#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hu3 n LYS 18 N 0.00 1.05 -3.03 3.23 2.85 -1.26 -4.96 118.16 116.04 3hu3 n LYS 18 Ca 0.00 -2.03 -0.41 0.00 -1.05 0.00 0.00 58.31 54.82 3hu3 n LYS 18 Cb 0.00 0.26 -0.05 0.00 -0.65 0.00 0.00 35.03 34.59 3hu3 n LYS 18 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 3hu3 s GLN 19 N -3.29 4.17 0.20 -1.58 0.74 -1.26 -5.04 119.66 113.60 3hu3 s GLN 19 Ca 0.16 0.72 -0.11 0.00 0.05 0.00 0.00 55.36 56.18 3hu3 s GLN 19 Cb -0.01 -3.63 -0.07 0.00 1.10 0.00 0.00 33.01 30.40 3hu3 s GLN 19 CO 0.10 -0.40 0.55 0.15 -0.55 0.00 0.00 175.29 175.13 3hu3 s LYS 20 N 2.46 3.85 -0.05 1.67 -0.14 -1.26 -5.04 119.74 121.22 3hu3 s LYS 20 Ca 0.30 0.33 -0.30 0.00 -1.36 0.00 0.00 55.97 54.94 3hu3 s LYS 20 Cb -0.16 -2.73 -0.04 0.00 -1.68 0.00 0.00 37.83 33.23 3hu3 s LYS 20 CO 0.09 0.36 1.30 -0.80 -0.76 0.00 0.00 175.35 175.54 3hu3 s ASN 21 N -2.18 6.95 0.06 2.83 -0.87 -1.26 -5.01 114.94 115.46 3hu3 s ASN 21 Ca 0.45 1.92 0.04 0.00 -1.57 0.00 0.00 52.86 53.69 3hu3 s ASN 21 Cb -0.12 -2.55 -0.03 0.00 -0.02 0.00 0.00 41.25 38.53 3hu3 s ASN 21 CO 0.20 -0.67 -0.11 -0.13 -2.57 0.00 0.00 177.10 173.82 3hu3 s ARG 22 N 2.56 0.70 0.59 -0.60 1.81 -1.26 -5.05 118.95 117.69 3hu3 s ARG 22 Ca 0.59 -0.91 0.35 0.00 -1.72 0.00 0.00 55.73 54.04 3hu3 s ARG 22 Cb -0.27 -0.54 1.86 0.00 -0.45 0.00 0.00 34.95 35.55 3hu3 s ARG 22 CO 0.23 0.11 2.20 -1.35 -0.68 0.00 0.00 175.30 175.81 3hu3 h PRO 23 N 4.25 0.00 -0.65 3.54 0.11 -2.02 -2.33 132.00 134.89 3hu3 h PRO 23 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3hu3 h PRO 23 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3hu3 h PRO 23 CO 0.43 0.04 0.00 0.27 -0.21 0.00 0.00 178.00 178.52 3hu3 n ASN 24 N -3.39 3.76 -4.65 -2.05 6.94 -1.26 -4.85 115.26 109.76 3hu3 n ASN 24 Ca -0.02 -2.00 -0.36 0.00 -0.02 0.00 0.00 54.58 52.18 3hu3 n ASN 24 Cb 0.16 -0.44 -0.10 0.00 -2.36 0.00 0.00 39.78 37.05 3hu3 n ASN 24 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 3hu3 s ARG 25 N -1.02 4.05 0.03 -3.83 3.00 -0.88 -1.59 118.95 118.71 3hu3 s ARG 25 Ca 0.44 -0.28 0.01 0.00 0.00 0.00 0.00 55.73 55.90 3hu3 s ARG 25 Cb 0.23 -3.51 -0.02 0.00 0.00 0.00 0.00 34.95 31.64 3hu3 s ARG 25 CO 0.30 0.06 -0.05 -0.51 0.00 0.00 0.00 175.30 175.11 3hu3 s LEU 26 N 1.04 2.28 -0.08 2.53 1.43 -0.53 -4.77 118.68 120.59 3hu3 s LEU 26 Ca 0.07 -0.59 -0.21 0.00 -1.03 0.00 0.00 54.13 52.37 3hu3 s LEU 26 Cb -0.14 0.01 -0.04 0.00 0.03 0.00 0.00 46.19 46.05 3hu3 s LEU 26 CO 0.04 -0.30 0.61 -0.63 0.23 0.00 0.00 176.35 176.30 3hu3 s ILE 27 N -1.78 5.10 -0.14 -0.59 1.01 0.01 -1.09 121.20 123.71 3hu3 s ILE 27 Ca -0.10 1.25 -0.29 0.00 0.00 0.00 0.00 60.65 61.50 3hu3 s ILE 27 Cb -0.07 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.42 3hu3 s ILE 27 CO -0.02 0.29 1.43 -0.69 0.00 0.00 0.00 174.94 175.95 3hu3 s VAL 28 N 0.70 3.99 0.19 2.92 1.01 0.32 -1.14 