.05 -0.09 -0.34 2.35 -1.94 -2.81 115.58 116.82 3hu2 h ASN 36 Ca -0.47 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 3hu2 h ASN 36 Cb 1.22 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.58 3hu2 h ASN 36 CO 0.68 0.04 0.00 -1.20 -1.65 0.00 0.00 177.43 175.30 3hu2 n SER 37 N -4.48 1.29 -4.15 5.81 7.64 -1.26 -4.71 113.62 113.76 3hu2 n SER 37 Ca 0.02 -1.56 -0.29 0.00 1.01 0.00 0.00 58.87 58.05 3hu2 n SER 37 Cb 0.27 -0.05 -0.17 0.00 -1.01 0.00 0.00 64.21 63.25 3hu2 n SER 37 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3hu2 s VAL 38 N -1.89 1.68 0.06 0.44 0.11 -1.06 0.19 120.40 119.93 3hu2 s VAL 38 Ca 0.34 -0.81 0.09 0.00 -2.93 0.00 0.00 61.98 58.68 3hu2 s VAL 38 Cb 0.18 -1.47 -0.03 0.00 -1.53 0.00 0.00 36.38 33.53 3hu2 s VAL 38 CO 0.28 0.48 -0.23 0.68 -3.33 0.00 0.00 175.10 172.98 3hu2 s VAL 39 N 0.39 2.46 -0.10 2.04 -7.23 0.06 -4.62 120.40 113.39 3hu2 s VAL 39 Ca -0.15 -1.39 0.01 0.00 -1.81 0.00 0.00 61.98 58.64 3hu2 s VAL 39 Cb -0.16 -2.02 -0.02 0.00 0.56 0.00 0.00 36.38 34.73 3hu2 s VAL 39 CO 0.06 0.28 -0.13 -0.44 -0.31 0.00 0.00 175.10 174.56 3hu2 s SER 40 N -1.53 4.02 0.20 4.85 0.01 -0.13 -1.92 113.70 119.20 3hu2 s SER 40 Ca 0.14 -0.29 0.09 0.00 1.31 0.00 0.00 55.95 57.21 3hu2 s SER 40 Cb -0.10 -1.38 -0.04 0.00 0.21 0.00 0.00 66.02 64.71 3hu2 s SER 40 CO 0.05 0.22 -0.19 -0.76 0.41 0.00 0.00 173.24 172.97 3hu2 s LEU 41 N 0.01 2.50 0.68 2.44 1.43 -0.98 -0.59 118.68 124.18 3hu2 s LEU 41 Ca -0.04 -0.94 -0.15 0.00 -1.03 0.00 0.00 54.13 51.97 3hu2 s LEU 41 Cb -0.14 -0.90 0.01 0.00 0.03 0.00 0.00 46.19 45.19 3hu2 s LEU 41 CO 0.04 -0.03 1.14 -0.94 0.23 0.00 0.00 176.35 176.80 3hu2 s SER 42 N -3.00 4.80 0.19 2.29 1.04 -1.26 -0.75 113.70 117.02 3hu2 s SER 42 Ca 0.21 2.13 -0.12 0.00 0.48 0.00 0.00 55.95 58.65 3hu2 s SER 42 Cb -0.05 -2.57 0.11 0.00 0.10 0.00 0.00 66.02 63.62 3hu2 s SER 42 CO 0.09 -1.84 1.85 -0.61 0.98 0.00 0.00 173.24 173.71 3hu2 h GLN 43 N -0.04 0.87 0.00 4.02 5.75 -1.90 -2.17 115.11 121.63 3hu2 h GLN 43 Ca -0.47 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 57.97 3hu2 h GLN 43 Cb 1.26 -0.19 0.00 0.00 1.07 0.00 0.00 27.48 29.62 3hu2 h GLN 43 CO 0.53 0.58 0.00 -1.35 -2.65 0.00 0.00 178.83 175.94 3hu2 h PRO 44 N 0.88 0.00 0.15 -2.39 0.11 -1.96 -2.62 132.00 126.18 3hu2 h PRO 44 Ca 0.24 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 66.01 3hu2 h PRO 44 Cb -0.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.03 3hu2 h PRO 44 CO -0.05 0.00 -1.68 -0.22 -0.21 0.00 0.00 178.00 175.84 3hu2 h LYS 45 N 0.00 0.32 -0.72 1.05 1.63 -1.76 -3.20 116.57 113.88 3hu2 h LYS 45 Ca 0.00 -0.54 -0.05 0.00 -0.85 0.00 0.00 60.65 59.20 3hu2 h LYS 45 Cb 0.30 0.20 -0.03 0.00 -0.60 0.00 0.00 32.23 32.10 3hu2 h LYS 45 CO 0.00 1.21 0.24 0.52 -3.45 0.00 0.00 179.45 177.97 3hu2 h MET 46 N 0.09 1.10 -0.78 1.90 2.86 -1.22 -2.76 114.93 116.12 3hu2 h MET 46 Ca -0.31 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.11 3hu2 h MET 46 Cb 2.06 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 33.52 3hu2 h MET 46 CO 0.16 0.92 0.46 -0.44 1.06 0.00 0.00 176.91 179.07 3hu2 h ASP 47 N 1.06 0.94 -0.38 1.22 5.19 -1.61 0.85 116.42 123.70 3hu2 h ASP 47 Ca 0.24 -0.07 -0.10 0.00 -0.62 0.00 0.00 57.03 56.47 3hu2 h ASP 47 Cb 0.27 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.53 3hu2 h ASP 47 CO -0.01 0.74 -0.16 -0.08 -3.12 0.00 0.00 179.24 176.61 3hu2 h GLU 48 N 1.07 0.78 -0.05 3.56 4.81 -1.51 -2.93 114.58 120.30 3hu2 h GLU 48 Ca 0.28 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3hu2 h GLU 48 Cb -0.02 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.34 3hu2 h GLU 48 CO -0.05 0.95 0.00 1.28 -0.73 0.00 0.00 179.01 180.46 3hu2 n LEU 49 N -4.29 1.12 -3.73 1.64 4.77 -1.06 -4.94 117.00 110.51 3hu2 n LEU 49 Ca -0.02 -0.41 -0.25 0.00 -0.03 0.00 0.00 56.01 55.30 3hu2 n LEU 49 Cb 0.40 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.49 3hu2 n LEU 49 CO 0.44 0.20 -0.11 0.00 -1.33 0.00 0.00 177.39 176.59 3hu2 n GLN 50 N -0.10 -3.16 -3.88 3.23 6.02 -1.01 -4.95 117.38 113.52 3hu2 n GLN 50 Ca 0.19 0.53 -0.35 0.00 -0.01 0.00 0.00 57.00 57.35 3hu2 n GLN 50 Cb 0.28 -4.71 -0.14 0.00 1.02 0.00 0.00 30.24 26.69 3hu2 n GLN 50 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3hu2 s LEU 51 N -6.61 3.78 0.78 1.08 1.43 0.26 -5.04 118.68 114.36 3hu2 s LEU 51 Ca 0.18 -1.09 -0.12 0.00 -1.03 0.00 0.00 54.13 52.07 3hu2 s LEU 51 Cb -0.06 -1.74 0.06 0.00 0.03 0.00 0.00 46.19 44.48 3hu2 s LEU 51 CO 0.84 -0.23 1.16 -0.36 0.23 0.00 0.00 176.35 177.99 3hu2 s PHE 52 N 1.32 3.05 0.14 0.29 2.99 -1.26 -4.51 117.98 120.00 3hu2 s PHE 52 Ca -0.03 0.82 -0.31 0.00 0.00 0.00 0.00 56.93 57.41 3hu2 s PHE 52 Cb -0.19 -3.39 -0.09 0.00 0.00 0.00 0.00 43.02 39.36 3hu2 s PHE 52 CO -0.01 -1.62 1.47 0.50 -0.00 0.00 0.00 175.22 175.56 3hu2 s ARG 53 N -5.52 4.27 0.00 0.44 3.52 -1.26 -3.30 118.95 117.10 3hu2 s ARG 53 Ca 0.61 2.21 0.00 0.00 -0.13 0.00 0.00 55.73 58.42 3hu2 s ARG 53 Cb -0.11 -3.20 0.00 0.00 -1.56 0.00 0.00 34.95 30.08 3hu2 s ARG 53 CO 0.50 -0.52 0.00 0.41 -0.81 0.00 0.00 175.30 174.88 3hu2 n GLY 54 N 3.59 0.91 3.75 8.12 0.00 0.14 -5.03 105.19 116.67 3hu2 n GLY 54 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3hu2 n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu2 s ASP 55 N -2.92 6.91 -0.04 1.61 1.01 -1.21 -4.68 116.67 117.36 3hu2 s ASP 55 Ca 0.00 2.46 -0.30 0.00 0.71 0.00 0.00 52.55 55.42 3hu2 s ASP 55 Cb 0.00 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 3hu2 s ASP 55 CO 0.00 -0.48 1.25 0.42 0.21 0.00 0.00 175.17 176.57 3hu2 s THR 56 N -0.34 4.10 0.22 -1.27 -4.23 -1.26 -1.73 115.64 111.14 3hu2 s THR 56 Ca 0.53 1.45 0.12 0.00 -1.18 0.00 0.00 61.69 62.61 3hu2 s THR 56 Cb -0.37 -3.93 -0.05 0.00 1.34 0.00 0.00 72.50 69.50 3hu2 s THR 56 CO 0.42 0.00 -0.22 0.68 -0.54 0.00 0.00 174.62 174.96 3hu2 s VAL 57 N 2.21 2.38 -0.24 2.29 -7.23 0.27 -2.55 120.40 117.52 3hu2 s VAL 57 Ca 0.58 -2.16 -0.07 0.00 -1.81 0.00 0.00 61.98 58.52 3hu2 s VAL 57 Cb -0.27 -2.18 -0.03 0.00 0.56 0.00 0.00 36.38 34.47 3hu2 s VAL 57 CO 0.23 -0.22 0.07 -0.22 -0.31 0.00 0.00 175.10 174.65 3hu2 s LEU 58 N -2.95 3.48 -0.15 1.32 2.96 0.15 -1.28 118.68 122.20 3hu2 s LEU 58 Ca 0.24 -0.18 -0.05 0.00 -0.22 0.00 0.00 54.13 53.92 3hu2 s LEU 58 Cb -0.07 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 3hu2 s LEU 58 CO 0.11 -0.01 0.03 -0.76 -1.32 0.00 0.00 176.35 174.40 3hu2 s LEU 59 N 1.50 3.66 -0.26 -0.68 1.43 -0.03 -0.65 118.68 123.65 3hu2 s LEU 59 Ca 0.06 0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.21 3hu2 s LEU 59 Cb -0.15 -1.89 0.03 0.00 0.03 0.00 0.00 46.19 44.21 3hu2 s LEU 59 CO 0.04 0.23 -0.05 -0.54 0.23 0.00 0.00 176.35 176.26 3hu2 s LYS 60 N -0.00 2.76 0.00 1.70 1.02 -0.47 -1.69 119.74 123.05 3hu2 s LYS 60 Ca 0.04 -1.03 0.00 0.00 0.02 0.00 0.00 55.97 55.00 3hu2 s LYS 60 Cb -0.13 -3.03 0.00 0.00 -0.52 0.00 0.00 37.83 34.16 3hu2 s LYS 60 CO 0.01 -0.44 0.00 0.41 -0.92 0.00 0.00 175.35 174.41 3hu2 n GLY 61 N 4.66 1.71 3.94 -3.33 0.00 -0.08 -2.27 105.19 109.83 3hu2 n GLY 61 Ca -0.16 -1.71 -0.24 0.00 0.00 0.00 0.00 46.02 43.91 3hu2 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu2 s LYS 62 N 3.81 3.40 -1.27 1.61 1.02 -0.38 -4.66 119.74 123.28 3hu2 s LYS 62 Ca 0.00 -0.33 -0.08 0.00 0.02 0.00 0.00 55.97 55.58 3hu2 s LYS 62 Cb 0.00 -2.62 -0.01 0.00 -0.52 0.00 0.00 37.83 34.68 3hu2 s LYS 62 CO 0.00 0.04 0.65 1.63 -0.92 0.00 0.00 175.35 176.75 3hu2 n LYS 63 N -1.88 -2.95 0.00 1.68 5.02 -1.26 -1.46 118.16 117.31 3hu2 n LYS 63 Ca -0.03 0.50 0.00 0.00 -2.02 0.00 0.00 58.31 56.76 3hu2 n LYS 63 Cb 0.56 -4.61 0.00 0.00 -0.02 0.00 0.00 35.03 30.96 3hu2 n LYS 63 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3hu2 n ARG 64 N -4.24 0.00 -2.25 1.97 3.00 -1.23 -4.80 116.66 109.11 3hu2 n ARG 64 Ca -0.22 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.22 3hu2 n ARG 64 Cb 0.65 -1.76 -0.03 0.00 0.00 0.00 0.00 32.46 31.31 3hu2 n ARG 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3hu2 s ARG 65 N 0.00 4.45 0.16 -0.14 1.81 -0.53 -4.89 118.95 119.80 3hu2 s ARG 65 Ca 0.00 2.05 0.06 0.00 -1.72 0.00 0.00 55.73 56.11 3hu2 s ARG 65 Cb 0.00 -3.14 -0.04 0.00 -0.45 0.00 0.00 34.95 31.32 3hu2 s ARG 65 CO 0.00 -0.08 -0.12 -1.21 -0.68 0.00 0.00 175.30 173.21 3hu2 s GLU 66 N -1.24 1.12 -0.01 3.54 2.02 -1.26 -0.90 118.70 121.97 3hu2 s GLU 66 Ca 0.50 -1.44 -0.03 0.00 0.02 0.00 0.00 54.97 54.01 3hu2 s GLU 66 Cb -0.36 -0.81 -0.00 0.00 0.10 0.00 0.00 34.13 33.06 3hu2 s GLU 66 CO 0.45 0.12 0.07 0.00 0.02 0.00 0.00 175.26 175.93 3hu2 s ALA 67 N -2.99 -0.16 -0.18 5.21 0.00 -0.68 -4.67 121.76 118.29 3hu2 s ALA 67 Ca 0.17 -0.08 -0.03 0.00 0.00 0.00 0.00 51.96 52.01 3hu2 s ALA 67 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 3hu2 s ALA 67 CO 0.03 -0.12 -0.06 0.14 0.00 0.00 0.00 175.76 175.75 3hu2 s VAL 68 N -0.76 3.50 0.10 0.00 -7.23 -1.26 -0.85 120.40 113.89 3hu2 s VAL 68 Ca -0.08 -0.48 -0.00 0.00 -1.81 0.00 0.00 61.98 59.60 3hu2 s VAL 68 Cb -0.05 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.30 3hu2 s VAL 68 CO 0.00 0.47 0.00 0.00 -0.31 0.00 0.00 175.10 175.26 3hu2 s ILE 70 N -3.92 5.05 -0.21 0.00 1.01 0.13 0.96 121.20 124.22 3hu2 s ILE 70 Ca 0.16 0.95 -0.11 0.00 0.00 0.00 0.00 60.65 61.64 3hu2 s ILE 70 Cb 0.07 -3.79 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 3hu2 s ILE 70 CO -0.03 0.47 0.19 0.54 0.00 0.00 0.00 174.94 176.10 3hu2 s VAL 71 N -0.35 5.36 0.09 2.92 0.11 -0.70 -0.76 120.40 127.07 3hu2 s VAL 71 Ca 0.25 0.28 0.06 0.00 -2.93 0.00 0.00 61.98 59.65 3hu2 s VAL 71 Cb -0.16 -3.52 -0.03 0.00 -1.53 0.00 0.00 36.38 31.13 3hu2 s VAL 71 CO 0.13 0.39 -0.16 -0.76 -3.33 0.00 0.00 175.10 171.37 3hu2 s LEU 72 N 0.65 2.31 0.52 2.54 1.43 -0.81 -0.68 118.68 124.65 3hu2 s LEU 72 Ca 0.10 -0.68 -0.21 0.00 -1.03 0.00 0.00 54.13 52.31 3hu2 s LEU 72 Cb -0.12 -0.60 -0.06 0.00 0.03 0.00 0.00 46.19 45.44 3hu2 s LEU 72 CO 0.02 -0.07 1.18 -0.94 0.23 0.00 0.00 176.35 176.77 3hu2 s SER 73 N -1.96 5.77 -0.07 2.29 1.04 -1.26 -2.31 113.70 117.20 3hu2 s SER 73 Ca 0.03 2.32 -0.03 0.00 0.48 0.00 0.00 55.95 58.74 3hu2 s SER 73 Cb -0.09 -2.60 0.04 0.00 0.10 0.00 0.00 66.02 63.47 3hu2 s SER 73 CO 0.03 -1.19 0.16 -0.62 0.98 0.00 0.00 173.24 172.60 3hu2 s ASP 74 N -1.49 -0.14 -0.02 7.02 2.15 0.07 -4.80 116.67 119.45 3hu2 s ASP 74 Ca 0.70 0.34 -0.21 0.00 0.43 0.00 0.00 52.55 53.81 3hu2 s ASP 74 Cb -0.28 0.23 -0.28 0.00 -0.30 0.00 0.00 42.92 42.29 3hu2 s ASP 74 CO 0.33 -0.14 1.00 0.44 -0.17 0.00 0.00 175.17 176.62 3hu2 h ASP 75 N 7.14 0.51 0.78 -0.34 5.19 -1.98 -3.26 116.42 124.46 3hu2 h ASP 75 Ca -0.41 -0.86 0.00 0.00 -0.62 0.00 0.00 57.03 55.13 3hu2 h ASP 75 Cb 1.15 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 40.50 3hu2 h ASP 75 CO 0.42 1.32 0.00 1.07 -3.12 0.00 0.00 179.24 178.92 3hu2 n THR 76 N -4.16 0.79 -2.91 0.35 5.66 -1.26 -4.73 114.28 108.01 3hu2 n THR 76 Ca -0.12 0.15 -0.40 0.00 -3.05 0.00 0.00 64.05 60.63 3hu2 n THR 76 Cb 0.76 -1.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.48 3hu2 n THR 76 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hu2 s SER 78 N -1.04 5.29 0.11 0.00 0.01 -1.26 -4.45 113.70 112.36 3hu2 s SER 78 Ca 0.38 1.64 -0.22 0.00 1.31 0.00 0.00 55.95 59.06 3hu2 s SER 78 Cb -0.24 -2.50 -0.10 0.00 0.21 0.00 0.00 66.02 63.40 3hu2 s SER 78 CO 0.28 -1.50 1.72 0.44 0.41 0.00 0.00 173.24 174.58 3hu2 h ASP 79 N -0.75 -0.10 -0.38 2.44 3.45 -1.96 -3.02 116.42 116.09 3hu2 h ASP 79 Ca -0.44 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.05 3hu2 h ASP 79 Cb 1.21 0.06 0.00 0.00 -0.56 0.00 0.00 39.33 40.04 3hu2 h ASP 79 CO 0.56 -0.04 0.00 -0.62 -1.57 0.00 0.00 179.24 177.57 3hu2 n GLU 80 N -5.15 2.50 -4.39 3.56 -0.58 -1.26 -4.66 120.64 110.67 3hu2 n GLU 80 Ca -0.05 -1.62 -0.25 0.00 -0.42 0.00 0.00 57.16 54.82 3hu2 n GLU 80 Cb 0.08 -1.59 -0.09 0.00 -0.57 0.00 0.00 31.44 29.27 3hu2 n GLU 80 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3hu2 s LYS 81 N -1.68 1.88 -0.07 3.49 1.02 -1.14 -1.86 119.74 121.39 3hu2 s LYS 81 Ca 0.29 -1.56 0.01 0.00 0.02 0.00 0.00 55.97 54.73 3hu2 s LYS 81 Cb 0.18 -1.95 0.02 0.00 -0.52 0.00 0.00 37.83 35.57 3hu2 s LYS 81 CO 0.15 0.37 -0.07 -1.50 -0.92 0.00 0.00 175.35 173.37 3hu2 s ILE 82 N -2.21 0.80 -0.30 2.17 2.07 0.30 -4.54 121.20 119.48 3hu2 s ILE 82 Ca 0.28 -0.23 -0.19 0.00 -1.41 0.00 0.00 60.65 59.11 3hu2 s ILE 82 Cb -0.06 -0.80 -0.01 0.00 0.13 0.00 0.00 42.46 41.71 3hu2 s ILE 82 CO 0.16 0.30 0.55 -0.13 -1.91 0.00 0.00 174.94 173.90 3hu2 s ARG 83 N 1.16 3.87 -0.09 3.50 0.52 0.25 0.12 118.95 128.28 3hu2 s ARG 83 Ca -0.06 0.15 -0.08 0.00 -0.52 0.00 0.00 55.73 55.22 3hu2 s ARG 83 Cb -0.14 -3.73 0.03 0.00 0.52 0.00 0.00 34.95 31.63 3hu2 s ARG 83 CO -0.01 -0.51 0.24 0.00 0.02 0.00 0.00 175.30 175.03 3hu2 s MET 84 N 2.43 0.26 0.94 3.54 0.23 -0.54 -0.96 119.30 125.20 3hu2 s MET 84 Ca 0.21 0.36 -0.13 0.00 -1.03 0.00 0.00 55.69 55.11 3hu2 s MET 84 Cb -0.15 0.09 0.15 0.00 -1.53 0.00 0.00 34.83 33.39 3hu2 s MET 84 CO 0.11 -0.06 1.14 0.54 -2.03 0.00 0.00 175.02 174.73 3hu2 s ASN 85 N 0.32 3.29 0.43 -1.18 2.20 -1.26 -3.45 114.94 115.29 3hu2 s ASN 85 Ca -0.02 0.91 0.21 0.00 -0.94 0.00 0.00 52.86 53.03 3hu2 s ASN 85 Cb -0.03 -1.44 1.17 0.00 -2.00 0.00 0.00 41.25 38.95 3hu2 s ASN 85 CO -0.01 -2.68 1.82 0.00 -2.94 0.00 0.00 177.10 173.29 3hu2 h ALA 86 N -1.59 2.36 0.03 3.54 0.00 -1.98 -2.18 119.26 119.44 3hu2 h ALA 86 Ca -0.50 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 3hu2 h ALA 86 Cb 1.32 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3hu2 h ALA 86 CO 0.59 -0.70 -0.01 0.28 0.00 0.00 0.00 179.25 179.41 3hu2 h VAL 87 N 0.32 1.31 -0.42 0.00 2.07 -1.91 0.16 116.25 117.78 3hu2 h VAL 87 Ca 0.52 -1.