120.40 128.40 3hu3 s VAL 28 Ca 0.33 1.18 0.09 0.00 0.00 0.00 0.00 61.98 63.58 3hu3 s VAL 28 Cb -0.17 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 3hu3 s VAL 28 CO 0.15 -0.14 -0.18 -0.62 0.00 0.00 0.00 175.10 174.31 3hu3 s ASP 29 N 2.66 2.86 0.62 3.32 2.15 0.75 -1.24 116.67 127.79 3hu3 s ASP 29 Ca 0.63 -0.92 -0.16 0.00 0.43 0.00 0.00 52.55 52.52 3hu3 s ASP 29 Cb -0.26 -0.18 -0.02 0.00 -0.30 0.00 0.00 42.92 42.16 3hu3 s ASP 29 CO 0.21 -0.04 1.09 -0.70 -0.17 0.00 0.00 175.17 175.56 3hu3 s GLU 30 N -3.08 3.07 -0.47 4.34 2.56 -1.26 -1.55 118.70 122.30 3hu3 s GLU 30 Ca 0.20 1.34 0.06 0.00 0.00 0.00 0.00 54.97 56.56 3hu3 s GLU 30 Cb -0.05 -1.99 0.19 0.00 2.00 0.00 0.00 34.13 34.28 3hu3 s GLU 30 CO 0.08 -1.03 0.59 0.00 -0.56 0.00 0.00 175.26 174.34 3hu3 n ALA 31 N -2.14 -0.01 -1.77 6.30 0.00 -1.18 -4.37 120.51 117.33 3hu3 n ALA 31 Ca 0.10 -1.87 -0.41 0.00 0.00 0.00 0.00 53.44 51.26 3hu3 n ALA 31 Cb 0.52 -1.20 -0.00 0.00 0.00 0.00 0.00 19.45 18.77 3hu3 n ALA 31 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3hu3 n ILE 32 N 2.79 1.86 -0.85 0.00 5.41 -1.26 -2.15 119.36 125.16 3hu3 n ILE 32 Ca 0.22 -0.47 0.00 0.00 1.00 0.00 0.00 62.75 63.50 3hu3 n ILE 32 Cb 0.53 -1.98 0.00 0.00 -0.71 0.00 0.00 39.64 37.48 3hu3 n ILE 32 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3hu3 n ASN 33 N 0.68 -1.26 -4.77 4.38 3.02 -1.26 -4.99 115.26 111.06 3hu3 n ASN 33 Ca 0.02 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.20 3hu3 n ASN 33 Cb 0.39 -1.25 -0.01 0.00 -0.61 0.00 0.00 39.78 38.30 3hu3 n ASN 33 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3hu3 s GLU 34 N -0.54 3.73 0.54 3.52 2.56 -0.91 -5.00 118.70 122.60 3hu3 s GLU 34 Ca 0.00 1.78 -0.21 0.00 0.00 0.00 0.00 54.97 56.54 3hu3 s GLU 34 Cb 0.00 -2.39 -0.05 0.00 2.00 0.00 0.00 34.13 33.69 3hu3 s GLU 34 CO 0.00 -0.58 1.23 0.34 -0.56 0.00 0.00 175.26 175.69 3hu3 s ASP 35 N -1.37 5.52 0.40 -1.70 2.15 -1.26 -4.83 116.67 115.57 3hu3 s ASP 35 Ca 0.64 2.45 0.25 0.00 0.43 0.00 0.00 52.55 56.32 3hu3 s ASP 35 Cb -0.29 -2.61 1.37 0.00 -0.30 0.00 0.00 42.92 41.10 3hu3 s ASP 35 CO 0.35 -1.38 1.76 0.78 -0.17 0.00 0.00 175.17 176.51 3hu3 h ASN 36 N 1.38 0.00 -0.04 -0.34 2.35 -1.98 -2.99 115.58 113.96 3hu3 h ASN 36 Ca -0.50 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.25 3hu3 h ASN 36 Cb 1.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.65 3hu3 h ASN 36 CO 0.57 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 175.15 3hu3 n SER 37 N -2.41 2.50 -4.30 5.81 7.64 -1.26 -4.77 113.62 116.83 3hu3 n SER 37 Ca -0.02 -1.74 -0.32 0.00 1.01 0.00 0.00 58.87 57.80 3hu3 n SER 37 Cb 0.08 -0.01 -0.16 0.00 -1.01 0.00 0.00 64.21 63.11 3hu3 n SER 37 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3hu3 s VAL 38 N -1.46 2.32 0.15 0.44 1.01 -1.13 0.13 120.40 121.86 3hu3 s VAL 38 Ca 0.21 -0.97 0.11 0.00 0.00 0.00 0.00 61.98 61.33 3hu3 s VAL 38 Cb 0.15 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 3hu3 s VAL 38 CO 0.22 0.57 -0.24 0.68 0.00 0.00 0.00 175.10 176.33 3hu3 s VAL 39 N -0.12 2.17 -0.06 2.92 -7.23 0.71 -4.68 120.40 114.11 3hu3 s VAL 39 Ca -0.04 -1.85 0.05 0.00 -1.81 0.00 0.00 61.98 58.33 3hu3 s VAL 39 Cb -0.14 -1.97 -0.01 0.00 0.56 0.00 0.00 36.38 34.82 3hu3 s VAL 39 CO 0.04 -0.05 -0.22 -0.44 -0.31 0.00 0.00 175.10 174.13 3hu3 s SER 40 N -2.32 3.36 0.38 4.85 0.01 -0.73 -1.17 113.70 118.08 3hu3 s SER 40 Ca 0.16 -0.43 0.08 0.00 1.31 0.00 0.00 55.95 57.06 3hu3 s SER 40 Cb -0.09 -0.92 -0.07 0.00 0.21 0.00 0.00 66.02 65.14 3hu3 s SER 40 CO 0.07 0.25 -0.02 -0.76 0.41 0.00 0.00 173.24 173.19 3hu3 s LEU 41 N -0.21 2.76 0.65 2.44 1.43 -0.98 -1.05 118.68 123.71 3hu3 s LEU 41 Ca -0.01 -1.31 -0.12 0.00 -1.03 0.00 0.00 54.13 51.65 3hu3 s LEU 41 Cb -0.13 -0.88 -0.01 0.00 0.03 0.00 0.00 46.19 45.19 3hu3 s LEU 41 CO 0.03 -0.38 1.05 -0.94 0.23 0.00 0.00 176.35 176.34 3hu3 s SER 42 N -3.65 5.67 0.18 2.29 1.04 -1.26 -0.42 113.70 117.56 3hu3 s SER 42 Ca 0.34 1.64 -0.11 0.00 0.48 0.00 0.00 55.95 58.29 3hu3 s SER 42 Cb 0.07 -2.50 0.10 0.00 0.10 0.00 0.00 66.02 63.79 3hu3 s SER 42 CO 0.17 -1.24 1.78 -0.61 0.98 0.00 0.00 173.24 174.31 3hu3 h GLN 43 N -0.28 0.92 -0.83 4.02 5.75 -1.89 -2.09 115.11 120.71 3hu3 h GLN 43 Ca -0.45 -0.13 -0.02 0.00 -0.15 0.00 0.00 58.65 57.91 3hu3 h GLN 43 Cb 1.21 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 29.55 3hu3 h GLN 43 CO 0.58 0.72 0.44 -1.35 -2.65 0.00 0.00 178.83 176.57 3hu3 h PRO 44 N 0.88 1.15 -0.20 -2.39 0.11 -1.98 0.19 132.00 129.77 3hu3 h PRO 44 Ca 0.22 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 66.20 3hu3 h PRO 44 Cb 0.10 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 3hu3 h PRO 44 CO -0.03 0.85 0.13 -0.22 -0.21 0.00 0.00 178.00 178.52 3hu3 h LYS 45 N 1.16 0.25 -0.57 1.05 1.63 -1.82 0.35 116.57 118.62 3hu3 h LYS 45 Ca 0.29 -0.02 0.06 0.00 -0.85 0.00 0.00 60.65 60.13 3hu3 h LYS 45 Cb 0.04 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 31.56 3hu3 h LYS 45 CO -0.05 0.17 0.28 0.52 -3.45 0.00 0.00 179.45 176.92 3hu3 h MET 46 N 0.26 0.51 -0.17 1.90 2.86 -0.92 0.67 114.93 120.04 3hu3 h MET 46 Ca 0.07 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 3hu3 h MET 46 Cb -0.02 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.51 3hu3 h MET 46 CO -0.02 0.33 0.09 -0.44 1.06 0.00 0.00 176.91 177.93 3hu3 h ASP 47 N 0.52 0.14 -0.62 1.22 3.32 -0.32 0.25 116.42 120.93 3hu3 h ASP 47 Ca 0.26 0.00 0.10 0.00 0.02 0.00 0.00 57.03 57.41 3hu3 h ASP 47 Cb 0.21 -0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.66 3hu3 h ASP 47 CO -0.20 0.11 0.23 -0.08 -1.72 0.00 0.00 179.24 177.57 3hu3 h GLU 48 N 0.19 0.39 -0.08 3.56 4.81 0.12 -2.50 114.58 121.07 3hu3 h GLU 48 Ca 0.07 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 3hu3 h GLU 48 Cb 