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 3hu2 h VAL 87 Cb 1.45 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 33.25 3hu2 h VAL 87 CO -0.19 0.28 0.22 0.58 0.02 0.00 0.00 177.57 178.48 3hu2 h VAL 88 N -0.52 1.17 -0.97 2.57 2.07 -1.74 -0.80 116.25 118.03 3hu2 h VAL 88 Ca -0.00 -0.45 0.03 0.00 0.82 0.00 0.00 66.70 67.10 3hu2 h VAL 88 Cb 0.49 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3hu2 h VAL 88 CO 0.01 0.18 0.63 0.03 0.02 0.00 0.00 177.57 178.44 3hu2 h ARG 89 N 0.54 1.21 -0.21 1.57 3.08 -1.34 0.63 114.38 119.87 3hu2 h ARG 89 Ca 0.15 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3hu2 h ARG 89 Cb 0.08 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 3hu2 h ARG 89 CO -0.02 0.80 0.08 -0.97 -1.07 0.00 0.00 179.97 178.79 3hu2 h ASN 90 N 1.25 0.30 -0.54 7.04 -1.24 -0.35 -0.23 115.58 121.81 3hu2 h ASN 90 Ca 0.38 -0.17 -0.02 0.00 0.71 0.00 0.00 56.30 57.20 3hu2 h ASN 90 Cb -0.04 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 38.90 3hu2 h ASN 90 CO -0.11 0.39 0.28 0.78 -1.29 0.00 0.00 177.43 177.48 3hu2 h ASN 91 N 0.19 0.72 0.12 1.15 -0.26 -0.55 -1.07 115.58 115.88 3hu2 h ASN 91 Ca 0.07 -0.07 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 3hu2 h ASN 91 Cb 0.19 -0.18 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 3hu2 h ASN 91 CO -0.01 0.61 -0.02 0.18 -1.06 0.00 0.00 177.43 177.13 3hu2 n LEU 92 N -4.37 0.44 -3.78 1.61 4.77 0.16 -4.45 117.00 111.38 3hu2 n LEU 92 Ca 0.05 -0.09 -0.29 0.00 -0.03 0.00 0.00 56.01 55.65 3hu2 n LEU 92 Cb 0.12 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.17 3hu2 n LEU 92 CO 0.38 0.08 -0.13 0.54 -1.33 0.00 0.00 177.39 176.92 3hu2 n ARG 93 N -0.75 -2.28 -4.31 3.23 5.12 -0.41 -1.24 116.66 116.03 3hu2 n ARG 93 Ca 0.20 0.45 -0.21 0.00 -1.93 0.00 0.00 57.85 56.36 3hu2 n ARG 93 Cb 0.21 -4.33 -0.16 0.00 -1.16 0.00 0.00 32.46 27.02 3hu2 n ARG 93 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3hu2 s VAL 94 N -3.66 0.71 0.62 1.55 -7.23 -0.19 -4.29 120.40 107.92 3hu2 s VAL 94 Ca 0.27 -0.26 -0.11 0.00 -1.81 0.00 0.00 61.98 60.06 3hu2 s VAL 94 Cb -0.10 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 3hu2 s VAL 94 CO 0.87 0.25 1.03 -0.13 -0.31 0.00 0.00 175.10 176.81 3hu2 s ARG 95 N 0.61 3.57 0.19 4.82 3.00 -1.26 -4.47 118.95 125.41 3hu2 s ARG 95 Ca -0.09 0.76 -0.33 0.00 0.00 0.00 0.00 55.73 56.07 3hu2 s ARG 95 Cb -0.13 -2.08 -0.14 0.00 0.00 0.00 0.00 34.95 32.61 3hu2 s ARG 95 CO 0.01 -0.59 1.46 1.28 0.00 0.00 0.00 175.30 177.46 3hu2 n LEU 96 N -2.76 2.91 -0.08 2.53 4.32 -1.26 -2.72 117.00 119.94 3hu2 n LEU 96 Ca 0.06 1.12 0.00 0.00 -0.02 0.00 0.00 56.01 57.17 3hu2 n LEU 96 Cb 0.54 -1.40 0.00 0.00 -1.62 0.00 0.00 43.42 40.94 3hu2 n LEU 96 CO 0.58 -0.49 0.00 0.61 -1.22 0.00 0.00 177.39 176.86 3hu2 n GLY 97 N 2.67 0.78 3.83 -0.72 0.00 0.63 -4.96 105.19 107.43 3hu2 n GLY 97 Ca 0.14 -0.66 -0.26 0.00 0.00 0.00 0.00 46.02 45.25 3hu2 n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu2 s ASP 98 N -2.77 5.71 0.04 1.61 1.01 -1.10 -4.82 116.67 116.34 3hu2 s ASP 98 Ca 0.00 -0.07 -0.24 0.00 0.71 0.00 0.00 52.55 52.95 3hu2 s ASP 98 Cb 0.00 -1.55 -0.05 0.00 1.01 0.00 0.00 42.92 42.33 3hu2 s ASP 98 CO 0.00 0.06 0.74 0.68 0.21 0.00 0.00 175.17 176.86 3hu2 s VAL 99 N -1.77 4.76 0.07 -1.27 -7.23 -1.26 -1.04 120.40 112.66 3hu2 s VAL 99 Ca 0.32 1.57 0.05 0.00 -1.81 0.00 0.00 61.98 62.11 3hu2 s VAL 99 Cb -0.10 -4.09 -0.03 0.00 0.56 0.00 0.00 36.38 32.72 3hu2 s VAL 99 CO 0.25 0.37 -0.13 0.27 -0.31 0.00 0.00 175.10 175.55 3hu2 s ILE 100 N -0.08 1.04 -0.05 -0.62 -5.25 -0.58 -4.87 121.20 110.78 3hu2 s ILE 100 Ca 0.37 -1.34 -0.26 0.00 -0.99 0.00 0.00 60.65 58.43 3hu2 s ILE 100 Cb -0.20 -1.07 -0.03 0.00 2.95 0.00 0.00 42.46 44.10 3hu2 s ILE 100 CO 0.22 -0.29 0.82 -0.44 -1.79 0.00 0.00 174.94 173.46 3hu2 s SER 101 N -1.84 7.12 -0.15 4.36 0.01 -0.96 -1.68 113.70 120.57 3hu2 s SER 101 Ca -0.02 1.36 -0.05 0.00 1.31 0.00 0.00 55.95 58.55 3hu2 s SER 101 Cb -0.09 -2.47 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 3hu2 s SER 101 CO 0.02 -0.20 0.04 -0.51 0.41 0.00 0.00 173.24 172.99 3hu2 s ILE 102 N 1.03 4.57 -0.02 1.44 2.07 -1.09 -1.37 121.20 127.83 3hu2 s ILE 102 Ca 0.43 -0.12 0.02 0.00 -1.41 0.00 0.00 60.65 59.57 3hu2 s ILE 102 Cb -0.19 -3.01 0.00 0.00 0.13 0.00 0.00 42.46 39.40 3hu2 s ILE 102 CO 0.21 0.52 -0.08 -1.58 -1.91 0.00 0.00 174.94 172.10 3hu2 s GLN 103 N -0.08 0.83 0.26 3.50 0.74 0.18 -4.81 119.66 120.29 3hu2 s GLN 103 Ca 0.05 -0.26 -0.31 0.00 0.05 0.00 0.00 55.36 54.90 3hu2 s GLN 103 Cb -0.12 -0.79 -0.12 0.00 1.10 0.00 0.00 33.01 33.07 3hu2 s GLN 103 CO 0.01 0.10 1.58 -0.35 -0.55 0.00 0.00 175.29 176.08 3hu2 n PRO 104 N 3.30 2.56 -3.36 1.67 -0.04 -1.26 -0.67 135.00 137.19 3hu2 n PRO 104 Ca -0.18 0.91 -0.26 0.00 -0.04 0.00 0.00 63.50 63.94 3hu2 n PRO 104 Cb 0.55 -2.68 -0.08 0.00 -0.04 0.00 0.00 33.50 31.24 3hu2 n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hu2 n PRO 106 N 1.72 0.08 -2.69 0.00 -0.02 -1.26 -4.45 135.00 128.38 3hu2 n PRO 106 Ca 0.25 0.05 -0.43 0.00 -2.02 0.00 0.00 63.50 61.34 3hu2 n PRO 106 Cb 0.48 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.39 3hu2 n PRO 106 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3hu2 n ASP 107 N -1.71 5.42 -3.83 2.55 8.00 -1.26 -4.91 116.55 120.82 3hu2 n ASP 107 Ca 0.06 -3.14 -0.29 0.00 0.71 0.00 0.00 54.79 52.13 3hu2 n ASP 107 Cb 0.37 -1.45 -0.16 0.00 -0.02 0.00 0.00 41.12 39.86 3hu2 n ASP 107 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3hu2 s VAL 108 N -0.12 1.03 0.48 2.53 1.01 -1.26 -5.09 120.40 118.98 3hu2 s VAL 108 Ca 0.38 -0.95 -0.18 0.00 0.00 0.00 0.00 61.98 61.23 3hu2 s VAL 108 Cb 0.04 -1.45 -0.09 0.00 0.00 0.00 0.00 36.38 34.88 3hu2 s VAL 108 CO 0.02 -0.20 0.97 -0.54 0.00 0.00 0.00 175.10 175.35 3hu2 s LYS 109 N 1.62 4.05 -0.00 2.72 3.01 -1.26 -4.74 119.74 125.13 3hu2 s LYS 109 Ca -0.02 1.03 -0.30 0.00 -1.01 0.00 0.00 55.97 55.67 3hu2 s LYS 109 Cb -0.18 -2.15 -0.06 0.00 -1.01 0.00 0.00 37.83 34.43 3hu2 s LYS 109 CO -0.08 -0.19 1.47 0.71 0.51 0.00 0.00 175.35 177.77 3hu2 s TYR 110 N -2.44 2.67 0.43 3.18 1.51 -1.26 -2.00 117.35 119.43 3hu2 s TYR 110 Ca 0.60 0.66 -0.22 0.00 -1.01 0.00 0.00 57.07 57.10 3hu2 s TYR 110 Cb -0.10 -3.74 -0.09 0.00 -0.11 0.00 0.00 41.96 37.92 3hu2 s TYR 110 CO 0.24 -2.83 1.03 0.20 -1.11 0.00 0.00 175.55 173.08 3hu2 s GLY 111 N 2.16 2.62 -0.00 0.71 0.00 0.04 -4.83 107.32 108.03 3hu2 s GLY 111 Ca 0.66 0.63 0.06 0.00 0.00 0.00 0.00 44.72 46.07 3hu2 s GLY 111 CO 0.27 1.01 0.23 0.28 0.00 0.00 0.00 173.10 174.89 3hu2 n LYS 112 N -0.41 3.90 -3.50 2.90 4.76 -1.26 -3.62 118.16 120.92 3hu2 n LYS 112 Ca 0.07 -0.01 -0.17 0.00 -2.87 0.00 0.00 58.31 55.32 3hu2 n LYS 112 Cb 0.51 -0.87 -0.13 0.00 -1.84 0.00 0.00 35.03 32.71 3hu2 n LYS 112 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 3hu2 s ARG 113 N -1.77 0.20 0.04 1.97 0.52 -1.26 -0.49 118.95 118.16 3hu2 s ARG 113 Ca 0.01 0.29 0.08 0.00 -0.52 0.00 0.00 55.73 55.59 3hu2 s ARG 113 Cb 0.04 -1.02 -0.03 0.00 0.52 0.00 0.00 34.95 34.46 3hu2 s ARG 113 CO 0.25 -0.61 -0.23 0.96 0.02 0.00 0.00 175.30 175.69 3hu2 s ILE 114 N 2.35 2.44 -0.25 1.52 -4.36 0.31 -2.12 121.20 121.09 3hu2 s ILE 114 Ca 0.07 -1.27 -0.01 0.00 -0.26 0.00 0.00 60.65 59.17 3hu2 s ILE 114 Cb -0.15 -1.98 0.03 0.00 1.25 0.00 0.00 42.46 41.61 3hu2 s ILE 114 CO -0.12 0.37 -0.06 -2.28 0.24 0.00 0.00 174.94 173.09 3hu2 s HIS 115 N -0.84 3.10 -0.02 1.37 5.65 -0.19 0.32 115.29 124.66 3hu2 s HIS 115 Ca 0.13 -1.63 0.08 0.00 0.25 0.00 0.00 55.06 53.88 3hu2 s HIS 115 Cb -0.10 -2.06 -0.02 0.00 -1.18 0.00 0.00 32.58 29.22 3hu2 s HIS 115 CO 0.03 -0.75 -0.26 0.14 -0.65 0.00 0.00 174.74 173.26 3hu2 s VAL 116 N 1.30 2.09 -0.01 0.89 -7.23 0.08 -0.52 120.40 116.99 3hu2 s VAL 116 Ca -0.01 -1.09 0.04 0.00 -1.81 0.00 0.00 61.98 59.11 3hu2 s VAL 116 Cb -0.17 -1.72 -0.01 0.00 0.56 0.00 0.00 36.38 35.04 3hu2 s VAL 116 CO -0.04 0.58 -0.14 -0.76 -0.31 0.00 0.00 175.10 174.43 3hu2 s LEU 117 N -0.60 2.00 0.77 1.32 1.43 -0.36 -4.14 118.68 119.10 3hu2 s LEU 117 Ca 0.10 -0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 52.83 3hu2 s LEU 117 Cb -0.10 -0.73 0.06 0.00 0.03 0.00 0.00 46.19 45.45 3hu2 s LEU 117 CO -0.01 0.16 1.09 -2.16 0.23 0.00 0.00 176.35 175.66 3hu2 s PRO 118 N -0.26 2.28 -0.26 1.29 0.04 -1.26 -0.20 135.00 136.63 3hu2 s PRO 118 Ca 0.04 0.74 -0.13 0.00 0.04 0.00 0.00 61.00 61.70 3hu2 s PRO 118 Cb -0.06 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 3hu2 s PRO 118 CO -0.00 -1.51 0.28 0.42 0.04 0.00 0.00 177.00 176.23 3hu2 s ILE 119 N -3.11 5.25 0.28 0.56 1.01 -0.20 -0.56 121.20 124.43 3hu2 s ILE 119 Ca 0.60 0.38 0.03 0.00 0.00 0.00 0.00 60.65 61.66 3hu2 s ILE 119 Cb -0.14 -3.61 0.37 0.00 0.01 0.00 0.00 42.46 39.09 3hu2 s ILE 119 CO 0.55 0.22 1.41 -0.90 0.00 0.00 0.00 174.94 176.22 3hu2 n ASP 120 N 5.03 -0.08 0.23 3.58 5.75 0.02 -0.16 116.55 130.93 3hu2 n ASP 120 Ca -0.11 1.52 0.15 0.00 -0.01 0.00 0.00 54.79 56.34 3hu2 n ASP 120 Cb 0.51 -0.57 0.45 0.00 -1.03 0.00 0.00 41.12 40.49 3hu2 n ASP 120 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 3hu2 h ASP 121 N 0.00 0.00 -0.50 -1.12 2.03 -1.95 -2.75 116.42 112.13 3hu2 h ASP 121 Ca 0.56 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.85 3hu2 h ASP 121 Cb 1.18 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.68 3hu2 h ASP 121 CO -0.83 0.00 0.01 0.35 -1.03 0.00 0.00 179.24 177.73 3hu2 n THR 122 N -2.98 2.38 -1.32 1.15 -2.24 0.78 -4.40 114.28 107.65 3hu2 n THR 122 Ca 0.02 -1.20 0.00 0.00 -2.27 0.00 0.00 64.05 60.60 3hu2 n THR 122 Cb 0.40 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 3hu2 n THR 122 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 3hu2 n VAL 123 N 0.52 0.00 -2.10 2.28 3.14 -1.04 -4.47 118.33 116.66 3hu2 n VAL 123 Ca 0.24 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.20 3hu2 n VAL 123 Cb 1.07 0.78 -0.03 0.00 -1.06 0.00 0.00 33.84 34.61 3hu2 n VAL 123 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 3hu2 s GLU 124 N 0.00 4.22 0.00 1.45 2.02 -1.22 -4.73 118.70 120.44 3hu2 s GLU 124 Ca 0.00 2.09 0.00 0.00 0.02 0.00 0.00 54.97 57.08 3hu2 s GLU 124 Cb 0.00 -3.79 0.00 0.00 0.10 0.00 0.00 34.13 30.44 3hu2 s GLU 124 CO 0.00 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 174.95 3hu2 n GLY 125 N 3.92 0.08 1.75 -1.39 0.00 -1.26 -5.04 105.19 103.25 3hu2 n GLY 125 Ca 0.16 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.78 3hu2 n GLY 125 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3hu2 n ILE 126 N 0.87 -0.76 -0.12 -0.61 0.13 -1.26 -4.96 119.36 112.65 3hu2 n ILE 126 Ca 0.00 0.12 -0.10 0.00 -1.10 0.00 0.00 62.75 61.67 3hu2 n ILE 126 Cb 0.00 -1.43 -0.02 0.00 -0.84 0.00 0.00 39.64 37.34 3hu2 n ILE 126 CO 0.00 0.00 0.00 0.74 2.80 0.00 0.00 176.55 180.09 3hu2 h THR 127 N 3.05 1.24 0.00 9.51 2.02 -1.97 -3.47 112.91 123.30 3hu2 h THR 127 Ca 0.00 -0.87 0.00 0.00 0.77 0.00 0.00 66.41 66.31 3hu2 h THR 127 Cb 0.24 1.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 3hu2 h THR 127 CO 0.00 0.29 0.00 0.61 0.37 0.00 0.00 175.52 176.79 3hu2 n GLY 128 N -0.45 0.23 3.52 2.16 0.00 -1.26 -3.56 105.19 105.83 3hu2 n GLY 128 Ca -0.02 0.59 -0.03 0.00 0.00 0.00 0.00 46.02 46.56 3hu2 n GLY 128 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hu2 s ASN 129 N -4.00 -0.94 0.16 1.61 3.84 -1.26 -5.08 114.94 109.27 3hu2 s ASN 129 Ca 0.00 1.37 -0.11 0.00 0.21 0.00 0.00 52.86 54.34 3hu2 s ASN 129 Cb 0.00 2.06 0.01 0.00 -0.55 0.00 0.00 41.25 42.77 3hu2 s ASN 129 CO 0.00 -0.23 1.56 -0.07 -2.79 0.00 0.00 177.10 175.58 3hu2 h LEU 130 N 8.04 0.99 -0.52 3.21 3.38 -1.97 -2.15 115.31 126.29 3hu2 h LEU 130 Ca -0.18 -0.37 -0.14 0.00 0.09 0.00 0.00 57.88 57.28 3hu2 h LEU 130 Cb 1.11 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3hu2 h LEU 130 CO 0.12 1.14 -0.32 0.15 0.09 0.00 0.00 178.44 179.61 3hu2 h PHE 131 N 0.83 1.00 0.04 1.13 3.04 -1.95 -1.86 116.94 119.17 3hu2 h PHE 131 Ca 0.12 -0.27 -0.00 0.00 3.98 0.00 0.00 57.97 61.80 3hu2 h PHE 131 Cb 0.72 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 39.01 3hu2 h PHE 131 CO 0.05 1.06 -0.02 1.49 -2.02 0.00 0.00 178.31 178.87 3hu2 h GLU 132 N 0.72 -0.06 -0.08 1.11 4.57 -1.95 0.45 114.58 119.34 3hu2 h GLU 132 Ca 0.08 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 58.06 3hu2 h GLU 132 Cb 0.88 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.48 3hu2 h GLU 132 CO 0.08 0.54 -0.77 0.28 -1.18 0.00 0.00 179.01 177.96 3hu2 h VAL 133 N -0.72 1.36 0.00 0.32 2.07 -1.48 -3.40 116.25 114.41 3hu2 h VAL 133 Ca -0.01 -2.16 -0.00 0.00 0.82 0.00 0.00 66.70 65.35 3hu2 h VAL 133 Cb 0.62 2.14 -0.00 0.00 -1.52 0.00 0.00 31.29 32.53 3hu2 h VAL 133 CO 0.01 0.65 -0.49 -1.22 0.02 0.00 0.00 177.57 176.54 3hu2 n TYR 134 N -3.84 0.00 0.02 1.57 4.01 -0.72 -4.73 117.16 113.48 3hu2 n TYR 134 Ca -0.05 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.50 3hu2 n TYR 134 Cb 0.73 -0.24 -0.09 0.00 -0.31 0.00 0.00 39.34 39.44 3hu2 n TYR 134 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3hu2 h LEU 135 N -0.47 0.90 0.21 7.72 3.38 -1.23 -2.97 115.31 122.85 3hu2 h LEU 135 Ca -0.01 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 57.29 3hu2 h LEU 135 Cb 0.48 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3hu2 h LEU 135 CO -0.00 1.47 -0.17 0.50 0.09 0.00 0.00 178.44 180.32 3hu2 h LYS 136 N 0.44 -0.38 0.00 1.13 3.64 -0.33 -1.55 116.57 119.52 3hu2 h LYS 136 Ca -0.10 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 3hu2 h LYS 136 Cb 1.58 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 33.49 3hu2 h LYS 136 CO 0.19 -0.26 -0.06 -1.00 -2.27 0.00 0.00 179.45 176.05 3hu2 h PRO 137 N -0.40 0.00 -0.03 1.90 0.13 -1.77 0.22 132.00 132.05 3hu2 h PRO 137 Ca -0.01 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.97 3hu2 h PRO 137 Cb 0.36 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.48 3hu2 h PRO 137 CO -0.02 0.06 -0.69 -0.92 -0.23 0.00 0.00 178.00 176.20 3hu2 h TYR 138 N 0.00 0.19 0.00 1.56 3.20 -1.28 -3.36 116.97 117.28 3hu2 h TYR 138 Ca -0.00 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.79 3hu2 h TYR 138 Cb 0.29 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.53 3hu2 h TYR 138 CO 0.00 0.79 -1.25 1.19 -1.64 0.00 0.00 178.16 177.24 3hu2 n PHE 139 N -3.77 0.00 -1.49 -3.82 3.72 -0.62 -4.85 117.46 106.63 3hu2 n PHE 139 Ca -0.02 0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 56.89 3hu2 n PHE 139 Cb 0.68 -0.20 -0.06 0.00 -0.94 0.00 0.00 39.48 38.96 3hu2 n PHE 139 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3hu2 n LEU 140 N -1.73 2.46 0.00 4.37 7.94 -0.01 -1.88 117.00 128.15 3hu2 n LEU 140 Ca -0.01 0.35 0.00 0.00 -1.11 0.00 0.00 56.01 55.25 3hu2 n LEU 140 Cb 0.30 -1.35 0.00 0.00 0.53 0.00 0.00 43.42 42.90 3hu2 n LEU 140 CO 0.28 -0.72 0.00 -0.62 -1.11 0.00 0.00 177.39 175.22 3hu2 n GLU 141 N 8.36 -1.60 0.21 1.96 -0.58 -1.26 -4.81 120.64 122.91 3hu2 n GLU 141 Ca 0.38 0.40 0.10 0.00 -0.42 0.00 0.00 57.16 57.62 3hu2 n GLU 141 Cb 0.29 -4.80 0.31 0.00 -0.57 0.00 0.00 31.44 26.68 3hu2 n GLU 141 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hu2 h ALA 142 N 0.00 0.93 -6.43 0.62 0.00 -1.66 -3.48 119.26 109.24 3hu2 h ALA 142 Ca 0.00 -0.17 -0.49 0.00 0.00 0.00 0.00 54.91 54.25 3hu2 h ALA 142 Cb 0.80 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 3hu2 h ALA 142 CO 0.00 0.24 -0.90 0.66 0.00 0.00 0.00 179.25 179.25 3hu2 n TYR 143 N -3.22 -1.70 -2.54 0.00 4.01 -1.23 -4.91 117.16 107.56 3hu2 n TYR 143 Ca 0.02 0.66 -0.42 0.00 -0.16 0.00 0.00 57.90 58.00 3hu2 n TYR 143 Cb 0.51 -3.68 -0.03 0.00 -0.31 0.00 0.00 39.34 35.83 3hu2 n TYR 143 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3hu2 s ARG 144 N -6.43 4.45 0.01 -0.72 0.52 -1.22 -4.66 118.95 110.90 3hu2 s ARG 144 Ca 0.12 1.60 -0.29 0.00 -0.52 0.00 0.00 55.73 56.64 3hu2 s ARG 144 Cb -0.05 -3.45 -0.03 0.00 0.52 0.00 0.00 34.95 31.94 3hu2 s ARG 144 