0.00 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.30 3hu3 h GLU 48 CO -0.04 0.26 0.00 1.28 -0.73 0.00 0.00 179.01 179.78 3hu3 n LEU 49 N -5.00 1.74 -3.54 1.64 4.77 0.19 -4.94 117.00 111.86 3hu3 n LEU 49 Ca 0.09 -0.64 -0.22 0.00 -0.03 0.00 0.00 56.01 55.21 3hu3 n LEU 49 Cb 0.28 -0.05 0.08 0.00 -2.33 0.00 0.00 43.42 41.41 3hu3 n LEU 49 CO 0.22 0.32 0.22 0.00 -1.33 0.00 0.00 177.39 176.81 3hu3 n GLN 50 N 0.36 -7.65 -4.47 3.23 6.02 0.57 -4.94 117.38 110.50 3hu3 n GLN 50 Ca 0.18 0.83 -0.34 0.00 -0.01 0.00 0.00 57.00 57.65 3hu3 n GLN 50 Cb 0.37 -5.85 -0.11 0.00 1.02 0.00 0.00 30.24 25.67 3hu3 n GLN 50 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3hu3 s LEU 51 N -7.07 3.33 0.16 1.08 1.43 0.53 -5.02 118.68 113.13 3hu3 s LEU 51 Ca 0.46 -0.00 0.09 0.00 -1.03 0.00 0.00 54.13 53.65 3hu3 s LEU 51 Cb -0.20 -1.76 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 3hu3 s LEU 51 CO 0.72 0.30 -0.12 -0.36 0.23 0.00 0.00 176.35 177.13 3hu3 s PHE 52 N -0.44 2.61 0.12 0.29 0.40 -1.26 -4.41 117.98 115.29 3hu3 s PHE 52 Ca 0.07 -0.23 -0.35 0.00 -0.60 0.00 0.00 56.93 55.82 3hu3 s PHE 52 Cb -0.12 -1.30 -0.17 0.00 0.51 0.00 0.00 43.02 41.94 3hu3 s PHE 52 CO 0.02 0.48 1.17 -2.13 0.70 0.00 0.00 175.22 175.46 3hu3 n ARG 53 N 0.26 0.91 0.00 0.44 0.63 -1.26 -1.46 116.66 116.18 3hu3 n ARG 53 Ca -0.12 0.33 0.00 0.00 -0.92 0.00 0.00 57.85 57.14 3hu3 n ARG 53 Cb 0.55 -1.84 0.00 0.00 0.45 0.00 0.00 32.46 31.61 3hu3 n ARG 53 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3hu3 n GLY 54 N 2.10 1.85 3.73 5.14 0.00 -0.68 -5.02 105.19 112.31 3hu3 n GLY 54 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3hu3 n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hu3 n ASP 55 N 0.00 3.73 -4.73 1.61 8.00 -0.54 -4.65 116.55 119.98 3hu3 n ASP 55 Ca 0.00 1.13 -0.41 0.00 0.71 0.00 0.00 54.79 56.22 3hu3 n ASP 55 Cb 0.00 -1.57 -0.03 0.00 -0.02 0.00 0.00 41.12 39.50 3hu3 n ASP 55 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3hu3 s THR 56 N 0.18 3.38 0.09 -3.53 2.01 -1.26 -1.66 115.64 114.85 3hu3 s THR 56 Ca 0.66 1.12 0.06 0.00 0.31 0.00 0.00 61.69 63.84 3hu3 s THR 56 Cb -0.52 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.24 3hu3 s THR 56 CO 0.46 0.16 -0.15 0.68 -0.69 0.00 0.00 174.62 175.08 3hu3 s VAL 57 N 0.20 1.25 -0.19 3.82 -7.23 0.13 -1.37 120.40 117.01 3hu3 s VAL 57 Ca 0.56 -1.48 -0.07 0.00 -1.81 0.00 0.00 61.98 59.19 3hu3 s VAL 57 Cb -0.35 -1.29 -0.04 0.00 0.56 0.00 0.00 36.38 35.27 3hu3 s VAL 57 CO 0.37 -0.28 0.04 -0.22 -0.31 0.00 0.00 175.10 174.70 3hu3 s LEU 58 N -2.02 3.65 -0.02 1.32 2.96 0.01 -1.21 118.68 123.38 3hu3 s LEU 58 Ca 0.03 -0.00 0.04 0.00 -0.22 0.00 0.00 54.13 53.97 3hu3 s LEU 58 Cb -0.08 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 3hu3 s LEU 58 CO 0.03 0.14 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.33 3hu3 s LEU 59 N 0.55 2.95 -0.13 -0.68 1.43 0.12 -1.86 118.68 121.07 3hu3 s LEU 59 Ca 0.02 -0.18 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3hu3 s LEU 59 Cb -0.13 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.43 3hu3 s LEU 59 CO 0.01 0.31 -0.16 -0.54 0.23 0.00 0.00 176.35 176.20 3hu3 s LYS 60 N -1.11 2.42 0.00 1.70 1.02 -0.81 -1.50 119.74 121.46 3hu3 s LYS 60 Ca 0.14 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.51 3hu3 s LYS 60 Cb -0.11 -2.08 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 3hu3 s LYS 60 CO 0.04 -0.11 0.00 0.41 -0.92 0.00 0.00 175.35 174.77 3hu3 n GLY 61 N 4.36 1.62 3.97 -3.33 0.00 -0.41 -2.55 105.19 108.86 3hu3 n GLY 61 Ca -0.19 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.17 3hu3 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu3 s LYS 62 N 4.27 3.33 -1.57 1.61 1.02 -0.76 -4.55 119.74 123.09 3hu3 s LYS 62 Ca 0.00 -0.80 -0.10 0.00 0.02 0.00 0.00 55.97 55.09 3hu3 s LYS 62 Cb 0.00 -2.84 0.08 0.00 -0.52 0.00 0.00 37.83 34.55 3hu3 s LYS 62 CO 0.00 0.27 0.59 1.63 -0.92 0.00 0.00 175.35 176.91 3hu3 n LYS 63 N -1.54 -3.13 -1.62 1.68 5.02 -1.26 -1.55 118.16 115.76 3hu3 n LYS 63 Ca -0.05 0.37 -0.20 0.00 -2.02 0.00 0.00 58.31 56.41 3hu3 n LYS 63 Cb 0.57 -4.77 -0.08 0.00 -0.02 0.00 0.00 35.03 30.73 3hu3 n LYS 63 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hu3 n ARG 64 N -4.41 -1.45 -2.45 1.97 5.12 -1.25 -4.80 116.66 109.39 3hu3 n ARG 64 Ca -0.11 1.16 -0.39 0.00 -1.93 0.00 0.00 57.85 56.58 3hu3 n ARG 64 Cb 0.59 -5.54 -0.04 0.00 -1.16 0.00 0.00 32.46 26.31 3hu3 n ARG 64 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3hu3 s ARG 65 N -3.75 4.39 0.11 5.56 1.81 -0.60 -4.94 118.95 121.54 3hu3 s ARG 65 Ca 0.00 1.74 0.04 0.00 -1.72 0.00 0.00 55.73 55.78 3hu3 s ARG 65 Cb 0.00 -2.91 -0.04 0.00 -0.45 0.00 0.00 34.95 31.55 3hu3 s ARG 65 CO 0.00 0.01 -0.10 -1.21 -0.68 0.00 0.00 175.30 173.32 3hu3 s GLU 66 N -1.91 0.92 -0.09 3.54 2.02 -1.26 -1.28 118.70 120.63 3hu3 s GLU 66 Ca 0.51 -1.27 -0.08 0.00 0.02 0.00 0.00 54.97 54.15 3hu3 s GLU 66 Cb -0.29 -0.55 0.03 0.00 0.10 0.00 0.00 34.13 33.42 3hu3 s GLU 66 CO 0.37 0.07 0.24 0.00 0.02 0.00 0.00 175.26 175.97 3hu3 s ALA 67 N -2.81 -0.60 -0.17 5.21 0.00 -0.56 -4.72 121.76 118.10 3hu3 s ALA 67 Ca 0.10 0.71 -0.05 0.00 0.00 0.00 0.00 51.96 52.71 3hu3 s ALA 67 Cb -0.01 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 3hu3 s ALA 67 CO -0.00 -0.12 0.01 0.08 0.00 0.00 0.00 175.76 175.73 3hu3 s VAL 68 N 0.19 4.26 0.16 0.00 1.01 -1.26 0.16 120.40 124.93 3hu3 s VAL 68 Ca -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 3hu3 s VAL 68 Cb -0.02 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 3hu3 s VAL 68 CO -0.00 0.47 0.09 0.00 0.00 0.00 0.00 175.10 175.66 3hu3 s ILE 70 N -4.09 5.19 -0.20 0.00 -1.09 0.34 0.20 121.20 121.55 3hu3 s ILE 70 Ca 0.30 0.74 -0.10 0.00 -2.23 0.00 0.00 60.65 59.35 3hu3 s ILE 70 