CO 0.88 -0.25 0.94 -1.25 0.02 0.00 0.00 175.30 175.64 3hu2 s PRO 145 N 1.43 4.56 0.02 3.54 0.04 -1.26 0.26 135.00 143.59 3hu2 s PRO 145 Ca 0.55 1.35 0.01 0.00 0.04 0.00 0.00 61.00 62.95 3hu2 s PRO 145 Cb -0.25 -3.45 -0.02 0.00 0.04 0.00 0.00 34.50 30.83 3hu2 s PRO 145 CO 0.26 0.00 -0.04 0.96 0.04 0.00 0.00 177.00 178.22 3hu2 s ILE 146 N 0.84 0.25 0.13 0.56 -4.36 -0.98 -4.73 121.20 112.92 3hu2 s ILE 146 Ca 0.49 -0.70 0.05 0.00 -0.26 0.00 0.00 60.65 60.23 3hu2 s ILE 146 Cb -0.21 -0.33 -0.04 0.00 1.25 0.00 0.00 42.46 43.14 3hu2 s ILE 146 CO 0.27 -0.29 0.08 -0.60 0.24 0.00 0.00 174.94 174.64 3hu2 s ARG 147 N -1.05 2.78 0.14 0.37 3.52 -1.26 -2.47 118.95 120.97 3hu2 s ARG 147 Ca -0.09 -0.85 -0.34 0.00 -0.13 0.00 0.00 55.73 54.32 3hu2 s ARG 147 Cb -0.07 -2.61 -0.14 0.00 -1.56 0.00 0.00 34.95 30.57 3hu2 s ARG 147 CO -0.00 0.51 1.58 1.17 -0.81 0.00 0.00 175.30 177.74 3hu2 n LYS 148 N 0.01 2.07 -0.49 5.12 4.81 0.87 -2.40 118.16 128.15 3hu2 n LYS 148 Ca -0.09 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.10 3hu2 n LYS 148 Cb 0.54 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 33.08 3hu2 n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hu2 n GLY 149 N 3.41 0.74 3.72 3.14 0.00 0.55 -5.01 105.19 111.74 3hu2 n GLY 149 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3hu2 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu2 s ASP 150 N -3.00 6.61 -0.37 1.61 1.11 -1.01 -4.79 116.67 116.84 3hu2 s ASP 150 Ca 0.00 2.59 -0.10 0.00 0.18 0.00 0.00 52.55 55.22 3hu2 s ASP 150 Cb 0.00 -2.59 0.03 0.00 1.07 0.00 0.00 42.92 41.43 3hu2 s ASP 150 CO 0.00 -0.81 0.20 -0.63 1.18 0.00 0.00 175.17 175.11 3hu2 s ILE 151 N 1.13 4.42 0.12 0.77 1.09 -1.26 -0.51 121.20 126.96 3hu2 s ILE 151 Ca 0.69 -0.96 0.09 0.00 -1.10 0.00 0.00 60.65 59.38 3hu2 s ILE 151 Cb -0.43 -3.50 -0.04 0.00 -1.06 0.00 0.00 42.46 37.43 3hu2 s ILE 151 CO 0.31 -0.26 -0.19 0.72 -0.10 0.00 0.00 174.94 175.42 3hu2 s PHE 152 N 1.52 2.50 -0.07 3.97 -0.71 -0.04 -4.79 117.98 120.37 3hu2 s PHE 152 Ca 0.01 -0.28 -0.04 0.00 -1.04 0.00 0.00 56.93 55.58 3hu2 s PHE 152 Cb -0.20 -1.33 -0.04 0.00 -1.21 0.00 0.00 43.02 40.25 3hu2 s PHE 152 CO 0.06 0.38 0.12 -1.17 -1.34 0.00 0.00 175.22 173.27 3hu2 s LEU 153 N -2.14 4.19 -0.02 -1.99 2.96 -1.26 -0.69 118.68 119.73 3hu2 s LEU 153 Ca 0.17 0.33 0.03 0.00 -0.22 0.00 0.00 54.13 54.45 3hu2 s LEU 153 Cb -0.10 -2.22 -0.00 0.00 0.50 0.00 0.00 46.19 44.37 3hu2 s LEU 153 CO 0.10 0.34 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.68 3hu2 s VAL 154 N -1.12 0.82 -0.13 1.68 1.01 -0.05 -4.98 120.40 117.63 3hu2 s VAL 154 Ca 0.19 -0.42 -0.06 0.00 0.00 0.00 0.00 61.98 61.69 3hu2 s VAL 154 Cb -0.12 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 3hu2 s VAL 154 CO 0.09 0.24 0.11 -0.13 0.00 0.00 0.00 175.10 175.42 3hu2 s ARG 155 N -0.07 3.46 -0.36 2.72 0.52 -1.26 -0.86 118.95 123.10 3hu2 s ARG 155 Ca 0.01 -0.20 0.05 0.00 -0.52 0.00 0.00 55.73 55.07 3hu2 s ARG 155 Cb -0.06 -3.14 0.17 0.00 0.52 0.00 0.00 34.95 32.44 3hu2 s ARG 155 CO -0.00 0.69 0.50 0.20 0.02 0.00 0.00 175.30 176.70 3hu2 s GLY 156 N -0.78 -0.73 0.00 -3.53 0.00 -0.79 -4.90 107.32 96.60 3hu2 s GLY 156 Ca 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 44.72 44.78 3hu2 s GLY 156 CO 0.03 3.24 0.00 0.61 0.00 0.00 0.00 173.10 176.98 3hu2 n GLY 157 N 4.67 1.09 0.24 0.20 0.00 -1.26 -3.59 105.19 106.54 3hu2 n GLY 157 Ca 0.08 0.46 0.01 0.00 0.00 0.00 0.00 46.02 46.58 3hu2 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu2 h MET 158 N 0.00 0.21 -3.01 1.61 -0.00 -2.03 -3.46 114.93 108.25 3hu2 h MET 158 Ca 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 59.70 59.68 3hu2 h MET 158 Cb 0.00 -0.05 -0.01 0.00 -0.00 0.00 0.00 31.60 31.55 3hu2 h MET 158 CO 0.00 0.14 0.26 -0.98 -0.00 0.00 0.00 176.91 176.33 3hu2 s ARG 159 N -6.11 2.18 -0.10 -0.10 1.70 -1.24 -5.17 118.95 110.11 3hu2 s ARG 159 Ca -0.13 -1.38 -0.02 0.00 -0.47 0.00 0.00 55.73 53.73 3hu2 s ARG 159 Cb 0.19 0.62 -0.03 0.00 -0.57 0.00 0.00 34.95 35.16 3hu2 s ARG 159 CO 0.74 -1.02 -0.04 0.00 -1.08 0.00 0.00 175.30 173.91 3hu2 s ALA 160 N -2.53 3.08 -0.07 7.88 0.00 -1.26 -1.88 121.76 126.98 3hu2 s ALA 160 Ca 0.15 -0.84 0.04 0.00 0.00 0.00 0.00 51.96 51.31 3hu2 s ALA 160 Cb -0.05 -1.42 -0.02 0.00 0.00 0.00 0.00 23.12 21.64 3hu2 s ALA 160 CO 0.11 0.46 -0.19 0.08 0.00 0.00 0.00 175.76 176.22 3hu2 s VAL 161 N -0.43 2.64 0.06 0.00 1.01 -0.04 -4.94 120.40 118.70 3hu2 s VAL 161 Ca 0.07 -0.85 -0.19 0.00 0.00 0.00 0.00 61.98 61.00 3hu2 s VAL 161 Cb -0.12 -2.02 -0.07 0.00 0.00 0.00 0.00 36.38 34.17 3hu2 s VAL 161 CO 0.02 0.57 0.56 -1.61 0.00 0.00 0.00 175.10 174.64 3hu2 s GLU 162 N -0.28 4.19 0.06 2.72 2.02 -1.26 -0.88 118.70 125.27 3hu2 s GLU 162 Ca 0.01 0.71 0.06 0.00 0.02 0.00 0.00 54.97 55.78 3hu2 s GLU 162 Cb -0.13 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.83 3hu2 s GLU 162 CO 0.03 0.62 -0.17 -0.06 0.02 0.00 0.00 175.26 175.70 3hu2 s PHE 163 N -1.03 1.48 -0.10 1.61 0.08 0.13 -1.03 117.98 119.12 3hu2 s PHE 163 Ca 0.29 -0.38 -0.02 0.00 0.12 0.00 0.00 56.93 56.93 3hu2 s PHE 163 Cb -0.19 -0.86 -0.03 0.00 -0.57 0.00 0.00 43.02 41.36 3hu2 s PHE 163 CO 0.18 0.08 -0.02 0.21 -0.10 0.00 0.00 175.22 175.58 3hu2 s LYS 164 N -1.36 3.11 -0.52 0.44 2.20 0.73 -0.86 119.74 123.47 3hu2 s LYS 164 Ca 0.04 -0.45 -0.26 0.00 -0.36 0.00 0.00 55.97 54.93 3hu2 s LYS 164 Cb -0.09 -2.79 0.03 0.00 -1.51 0.00 0.00 37.83 33.47 3hu2 s LYS 164 CO 0.02 0.59 1.02 0.08 -0.36 0.00 0.00 175.35 176.70 3hu2 s VAL 165 N -0.58 4.31 -0.05 4.02 1.01 0.33 -1.22 120.40 128.22 3hu2 s VAL 165 Ca 0.09 0.70 0.02 0.00 0.00 0.00 0.00 61.98 62.79 3hu2 s VAL 165 Cb -0.12 -4.55 -0.25 0.00 0.00 0.00 0.00 36.38 31.46 3hu2 s VAL 165 CO 0.02 -1.06 0.65 0.58 0.00 0.00 0.00 175.10 175.29 3hu2 h VAL 166 N 6.10 0.89 -2.87 2.92 2.07 -1.14 0.16 116.25 124.37 3hu2 h VAL 166 Ca -0.25 -2.64 -0.13 0.00 0.82 0.00 0.00 66.70 64.50 3hu2 h VAL 166 Cb 1.07 2.55 -0.23 0.00 -1.52 0.00 0.00 31.29 33.15 3hu2 h VAL 166 CO 1.09 0.72 -0.28 -0.70 0.02 0.00 0.00 177.57 178.42 3hu2 s GLU 167 N -2.60 0.49 0.31 1.57 2.56 -1.05 -4.80 118.70 115.18 3hu2 s GLU 167 Ca -0.11 0.35 0.06 0.00 0.00 0.00 0.00 54.97 55.28 3hu2 s GLU 167 Cb 0.07 0.23 -0.06 0.00 2.00 0.00 0.00 34.13 36.37 3hu2 s GLU 167 CO 0.82 -0.08 -0.03 0.95 -0.56 0.00 0.00 175.26 176.35 3hu2 s THR 168 N -0.16 1.66 -0.11 -1.70 -4.23 -1.26 -1.03 115.64 108.82 3hu2 s THR 168 Ca -0.03 -2.10 -0.03 0.00 -1.18 0.00 0.00 61.69 58.35 3hu2 s THR 168 Cb -0.03 -2.59 -0.01 0.00 1.34 0.00 0.00 72.50 71.21 3hu2 s THR 168 CO 0.01 -0.20 -0.07 -0.78 -0.54 0.00 0.00 174.62 173.04 3hu2 h ASP 169 N 2.17 0.00 -4.25 3.99 3.58 -1.79 -3.44 116.42 116.68 3hu2 h ASP 169 Ca -0.41 0.00 -0.51 0.00 0.42 0.00 0.00 57.03 56.53 3hu2 h ASP 169 Cb 1.24 0.00 0.15 0.00 1.72 0.00 0.00 39.33 42.43 3hu2 h ASP 169 CO 0.69 0.56 0.29 -2.84 -2.88 0.00 0.00 179.24 175.06 3hu2 s PRO 170 N -1.77 1.84 0.00 0.28 0.02 -1.26 -4.96 135.00 129.15 3hu2 s PRO 170 Ca -0.06 1.18 0.00 0.00 0.02 0.00 0.00 61.00 62.14 3hu2 s PRO 170 Cb 0.01 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.68 3hu2 s PRO 170 CO 0.08 -1.94 0.92 0.43 -0.33 0.00 0.00 177.00 176.17 3hu2 n SER 171 N -3.72 0.00 -0.09 2.53 7.64 -1.26 -4.03 113.62 114.69 3hu2 n SER 171 Ca 0.09 0.92 -0.09 0.00 1.01 0.00 0.00 58.87 60.80 3hu2 n SER 171 Cb 0.53 -0.42 -0.14 0.00 -1.01 0.00 0.00 64.21 63.18 3hu2 n SER 171 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3hu2 n PRO 172 N -2.45 1.10 -3.95 1.43 -0.05 -1.26 -4.66 135.00 125.17 3hu2 n PRO 172 Ca 0.00 -0.00 -0.10 0.00 -0.05 0.00 0.00 63.50 63.35 3hu2 n PRO 172 Cb 0.00 -1.45 -0.10 0.00 -0.05 0.00 0.00 33.50 31.90 3hu2 n PRO 172 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 175.50 176.97 3hu2 s TYR 173 N -2.43 0.21 0.12 0.54 -0.85 -1.26 -0.09 117.35 113.59 3hu2 s TYR 173 Ca -0.10 -0.44 -0.14 0.00 -0.52 0.00 0.00 57.07 55.86 3hu2 s TYR 173 Cb 0.05 -0.16 0.03 0.00 0.38 0.00 0.00 41.96 42.26 3hu2 s TYR 173 CO 0.71 -0.24 0.35 0.00 -1.52 0.00 0.00 175.55 174.84 3hu2 s ILE 175 N -3.82 4.99 -1.15 0.00 1.01 -0.85 -2.32 121.20 119.07 3hu2 s ILE 175 Ca 0.03 1.57 -0.19 0.00 0.00 0.00 0.00 60.65 62.06 3hu2 s ILE 175 Cb 0.03 -4.10 0.08 0.00 0.01 0.00 0.00 42.46 38.48 3hu2 s ILE 175 CO -0.12 0.20 1.53 -0.69 0.00 0.00 0.00 174.94 175.86 3hu2 s VAL 176 N 1.06 4.23 0.76 2.92 1.01 0.14 -0.78 120.40 129.75 3hu2 s VAL 176 Ca 0.40 -1.56 -0.11 0.00 0.00 0.00 0.00 61.98 60.71 3hu2 s VAL 176 Cb -0.18 -5.07 0.05 0.00 0.00 0.00 0.00 36.38 31.18 3hu2 s VAL 176 CO 0.19 -1.89 1.08 0.00 0.00 0.00 0.00 175.10 174.48 3hu2 s ALA 177 N 4.00 2.40 -0.68 5.51 0.00 -1.26 -3.39 121.76 128.34 3hu2 s ALA 177 Ca 0.47 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 52.35 3hu2 s ALA 177 Cb 0.01 -3.13 0.15 0.00 0.00 0.00 0.00 23.12 20.15 3hu2 s ALA 177 CO -0.01 -1.55 0.99 -0.35 0.00 0.00 0.00 175.76 174.83 3hu2 n PRO 178 N -3.33 0.02 -0.02 0.00 -0.04 -1.26 -1.64 135.00 128.73 3hu2 n PRO 178 Ca 0.07 0.43 -0.07 0.00 -0.04 0.00 0.00 63.50 63.89 3hu2 n PRO 178 Cb 0.55 -1.67 0.10 0.00 -0.04 0.00 0.00 33.50 32.45 3hu2 n PRO 178 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3hu2 h ASP 179 N 0.00 0.63 -2.62 3.54 5.19 -1.92 -3.46 116.42 117.78 3hu2 h ASP 179 Ca 0.00 -0.27 -0.53 0.00 -0.62 0.00 0.00 57.03 55.61 3hu2 h ASP 179 Cb 0.22 -0.18 0.03 0.00 0.18 0.00 0.00 39.33 39.59 3hu2 h ASP 179 CO 0.00 0.94 1.05 -0.89 -3.12 0.00 0.00 179.24 177.23 3hu2 s THR 180 N -4.30 2.86 -0.19 0.35 2.01 -0.65 -4.85 115.64 110.87 3hu2 s THR 180 Ca -0.08 0.31 -0.29 0.00 0.31 0.00 0.00 61.69 61.94 3hu2 s THR 180 Cb 0.12 -3.20 0.00 0.00 0.01 0.00 0.00 72.50 69.44 3hu2 s THR 180 CO 0.83 -0.00 1.04 -0.69 -0.69 0.00 0.00 174.62 175.11 3hu2 s VAL 181 N 2.78 4.68 -0.67 3.82 1.01 0.35 -4.92 120.40 127.45 3hu2 s VAL 181 Ca 0.77 2.00 -0.11 0.00 0.00 0.00 0.00 61.98 64.64 3hu2 s VAL 181 Cb -0.42 -4.29 0.17 0.00 0.00 0.00 0.00 36.38 31.84 3hu2 s VAL 181 CO 0.34 -0.12 0.58 -0.63 0.00 0.00 0.00 175.10 175.27 3hu2 s ILE 182 N 2.83 4.89 0.10 2.22 1.01 -1.26 -0.53 121.20 130.47 3hu2 s ILE 182 Ca 0.46 -2.28 -0.30 0.00 0.00 0.00 0.00 60.65 58.53 3hu2 s ILE 182 Cb -0.16 -4.10 -0.06 0.00 0.01 0.00 0.00 42.46 38.14 3hu2 s ILE 182 CO 0.10 -0.92 1.07 -1.00 0.00 0.00 0.00 174.94 174.19 3hu2 s HIS 183 N 0.58 3.62 0.00 3.97 3.76 0.15 -4.94 115.29 122.43 3hu2 s HIS 183 Ca 0.13 1.59 0.00 0.00 -0.15 0.00 0.00 55.06 56.63 3hu2 s HIS 183 Cb -0.19 -3.23 0.00 0.00 1.11 0.00 0.00 32.58 30.27 3hu2 s HIS 183 CO -0.04 -0.48 0.50 0.00 -0.85 0.00 0.00 174.74 173.87 3hu2 s GLU 185 N -0.07 3.75 0.00 0.00 4.04 -1.26 -4.80 118.70 120.37 3hu2 s GLU 185 Ca 0.00 2.38 0.00 0.00 0.04 0.00 0.00 54.97 57.39 3hu2 s GLU 185 Cb 0.00 -2.69 0.00 0.00 0.02 0.00 0.00 34.13 31.46 3hu2 s GLU 185 CO 0.00 -0.75 0.00 0.41 -1.84 0.00 0.00 175.26 173.08 3hu2 n GLY 186 N 0.59 0.92 3.73 -3.83 0.00 -1.26 -4.96 105.19 100.37 3hu2 n GLY 186 Ca 0.05 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 3hu2 n GLY 186 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hu2 s GLU 187 N -1.27 4.35 0.13 1.61 0.41 -1.26 -4.99 118.70 117.68 3hu2 s GLU 187 Ca 0.00 2.07 -0.32 0.00 -0.41 0.00 0.00 54.97 56.31 3hu2 s GLU 187 Cb 0.00 -3.22 -0.12 0.00 -1.78 0.00 0.00 34.13 29.01 3hu2 s GLU 187 CO 0.00 -0.35 1.78 -2.30 -0.49 0.00 0.00 175.26 173.90 3hu2 n PRO 188 N 3.33 2.65 -1.69 0.39 -0.02 -1.26 -4.80 135.00 133.60 3hu2 n PRO 188 Ca 0.09 0.96 -0.43 0.00 -2.02 0.00 0.00 63.50 62.10 3hu2 n PRO 188 Cb 0.42 -2.83 -0.03 0.00 -0.02 0.00 0.00 33.50 31.05 3hu2 n PRO 188 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3hu2 n ILE 189 N 4.39 0.28 -2.23 4.25 2.08 0.27 -4.67 119.36 123.74 3hu2 n ILE 189 Ca 0.18 -0.05 -0.42 0.00 0.56 0.00 0.00 62.75 63.02 3hu2 n ILE 189 Cb 0.35 -2.01 -0.03 0.00 -0.75 0.00 0.00 39.64 37.20 3hu2 n ILE 189 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 3hu2 s LYS 190 N 2.35 4.32 0.30 0.38 1.02 -1.26 -0.80 119.74 126.04 3hu2 s LYS 190 Ca 0.81 1.98 0.06 0.00 0.02 0.00 0.00 55.97 58.84 3hu2 s LYS 190 Cb -0.53 -3.41 0.75 0.00 -0.52 0.00 0.00 37.83 34.12 3hu2 s LYS 190 CO 0.38 -0.48 1.74 -0.09 -0.92 0.00 0.00 175.35 175.98 3hu2 h ARG 191 N 7.29 0.58 -0.46 1.68 9.65 -1.92 -1.66 114.38 129.54 3hu2 h ARG 191 Ca -0.40 -0.04 0.08 0.00 -1.10 0.00 0.00 59.98 58.52 3hu2 h ARG 191 Cb 1.20 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 29.62 3hu2 h ARG 191 CO 0.87 0.39 0.31 0.93 2.80 0.00 0.00 179.97 185.27 3hu2 h GLU 192 N 0.60 0.28 -0.42 0.20 5.08 -1.99 -1.19 114.58 117.15 3hu2 h GLU 192 Ca 0.58 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.89 3hu2 h GLU 192 Cb 1.01 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.17 3hu2 h GLU 192 CO -0.44 0.19 0.15 -0.44 -1.00 0.00 0.00 179.01 177.46 3hu2 h ASP 193 N 0.29 0.60 1.69 1.42 3.45 -1.69 -2.25 116.42 119.92 3hu2 h ASP 193 Ca 0.21 -0.19 -0.05 0.00 0.43 0.00 0.00 57.03 57.43 3hu2 h ASP 193 Cb 0.44 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 39.05 3hu2 h ASP 193 CO -0.04 0.63 -0.23 -0.33 -1.57 0.00 0.00 179.24 177.69 3hu2 h GLU 194 N 0.53 0.00 -0.30 3.56 4.39 -1.40 -2.01 114.58 119.34 3hu2 h GLU 194 Ca 0.14 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.68 3hu2 h GLU 194 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 3hu2 h GLU 194 CO -0.01 0.23 -0.44 0.93 -1.16 0.00 0.00 179.01 178.56 3hu2 h GLU 195 N 0.00 0.76 0.00 2.33 4.39 -1.24 -0.29 114.58 120.53 3hu2 h GLU 195 Ca -0.00 -0.42 -0.06 0.00 0.34 0.00 0.00 59.36 59.22 3hu2 h GLU 195 Cb 1.14 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.80 3hu2 h GLU 195 CO 0.03 1.05 -0.28 1.49 -1.16 0.00 0.00 179.01 180.14 3hu2 h GLU 196 N 0.61 0.00 0.12 2.33 4.57 -1.13 -2.00 114.58 119.09 3hu2 h GLU 196 Ca 0.04 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.01 3hu2 h GLU 196 Cb 1.00 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.60 3hu2 h GLU 196 CO 0.10 0.28 -0.99 1.03 -1.18 0.00 0.00 179.01 178.24 3hu2 h SER 197 N 0.00 0.39 -0.38 1.04 0.87 -1.17 -2.70 113.55 111.59 3hu2 h SER 197 Ca -0.00 -0.90 0.02 0.00 -1.23 0.00 0.00 61.79 59.68 3hu2 h SER 197 Cb 0.54 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.35 3hu2 h SER 197 CO 0.04 1.45 0.20 -0.07 -0.53 0.00 0.00 176.83 177.92 3hu2 h LEU 198 N -0.41 0.31 -3.29 2.23 3.38 -1.11 -3.02 115.31 113.41 3hu2 h LEU 198 Ca -0.20 0.01 -0.34 0.00 0.09 0.00 0.00 57.88 57.45 3hu2 h LEU 198 Cb 1.63 -0.05 -0.20 0.00 0.09 0.00 0.00 40.66 42.13 3hu2 h LEU 198 CO 0.10 0.23 0.43 0.59 0.09 0.00 0.00 178.44 179.87 3hu2 n ASN 199 N -4.91 3.49 -4.76 -0.43 4.13 -0.75 -4.88 115.26 107.15 3hu2 n ASN 199 Ca 0.01 -3.04 -0.41 0.00 1.68 0.00 0.00 54.58 52.83 3hu2 n ASN 199 Cb 0.08 -0.72 -0.03 0.00 -1.54 0.00 0.00 39.78 37.57 3hu2 n ASN 199 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 