Cb 0.07 -3.70 -0.05 0.00 -1.58 0.00 0.00 42.46 37.21 3hu3 s ILE 70 CO 0.06 0.45 0.15 0.54 -1.23 0.00 0.00 174.94 174.91 3hu3 s VAL 71 N -0.10 5.40 0.03 2.92 0.11 -0.66 -0.21 120.40 127.89 3hu3 s VAL 71 Ca 0.21 0.22 0.06 0.00 -2.93 0.00 0.00 61.98 59.55 3hu3 s VAL 71 Cb -0.15 -3.49 -0.02 0.00 -1.53 0.00 0.00 36.38 31.19 3hu3 s VAL 71 CO 0.09 0.43 -0.18 -0.76 -3.33 0.00 0.00 175.10 171.35 3hu3 s LEU 72 N 0.43 2.14 0.52 2.54 1.43 -0.31 -1.69 118.68 123.74 3hu3 s LEU 72 Ca 0.09 -0.46 -0.19 0.00 -1.03 0.00 0.00 54.13 52.54 3hu3 s LEU 72 Cb -0.11 -0.83 -0.07 0.00 0.03 0.00 0.00 46.19 45.21 3hu3 s LEU 72 CO -0.01 0.13 1.08 -0.94 0.23 0.00 0.00 176.35 176.83 3hu3 s SER 73 N -1.01 6.01 -0.21 2.29 1.04 -1.26 -2.33 113.70 118.23 3hu3 s SER 73 Ca 0.05 2.01 -0.04 0.00 0.48 0.00 0.00 55.95 58.45 3hu3 s SER 73 Cb -0.08 -2.56 0.11 0.00 0.10 0.00 0.00 66.02 63.58 3hu3 s SER 73 CO 0.01 -1.01 0.35 -0.62 0.98 0.00 0.00 173.24 172.95 3hu3 s ASP 74 N -2.01 0.27 0.10 7.02 2.15 0.44 -4.85 116.67 119.78 3hu3 s ASP 74 Ca 0.69 0.44 0.24 0.00 0.43 0.00 0.00 52.55 54.35 3hu3 s ASP 74 Cb -0.19 1.02 0.95 0.00 -0.30 0.00 0.00 42.92 44.40 3hu3 s ASP 74 CO 0.25 -0.27 1.76 -0.90 -0.17 0.00 0.00 175.17 175.84 3hu3 n ASP 75 N 5.36 0.33 -0.19 -0.34 5.68 -1.26 -1.86 116.55 124.28 3hu3 n ASP 75 Ca -0.06 0.55 0.14 0.00 -0.50 0.00 0.00 54.79 54.93 3hu3 n ASP 75 Cb 0.50 -0.63 0.65 0.00 -1.14 0.00 0.00 41.12 40.49 3hu3 n ASP 75 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3hu3 n THR 76 N -1.83 0.00 -3.53 2.12 -2.24 -1.26 -4.87 114.28 102.67 3hu3 n THR 76 Ca 0.05 -0.10 -0.38 0.00 -2.27 0.00 0.00 64.05 61.36 3hu3 n THR 76 Cb 0.31 -0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.45 3hu3 n THR 76 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hu3 n SER 78 N 4.56 1.68 -0.34 0.00 7.64 -1.26 -4.10 113.62 121.80 3hu3 n SER 78 Ca -0.12 0.86 0.06 0.00 1.01 0.00 0.00 58.87 60.68 3hu3 n SER 78 Cb 0.52 -1.49 0.22 0.00 -1.01 0.00 0.00 64.21 62.45 3hu3 n SER 78 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 3hu3 h ASP 79 N 0.76 0.84 -0.14 6.43 3.32 -1.97 -1.92 116.42 123.76 3hu3 h ASP 79 Ca -0.50 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3hu3 h ASP 79 Cb 1.34 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3hu3 h ASP 79 CO 0.53 0.45 0.00 -1.84 -1.72 0.00 0.00 179.24 176.66 3hu3 n GLU 80 N -4.66 1.59 -4.38 3.56 0.00 -1.26 -4.73 120.64 110.75 3hu3 n GLU 80 Ca 0.17 -0.89 -0.24 0.00 0.00 0.00 0.00 57.16 56.21 3hu3 n GLU 80 Cb 0.34 -1.37 -0.09 0.00 0.00 0.00 0.00 31.44 30.32 3hu3 n GLU 80 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 3hu3 s LYS 81 N -1.83 1.98 -0.09 3.44 1.02 -0.72 -0.81 119.74 122.73 3hu3 s LYS 81 Ca 0.31 -1.60 0.01 0.00 0.02 0.00 0.00 55.97 54.71 3hu3 s LYS 81 Cb 0.16 -1.96 0.02 0.00 -0.52 0.00 0.00 37.83 35.53 3hu3 s LYS 81 CO 0.25 0.35 -0.09 -1.50 -0.92 0.00 0.00 175.35 173.44 3hu3 s ILE 82 N -2.41 1.02 -0.00 2.17 2.07 -0.29 -4.62 121.20 119.14 3hu3 s ILE 82 Ca 0.31 -0.35 -0.22 0.00 -1.41 0.00 0.00 60.65 58.98 3hu3 s ILE 82 Cb -0.06 -0.99 -0.05 0.00 0.13 0.00 0.00 42.46 41.49 3hu3 s ILE 82 CO 0.17 0.35 0.65 -0.13 -1.91 0.00 0.00 174.94 174.07 3hu3 s ARG 83 N 1.20 4.38 -0.10 3.50 0.52 -0.22 -0.18 118.95 128.06 3hu3 s ARG 83 Ca -0.05 0.83 -0.23 0.00 -0.52 0.00 0.00 55.73 55.76 3hu3 s ARG 83 Cb -0.14 -3.37 0.05 0.00 0.52 0.00 0.00 34.95 32.02 3hu3 s ARG 83 CO -0.02 0.30 0.54 0.00 0.02 0.00 0.00 175.30 176.14 3hu3 s MET 84 N 0.01 0.82 0.98 3.54 0.23 -0.59 -1.77 119.30 122.52 3hu3 s MET 84 Ca 0.34 0.32 -0.16 0.00 -1.03 0.00 0.00 55.69 55.16 3hu3 s MET 84 Cb -0.19 0.39 0.20 0.00 -1.53 0.00 0.00 34.83 33.70 3hu3 s MET 84 CO 0.19 -0.21 1.29 0.54 -2.03 0.00 0.00 175.02 174.80 3hu3 s ASN 85 N -0.71 2.93 0.37 -1.18 2.20 -1.26 -3.12 114.94 114.17 3hu3 s ASN 85 Ca -0.08 0.35 0.08 0.00 -0.94 0.00 0.00 52.86 52.27 3hu3 s ASN 85 Cb -0.03 -0.45 0.74 0.00 -2.00 0.00 0.00 41.25 39.51 3hu3 s ASN 85 CO 0.05 -2.86 1.90 -0.09 -2.94 0.00 0.00 177.10 173.17 3hu3 h ARG 86 N -1.72 0.31 -0.26 3.55 2.43 -1.93 -1.93 114.38 114.82 3hu3 h ARG 86 Ca -0.45 -0.07 -0.03 0.00 -0.81 0.00 0.00 59.98 58.63 3hu3 h ARG 86 Cb 1.25 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.74 3hu3 h ARG 86 CO 0.39 0.42 0.06 0.28 -1.51 0.00 0.00 179.97 179.61 3hu3 h VAL 87 N 0.30 1.22 -0.25 0.20 2.07 -1.94 -1.45 116.25 116.39 3hu3 h VAL 87 Ca 0.06 -0.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.83 3hu3 h VAL 87 Cb 0.36 1.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 3hu3 h VAL 87 CO 0.02 0.23 0.00 0.58 0.02 0.00 0.00 177.57 178.42 3hu3 h VAL 88 N 0.24 1.25 -0.55 2.57 2.07 -1.81 -2.35 116.25 117.67 3hu3 h VAL 88 Ca 0.08 -0.90 0.11 0.00 0.82 0.00 0.00 66.70 66.80 3hu3 h VAL 88 Cb 0.29 1.35 -0.09 0.00 -1.52 0.00 0.00 31.29 31.32 3hu3 h VAL 88 CO 0.00 0.28 0.06 0.03 0.02 0.00 0.00 177.57 177.96 3hu3 h ARG 89 N 0.23 0.17 -0.60 1.57 3.08 -1.36 -0.76 114.38 116.71 3hu3 h ARG 89 Ca 0.07 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 3hu3 h ARG 89 Cb 0.41 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 3hu3 h ARG 89 CO 0.01 0.11 0.22 -0.97 -1.07 0.00 0.00 179.97 178.28 3hu3 h ASN 90 N 0.18 0.80 0.33 7.04 -1.24 -1.15 -1.10 115.58 120.44 3hu3 h ASN 90 Ca 0.28 -0.11 -0.11 0.00 0.71 0.00 0.00 56.30 57.07 3hu3 h ASN 90 Cb 0.43 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.26 3hu3 h ASN 90 CO -0.42 0.73 -0.47 0.78 -1.29 0.00 0.00 177.43 176.76 3hu3 h ASN 91 N 0.86 0.18 0.16 1.15 -0.26 -0.89 -2.62 115.58 114.16 3hu3 h ASN 91 Ca 0.20 -0.08 0.00 0.00 -0.56 0.00 0.00 56.30 55.86 3hu3 h ASN 91 Cb 0.19 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.40 3hu3 h ASN 91 CO -0.02 0.63 -0.07 0.18 -1.06 0.00 0.00 177.43 177.09 3hu3 n LEU 92 N -3.98 0.77 -3.85 