3hu2 s GLU 200 N -2.13 4.50 0.22 3.52 2.02 -1.02 -4.92 118.70 120.89 3hu2 s GLU 200 Ca 0.37 2.00 -0.30 0.00 0.02 0.00 0.00 54.97 57.06 3hu2 s GLU 200 Cb 0.31 -3.14 -0.09 0.00 0.10 0.00 0.00 34.13 31.31 3hu2 s GLU 200 CO 0.07 0.01 1.21 0.08 0.02 0.00 0.00 175.26 176.65 3hu2 s VAL 201 N -1.07 3.40 0.33 2.63 1.01 -1.26 -5.05 120.40 120.39 3hu2 s VAL 201 Ca 0.47 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.70 3hu2 s VAL 201 Cb -0.36 -3.78 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 3hu2 s VAL 201 CO 0.46 0.22 0.09 0.61 0.00 0.00 0.00 175.10 176.48 3hu2 n GLY 202 N 1.89 3.50 0.26 4.51 0.00 -1.26 -4.15 105.19 109.95 3hu2 n GLY 202 Ca 0.03 -2.13 0.11 0.00 0.00 0.00 0.00 46.02 44.03 3hu2 n GLY 202 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hu2 h TYR 203 N 1.45 0.00 0.00 1.61 0.99 -1.93 -1.44 116.97 117.65 3hu2 h TYR 203 Ca -0.26 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.44 3hu2 h TYR 203 Cb 0.95 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.68 3hu2 h TYR 203 CO 0.00 0.07 -0.14 -0.44 -0.00 0.00 0.00 178.16 177.65 3hu2 h ASP 204 N 0.00 0.00 0.46 3.88 3.32 -2.00 -2.97 116.42 119.11 3hu2 h ASP 204 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3hu2 h ASP 204 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3hu2 h ASP 204 CO 0.01 0.14 -0.07 0.47 -1.72 0.00 0.00 179.24 178.07 3hu2 n ASP 205 N -3.30 0.26 -4.22 6.45 9.92 -0.54 -4.75 116.55 120.36 3hu2 n ASP 205 Ca 0.00 -0.37 -0.33 0.00 -0.53 0.00 0.00 54.79 53.56 3hu2 n ASP 205 Cb 0.38 -0.16 -0.15 0.00 -0.64 0.00 0.00 41.12 40.55 3hu2 n ASP 205 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 3hu2 s ILE 206 N -2.53 2.54 0.25 0.53 1.10 -1.12 -4.96 121.20 117.01 3hu2 s ILE 206 Ca 0.28 -0.80 0.10 0.00 -0.51 0.00 0.00 60.65 59.72 3hu2 s ILE 206 Cb 0.20 -2.08 -0.05 0.00 0.15 0.00 0.00 42.46 40.68 3hu2 s ILE 206 CO 0.48 0.51 -0.17 -0.83 -2.11 0.00 0.00 174.94 172.82 3hu2 s GLY 207 N 1.04 1.69 -1.40 1.50 0.00 -1.26 -4.73 107.32 104.15 3hu2 s GLY 207 Ca -0.01 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 42.92 3hu2 s GLY 207 CO -0.04 -1.87 0.00 0.61 0.00 0.00 0.00 173.10 171.80 3hu2 n GLY 208 N -0.52 1.38 0.35 0.20 0.00 -1.26 -4.78 105.19 100.56 3hu2 n GLY 208 Ca -0.06 -0.41 0.05 0.00 0.00 0.00 0.00 46.02 45.59 3hu2 n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu2 h ARG 210 N 0.07 -0.15 0.00 0.00 3.08 -1.91 0.52 114.38 115.99 3hu2 h ARG 210 Ca -0.01 0.01 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 3hu2 h ARG 210 Cb 1.23 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.30 3hu2 h ARG 210 CO 0.00 -0.10 -0.42 1.57 -1.07 0.00 0.00 179.97 179.96 3hu2 h LYS 211 N -0.16 0.00 -0.03 0.04 2.10 -2.00 -1.55 116.57 114.98 3hu2 h LYS 211 Ca 0.23 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.66 3hu2 h LYS 211 Cb 0.55 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.89 3hu2 h LYS 211 CO -0.70 0.42 -0.90 1.96 -2.00 0.00 0.00 179.45 178.23 3hu2 h GLN 212 N 0.00 0.49 -0.30 0.07 7.50 -1.65 -2.36 115.11 118.86 3hu2 h GLN 212 Ca -0.00 -0.49 -0.10 0.00 0.50 0.00 0.00 58.65 58.56 3hu2 h GLN 212 Cb 0.78 0.13 -0.01 0.00 0.05 0.00 0.00 27.48 28.42 3hu2 h GLN 212 CO 0.05 1.13 -0.23 -0.07 -1.50 0.00 0.00 178.83 178.22 3hu2 h LEU 213 N 0.29 0.58 -0.68 1.46 3.38 0.32 -1.62 115.31 119.05 3hu2 h LEU 213 Ca -0.08 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.71 3hu2 h LEU 213 Cb 1.53 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.09 3hu2 h LEU 213 CO 0.16 0.80 0.45 0.00 0.09 0.00 0.00 178.44 179.94 3hu2 h ALA 214 N 1.25 0.86 -0.66 1.53 0.00 -1.19 -1.48 119.26 119.57 3hu2 h ALA 214 Ca 0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3hu2 h ALA 214 Cb 0.67 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3hu2 h ALA 214 CO 0.05 0.29 0.27 1.96 0.00 0.00 0.00 179.25 181.82 3hu2 h GLN 215 N 0.92 0.98 -0.42 0.00 4.20 -1.05 -1.16 115.11 118.58 3hu2 h GLN 215 Ca 0.25 -0.17 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 3hu2 h GLN 215 Cb -0.11 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.50 3hu2 h GLN 215 CO -0.05 0.81 0.04 0.82 -0.67 0.00 0.00 178.83 179.78 3hu2 h ILE 216 N 0.93 1.25 -0.51 2.54 2.04 -0.98 -0.27 117.51 122.51 3hu2 h ILE 216 Ca 0.22 -0.94 -0.04 0.00 1.00 0.00 0.00 64.86 65.10 3hu2 h ILE 216 Cb 0.19 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 3hu2 h ILE 216 CO -0.02 0.32 0.15 0.11 0.00 0.00 0.00 178.15 178.72 3hu2 h LYS 217 N 0.56 0.76 -0.22 2.37 1.57 -0.75 0.19 116.57 121.05 3hu2 h LYS 217 Ca 0.12 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 3hu2 h LYS 217 Cb 0.42 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 3hu2 h LYS 217 CO 0.01 0.67 -0.03 0.93 -0.57 0.00 0.00 179.45 180.45 3hu2 h GLU 218 N 0.74 0.41 0.00 3.15 5.08 -0.80 0.38 114.58 123.54 3hu2 h GLU 218 Ca 0.17 -0.15 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 3hu2 h GLU 218 Cb 0.23 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 3hu2 h GLU 218 CO -0.01 0.63 -1.24 0.52 -1.00 0.00 0.00 179.01 177.92 3hu2 h MET 219 N 0.15 0.00 0.00 2.33 2.86 -0.66 -3.37 114.93 116.25 3hu2 h MET 219 Ca 0.06 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 3hu2 h MET 219 Cb 0.47 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 3hu2 h MET 219 CO 0.02 0.45 -0.58 0.28 1.06 0.00 0.00 176.91 178.14 3hu2 n VAL 220 N -3.04 1.03 -0.08 -2.22 0.31 0.65 -4.64 118.33 110.34 3hu2 n VAL 220 Ca -0.08 0.21 -0.13 0.00 -0.01 0.00 0.00 64.34 64.34 3hu2 n VAL 220 Cb 0.87 -1.72 -0.05 0.00 -0.91 0.00 0.00 33.84 32.02 3hu2 n VAL 220 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hu2 h GLU 221 N -0.25 0.54 -0.33 5.55 4.57 -1.39 -3.10 114.58 120.17 3hu2 h GLU 221 Ca -0.05 -0.28 -0.03 0.00 -1.18 0.00 0.00 59.36 57.83 3hu2 h GLU 221 Cb 0.51 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.09 3hu2 h GLU 221 CO -0.03 0.86 0.11 1.25 -1.18 0.00 0.00 179.01 180.02 3hu2 h LEU 222 N 0.24 0.48 -1.22 1.64 5.85 -0.44 -0.10 115.31 121.76 3hu2 h LEU 222 Ca 0.04 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 3hu2 h LEU 222 Cb 0.75 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 3hu2 h LEU 222 CO 0.05 0.55 -0.11 -0.65 -0.34 0.00 0.00 178.44 177.94 3hu2 h PRO 223 N 0.39 0.00 0.02 5.25 0.11 -1.71 -0.73 132.00 135.32 3hu2 h PRO 223 Ca 0.11 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.10 3hu2 h PRO 223 Cb 0.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 3hu2 h PRO 223 CO -0.00 0.11 -0.64 -0.07 -0.21 0.00 0.00 178.00 177.18 3hu2 h LEU 224 N 0.00 0.06 -0.48 2.35 3.38 -1.44 -3.14 115.31 116.04 3hu2 h LEU 224 Ca -0.00 -0.80 0.00 0.00 0.09 0.00 0.00 57.88 57.17 3hu2 h LEU 224 Cb 0.65 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.38 3hu2 h LEU 224 CO 0.01 1.26 -0.26 0.54 0.09 0.00 0.00 178.44 180.08 3hu2 n ARG 225 N -4.46 0.82 -3.07 1.13 1.74 -0.06 -4.28 116.66 108.47 3hu2 n ARG 225 Ca -0.20 -0.48 -0.16 0.00 -0.77 0.00 0.00 57.85 56.24 3hu2 n ARG 225 Cb 0.61 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.55 3hu2 n ARG 225 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3hu2 n HIS 226 N -0.67 -0.04 0.30 -1.55 8.25 -0.28 -4.97 115.22 116.26 3hu2 n HIS 226 Ca 0.12 -3.50 0.15 0.00 -0.26 0.00 0.00 57.72 54.23 3hu2 n HIS 226 Cb 0.35 -0.18 0.68 0.00 1.12 0.00 0.00 29.99 31.96 3hu2 n HIS 226 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3hu2 h PRO 227 N 2.98 0.00 -0.75 -0.41 0.13 -1.69 -2.54 132.00 129.72 3hu2 h PRO 227 Ca 0.05 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.29 3hu2 h PRO 227 Cb 1.01 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.06 3hu2 h PRO 227 CO 0.45 0.00 0.36 0.00 -0.23 0.00 0.00 178.00 178.59 3hu2 h ALA 228 N 2.09 1.05 -0.32 -0.56 0.00 -1.92 -2.43 119.26 117.17 3hu2 h ALA 228 Ca 0.00 0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.03 3hu2 h ALA 228 Cb 0.23 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 3hu2 h ALA 228 CO 0.00 -0.08 0.03 -0.07 0.00 0.00 0.00 179.25 179.13 3hu2 h LEU 229 N 0.58 -0.06 -0.31 0.00 3.38 -1.84 0.19 115.31 117.27 3hu2 h LEU 229 Ca 0.38 0.06 -0.14 0.00 0.09 0.00 0.00 57.88 58.28 3hu2 h LEU 229 Cb 0.46 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 3hu2 h LEU 229 CO -0.31 0.01 -0.35 -0.26 0.09 0.00 0.00 178.44 177.61 3hu2 h PHE 230 N 0.13 0.95 -0.64 1.13 -1.00 -1.72 0.07 116.94 115.86 3hu2 h PHE 230 Ca 0.15 -0.30 -0.07 0.00 2.81 0.00 0.00 57.97 60.56 3hu2 h PHE 230 Cb 0.19 -0.20 -0.03 0.00 3.61 0.00 0.00 35.95 39.53 3hu2 h PHE 230 CO -0.20 1.08 0.11 -0.22 -1.61 0.00 0.00 178.31 177.47 3hu2 h LYS 231 N 0.55 1.04 -0.29 1.51 3.11 -1.13 0.11 116.57 121.46 3hu2 h LYS 231 Ca 0.04 -0.26 -0.14 0.00 -2.81 0.00 0.00 60.65 57.48 3hu2 h LYS 231 Cb 0.94 -0.13 -0.00 0.00 -1.00 0.00 0.00 32.23 32.04 3hu2 h LYS 231 CO 0.09 0.95 -0.36 0.00 -2.81 0.00 0.00 179.45 177.31 3hu2 h ALA 232 N 1.14 0.44 0.00 5.00 0.00 -0.41 -2.86 119.26 122.57 3hu2 h ALA 232 Ca 0.20 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3hu2 h ALA 232 Cb 0.41 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3hu2 h ALA 232 CO 0.01 0.52 0.00 1.51 0.00 0.00 0.00 179.25 181.28 3hu2 n ILE 233 N -4.18 0.53 -1.15 0.00 3.06 -0.01 -4.92 119.36 112.69 3hu2 n ILE 233 Ca -0.04 -0.13 0.00 0.00 -2.50 0.00 0.00 62.75 60.08 3hu2 n ILE 233 Cb 0.52 -0.67 0.00 0.00 0.54 0.00 0.00 39.64 40.03 3hu2 n ILE 233 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3hu2 n GLY 234 N 1.09 0.74 3.22 4.50 0.00 -0.42 -5.06 105.19 109.27 3hu2 n GLY 234 Ca 0.05 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.09 3hu2 n GLY 234 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hu2 s VAL 235 N -2.00 1.86 -0.08 1.61 1.01 0.23 -5.01 120.40 118.02 3hu2 s VAL 235 Ca 0.00 -0.95 -0.27 0.00 0.00 0.00 0.00 61.98 60.76 3hu2 s VAL 235 Cb 0.00 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 3hu2 s VAL 235 CO 0.00 0.52 0.88 -0.54 0.00 0.00 0.00 175.10 175.96 3hu2 s LYS 236 N -0.06 4.44 0.33 2.72 1.02 -1.26 -4.07 119.74 122.86 3hu2 s LYS 236 Ca -0.05 1.18 -0.28 0.00 0.02 0.00 0.00 55.97 56.84 3hu2 s LYS 236 Cb -0.13 -3.50 -0.10 0.00 -0.52 0.00 0.00 37.83 33.58 3hu2 s LYS 236 CO 0.04 -0.13 1.21 -1.25 -0.92 0.00 0.00 175.35 174.29 3hu2 s PRO 237 N 1.41 4.40 0.47 -1.68 0.04 -1.26 -4.99 135.00 133.39 3hu2 s PRO 237 Ca 0.44 2.00 -0.24 0.00 0.04 0.00 0.00 61.00 63.25 3hu2 s PRO 237 Cb -0.19 -3.04 -0.07 0.00 0.04 0.00 0.00 34.50 31.24 3hu2 s PRO 237 CO 0.20 -0.07 1.36 -2.14 0.04 0.00 0.00 177.00 176.39 3hu2 s PRO 238 N -1.76 3.57 0.00 0.56 0.02 -1.26 -4.98 135.00 131.15 3hu2 s PRO 238 Ca 0.49 2.26 0.01 0.00 0.02 0.00 0.00 61.00 63.78 3hu2 s PRO 238 Cb -0.35 -2.53 0.01 0.00 0.02 0.00 0.00 34.50 31.65 3hu2 s PRO 238 CO 0.46 -0.86 0.79 2.89 -0.33 0.00 0.00 177.00 179.96 3hu2 n ARG 239 N -0.42 1.22 -3.53 5.54 1.85 -1.26 -4.94 116.66 115.11 3hu2 n ARG 239 Ca 0.07 -1.08 -0.18 0.00 -1.00 0.00 0.00 57.85 55.65 3hu2 n ARG 239 Cb 0.44 -1.02 -0.13 0.00 -1.05 0.00 0.00 32.46 30.70 3hu2 n ARG 239 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 3hu2 s GLY 240 N -0.57 0.00 -0.24 2.89 0.00 -1.10 -1.29 107.32 107.01 3hu2 s GLY 240 Ca 0.01 0.34 -0.03 0.00 0.00 0.00 0.00 44.72 45.04 3hu2 s GLY 240 CO 0.01 2.08 -0.04 -0.42 0.00 0.00 0.00 173.10 174.73 3hu2 s ILE 241 N 2.33 3.16 -0.34 0.90 1.09 0.52 -2.32 121.20 126.54 3hu2 s ILE 241 Ca 0.06 -0.77 -0.12 0.00 -1.10 0.00 0.00 60.65 58.71 3hu2 s ILE 241 Cb -0.15 -2.53 -0.01 0.00 -1.06 0.00 0.00 42.46 38.71 3hu2 s ILE 241 CO -0.11 0.29 0.23 -0.22 -0.10 0.00 0.00 174.94 175.03 3hu2 s LEU 242 N 1.40 4.50 -0.07 2.97 2.96 0.44 -0.63 118.68 130.25 3hu2 s LEU 242 Ca 0.03 -0.49 -0.23 0.00 -0.22 0.00 0.00 54.13 53.21 3hu2 s LEU 242 Cb -0.16 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 3hu2 s LEU 242 CO -0.04 -0.25 0.69 -0.76 -1.32 0.00 0.00 176.35 174.68 3hu2 s LEU 243 N 1.69 4.31 0.12 -0.68 1.43 0.29 -0.29 118.68 125.56 3hu2 s LEU 243 Ca 0.06 1.17 0.02 0.00 -1.03 0.00 0.00 54.13 54.35 3hu2 s LEU 243 Cb -0.18 -3.07 -0.04 0.00 0.03 0.00 0.00 46.19 42.93 3hu2 s LEU 243 CO 0.10 -0.11 -0.07 -0.72 0.23 0.00 0.00 176.35 175.78 3hu2 s TYR 244 N 0.81 1.03 -4.36 0.29 -0.85 -0.63 -0.86 117.35 112.78 3hu2 s TYR 244 Ca 0.37 -0.89 0.00 0.00 -0.52 0.00 0.00 57.07 56.03 3hu2 s TYR 244 Cb -0.18 -0.57 0.00 0.00 0.38 0.00 0.00 41.96 41.59 3hu2 s TYR 244 CO 0.18 -0.10 0.00 0.41 -1.52 0.00 0.00 175.55 174.52 3hu2 n GLY 245 N -0.11 -2.53 3.74 5.49 0.00 -1.10 -0.52 105.19 110.16 3hu2 n GLY 245 Ca -0.11 -1.27 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 3hu2 n GLY 245 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hu2 s PRO 246 N -1.96 1.94 0.04 1.61 0.02 -1.26 -4.08 135.00 131.30 3hu2 s PRO 246 Ca 0.00 1.32 -0.38 0.00 0.02 0.00 0.00 61.00 61.96 3hu2 s PRO 246 Cb 0.00 -1.85 -0.17 0.00 0.02 0.00 0.00 34.50 32.50 3hu2 s PRO 246 CO 0.00 -1.91 1.31 -2.30 -0.33 0.00 0.00 177.00 173.77 3hu2 n PRO 247 N -3.61 0.87 -1.81 5.54 -0.02 -1.26 -3.52 135.00 131.18 3hu2 n PRO 247 Ca 0.10 0.31 -0.01 0.00 -2.02 0.00 0.00 63.50 61.89 3hu2 n PRO 247 Cb 0.53 -1.92 -0.00 0.00 -0.02 0.00 0.00 33.50 32.08 3hu2 n PRO 247 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hu2 n GLY 248 N 2.40 0.36 0.09 -1.23 0.00 -1.26 -4.92 105.19 100.63 3hu2 n GLY 248 Ca 0.19 -0.89 0.11 0.00 0.00 0.00 0.00 46.02 45.43 3hu2 n GLY 248 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hu2 n THR 249 N -3.79 0.45 0.00 2.61 -2.24 -1.23 -1.46 114.28 108.62 3hu2 n THR 249 Ca -0.01 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 3hu2 n THR 249 Cb 0.41 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.41 3hu2 n THR 249 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hu2 n GLY 250 N 1.21 0.17 0.10 3.38 0.00 -1.26 -4.64 105.19 104.14 3hu2 n GLY 250 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 3hu2 n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hu2 h LYS 251 N 0.00 -0.14 -0.53 1.61 1.57 -1.93 0.55 116.57 117.69 3hu2 h LYS 251 Ca 0.00 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 3hu2 h LYS 251 Cb 0.00 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 3hu2 h LYS 251 CO 0.00 0.13 0.06 1.15 -0.57 0.00 0.00 179.45 180.22 3hu2 h THR 252 N -0.40 1.24 -0.25 -0.16 2.02 -1.98 0.21 112.91 113.60 3hu2 h THR 252 Ca -0.01 -0.95 0.00 0.00 0.77 0.00 0.00 66.41 66.22 3hu2 h THR 252 Cb 0.33 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 3hu2 h THR 252 CO 0.02 0.35 0.16 0.25 0.37 0.00 0.00 175.52 176.67 3hu2 h LEU 253 N 0.81 0.28 -1.01 2.58 5.85 -1.85 0.19 115.31 122.16 3hu2 h LEU 253 Ca 0.17 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3hu2 h LEU 253 Cb 0.40 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 3hu2 h LEU 253 CO 0.01 0.20 0.49 0.40 -0.34 0.00 0.00 178.44 179.20 3hu2 h ILE 254 N 0.33 1.24 -0.90 4.05 2.04 0.70 0.15 117.51 125.12 3hu2 h ILE 254 Ca 0.09 -0.58 0.04 0.00 1.00 0.00 0.00 64.86 65.42 3hu2 h ILE 254 Cb -0.03 0.06 -0.06 0.00 -0.74 0.00 0.00 36.82 36.05 3hu2 h ILE 254 CO -0.02 0.27 0.58 0.00 0.00 0.00 0.00 178.15 178.97 3hu2 h ALA 255 N 1.35 1.21 -0.38 1.87 0.00 0.16 0.26 119.26 123.73 3hu2 h ALA 255 Ca 0.31 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 3hu2 h ALA 255 Cb -0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 3hu2 h ALA 255 CO -0.05 0.41 -0.29 0.00 0.00 0.00 0.00 179.25 179.32 3hu2 h ARG 256 N 1.11 0.87 -0.35 0.00 2.47 0.43 -1.88 114.38 117.03 3hu2 h ARG 256 Ca 0.37 -0.42 -0.07 0.00 -1.26 0.00 0.00 59.98 58.60 3hu2 h ARG 256 Cb 0.05 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 3hu2 h ARG 256 CO -0.13 1.07 -0.05 0.00 0.56 0.00 0.00 179.97 181.41 3hu2 h ALA 257 N 0.78 0.47 -0.35 0.04 0.00 0.44 -1.97 119.26 118.67 3hu2 h ALA 257 Ca 0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 3hu2 h ALA 257 Cb 0.87 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3hu2 h ALA 257 CO 0.08 0.29 0.19 0.28 0.00 0.00 0.00 179.25 180.08 3hu2 h VAL 258 N 0.44 1.14 -0.92 0.00 2.07 -0.55 0.49 116.25 118.92 3hu2 h VAL 258 Ca 0.09 -0.38 0.12 0.00 0.82 0.00 0.00 66.70 67.35 3hu2 h VAL 258 Cb 0.54 0.76 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 3hu2 h VAL 258 CO 0.03 0.15 0.59 0.00 0.02 0.00 0.00 177.57 178.35 3hu2 h ALA 259 N 1.05 1.68 0.00 1.67 0.00 -1.03 -0.71 119.26 121.92 3hu2 h ALA 259 Ca 0.12 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.91 3hu2 h ALA 259 Cb 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3hu2 h ALA 259 CO -0.02 0.10 -1.26 -0.91 0.00 0.00 0.00 179.25 177.16 3hu2 h ASN 260 N 0.84 0.00 0.00 0.00 -0.26 -0.80 -3.37 115.58 111.99 3hu2 h ASN 260 Ca 0.45 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.19 3hu2 h ASN 260 Cb 0.55 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.81 3hu2 h ASN 260 CO -0.21 0.48 -1.41 -0.62 -1.06 0.00 0.00 177.43 174.61 3hu2 n GLU 261 N -2.89 0.37 -2.55 0.81 -0.58 0.11 -3.47 120.64 112.44 3hu2 n GLU 261 Ca -0.07 -0.09 -0.32 0.00 -0.42 0.00 0.00 57.16 56.27 3hu2 n GLU 261 Cb 0.79 -1.49 -0.04 0.00 -0.57 0.00 0.00 31.44 30.13 3hu2 n GLU 261 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3hu2 s THR 262 N -3.19 4.59 -0.20 2.62 -4.23 -0.33 -4.61 115.64 110.29 3hu2 s THR 262 Ca 0.01 1.07 0.23 0.00 -1.18 0.00 0.00 61.69 61.83 3hu2 s THR 262 Cb 0.15 -3.72 0.28 0.00 1.34 0.00 0.00 72.50 70.55 3hu2 s THR 262 CO 0.87 -0.62 1.67 1.23 -0.54 0.00 0.00 174.62 177.23 3hu2 h GLY 263 N 1.08 0.00 -2.03 3.99 0.00 -1.94 -3.47 103.07 100.70 3hu2 h GLY 263 Ca -0.47 0.00 -0.48 0.00 0.00 0.00 0.00 47.33 46.38 3hu2 h GLY 263 CO 0.62 0.00 0.40 0.00 0.00 0.00 0.00 176.54 177.56 3hu2 s ALA 264 N -3.30 2.79 0.35 3.60 0.00 -1.26 -5.02 121.76 118.91 3hu2 s ALA 264 Ca 0.04 0.66 -0.29 0.00 0.00 0.00 0.00 51.96 52.38 3hu2 s ALA 264 Cb 0.07 -3.29 -0.11 0.00 0.00 0.00 0.00 23.12 19.79 3hu2 s ALA 264 CO 0.66 -0.55 1.41 0.12 0.00 0.00 0.00 175.76 177.40 3hu2 s PHE 265 N -1.97 2.81 -0.04 0.00 5.36 -0.85 -4.87 117.98 118.43 3hu2 s PHE 265 Ca 0.69 1.25 0.04 0.00 -0.96 0.00 0.00 56.93 57.95 3hu2 s PHE 265 Cb -0.19 -3.87 -0.00 0.00 -0.34 0.00 0.00 43.02 38.62 3hu2 s PHE 265 CO 0.25 -2.51 -0.15 0.12 -1.46 0.00 0.00 175.22 171.46 3hu2 s PHE 266 N -1.03 1.54 -0.11 10.12 5.36 -1.26 0.18 117.98 132.79 3hu2 s PHE 266 Ca 0.52 -0.43 -0.01 0.00 -0.96 0.00 0.00 56.93 56.05 3hu2 s PHE 266 Cb -0.43 -1.05 0.03 0.00 -0.34 0.00 0.00 43.02 41.23 3hu2 s PHE 266 CO 0.57 -0.15 -0.03 0.12 -1.46 0.00 0.00 175.22 174.27 3hu2 s PHE 267 N 0.06 1.10 -0.12 10.12 2.19 0.67 -4.96 117.98 127.04 3hu2 s PHE 267 Ca -0.03 -0.52 -0.14 0.00 0.33 0.00 0.00 56.93 56.57 3hu2 s PHE 267 Cb -0.11 -1.03 -0.05 0.00 -1.31 0.00 0.00 43.02 40.53 3hu2 s PHE 267 CO 0.02 -0.45 0.33 -1.17 1.83 0.00 0.00 175.22 175.78 3hu2 s LEU 268 N 1.83 4.31 -0.19 6.12 2.96 -1.26 -0.65 118.68 131.80 3hu2 s LEU 268 Ca 0.04 0.64 0.01 0.00 -0.22 0.00 0.00 54.13 54.60 3hu2 s LEU 268 Cb -0.13 -2.43 0.03 0.00 0.50 0.00 0.00 46.19 44.16 3hu2 s LEU 268 CO -0.07 0.16 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.33 3hu2 s ILE 269 N 0.04 1.97 -0.15 6.68 1.01 0.10 -4.95 121.20 125.90 3hu2 s ILE 269 Ca 0.19 -1.05 -0.19 0.00 0.00 0.00 0.00 60.65 59.60 3hu2 s ILE 269 Cb -0.14 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 3hu2 s ILE 269 CO 0.07 0.37 0.52 0.20 0.00 0.00 0.00 174.94 176.10 3hu2 s ASN 270 N 1.29 6.67 0.14 3.58 0.01 -1.26 -0.01 114.94 125.36 3hu2 s ASN 270 Ca 0.01 0.80 -0.32 0.00 -0.71 0.00 0.00 52.86 52.64 3hu2 s ASN 270 Cb -0.15 -2.30 -0.10 0.00 0.41 0.00 0.00 41.25 39.11 3hu2 s ASN 270 CO -0.11 -0.10 1.55 1.23 -1.51 0.00 0.00 177.10 178.16 3hu2 h GLY 271 N 7.27 -0.98 1.70 0.66 0.00 0.09 -1.61 103.07 110.20 3hu2 h GLY 271 Ca -0.38 0.74 -0.03 0.00 0.00 0.00 0.00 47.33 47.67 3hu2 h GLY 271 CO 0.75 -0.08 0.05 -2.55 0.00 0.00 0.00 176.54 174.71 3hu2 h PRO 272 N -0.31 0.39 -0.92 4.80 0.11 -1.83 -1.82 132.00 132.42 3hu2 h PRO 272 Ca 0.09 -0.06 0.07 0.00 0.11 0.00 0.00 66.00 66.21 3hu2 h PRO 272 Cb 0.55 -0.07 -0.07 0.00 0.11 0.00 0.00 31.00 31.53 3hu2 h PRO 272 CO -0.67 0.38 0.58 0.93 -0.21 0.00 0.00 178.00 179.00 3hu2 h GLU 273 N 0.39 1.01 0.04 1.05 4.39 -1.77 0.17 114.58 119.85 3hu2 h GLU 273 Ca 0.09 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 3hu2 h GLU 273 Cb 0.18 -0.23 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 3hu2 h GLU 273 CO -0.00 0.67 -0.02 0.82 -1.16 0.00 0.00 179.01 179.32 3hu2 h ILE 274 N 1.04 1.30 0.00 3.13 1.08 -0.68 -3.22 117.51 120.15 3hu2 h ILE 274 Ca 0.40 -1.13 0.00 0.00 -0.39 0.00 0.00 64.86 63.74 3hu2 h ILE 274 Cb 0.20 2.04 0.00 0.00 -3.07 0.00 0.00 36.82 35.99 3hu2 h ILE 274 CO -0.18 0.28 0.00 0.23 -0.69 0.00 0.00 178.15 177.79 3hu2 n MET 275 N -4.88 0.17 0.18 2.37 2.81 -0.74 -2.30 117.12 114.73 3hu2 n MET 275 Ca -0.09 0.47 0.05 0.00 -1.81 0.00 0.00 57.70 56.32 3hu2 n MET 275 Cb 0.26 -1.87 0.26 0.00 -0.71 0.00 0.00 33.22 31.16 3hu2 n MET 275 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3hu2 h SER 276 N 0.00 0.00 -3.69 7.83 4.64 -0.69 -3.47 113.55 118.18 3hu2 h SER 276 Ca 0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.83 3hu2 h SER 276 Cb 0.27 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.38 3hu2 h SER 276 CO 0.00 0.40 0.13 -0.54 -0.87 0.00 0.00 176.83 175.96 3hu2 s LYS 277 N -3.42 3.66 0.68 4.77 1.02 -0.97 -5.06 119.74 120.43 3hu2 s LYS 277 Ca 0.01 0.37 -0.17 0.00 0.02 0.00 0.00 55.97 56.20 3hu2 s LYS 277 Cb 0.10 -2.36 -0.03 0.00 -0.52 0.00 0.00 37.83 35.01 3hu2 s LYS 277 CO 0.70 -0.15 0.77 1.28 -0.92 0.00 0.00 175.35 177.04 3hu2 n LEU 278 N -1.81 2.39 -4.68 3.17 4.77 -1.26 -4.65 117.00 114.92 3hu2 n LEU 278 Ca 0.02 0.68 -0.49 0.00 -0.03 0.00 0.00 56.01 56.19 3hu2 n LEU 278 Cb 0.54 -1.31 -0.05 0.00 -2.33 0.00 0.00 43.42 40.27 3hu2 n LEU 278 CO 0.51 -2.47 1.37 0.00 -1.33 0.00 0.00 177.39 175.47 3hu2 n ALA 279 N -2.21 0.84 0.00 -1.18 0.00 -1.26 -1.95 120.51 114.76 3hu2 n ALA 279 Ca 0.12 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3hu2 n ALA 279 Cb 0.49 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.52 3hu2 n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hu2 n GLY 280 N 4.03 2.39 0.28 0.00 0.00 -1.26 -4.70 105.19 105.92 3hu2 n GLY 280 Ca 0.21 -0.51 0.19 0.00 0.00 0.00 0.00 46.02 45.90 3hu2 n GLY 280 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hu2 h GLU 281 N 0.00 0.00 0.17 1.61 4.81 -1.84 -0.52 114.58 118.81 3hu2 h GLU 281 Ca 0.00 0.00 -0.33 0.00 -0.13 0.00 0.00 59.36 58.90 3hu2 h GLU 281 Cb 0.00 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.39 3hu2 h GLU 281 CO 0.00 0.00 -1.63 0.66 -0.73 0.00 0.00 179.01 177.31 3hu2 h SER 282 N 0.00 0.57 -0.63 1.04 4.64 -1.66 -3.05 113.55 114.46 3hu2 h SER 282 Ca 0.00 -0.92 -0.01 0.00 -0.47 0.00 0.00 61.79 60.39 3hu2 h SER 282 Cb 0.12 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 3hu2 h SER 282 CO 0.00 1.74 0.37 -0.33 -0.87 0.00 0.00 176.83 177.73 3hu2 h GLU 283 N -0.01 0.89 -0.23 4.77 3.07 -1.74 -2.17 114.58 119.17 3hu2 h GLU 283 Ca -0.33 -0.09 -0.15 0.00 -0.50 0.00 0.00 59.36 58.30 3hu2 h GLU 283 Cb 2.01 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 29.72 3hu2 h GLU 283 CO 0.15 0.64 -0.46 1.03 -1.40 0.00 0.00 179.01 178.97 3hu2 h SER 284 N 0.90 0.63 0.24 1.42 0.87 -1.25 -1.09 113.55 115.28 3hu2 h SER 284 Ca 0.23 -0.30 -0.10 0.00 -1.23 0.00 0.00 61.79 60.39 3hu2 h SER 284 Cb 0.00 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 3hu2 h SER 284 CO -0.04 1.00 -0.39 0.78 -0.53 0.00 0.00 176.83 177.65 3hu2 h ASN 285 N 0.47 0.21 0.24 6.23 -0.26 -1.32 0.15 115.58 121.30 3hu2 h ASN 285 Ca 0.03 -0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.67 3hu2 h ASN 285 Cb 0.99 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 38.19 3hu2 h ASN 285 CO 0.09 0.59 -0.12 -0.07 -1.06 0.00 0.00 177.43 176.86 3hu2 h LEU 286 N 0.17 -0.27 -0.61 1.61 3.38 -1.21 -2.14 115.31 116.24 3hu2 h LEU 286 Ca 0.02 -0.18 0.12 0.00 0.09 0.00 0.00 57.88 57.93 3hu2 h LEU 286 Cb 0.77 0.07 -0.12 0.00 0.09 0.00 0.00 40.66 41.48 3hu2 h LEU 286 CO 0.06 0.04 -0.19 -0.09 0.09 0.00 0.00 178.44 178.35 3hu2 h ARG 287 N -0.60 -0.03 -0.82 1.13 2.43 -1.13 -2.15 114.38 113.21 3hu2 h ARG 287 Ca -0.03 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.16 3hu2 h ARG 287 Cb 0.44 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.95 3hu2 h ARG 287 CO 0.05 -0.02 0.53 -0.22 -1.51 0.00 0.00 179.97 178.80 3hu2 h LYS 288 N -0.04 1.02 -0.24 0.20 3.64 -0.95 -0.90 116.57 119.31 3hu2 h LYS 288 Ca 0.29 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.59 3hu2 h LYS 288 Cb 0.47 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 3hu2 h LYS 288 CO -0.64 0.67 0.08 0.00 -2.27 0.00 0.00 179.45 177.29 3hu2 h ALA 289 N 1.33 0.31 -0.53 5.00 0.00 -0.77 0.11 119.26 124.71 3hu2 h ALA 289 Ca 0.32 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 3hu2 h ALA 289 Cb -0.04 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3hu2 h ALA 289 CO -0.10 -0.07 0.04 0.74 0.00 0.00 0.00 179.25 179.86 3hu2 h PHE 290 N 0.22 0.97 -0.64 0.00 -1.00 -1.09 -1.19 116.94 114.22 3hu2 h PHE 290 Ca 0.08 -0.15 -0.05 0.00 2.81 0.00 0.00 57.97 60.65 3hu2 h PHE 290 Cb 0.22 -0.26 -0.03 0.00 3.61 0.00 0.00 35.95 39.49 3hu2 h PHE 290 CO -0.00 0.89 0.20 0.93 -1.61 0.00 0.00 178.31 178.72 3hu2 h GLU 291 N 0.78 0.99 -0.06 1.51 5.08 -1.02 -0.87 114.58 120.98 3hu2 h GLU 291 Ca 0.15 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3hu2 h GLU 291 Cb 0.47 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 3hu2 h GLU 291 CO 0.02 0.87 0.04 1.49 -1.00 0.00 0.00 179.01 180.43 3hu2 h GLU 292 N 0.92 0.08 -0.21 2.33 4.57 -0.61 0.18 114.58 121.84 3hu2 h GLU 292 Ca 0.21 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.40 3hu2 h GLU 292 Cb 0.29 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.84 3hu2 h GLU 292 CO -0.01 0.06 0.08 0.00 -1.18 0.00 0.00 179.01 177.96 3hu2 h ALA 293 N 1.02 0.23 -0.87 2.92 0.00 -1.16 -0.75 119.26 120.65 3hu2 h ALA 293 Ca 0.02 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.04 3hu2 h ALA 293 Cb -0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 3hu2 h ALA 293 CO -0.00 -0.34 0.52 0.93 0.00 0.00 0.00 179.25 180.35 3hu2 h GLU 294 N 0.18 0.86 -0.27 0.00 5.08 -0.93 -2.42 114.58 117.08 3hu2 h GLU 294 Ca 0.09 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.29 3hu2 h GLU 294 Cb 0.05 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3hu2 h GLU 294 CO -0.08 0.57 -0.28 -0.22 -1.00 0.00 0.00 179.01 178.00 3hu2 h LYS 295 N 0.88 0.54 -3.16 2.33 3.64 -0.21 -3.30 116.57 117.28 3hu2 h LYS 295 Ca 0.41 -0.22 -0.79 0.00 -1.27 0.00 0.00 60.65 58.78 3hu2 h LYS 295 Cb 0.32 -0.02 -0.24 0.00 -0.41 0.00 0.00 32.23 31.88 3hu2 h LYS 295 CO -0.23 0.76 1.20 0.09 -2.27 0.00 0.00 179.45 179.00 3hu2 n ASN 296 N -4.10 5.94 0.00 4.20 4.13 -0.33 -5.00 115.26 120.11 3hu2 n ASN 296 Ca -0.01 -3.30 0.00 0.00 1.68 0.00 0.00 54.58 52.96 3hu2 n ASN 296 Cb 0.43 -1.35 0.00 0.00 -1.54 0.00 0.00 39.78 37.32 3hu2 n ASN 296 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3hu2 n ALA 297 N 2.28 0.00 -2.61 5.41 0.00 -1.25 -4.05 120.51 120.29 3hu2 n ALA 297 Ca 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.32 3hu2 n ALA 297 Cb 0.34 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.76 3hu2 n ALA 297 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3hu2 s PRO 298 N -0.04 3.92 0.06 0.00 0.02 -1.26 -4.59 135.00 133.11 3hu2 s PRO 298 Ca 0.00 0.67 0.01 0.00 0.02 0.00 0.00 61.00 61.70 3hu2 s PRO 298 Cb 0.00 -3.77 -0.03 0.00 0.02 0.00 0.00 34.50 30.72 3hu2 s PRO 298 CO 0.00 -0.84 -0.06 0.00 -0.33 0.00 0.00 177.00 175.76 3hu2 s ALA 299 N 3.32 0.61 -0.16 -1.55 0.00 -0.82 -2.00 121.76 121.16 3hu2 s ALA 299 Ca 0.37 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.38 3hu2 s ALA 299 Cb -0.13 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.12 3hu2 s ALA 299 CO 0.16 -0.15 -0.17 0.42 0.00 0.00 0.00 175.76 176.03 3hu2 s ILE 300 N -2.34 2.47 -0.24 0.00 1.01 0.13 -2.39 121.20 119.84 3hu2 s ILE 300 Ca -0.03 -0.83 -0.10 0.00 0.00 0.00 0.00 60.65 59.70 3hu2 s ILE 300 Cb -0.03 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.35 3hu2 s ILE 300 CO -0.03 0.52 0.15 -0.63 0.00 0.00 0.00 174.94 174.95 3hu2 s ILE 301 N 0.96 5.22 -0.26 2.92 1.01 -0.86 -0.24 121.20 129.95 3hu2 s ILE 301 Ca -0.03 0.13 -0.04 0.00 0.00 0.00 0.00 60.65 60.71 3hu2 s ILE 301 Cb -0.15 -3.43 0.01 0.00 0.01 0.00 0.00 42.46 38.90 3hu2 s ILE 301 CO -0.03 0.35 0.00 0.12 0.00 0.00 0.00 174.94 175.37 3hu2 s PHE 302 N 1.11 3.08 -0.78 3.97 5.36 0.18 0.60 117.98 131.50 3hu2 s PHE 302 Ca 0.07 -1.21 -0.15 0.00 -0.96 0.00 0.00 56.93 54.68 3hu2 s PHE 302 Cb -0.14 -2.15 0.19 0.00 -0.34 0.00 0.00 43.02 40.59 3hu2 s PHE 302 CO 0.05 -0.63 0.75 0.42 -1.46 0.00 0.00 175.22 174.35 3hu2 s ILE 303 N 1.42 5.44 0.31 3.12 1.01 0.11 0.01 121.20 132.61 3hu2 s ILE 303 Ca 0.02 -2.17 -0.28 0.00 0.00 0.00 0.00 60.65 58.22 3hu2 s ILE 303 Cb -0.16 -4.48 -0.09 0.00 0.01 0.00 0.00 42.46 37.73 3hu2 s ILE 303 CO -0.01 -1.05 1.13 -0.62 0.00 0.00 0.00 174.94 174.39 3hu2 s ASP 304 N 2.59 7.06 -1.18 3.58 2.15 0.99 -1.70 116.67 130.15 3hu2 s ASP 304 Ca 0.17 2.32 -0.03 0.00 0.43 0.00 0.00 52.55 55.43 3hu2 s ASP 304 Cb -0.13 -2.62 -0.02 0.00 -0.30 0.00 0.00 42.92 39.84 3hu2 s ASP 304 CO -0.06 -0.30 0.89 -0.62 -0.17 0.00 0.00 175.17 174.91 3hu2 n GLU 305 N 0.87 -4.68 -0.34 4.34 1.02 -0.89 0.68 120.64 121.64 3hu2 n GLU 305 Ca 0.00 0.77 0.13 0.00 -0.02 0.00 0.00 57.16 58.04 3hu2 n GLU 305 Cb 0.45 -5.57 0.34 0.00 -0.02 0.00 0.00 31.44 26.64 3hu2 n GLU 305 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3hu2 h LEU 306 N -1.68 0.76 -2.08 -4.62 5.85 -1.10 -1.74 115.31 110.69 3hu2 h LEU 306 Ca -0.61 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.29 3hu2 h LEU 306 Cb 1.34 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 3hu2 h LEU 306 CO 0.50 0.29 0.33 -2.24 -0.34 0.00 0.00 178.44 176.98 3hu2 h ASP 307 N 0.75 0.00 -0.45 1.25 3.04 -1.87 0.43 116.42 119.58 3hu2 h ASP 307 Ca 0.55 0.00 -0.07 0.00 -3.24 0.00 0.00 57.03 54.27 3hu2 h ASP 307 Cb 0.88 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.15 3hu2 h ASP 307 CO -0.34 0.00 0.03 0.00 -2.04 0.00 0.00 179.24 176.89 3hu2 h ALA 308 N 1.65 1.09 0.00 4.15 0.00 -1.67 -3.32 119.26 121.15 3hu2 h ALA 308 Ca 0.15 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 3hu2 h ALA 308 Cb 0.81 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3hu2 h ALA 308 CO -0.00 0.58 -2.04 0.44 0.00 0.00 0.00 179.25 178.23 3hu2 n ILE 309 N -4.22 0.38 -3.00 0.00 -5.35 0.13 -4.69 119.36 102.61 3hu2 n ILE 309 Ca 0.03 -0.57 -0.24 0.00 -0.27 0.00 0.00 62.75 61.70 3hu2 n ILE 309 Cb 0.29 -0.12 -0.04 0.00 -1.74 0.00 0.00 39.64 38.03 3hu2 n ILE 309 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hu2 n ALA 310 N -2.36 3.91 -1.93 -1.28 0.00 -0.08 -4.12 120.51 114.65 3hu2 n ALA 310 Ca -0.12 -4.31 -0.28 0.00 0.00 0.00 0.00 53.44 48.73 3hu2 n ALA 310 Cb 0.71 -0.79 0.06 0.00 0.00 0.00 0.00 19.45 19.43 3hu2 n ALA 310 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hu2 s PRO 311 N -3.17 2.45 -0.16 0.00 0.04 -1.25 -1.68 135.00 131.23 3hu2 s PRO 311 Ca 0.46 0.12 -0.31 0.00 0.04 0.00 0.00 61.00 61.31 3hu2 s PRO 311 Cb 0.30 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.69 3hu2 s PRO 311 CO -0.12 -1.19 2.11 1.63 0.04 0.00 0.00 177.00 179.46 3hu2 n LYS 312 N -3.01 2.05 0.25 4.56 5.02 -0.95 -4.07 118.16 122.01 3hu2 n LYS 312 Ca 0.07 0.65 0.06 0.00 -2.02 0.00 0.00 58.31 57.08 3hu2 n LYS 312 Cb 0.59 -2.96 0.34 0.00 -0.02 0.00 0.00 35.03 32.99 3hu2 n LYS 312 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hu2 h ARG 313 N 12.66 0.00 0.15 1.97 3.08 -1.93 0.11 114.38 130.41 3hu2 h ARG 313 Ca -0.42 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.62 3hu2 h ARG 313 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 3hu2 h ARG 313 CO 0.96 0.00 -0.07 0.93 -1.07 0.00 0.00 179.97 180.72 3hu2 h GLU 314 N 0.00 -0.20 -2.50 0.04 5.08 -2.02 -3.38 114.58 111.60 3hu2 h GLU 314 Ca 0.00 0.01 -0.27 0.00 -1.00 0.00 0.00 59.36 58.11 3hu2 h GLU 314 Cb 1.10 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 3hu2 h GLU 314 CO 0.00 -0.13 0.85 1.17 -1.00 0.00 0.00 179.01 179.90 3hu2 n LYS 315 N -3.85 2.02 -3.49 2.33 4.81 0.37 -4.64 118.16 115.70 3hu2 n LYS 315 Ca -0.03 -1.12 -0.09 0.00 -0.87 0.00 0.00 58.31 56.21 3hu2 n LYS 315 Cb 0.08 -2.12 -0.09 0.00 0.02 0.00 0.00 35.03 32.92 3hu2 n LYS 315 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 3hu2 s THR 316 N 1.80 -0.62 0.04 3.15 -1.32 -1.22 -4.66 115.64 112.81 3hu2 s THR 316 Ca 0.54 0.05 -0.10 0.00 -1.21 0.00 0.00 61.69 60.97 3hu2 s THR 316 Cb 0.22 -0.74 -0.32 0.00 -1.51 0.00 0.00 72.50 70.16 3hu2 s THR 316 CO -0.01 -0.03 1.01 0.45 -2.21 0.00 0.00 174.62 173.83 3hu2 h HIS 317 N 8.18 0.74 -3.53 9.09 3.86 -1.92 -3.45 115.15 128.12 3hu2 h HIS 317 Ca -0.18 -0.54 -0.52 0.00 -1.16 0.00 0.00 60.37 57.98 3hu2 h HIS 317 Cb 1.13 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.57 3hu2 h HIS 317 CO 0.20 1.45 0.43 0.20 0.86 0.00 0.00 177.93 181.08 3hu2 s GLY 318 N -4.70 2.88 0.23 2.45 0.00 -1.26 -4.97 107.32 101.95 3hu2 s GLY 318 Ca -0.08 0.71 -0.07 0.00 0.00 0.00 0.00 44.72 45.29 3hu2 s GLY 318 CO 0.91 1.61 1.86 0.83 0.00 0.00 0.00 173.10 178.31 3hu2 h GLU 319 N 5.49 0.98 -0.78 2.90 5.08 -1.99 -1.25 114.58 125.02 3hu2 h GLU 319 Ca -0.43 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 57.83 3hu2 h GLU 319 Cb 1.21 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.21 3hu2 h GLU 319 CO 0.73 0.65 0.34 0.28 -1.00 0.00 0.00 179.01 180.01 3hu2 h VAL 320 N 1.01 1.25 0.04 3.13 2.07 -1.98 0.32 116.25 122.09 3hu2 h VAL 320 Ca 0.34 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 3hu2 h VAL 320 Cb 0.06 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 3hu2 h VAL 320 CO -0.13 0.31 -0.02 -0.33 0.02 0.00 0.00 177.57 177.42 3hu2 h GLU 321 N 1.11 -0.05 -1.00 1.57 5.08 -1.86 -0.74 114.58 118.69 3hu2 h GLU 321 Ca 0.26 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.78 3hu2 h GLU 321 Cb 0.16 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.33 3hu2 h GLU 321 CO -0.03 0.19 0.62 0.00 -1.00 0.00 0.00 179.01 178.79 3hu2 h ARG 322 N -0.29 0.85 -0.63 2.33 3.08 -1.04 -2.10 114.38 116.58 3hu2 h ARG 322 Ca -0.01 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 3hu2 h ARG 322 Cb 0.26 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3hu2 h ARG 322 CO 0.01 0.56 0.13 -0.09 -1.07 0.00 0.00 179.97 179.51 3hu2 h ARG 323 N 0.87 1.01 -0.50 0.04 2.43 -0.29 -2.91 114.38 115.03 3hu2 h ARG 323 Ca 0.53 -0.24 -0.08 0.00 -0.81 0.00 0.00 59.98 59.37 3hu2 h ARG 323 Cb 0.69 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 3hu2 h ARG 323 CO -0.31 0.92 -0.02 0.82 -1.51 0.00 0.00 179.97 179.87 3hu2 h ILE 324 N 0.96 1.25 -0.29 1.20 2.04 -0.45 0.11 117.51 122.33 3hu2 h ILE 324 Ca 0.20 -1.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.98 3hu2 h ILE 324 Cb 0.38 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 3hu2 h ILE 324 CO 0.01 0.38 0.14 0.58 0.00 0.00 0.00 178.15 179.25 3hu2 h VAL 325 N 0.79 1.15 -0.88 1.67 2.07 -1.43 -0.47 116.25 119.16 3hu2 h VAL 325 Ca 0.15 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.24 3hu2 h VAL 325 Cb 0.50 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 3hu2 h VAL 325 CO 0.03 0.15 0.55 0.28 0.02 0.00 0.00 177.57 178.60 3hu2 h SER 326 N 0.33 1.04 -0.83 0.57 0.02 -1.27 -1.84 113.55 111.57 3hu2 h SER 326 Ca 0.10 -0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 3hu2 h SER 326 Cb 0.12 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.36 3hu2 h SER 326 CO -0.01 0.77 0.44 -0.61 -1.14 0.00 0.00 176.83 176.28 3hu2 h GLN 327 N 1.20 1.18 0.22 3.45 5.75 -0.26 -2.24 115.11 124.42 3hu2 h GLN 327 Ca 0.32 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.66 3hu2 h GLN 327 Cb -0.09 -0.23 0.00 0.00 1.07 0.00 0.00 27.48 28.24 3hu2 h GLN 327 CO -0.06 0.88 -0.11 1.25 -2.65 0.00 0.00 178.83 178.14 3hu2 h LEU 328 N 1.18 -0.26 -0.67 -2.39 5.85 -0.56 -2.70 115.31 115.76 3hu2 h LEU 328 Ca 0.29 -0.27 0.14 0.00 0.84 0.00 0.00 57.88 58.88 3hu2 h LEU 328 Cb 0.06 0.07 -0.12 0.00 0.37 0.00 0.00 40.66 41.04 3hu2 h LEU 328 CO -0.04 0.22 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.20 3hu2 h LEU 329 N -0.83 -0.33 -0.60 2.25 3.38 -1.39 -0.10 115.31 117.69 3hu2 h LEU 329 Ca -0.03 0.17 0.10 0.00 0.09 0.00 0.00 57.88 58.21 3hu2 h LEU 329 Cb 0.51 0.31 -0.07 0.00 0.09 0.00 0.00 40.66 41.50 3hu2 h LEU 329 CO 0.05 -0.15 0.21 0.74 0.09 0.00 0.00 178.44 179.38 3hu2 h THR 330 N 0.10 0.75 -0.48 0.22 2.02 -1.42 -1.40 112.91 112.71 3hu2 h THR 330 Ca 0.36 -0.13 -0.11 0.00 0.77 0.00 0.00 66.41 67.29 3hu2 h THR 330 Cb 0.59 0.34 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 3hu2 h THR 330 CO -0.59 0.07 -0.14 -0.07 0.37 0.00 0.00 175.52 175.16 3hu2 h LEU 331 N 0.38 0.96 -0.60 2.58 3.38 -0.74 0.29 115.31 121.55 3hu2 h LEU 331 Ca 0.30 -0.37 0.06 0.00 0.09 0.00 0.00 57.88 57.96 3hu2 h LEU 331 Cb 0.39 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 3hu2 h LEU 331 CO -0.32 1.11 0.31 0.24 0.09 0.00 0.00 178.44 179.87 3hu2 h MET 332 N 0.79 0.57 0.00 1.13 2.86 -0.75 -1.79 114.93 117.75 3hu2 h MET 332 Ca 0.12 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 3hu2 h MET 332 Cb 0.70 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.23 3hu2 h MET 332 CO 0.05 0.38 -0.05 -0.44 1.06 0.00 0.00 176.91 177.91 3hu2 h ASP 333 N 0.59 0.00 0.39 1.22 3.32 -0.99 -3.33 116.42 117.61 3hu2 h ASP 333 Ca 0.27 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.18 3hu2 h ASP 333 Cb 0.18 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3hu2 h ASP 333 CO -0.18 0.05 -0.58 1.23 -1.72 0.00 0.00 179.24 178.04 3hu2 h GLY 334 N 3.76 0.21 -6.77 2.75 0.00 0.45 -3.42 103.07 100.05 3hu2 h GLY 334 Ca -0.00 -0.25 -0.58 0.00 0.00 0.00 0.00 47.33 46.50 3hu2 h GLY 334 CO 0.01 0.23 1.25 1.08 0.00 0.00 0.00 176.54 179.10 3hu2 s LEU 335 N -7.91 3.56 0.98 3.11 1.43 -1.04 -5.01 118.68 113.79 3hu2 s LEU 335 Ca -0.04 1.33 -0.12 0.00 -1.03 0.00 0.00 54.13 54.28 3hu2 s LEU 335 Cb 0.12 -3.53 0.18 0.00 0.03 0.00 0.00 46.19 42.99 3hu2 s LEU 335 CO 0.79 -1.63 1.09 -0.54 0.23 0.00 0.00 176.35 176.29 3hu2 s LYS 336 N 5.48 0.58 0.21 1.70 1.02 -1.26 -4.95 119.74 122.51 3hu2 s LYS 336 Ca 0.78 0.67 -0.11 0.00 0.02 0.00 0.00 55.97 57.33 3hu2 s LYS 336 Cb -0.23 -1.74 0.28 0.00 -0.52 0.00 0.00 37.83 35.62 3hu2 s LYS 336 CO 0.33 -2.67 1.70 1.96 -0.92 0.00 0.00 175.35 175.75 3hu2 h GLN 337 N -1.85 0.21 -0.80 1.68 1.08 -1.98 -2.46 115.11 111.00 3hu2 h GLN 337 Ca -0.53 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.65 3hu2 h GLN 337 Cb 1.31 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 3hu2 h GLN 337 CO 0.56 0.14 0.00 2.89 -0.95 0.00 0.00 178.83 181.47 3hu2 n ARG 338 N -5.16 0.94 0.09 1.46 -4.01 -1.26 -3.66 116.66 105.06 3hu2 n ARG 338 Ca 0.08 0.00 -0.14 0.00 -1.04 0.00 0.00 57.85 56.75 3hu2 n ARG 338 Cb 0.32 -1.40 -0.11 0.00 -3.04 0.00 0.00 32.46 28.23 3hu2 n ARG 338 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 3hu2 h ALA 339 N 2.07 0.20 -6.03 2.89 0.00 -1.80 -3.48 119.26 113.10 3hu2 h ALA 339 Ca 0.00 -0.84 -0.41 0.00 0.00 0.00 0.00 54.91 53.66 3hu2 h ALA 339 Cb 0.40 -0.02 0.07 0.00 0.00 0.00 0.00 17.79 18.24 3hu2 h ALA 339 CO 0.00 0.96 -0.82 0.72 0.00 0.00 0.00 179.25 180.11 3hu2 n HIS 340 N -3.57 -1.98 -3.92 0.00 8.25 -1.24 -4.72 115.22 108.04 3hu2 n HIS 340 Ca -0.07 0.86 -0.28 0.00 -0.26 0.00 0.00 57.72 57.97 3hu2 n HIS 340 Cb 0.96 -4.48 -0.17 0.00 1.12 0.00 0.00 29.99 27.43 3hu2 n HIS 340 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3hu2 s VAL 341 N -3.61 1.14 -0.15 1.59 1.01 -1.26 -1.95 120.40 117.16 3hu2 s VAL 341 Ca 0.04 -0.45 -0.07 0.00 0.00 0.00 0.00 61.98 61.50 3hu2 s VAL 341 Cb -0.02 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 3hu2 s VAL 341 CO 0.80 0.30 0.07 -0.63 0.00 0.00 0.00 175.10 175.65 3hu2 s ILE 342 N 1.65 4.92 -0.27 2.22 -1.09 -1.00 -4.91 121.20 122.72 3hu2 s ILE 342 Ca 0.04 0.00 -0.09 0.00 -2.23 0.00 0.00 60.65 58.37 3hu2 s ILE 342 Cb -0.13 -3.18 -0.03 0.00 -1.58 0.00 0.00 42.46 37.54 3hu2 s ILE 342 CO -0.08 0.52 0.12 -0.69 -1.23 0.00 0.00 174.94 173.58 3hu2 s VAL 343 N -0.16 4.63 0.02 2.92 1.01 -0.41 -2.03 120.40 126.37 3hu2 s VAL 343 Ca 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 61.98 61.89 3hu2 s VAL 343 Cb -0.12 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 3hu2 s VAL 343 CO 0.01 0.25 0.19 -0.04 0.00 0.00 0.00 175.10 175.51 3hu2 s MET 344 N 1.65 3.44 0.03 2.72 -1.94 0.20 -0.35 119.30 125.05 3hu2 s MET 344 Ca 0.06 -0.36 -0.04 0.00 -1.71 0.00 0.00 55.69 53.64 3hu2 s MET 344 Cb -0.16 -3.08 -0.02 0.00 2.01 0.00 0.00 34.83 33.59 3hu2 s MET 344 CO 0.06 0.65 0.06 0.00 -0.01 0.00 0.00 175.02 175.78 3hu2 s ALA 345 N -1.39 0.02 0.02 3.03 0.00 0.19 0.04 121.76 123.67 3hu2 s ALA 345 Ca 0.30 -0.60 0.07 0.00 0.00 0.00 0.00 51.96 51.73 3hu2 s ALA 345 Cb -0.13 0.21 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 3hu2 s ALA 345 CO 0.22 -0.28 -0.20 0.00 0.00 0.00 0.00 175.76 175.51 3hu2 s ALA 346 N -2.38 1.67 0.02 0.00 0.00 -0.69 0.11 121.76 120.49 3hu2 s ALA 346 Ca -0.07 -0.95 -0.14 0.00 0.00 0.00 0.00 51.96 50.80 3hu2 s ALA 346 Cb -0.03 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.75 3hu2 s ALA 346 CO -0.04 0.39 0.31 -0.08 0.00 0.00 0.00 175.76 176.34 3hu2 s THR 347 N -0.65 0.07 -2.21 0.00 -1.32 -0.04 -0.91 115.64 110.58 3hu2 s THR 347 Ca 0.07 -0.60 0.20 0.00 -1.21 0.00 0.00 61.69 60.16 3hu2 s THR 347 Cb -0.08 -0.81 0.08 0.00 -1.51 0.00 0.00 72.50 70.18 3hu2 s THR 347 CO 0.01 -0.33 1.07 -0.46 -2.21 0.00 0.00 174.62 172.70 3hu2 n ASN 348 N 0.85 2.32 -3.30 8.08 0.23 -1.26 -2.72 115.26 119.46 3hu2 n ASN 348 Ca -0.20 -1.66 -0.25 0.00 -0.53 0.00 0.00 54.58 51.94 3hu2 n ASN 348 Cb 0.58 0.22 -0.08 0.00 -2.08 0.00 0.00 39.78 38.42 3hu2 n ASN 348 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3hu2 n ARG 349 N 0.59 1.22 0.15 -3.83 1.74 -1.26 -4.73 116.66 110.54 3hu2 n ARG 349 Ca 0.10 -3.67 0.06 0.00 -0.77 0.00 0.00 57.85 53.57 3hu2 n ARG 349 Cb 0.47 -1.58 0.52 0.00 -1.02 0.00 0.00 32.46 30.85 3hu2 n ARG 349 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3hu2 h PRO 350 N 4.23 0.22 0.00 5.56 0.13 -1.93 -1.51 132.00 138.70 3hu2 h PRO 350 Ca 0.12 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3hu2 h PRO 350 Cb 0.82 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3hu2 h PRO 350 CO 0.57 0.19 0.00 0.09 -0.23 0.00 0.00 178.00 178.61 3hu2 n ASN 351 N -4.47 0.00 -0.99 1.44 3.02 -1.26 -1.67 115.26 111.33 3hu2 n ASN 351 Ca -0.01 -0.58 0.12 0.00 -0.03 0.00 0.00 54.58 54.08 3hu2 n ASN 351 Cb 0.11 -0.10 0.19 0.00 -0.61 0.00 0.00 39.78 39.37 3hu2 n ASN 351 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3hu2 n SER 352 N -1.10 3.03 -4.78 6.41 3.41 -0.57 -4.93 113.62 115.09 3hu2 n SER 352 Ca 0.18 -1.95 -0.39 0.00 -0.26 0.00 0.00 58.87 56.45 3hu2 n SER 352 Cb 0.13 -0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 3hu2 n SER 352 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hu2 s ILE 353 N -1.77 4.86 -0.14 -1.33 1.01 -0.67 -2.23 121.20 120.93 3hu2 s ILE 353 Ca 0.34 1.21 -0.39 0.00 0.00 0.00 0.00 60.65 61.80 3hu2 s ILE 353 Cb 0.21 -3.91 -0.17 0.00 0.01 0.00 0.00 42.46 38.61 3hu2 s ILE 353 CO 0.31 0.47 1.54 -0.67 0.00 0.00 0.00 174.94 176.59 3hu2 n ASP 354 N 2.38 1.87 0.29 3.58 -0.08 -0.68 -4.63 116.55 119.29 3hu2 n ASP 354 Ca -0.08 1.11 0.17 0.00 -1.51 0.00 0.00 54.79 54.48 3hu2 n ASP 354 Cb 0.51 -1.12 0.87 0.00 2.34 0.00 0.00 41.12 43.71 3hu2 n ASP 354 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hu2 h PRO 355 N 5.80 0.00 -0.15 -0.67 0.11 -1.94 -2.51 132.00 132.64 3hu2 h PRO 355 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3hu2 h PRO 355 Cb 1.34 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.44 3hu2 h PRO 355 CO 0.87 0.05 0.02 0.00 -0.21 0.00 0.00 178.00 178.73 3hu2 h ALA 356 N 1.95 1.77 0.00 -0.75 0.00 -1.99 0.21 119.26 120.45 3hu2 h ALA 356 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3hu2 h ALA 356 Cb 0.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hu2 h ALA 356 CO 0.01 0.18 0.00 -0.07 0.00 0.00 0.00 179.25 179.37 3hu2 h LEU 357 N 0.21 0.00 -1.89 0.00 4.07 -1.82 -3.07 115.31 112.81 3hu2 h LEU 357 Ca 0.05 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.01 3hu2 h LEU 357 Cb 0.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.85 3hu2 h LEU 357 CO -0.00 0.00 0.00 -1.14 -1.08 0.00 0.00 178.44 176.22 3hu2 n ARG 358 N -2.63 2.07 -1.64 1.13 0.63 0.05 -0.80 116.66 115.46 3hu2 n ARG 358 Ca 0.03 -1.84 -0.29 0.00 -0.92 0.00 0.00 57.85 54.83 3hu2 n ARG 358 Cb 0.36 -1.42 0.12 0.00 0.45 0.00 0.00 32.46 31.97 3hu2 n ARG 358 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3hu2 s ARG 359 N -1.79 1.50 0.02 -0.14 3.00 -1.13 -4.22 118.95 116.20 3hu2 s ARG 359 Ca 0.26 0.29 -0.36 0.00 0.00 0.00 0.00 55.73 55.92 3hu2 s ARG 359 Cb 0.18 -1.88 -0.15 0.00 0.00 0.00 0.00 34.95 33.10 3hu2 s ARG 359 CO 0.28 -1.95 1.57 0.34 0.00 0.00 0.00 175.30 175.53 3hu2 n PHE 360 N -3.59 1.97 0.00 -0.53 7.35 -1.26 -1.79 117.46 119.60 3hu2 n PHE 360 Ca 0.07 0.41 0.00 0.00 -0.76 0.00 0.00 57.45 57.17 3hu2 n PHE 360 Cb 0.59 -2.47 0.00 0.00 0.35 0.00 0.00 39.48 37.95 3hu2 n PHE 360 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3hu2 n GLY 361 N 3.37 3.09 0.00 7.13 0.00 -1.26 -4.98 105.19 112.53 3hu2 n GLY 361 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3hu2 n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu2 n ARG 362 N -0.52 0.00 -2.40 1.61 3.00 -0.74 -4.67 116.66 112.95 3hu2 n ARG 362 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.85 57.41 3hu2 n ARG 362 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 3hu2 n ARG 362 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 3hu2 n PHE 363 N 0.00 4.21 0.18 -1.55 3.72 0.02 -2.71 117.46 121.33 3hu2 n PHE 363 Ca 0.00 -2.97 0.09 0.00 -0.05 0.00 0.00 57.45 54.52 3hu2 n PHE 363 Cb 0.00 -2.44 0.25 0.00 -0.94 0.00 0.00 39.48 36.35 3hu2 n PHE 363 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3hu2 n ASP 364 N 6.68 3.07 -4.00 4.37 3.85 -1.06 -4.38 116.55 125.08 3hu2 n ASP 364 Ca 0.46 -2.02 -0.18 0.00 -0.71 0.00 0.00 54.79 52.34 3hu2 n ASP 364 Cb 0.42 -0.39 -0.15 0.00 -1.35 0.00 0.00 41.12 39.66 3hu2 n ASP 364 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 3hu2 s ARG 365 N -1.28 0.69 -0.04 0.11 1.81 -0.98 -4.97 118.95 114.29 3hu2 s ARG 365 Ca 0.38 -0.28 0.05 0.00 -1.72 0.00 0.00 55.73 54.15 3hu2 s ARG 365 Cb 0.20 -0.67 -0.00 0.00 -0.45 0.00 0.00 34.95 34.03 3hu2 s ARG 365 CO 0.25 0.16 -0.18 -1.21 -0.68 0.00 0.00 175.30 173.64 3hu2 s GLU 366 N -0.10 1.87 -0.21 3.54 2.02 -1.26 -0.42 118.70 124.14 3hu2 s GLU 366 Ca 0.02 -0.65 -0.01 0.00 0.02 0.00 0.00 54.97 54.36 3hu2 s GLU 366 Cb -0.04 -1.62 0.02 0.00 0.10 0.00 0.00 34.13 32.58 3hu2 s GLU 366 CO -0.00 0.26 -0.12 0.08 0.02 0.00 0.00 175.26 175.50 3hu2 s VAL 367 N 0.01 2.61 -0.83 2.63 1.01 0.61 -4.93 120.40 121.50 3hu2 s VAL 367 Ca -0.04 -0.89 -0.22 0.00 0.00 0.00 0.00 61.98 60.83 3hu2 s VAL 367 Cb -0.12 -2.21 0.08 0.00 0.00 0.00 0.00 36.38 34.13 3hu2 s VAL 367 CO 0.02 0.39 1.15 -0.62 0.00 0.00 0.00 175.10 176.04 3hu2 s ASP 368 N 1.34 6.38 -1.07 3.32 2.15 -1.26 -1.61 116.67 125.92 3hu2 s ASP 368 Ca 0.03 -1.36 -0.19 0.00 0.43 0.00 0.00 52.55 51.45 3hu2 s ASP 368 Cb -0.15 -2.46 0.10 0.00 -0.30 0.00 0.00 42.92 40.11 3hu2 s ASP 368 CO -0.08 -1.38 1.40 -0.63 -0.17 0.00 0.00 175.17 174.32 3hu2 s ILE 369 N 3.97 4.36 0.00 4.11 -1.09 0.32 -4.96 121.20 127.91 3hu2 s ILE 369 Ca 0.32 -1.49 0.00 0.00 -2.23 0.00 0.00 60.65 57.25 3hu2 s ILE 369 Cb -0.09 -4.98 0.00 0.00 -1.58 0.00 0.00 42.46 35.81 3hu2 s ILE 369 CO 0.00 -1.78 0.00 0.61 -1.23 0.00 0.00 174.94 172.55 3hu2 n GLY 370 N 5.79 0.46 3.71 6.18 0.00 -1.26 -4.11 105.19 115.97 3hu2 n GLY 370 Ca 0.34 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 3hu2 n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hu2 s ILE 371 N 0.08 2.96 0.34 -0.61 1.01 -1.26 -4.90 121.20 118.82 3hu2 s ILE 371 Ca 0.00 0.64 -0.28 0.00 0.00 0.00 0.00 60.65 61.02 3hu2 s ILE 371 Cb 0.00 -3.41 -0.09 0.00 0.01 0.00 0.00 42.46 38.96 3hu2 s ILE 371 CO 0.00 0.04 1.19 -2.16 0.00 0.00 0.00 174.94 174.01 3hu2 s PRO 372 N 1.41 4.33 0.78 2.79 0.04 -1.26 -5.06 135.00 138.03 3hu2 s PRO 372 Ca 0.69 1.94 -0.13 0.00 0.04 0.00 0.00 61.00 63.53 3hu2 s PRO 372 Cb -0.40 -2.95 0.19 0.00 0.04 0.00 0.00 34.50 31.38 3hu2 s PRO 372 CO 0.31 -0.11 0.82 -0.40 0.04 0.00 0.00 177.00 177.65 3hu2 n ASP 373 N 0.63 -1.05 -0.31 6.66 5.75 -1.26 -4.63 116.55 122.35 3hu2 n ASP 373 Ca 0.01 -1.11 0.05 0.00 -0.01 0.00 0.00 54.79 53.74 3hu2 n ASP 373 Cb 0.45 -0.70 0.20 0.00 -1.03 0.00 0.00 41.12 40.04 3hu2 n ASP 373 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hu2 h ALA 374 N -2.26 1.28 -0.29 2.12 0.00 -1.96 -0.76 119.26 117.39 3hu2 h ALA 374 Ca -0.29 0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.51 3hu2 h ALA 374 Cb 0.85 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3hu2 h ALA 374 CO 0.20 0.05 -0.46 1.15 0.00 0.00 0.00 179.25 180.18 3hu2 h THR 375 N 0.76 1.29 0.32 0.00 2.02 -1.95 -2.17 112.91 113.19 3hu2 h THR 375 Ca 0.44 -1.66 0.00 0.00 0.77 0.00 0.00 66.41 65.97 3hu2 h THR 375 Cb 0.50 1.56 -0.03 0.00 -1.74 0.00 0.00 68.15 68.44 3hu2 h THR 375 CO -0.29 0.54 -0.45 1.23 0.37 0.00 0.00 175.52 176.92 3hu2 h GLY 376 N 0.87 -1.02 0.10 2.16 0.00 -1.74 -2.30 103.07 101.14 3hu2 h GLY 376 Ca 0.03 0.52 0.18 0.00 0.00 0.00 0.00 47.33 48.07 3hu2 h GLY 376 CO 0.10 -0.32 0.49 3.21 0.00 0.00 0.00 176.54 180.03 3hu2 h ARG 377 N -0.82 0.61 -0.36 4.80 3.08 -0.96 -0.24 114.38 120.50 3hu2 h ARG 377 Ca -0.02 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.01 3hu2 h ARG 377 Cb 0.76 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 3hu2 h ARG 377 CO -0.14 0.40 0.21 1.25 -1.07 0.00 0.00 179.97 180.63 3hu2 h LEU 378 N 0.63 0.33 -0.31 3.04 5.85 -1.29 -0.05 115.31 123.50 3hu2 h LEU 378 Ca 0.53 0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.27 3hu2 h LEU 378 Cb 0.83 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 3hu2 h LEU 378 CO -0.40 0.24 0.15 -0.33 -0.34 0.00 0.00 178.44 177.76 3hu2 h GLU 379 N 0.42 0.31 -0.72 1.25 5.08 -0.51 -0.92 114.58 119.50 3hu2 h GLU 379 Ca 0.14 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 3hu2 h GLU 379 Cb 0.01 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 3hu2 h GLU 379 CO -0.07 0.20 0.20 0.82 -1.00 0.00 0.00 179.01 179.17 3hu2 h ILE 380 N 0.32 1.26 -0.36 3.13 2.04 -0.88 -0.38 117.51 122.64 3hu2 h ILE 380 Ca 0.13 -0.93 -0.12 0.00 1.00 0.00 0.00 64.86 64.94 3hu2 h ILE 380 Cb 0.05 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 3hu2 h ILE 380 CO -0.10 0.36 -0.27 -0.07 0.00 0.00 0.00 178.15 178.07 3hu2 h LEU 381 N 1.08 0.77 -0.85 1.44 3.38 -0.70 0.06 115.31 120.48 3hu2 h LEU 381 Ca 0.23 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 3hu2 h LEU 381 Cb 0.33 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 3hu2 h LEU 381 CO -0.00 1.00 0.13 1.56 0.09 0.00 0.00 178.44 181.22 3hu2 h GLN 382 N 0.65 0.99 -0.25 1.13 4.20 -0.62 -1.65 115.11 119.55 3hu2 h GLN 382 Ca 0.08 -0.23 -0.17 0.00 0.06 0.00 0.00 58.65 58.40 3hu2 h GLN 382 Cb 0.79 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.43 3hu2 h GLN 382 CO 0.07 0.89 -0.51 0.82 -0.67 0.00 0.00 178.83 179.42 3hu2 h ILE 383 N 0.94 1.30 0.00 2.54 2.04 -0.72 -3.07 117.51 120.54 3hu2 h ILE 383 Ca 0.20 -1.72 0.00 0.00 1.00 0.00 0.00 64.86 64.34 3hu2 h ILE 383 Cb 0.36 1.65 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 3hu2 h ILE 383 CO 0.00 0.55 0.00 0.45 0.00 0.00 0.00 178.15 179.15 3hu2 h HIS 384 N 0.55 0.00 -0.27 1.37 3.86 -0.74 -3.22 115.15 116.70 3hu2 h HIS 384 Ca 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3hu2 h HIS 384 Cb 1.08 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.55 3hu2 h HIS 384 CO 0.05 0.00 0.00 0.25 0.86 0.00 0.00 177.93 179.09 3hu2 n THR 385 N -2.31 0.91 0.25 2.45 -2.24 -0.64 -4.64 114.28 108.05 3hu2 n THR 385 Ca 0.04 -0.95 0.11 0.00 -2.27 0.00 0.00 64.05 60.97 3hu2 n THR 385 Cb 0.34 0.56 0.65 0.00 -2.10 0.00 0.00 70.33 69.79 3hu2 n THR 385 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3hu2 h LYS 386 N 1.72 0.00 -0.08 -0.78 2.10 -1.55 -0.78 116.57 117.20 3hu2 h LYS 386 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3hu2 h LYS 386 Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 3hu2 h LYS 386 CO 0.00 0.15 0.00 0.09 -2.00 0.00 0.00 179.45 177.69 3hu2 n ASN 387 N -3.72 2.36 -4.85 7.07 3.02 -1.26 -4.98 115.26 112.89 3hu2 n ASN 387 Ca -0.02 -1.66 -0.35 0.00 -0.03 0.00 0.00 54.58 52.52 3hu2 n ASN 387 Cb 0.27 -0.04 -0.06 0.00 -0.61 0.00 0.00 39.78 39.34 3hu2 n ASN 387 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3hu2 s MET 388 N -1.19 3.94 -0.44 3.52 -1.94 -0.30 -5.05 119.30 117.84 3hu2 s MET 388 Ca 0.19 0.44 -0.28 0.00 -1.71 0.00 0.00 55.69 54.33 3hu2 s MET 388 Cb 0.13 -2.94 0.03 0.00 2.01 0.00 0.00 34.83 34.06 3hu2 s MET 388 CO 0.19 0.49 1.05 0.15 -0.01 0.00 0.00 175.02 176.89 3hu2 s LYS 389 N -1.97 3.73 0.05 2.03 1.02 -1.26 -4.99 119.74 118.36 3hu2 s LYS 389 Ca 0.37 0.53 0.04 0.00 0.02 0.00 0.00 55.97 56.93 3hu2 s LYS 389 Cb -0.15 -3.88 -0.04 0.00 -0.52 0.00 0.00 37.83 33.25 3hu2 s LYS 389 CO 0.19 -1.23 -0.03 -0.51 -0.92 0.00 0.00 175.35 172.85 3hu2 s LEU 390 N 4.07 3.34 0.58 3.17 1.43 -1.26 -1.34 118.68 128.67 3hu2 s LEU 390 Ca 0.44 -0.17 -0.15 0.00 -1.03 0.00 0.00 54.13 53.22 3hu2 s LEU 390 Cb -0.09 -2.02 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 3hu2 s LEU 390 CO 0.27 0.22 1.03 0.00 0.23 0.00 0.00 176.35 178.10 3hu2 s ALA 391 N -1.18 2.86 0.32 4.21 0.00 -0.98 -4.83 121.76 122.16 3hu2 s ALA 391 Ca 0.22 0.28 0.10 0.00 0.00 0.00 0.00 51.96 52.56 3hu2 s ALA 391 Cb -0.11 -3.18 0.96 0.00 0.00 0.00 0.00 23.12 20.78 3hu2 s ALA 391 CO 0.14 -0.65 1.66 0.22 0.00 0.00 0.00 175.76 177.13 3hu2 h ASP 392 N 0.47 0.38 0.63 0.00 1.82 -2.00 -2.31 116.42 115.40 3hu2 h ASP 392 Ca -0.46 0.19 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 3hu2 h ASP 392 Cb 1.21 0.17 0.00 0.00 0.68 0.00 0.00 39.33 41.38 3hu2 h ASP 392 CO 0.59 -0.12 -0.02 -0.90 -1.61 0.00 0.00 179.24 177.18 3hu2 n ASP 393 N -5.09 0.06 -4.62 2.28 5.75 -1.26 -4.84 116.55 108.83 3hu2 n ASP 393 Ca 0.28 -0.07 -0.43 0.00 -0.01 0.00 0.00 54.79 54.56 3hu2 n ASP 393 Cb 0.87 -0.29 -0.02 0.00 -1.03 0.00 0.00 41.12 40.65 3hu2 n ASP 393 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3hu2 s VAL 394 N -2.65 3.82 -0.39 2.12 1.01 -0.87 -4.67 120.40 118.77 3hu2 s VAL 394 Ca 0.25 0.90 -0.04 0.00 0.00 0.00 0.00 61.98 63.10 3hu2 s VAL 394 Cb 0.20 -3.89 0.09 0.00 0.00 0.00 0.00 36.38 32.78 3hu2 s VAL 394 CO 0.48 -0.42 0.17 -0.62 0.00 0.00 0.00 175.10 174.72 3hu2 s ASP 395 N 4.00 5.27 0.22 3.32 2.15 -1.26 -4.98 116.67 125.39 3hu2 s ASP 395 Ca 0.67 -1.74 0.09 0.00 0.43 0.00 0.00 52.55 51.99 3hu2 s ASP 395 Cb -0.21 -1.84 0.16 0.00 -0.30 0.00 0.00 42.92 40.73 3hu2 s ASP 395 CO 0.29 -0.48 1.50 -0.07 -0.17 0.00 0.00 175.17 176.23 3hu2 h LEU 396 N 8.13 0.03 -0.80 -1.34 4.07 -1.99 -2.72 115.31 120.69 3hu2 h LEU 396 Ca -0.17 -0.02 0.05 0.00 0.08 0.00 0.00 57.88 57.82 3hu2 h LEU 396 Cb 1.06 -0.01 -0.06 0.00 1.08 0.00 0.00 40.66 42.73 3hu2 h LEU 396 CO 0.68 0.77 0.49 -0.33 -1.08 0.00 0.00 178.44 178.97 3hu2 h GLU 397 N 0.02 0.89 -0.93 1.13 5.08 -1.94 0.56 114.58 119.39 3hu2 h GLU 397 Ca -0.01 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3hu2 h GLU 397 Cb 1.32 -0.20 -0.05 0.00 0.50 0.00 0.00 28.75 30.32 3hu2 h GLU 397 CO 0.10 0.59 0.61 0.37 -1.00 0.00 0.00 179.01 179.68 3hu2 h GLN 398 N 0.91 1.20 -0.34 2.33 5.75 -1.92 -1.18 115.11 121.86 3hu2 h GLN 398 Ca 0.34 -0.07 -0.16 0.00 -0.15 0.00 0.00 58.65 58.61 3hu2 h GLN 398 Cb 0.13 -0.27 -0.00 0.00 1.07 0.00 0.00 27.48 28.41 3hu2 h GLN 398 CO -0.16 0.79 -0.40 0.28 -2.65 0.00 0.00 178.83 176.69 3hu2 h VAL 399 N 1.23 1.28 -0.96 2.39 2.07 -1.00 -2.13 116.25 119.13 3hu2 h VAL 399 Ca 0.35 -1.58 0.02 0.00 0.82 0.00 0.00 66.70 66.31 3hu2 h VAL 399 Cb -0.11 1.49 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 3hu2 h VAL 399 CO -0.09 0.52 0.63 0.00 0.02 0.00 0.00 177.57 178.65 3hu2 h ALA 400 N 0.73 1.24 0.00 1.67 0.00 0.42 -2.03 119.26 121.30 3hu2 h ALA 400 Ca 0.05 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 3hu2 h ALA 400 Cb 1.00 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3hu2 h ALA 400 CO 0.10 0.56 -0.46 -0.91 0.00 0.00 0.00 179.25 178.53 3hu2 h ASN 401 N 1.25 0.00 -0.17 0.00 2.35 -1.01 -2.95 115.58 115.05 3hu2 h ASN 401 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 3hu2 h ASN 401 Cb -0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.30 3hu2 h ASN 401 CO -0.10 0.46 0.00 -0.62 -1.65 0.00 0.00 177.43 175.52 3hu2 n GLU 402 N -3.45 1.60 -2.46 0.81 1.02 -0.78 -4.41 120.64 112.98 3hu2 n GLU 402 Ca 0.00 -0.91 -0.24 0.00 -0.02 0.00 0.00 57.16 55.99 3hu2 n GLU 402 Cb 0.60 -1.34 0.01 0.00 -0.02 0.00 0.00 31.44 30.69 3hu2 n GLU 402 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3hu2 n THR 403 N 0.16 2.20 -0.25 2.62 -2.24 -1.12 -4.92 114.28 110.72 3hu2 n THR 403 Ca 0.14 -4.58 0.06 0.00 -2.27 0.00 0.00 64.05 57.41 3hu2 n THR 403 Cb 0.27 -0.96 0.19 0.00 -2.10 0.00 0.00 70.33 67.73 3hu2 n THR 403 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3hu2 h HIS 404 N 2.59 0.28 -0.00 4.78 6.17 -1.79 -1.45 115.15 125.72 3hu2 h HIS 404 Ca 0.25 0.04 0.00 0.00 0.71 0.00 0.00 60.37 61.37 3hu2 h HIS 404 Cb 1.03 -0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.96 3hu2 h HIS 404 CO 0.78 -0.10 -0.01 0.41 0.71 0.00 0.00 177.93 179.72 3hu2 n GLY 405 N -1.36 -1.28 3.72 5.26 0.00 -1.26 -4.91 105.19 105.36 3hu2 n GLY 405 Ca 0.15 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3hu2 n GLY 405 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hu2 s HIS 406 N -2.59 3.67 0.64 1.61 4.02 -0.55 -4.85 115.29 117.24 3hu2 s HIS 406 Ca 0.28 1.50 0.01 0.00 1.02 0.00 0.00 55.06 57.87 3hu2 s HIS 406 Cb 0.20 -2.93 0.09 0.00 -1.02 0.00 0.00 32.58 28.92 3hu2 s HIS 406 CO 0.47 0.12 0.88 0.14 1.02 0.00 0.00 174.74 177.37 3hu2 s VAL 407 N 0.57 2.34 0.34 -0.90 -7.23 -1.26 -4.48 120.40 109.77 3hu2 s VAL 407 Ca 0.43 -0.68 0.03 0.00 -1.81 0.00 0.00 61.98 59.95 3hu2 s VAL 407 Cb -0.20 -2.67 0.28 0.00 0.56 0.00 0.00 36.38 34.35 3hu2 s VAL 407 CO 0.24 0.00 1.96 1.23 -0.31 0.00 0.00 175.10 178.21 3hu2 h GLY 408 N -0.21 1.06 1.09 2.32 0.00 -1.81 -2.10 103.07 103.42 3hu2 h GLY 408 Ca -0.38 -0.36 -0.04 0.00 0.00 0.00 0.00 47.33 46.56 3hu2 h GLY 408 CO 0.45 0.29 0.36 0.00 0.00 0.00 0.00 176.54 177.63 3hu2 h ALA 409 N 1.56 1.12 -0.64 3.60 0.00 -1.61 -0.25 119.26 123.05 3hu2 h ALA 409 Ca 0.31 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 3hu2 h ALA 409 Cb 0.12 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3hu2 h ALA 409 CO -0.10 0.65 0.14 -0.44 0.00 0.00 0.00 179.25 179.50 3hu2 h ASP 410 N 1.15 0.97 -0.31 0.00 3.32 -1.68 -1.77 116.42 118.10 3hu2 h ASP 410 Ca 0.27 -0.20 -0.17 0.00 0.02 0.00 0.00 57.03 56.95 3hu2 h ASP 410 Cb 0.16 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 3hu2 h ASP 410 CO -0.03 0.94 -0.45 -0.07 -1.72 0.00 0.00 179.24 177.92 3hu2 h LEU 411 N 0.97 0.95 -0.28 1.55 3.38 -1.16 0.23 115.31 120.95 3hu2 h LEU 411 Ca 0.20 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 3hu2 h LEU 411 Cb 0.37 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3hu2 h LEU 411 CO 0.00 1.25 0.17 0.00 0.09 0.00 0.00 178.44 179.96 3hu2 h ALA 412 N 0.78 0.35 -0.90 1.53 0.00 -0.92 0.37 119.26 120.48 3hu2 h ALA 412 Ca 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hu2 h ALA 412 Cb 1.04 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 3hu2 h ALA 412 CO 0.10 -0.15 0.52 0.00 0.00 0.00 0.00 179.25 179.73 3hu2 h ALA 413 N 1.07 1.23 -0.50 0.00 0.00 -1.18 -0.24 119.26 119.63 3hu2 h ALA 413 Ca 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3hu2 h ALA 413 Cb 0.01 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3hu2 h ALA 413 CO -0.02 0.65 0.28 1.25 0.00 0.00 0.00 179.25 181.40 3hu2 h LEU 414 N 1.25 0.63 -0.84 0.00 5.85 -0.13 -0.81 115.31 121.26 3hu2 h LEU 414 Ca 0.32 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.84 3hu2 h LEU 414 Cb -0.02 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 3hu2 h LEU 414 CO -0.06 0.54 -0.34 0.00 -0.34 0.00 0.00 178.44 178.24 3hu2 h SER 416 N 0.40 0.89 0.37 0.00 0.87 -0.70 -2.47 113.55 112.91 3hu2 h SER 416 Ca 0.05 -0.23 -0.21 0.00 -1.23 0.00 0.00 61.79 60.17 3hu2 h SER 416 Cb 0.79 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.51 3hu2 h SER 416 CO 0.06 0.94 -0.87 -0.33 -0.53 0.00 0.00 176.83 176.10 3hu2 h GLU 417 N 0.85 0.36 -0.28 2.24 4.39 -0.68 -1.95 114.58 119.51 3hu2 h GLU 417 Ca 0.16 -0.36 -0.11 0.00 0.34 0.00 0.00 59.36 59.39 3hu2 h GLU 417 Cb 0.49 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 3hu2 h GLU 417 CO 0.02 1.04 -0.28 0.00 -1.16 0.00 0.00 179.01 178.63 3hu2 h ALA 418 N 0.84 0.99 -0.45 3.43 0.00 -1.38 0.15 119.26 122.86 3hu2 h ALA 418 Ca -0.06 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.37 3hu2 h ALA 418 Cb 1.49 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3hu2 h ALA 418 CO 0.15 0.60 -0.17 0.00 0.00 0.00 0.00 179.25 179.82 3hu2 h ALA 419 N 1.21 0.85 -0.14 0.00 0.00 -1.29 -1.44 119.26 118.45 3hu2 h ALA 419 Ca 0.07 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.49 3hu2 h ALA 419 Cb 0.73 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3hu2 h ALA 419 CO 0.06 0.64 -0.48 1.25 0.00 0.00 0.00 179.25 180.72 3hu2 h LEU 420 N 0.76 0.39 -0.54 0.00 6.46 -0.78 -1.69 115.31 119.91 3hu2 h LEU 420 Ca 0.11 -0.19 -0.07 0.00 -0.12 0.00 0.00 57.88 57.61 3hu2 h LEU 420 Cb 0.70 -0.11 -0.02 0.00 -0.73 0.00 0.00 40.66 40.50 3hu2 h LEU 420 CO 0.05 0.82 0.07 -0.61 -0.62 0.00 0.00 178.44 178.14 3hu2 h GLN 421 N 0.29 0.92 -0.24 1.25 5.75 -0.80 -0.01 115.11 122.27 3hu2 h GLN 421 Ca 0.02 -0.26 -0.01 0.00 -0.15 0.00 0.00 58.65 58.25 3hu2 h GLN 421 Cb 0.96 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.39 3hu2 h GLN 421 CO 0.08 0.90 0.09 0.00 -2.65 0.00 0.00 178.83 177.25 3hu2 h ALA 422 N 0.98 1.72 -0.26 3.38 0.00 -0.85 -0.55 119.26 123.69 3hu2 h ALA 422 Ca 0.16 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 3hu2 h ALA 422 Cb 0.44 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hu2 h ALA 422 CO 0.01 0.23 -0.43 0.82 0.00 0.00 0.00 179.25 179.88 3hu2 h ILE 423 N 0.33 1.30 -0.40 0.00 2.04 -1.02 -2.92 117.51 116.83 3hu2 h ILE 423 Ca 0.08 -1.63 -0.01 0.00 1.00 0.00 0.00 64.86 64.31 3hu2 h ILE 423 Cb 0.07 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 3hu2 h ILE 423 CO -0.01 0.52 0.23 0.03 0.00 0.00 0.00 178.15 178.92 3hu2 h ARG 424 N 0.50 0.55 0.00 2.37 3.08 0.32 0.08 114.38 121.28 3hu2 h ARG 424 Ca 0.02 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 3hu2 h ARG 424 Cb 1.03 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 3hu2 h ARG 424 CO 0.10 0.40 -0.31 0.87 -1.07 0.00 0.00 179.97 179.96 3hu2 h LYS 425 N 0.56 0.00 -0.73 0.04 1.57 -1.08 -2.80 116.57 114.13 3hu2 h LYS 425 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3hu2 h LYS 425 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3hu2 h LYS 425 CO -0.03 0.31 0.00 1.17 -0.57 0.00 0.00 179.45 180.33 3hu2 n LYS 426 N -3.89 2.79 0.31 3.15 3.00 -0.05 -4.49 118.16 118.98 3hu2 n LYS 426 Ca -0.02 -2.66 0.20 0.00 -0.00 0.00 0.00 58.31 55.83 3hu2 n LYS 426 Cb 0.38 -1.60 1.01 0.00 0.00 0.00 0.00 35.03 34.82 3hu2 n LYS 426 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.40 177.92 3hu2 h MET 427 N 4.27 0.00 -0.37 1.64 2.86 -1.09 -2.90 114.93 119.34 3hu2 h MET 427 Ca 0.00 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 3hu2 h MET 427 Cb 1.02 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 3hu2 h MET 427 CO 0.02 0.02 -0.31 -0.44 1.06 0.00 0.00 176.91 177.25 3hu2 h ASP 428 N 0.00 0.86 -0.29 1.22 3.32 -1.83 -3.17 116.42 116.52 3hu2 h ASP 428 Ca -0.00 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.69 3hu2 h ASP 428 Cb 0.17 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.48 3hu2 h ASP 428 CO 0.00 1.11 0.00 0.18 -1.72 0.00 0.00 179.24 178.81 3hu2 n LEU 429 N -4.07 2.49 -4.29 1.55 4.32 -1.11 -4.86 117.00 111.03 3hu2 n LEU 429 Ca -0.01 -1.08 -0.29 0.00 -0.02 0.00 0.00 56.01 54.61 3hu2 n LEU 429 Cb 0.49 -0.19 -0.15 0.00 -1.62 0.00 0.00 43.42 41.95 3hu2 n LEU 429 CO 0.46 0.54 -0.55 -0.63 -1.22 0.00 0.00 177.39 175.99 3hu2 s ILE 430 N -1.62 1.91 -0.00 -0.08 1.01 -1.17 -4.74 121.20 116.51 3hu2 s ILE 430 Ca 0.35 -1.16 0.01 0.00 0.00 0.00 0.00 60.65 59.84 3hu2 s ILE 430 Cb 0.19 -1.62 -0.00 0.00 0.01 0.00 0.00 42.46 41.04 3hu2 s ILE 430 CO 0.28 0.42 -0.03 -0.62 0.00 0.00 0.00 174.94 174.99 3hu2 s ASP 431 N -0.88 0.32 0.53 3.58 2.15 -1.26 -4.82 116.67 116.30 3hu2 s ASP 431 Ca 0.10 -0.06 0.24 0.00 0.43 0.00 0.00 52.55 53.26 3hu2 s ASP 431 Cb -0.09 -0.03 1.48 0.00 -0.30 0.00 0.00 42.92 43.97 3hu2 s ASP 431 CO 0.00 0.03 2.14 0.25 -0.17 0.00 0.00 175.17 177.43 3hu2 h LEU 432 N 6.06 0.00 -0.13 -1.34 5.85 -2.01 -2.78 115.31 120.96 3hu2 h LEU 432 Ca -0.26 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 3hu2 h LEU 432 Cb 1.20 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 3hu2 h LEU 432 CO 0.50 0.06 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.26 3hu2 h GLU 433 N 0.00 0.00 -7.18 1.25 4.39 -2.01 -3.46 114.58 107.57 3hu2 h GLU 433 Ca -0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 3hu2 h GLU 433 Cb 0.14 0.00 0.14 0.00 -0.10 0.00 0.00 28.75 28.93 3hu2 h GLU 433 CO 0.01 0.08 0.39 -0.51 -1.16 0.00 0.00 179.01 177.82 3hu2 s ASP 434 N -6.21 4.50 -0.02 1.42 1.01 -1.05 -4.99 116.67 111.33 3hu2 s ASP 434 Ca 0.06 2.27 -0.24 0.00 0.71 0.00 0.00 52.55 55.34 3hu2 s ASP 434 Cb 0.06 -2.58 -0.20 0.00 1.01 0.00 0.00 42.92 41.21 3hu2 s ASP 434 CO 0.67 -2.05 1.19 -0.08 0.21 0.00 0.00 175.17 175.11 3hu2 h GLU 435 N -0.13 0.13 -4.44 8.23 4.81 -1.89 -3.47 114.58 117.84 3hu2 h GLU 435 Ca -0.48 -0.09 -0.17 0.00 -0.13 0.00 0.00 59.36 58.49 3hu2 h GLU 435 Cb 1.28 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 30.53 3hu2 h GLU 435 CO 0.51 0.70 -0.68 0.95 -0.73 0.00 0.00 179.01 179.77 3hu2 s THR 436 N -3.83 0.36 0.12 0.32 -4.23 -1.26 -5.16 115.64 101.97 3hu2 s THR 436 Ca -0.16 -1.88 -0.27 0.00 -1.18 0.00 0.00 61.69 58.21 3hu2 s THR 436 Cb 0.02 -1.72 -0.07 0.00 1.34 0.00 0.00 72.50 72.07 3hu2 s THR 436 CO 0.71 -0.82 0.84 -0.63 -0.54 0.00 0.00 174.62 174.18 3hu2 s ILE 437 N -3.84 4.49 0.16 2.99 1.01 -1.26 -5.02 121.20 119.74 3hu2 s ILE 437 Ca 0.13 1.81 -0.33 0.00 0.00 0.00 0.00 60.65 62.26 3hu2 s ILE 437 Cb 0.07 -4.20 -0.16 0.00 0.01 0.00 0.00 42.46 38.18 3hu2 s ILE 437 CO -0.05 0.42 1.12 -0.67 0.00 0.00 0.00 174.94 175.75 3hu2 n ASP 438 N 2.29 1.11 0.19 3.58 -0.08 -1.26 -4.90 116.55 117.47 3hu2 n ASP 438 Ca -0.02 1.14 -0.15 0.00 -1.51 0.00 0.00 54.79 54.25 3hu2 n ASP 438 Cb 0.49 -1.18 -0.07 0.00 2.34 0.00 0.00 41.12 42.70 3hu2 n ASP 438 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hu2 h ALA 439 N 3.19 -0.62 -0.60 -1.67 0.00 -1.99 -2.76 119.26 114.80 3hu2 h ALA 439 Ca -0.43 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 54.48 3hu2 h ALA 439 Cb 1.35 0.43 -0.07 0.00 0.00 0.00 0.00 17.79 19.50 3hu2 h ALA 439 CO 0.69 -0.88 0.22 1.49 0.00 0.00 0.00 179.25 180.76 3hu2 h GLU 440 N -0.62 0.38 -0.78 0.00 4.57 -2.01 -2.58 114.58 113.53 3hu2 h GLU 440 Ca -0.01 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.21 3hu2 h GLU 440 Cb 0.57 -0.09 -0.06 0.00 -0.16 0.00 0.00 28.75 29.02 3hu2 h GLU 440 CO -0.06 0.25 0.46 0.28 -1.18 0.00 0.00 179.01 178.76 3hu2 h VAL 441 N 0.39 0.99 -0.72 0.32 2.07 -1.91 -2.09 116.25 115.31 3hu2 h VAL 441 Ca 0.30 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 3hu2 h VAL 441 Cb 0.37 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 3hu2 h VAL 441 CO -0.31 0.15 0.43 -0.03 0.02 0.00 0.00 177.57 177.84 3hu2 h MET 442 N 0.83 0.98 0.00 1.57 1.85 -1.18 -3.19 114.93 115.80 3hu2 h MET 442 Ca 0.35 -0.09 -0.27 0.00 -0.61 0.00 0.00 59.70 59.09 3hu2 h MET 442 Cb 0.20 -0.21 0.02 0.00 0.43 0.00 0.00 31.60 32.05 3hu2 h MET 442 CO -0.19 0.69 -1.05 -0.91 -0.40 0.00 0.00 176.91 175.06 3hu2 h ASN 443 N 1.00 0.89 0.51 1.39 -0.26 -1.34 -3.17 115.58 114.59 3hu2 h ASN 443 Ca 0.26 -0.71 0.00 0.00 -0.56 0.00 0.00 56.30 55.29 3hu2 h ASN 443 Cb -0.03 -0.27 0.00 0.00 -1.06 0.00 0.00 38.32 36.96 3hu2 h ASN 443 CO -0.05 1.52 0.00 -1.54 -1.06 0.00 0.00 177.43 176.30 3hu2 n SER 444 N -3.84 0.23 -4.55 5.81 3.41 -1.09 -4.73 113.62 108.85 3hu2 n SER 444 Ca -0.11 0.56 -0.38 0.00 -0.26 0.00 0.00 58.87 58.68 3hu2 n SER 444 Cb 0.88 -0.61 -0.04 0.00 -0.26 0.00 0.00 64.21 64.19 3hu2 n SER 444 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hu2 n LEU 445 N -1.76 2.35 -3.93 1.04 4.77 -1.20 -4.92 117.00 113.35 3hu2 n LEU 445 Ca 0.03 -0.33 -0.20 0.00 -0.03 0.00 0.00 56.01 55.48 3hu2 n LEU 445 Cb 0.17 -1.53 -0.16 0.00 -2.33 0.00 0.00 43.42 39.57 3hu2 n LEU 445 CO 0.14 -1.36 -0.42 0.00 -1.33 0.00 0.00 177.39 174.43 3hu2 s ALA 446 N 11.27 0.72 -0.48 -1.18 0.00 -1.26 -4.77 121.76 126.06 3hu2 s ALA 446 Ca 1.01 -0.15 -0.26 0.00 0.00 0.00 0.00 51.96 52.56 3hu2 s ALA 446 Cb -0.29 -0.37 0.03 0.00 0.00 0.00 0.00 23.12 22.50 3hu2 s ALA 446 CO 0.30 0.05 0.99 0.08 0.00 0.00 0.00 175.76 177.18 3hu2 s VAL 447 N 0.60 4.38 0.76 0.00 1.01 -0.45 -4.83 120.40 121.88 3hu2 s VAL 447 Ca -0.09 0.81 -0.12 0.00 0.00 0.00 0.00 61.98 62.59 3hu2 s VAL 447 Cb -0.12 -4.50 0.05 0.00 0.00 0.00 0.00 36.38 31.81 3hu2 s VAL 447 CO 0.01 -0.93 1.14 0.42 0.00 0.00 0.00 175.10 175.73 3hu2 s THR 448 N 3.99 2.61 0.23 3.92 -4.23 -1.26 -2.33 115.64 118.58 3hu2 s THR 448 Ca 0.39 0.18 -0.06 0.00 -1.18 0.00 0.00 61.69 61.03 3hu2 s THR 448 Cb -0.09 -3.19 0.16 0.00 1.34 0.00 0.00 72.50 70.72 3hu2 s THR 448 CO 0.27 -0.25 1.80 -0.03 -0.54 0.00 0.00 174.62 175.87 3hu2 h MET 449 N -0.88 1.11 -0.68 3.99 4.05 -1.91 -2.78 114.93 117.82 3hu2 h MET 449 Ca -0.46 -0.20 0.09 0.00 -0.28 0.00 0.00 59.70 58.86 3hu2 h MET 449 Cb 1.30 -0.18 -0.04 0.00 -0.80 0.00 0.00 31.60 31.87 3hu2 h MET 449 CO 0.65 0.90 0.45 0.22 0.23 0.00 0.00 176.91 179.36 3hu2 h ASP 450 N 1.08 0.50 -0.17 1.39 3.58 -1.94 -0.01 116.42 120.85 3hu2 h ASP 450 Ca 0.25 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.71 3hu2 h ASP 450 Cb 0.22 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.17 3hu2 h ASP 450 CO -0.02 0.30 0.10 0.44 -2.88 0.00 0.00 179.24 177.18 3hu2 h ASP 451 N 0.55 0.20 -0.86 2.28 3.32 -1.82 -2.36 116.42 117.73 3hu2 h ASP 451 Ca 0.31 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.32 3hu2 h ASP 451 Cb 0.48 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.94 3hu2 h ASP 451 CO -0.10 0.18 0.54 -0.26 -1.72 0.00 0.00 179.24 177.89 3hu2 h PHE 452 N 0.19 1.11 -0.20 4.55 -1.00 -0.95 -0.62 116.94 120.03 3hu2 h PHE 452 Ca 0.06 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.82 3hu2 h PHE 452 Cb 0.02 -0.37 -0.01 0.00 3.61 0.00 0.00 35.95 39.20 3hu2 h PHE 452 CO -0.05 0.72 -0.02 0.00 -1.61 0.00 0.00 178.31 177.35 3hu2 h ARG 453 N 1.18 0.29 -0.09 1.51 3.08 -1.04 0.53 114.38 119.83 3hu2 h ARG 453 Ca 0.31 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.30 3hu2 h ARG 453 Cb -0.09 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 3hu2 h ARG 453 CO -0.06 0.33 -0.01 2.35 -1.07 0.00 0.00 179.97 181.51 3hu2 h TRP 454 N 0.28 0.18 -0.94 3.04 7.01 -0.66 -1.33 115.95 123.52 3hu2 h TRP 454 Ca 0.07 -0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.07 3hu2 h TRP 454 Cb 0.23 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 27.19 3hu2 h TRP 454 CO 0.00 0.44 0.62 0.00 -2.79 0.00 0.00 178.44 176.72 3hu2 h ALA 455 N 0.71 1.41 -0.59 2.65 0.00 -0.28 -1.24 119.26 121.92 3hu2 h ALA 455 Ca 0.02 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3hu2 h ALA 455 Cb 0.38 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3hu2 h ALA 455 CO 0.01 0.49 0.03 -0.07 0.00 0.00 0.00 179.25 179.71 3hu2 h LEU 456 N 1.17 0.96 -1.30 0.00 3.38 0.10 -1.42 115.31 118.20 3hu2 h LEU 456 Ca 0.38 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 3hu2 h LEU 456 Cb 0.04 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3hu2 h LEU 456 CO -0.12 1.00 -0.32 0.77 0.09 0.00 0.00 178.44 179.85 3hu2 h SER 457 N 0.92 0.04 0.46 -0.43 4.64 -0.04 -2.38 113.55 116.76 3hu2 h SER 457 Ca 0.17 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3hu2 h SER 457 Cb 0.49 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 3hu2 h SER 457 CO 0.02 0.37 -0.73 0.00 -0.87 0.00 0.00 176.83 175.62 3hu2 n GLN 458 N -4.14 0.12 -1.19 4.77 1.13 -0.94 -5.00 117.38 112.12 3hu2 n GLN 458 Ca -0.02 0.01 -0.32 0.00 -1.94 0.00 0.00 57.00 54.73 3hu2 n GLN 458 Cb 0.38 -1.55 0.11 0.00 0.11 0.00 0.00 30.24 29.29 3hu2 n GLN 458 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3hu2 s SER 459 N -3.41 3.97 0.03 1.08 0.15 -0.57 -5.07 113.70 109.89 3hu2 s SER 459 Ca 0.08 2.13 0.01 0.00 0.70 0.00 0.00 55.95 58.87 3hu2 s SER 459 Cb 0.16 -2.56 -0.02 0.00 -1.71 0.00 0.00 66.02 61.89 3hu2 s SER 459 CO 0.75 -2.40 -0.05 0.20 1.20 0.00 0.00 173.24 172.95 3hu2 s ASN 460 N -2.64 0.46 0.82 5.45 0.02 -1.26 -5.06 114.94 112.73 3hu2 s ASN 460 Ca 0.68 -0.48 -0.11 0.00 -1.02 0.00 0.00 52.86 51.93 3hu2 s ASN 460 Cb -0.23 0.07 0.11 0.00 0.02 0.00 0.00 41.25 41.22 3hu2 s ASN 460 CO 0.51 -0.24 1.17 -2.16 0.02 0.00 0.00 177.10 176.40 3hu2 s PRO 461 N -1.38 1.64 -1.23 -0.60 0.04 -1.26 -4.93 135.00 127.29 3hu2 s PRO 461 Ca -0.12 -0.20 -0.19 0.00 0.04 0.00 0.00 61.00 60.53 3hu2 s PRO 461 Cb -0.09 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 3hu2 s PRO 461 CO -0.00 -1.72 1.93 -1.13 0.04 0.00 0.00 177.00 176.12 3hu2 n SER 462 N -3.31 3.88 0.00 6.66 3.41 -1.26 -5.15 113.62 117.85 3hu2 n SER 462 Ca 0.10 -2.81 0.10 0.00 -0.26 0.00 0.00 58.87 56.00 3hu2 n SER 462 Cb 0.60 -1.62 0.61 0.00 -0.26 0.00 0.00 64.21 63.54 3hu2 n SER 462 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88