1.61 4.77 -0.34 -4.37 117.00 111.61 3hu3 n LEU 92 Ca -0.02 -0.19 -0.28 0.00 -0.03 0.00 0.00 56.01 55.50 3hu3 n LEU 92 Cb 0.51 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.55 3hu3 n LEU 92 CO 0.42 0.13 0.07 0.54 -1.33 0.00 0.00 177.39 177.22 3hu3 n ARG 93 N -0.57 -5.48 -4.26 3.23 5.12 -0.62 -1.82 116.66 112.26 3hu3 n ARG 93 Ca 0.17 0.61 -0.19 0.00 -1.93 0.00 0.00 57.85 56.52 3hu3 n ARG 93 Cb 0.28 -5.42 -0.11 0.00 -1.16 0.00 0.00 32.46 26.04 3hu3 n ARG 93 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3hu3 s VAL 94 N -3.40 1.43 0.39 1.55 -7.23 -0.52 -4.42 120.40 108.19 3hu3 s VAL 94 Ca 0.48 -1.73 0.08 0.00 -1.81 0.00 0.00 61.98 59.00 3hu3 s VAL 94 Cb -0.24 -1.57 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 3hu3 s VAL 94 CO 0.82 -0.38 0.20 -0.13 -0.31 0.00 0.00 175.10 175.30 3hu3 s ARG 95 N -2.63 2.31 0.14 4.82 0.52 -1.26 -4.43 118.95 118.43 3hu3 s ARG 95 Ca 0.10 -1.70 -0.35 0.00 -0.52 0.00 0.00 55.73 53.25 3hu3 s ARG 95 Cb -0.05 -2.10 -0.15 0.00 0.52 0.00 0.00 34.95 33.16 3hu3 s ARG 95 CO 0.04 -0.05 1.46 1.28 0.02 0.00 0.00 175.30 178.05 3hu3 n LEU 96 N -1.25 2.48 0.00 2.53 4.77 -1.26 -1.57 117.00 122.70 3hu3 n LEU 96 Ca -0.01 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.07 3hu3 n LEU 96 Cb 0.63 -1.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.39 3hu3 n LEU 96 CO 0.44 -0.62 0.00 0.61 -1.33 0.00 0.00 177.39 176.49 3hu3 n GLY 97 N 2.97 3.40 3.73 -0.72 0.00 -0.37 -4.99 105.19 109.21 3hu3 n GLY 97 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 3hu3 n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu3 s ASP 98 N -0.93 3.69 -0.02 1.61 1.01 -0.61 -4.59 116.67 116.83 3hu3 s ASP 98 Ca 0.00 1.55 -0.01 0.00 0.71 0.00 0.00 52.55 54.79 3hu3 s ASP 98 Cb 0.00 -2.23 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 3hu3 s ASP 98 CO 0.00 -2.51 0.10 -0.69 0.21 0.00 0.00 175.17 172.28 3hu3 s VAL 99 N -2.93 4.89 0.27 -1.27 1.01 -1.26 -0.52 120.40 120.60 3hu3 s VAL 99 Ca 0.63 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 62.34 3hu3 s VAL 99 Cb -0.18 -3.23 -0.06 0.00 0.00 0.00 0.00 36.38 32.92 3hu3 s VAL 99 CO 0.57 0.39 0.06 0.27 0.00 0.00 0.00 175.10 176.38 3hu3 s ILE 100 N -1.18 0.91 0.09 2.22 -5.25 -0.25 -4.89 121.20 112.85 3hu3 s ILE 100 Ca 0.22 -2.01 0.08 0.00 -0.99 0.00 0.00 60.65 57.95 3hu3 s ILE 100 Cb -0.12 -2.61 -0.04 0.00 2.95 0.00 0.00 42.46 42.64 3hu3 s ILE 100 CO 0.13 -0.09 -0.16 -0.94 -1.79 0.00 0.00 174.94 172.09 3hu3 s SER 101 N -3.37 3.97 0.02 4.36 1.04 -1.06 -1.45 113.70 117.22 3hu3 s SER 101 Ca 0.35 -0.49 0.07 0.00 0.48 0.00 0.00 55.95 56.36 3hu3 s SER 101 Cb 0.08 -0.63 -0.02 0.00 0.10 0.00 0.00 66.02 65.55 3hu3 s SER 101 CO 0.13 0.20 -0.20 -0.51 0.98 0.00 0.00 173.24 173.84 3hu3 s ILE 102 N -1.10 1.56 0.05 -1.02 2.07 -0.62 -1.92 121.20 120.22 3hu3 s ILE 102 Ca 0.18 -1.05 -0.11 0.00 -1.41 0.00 0.00 60.65 58.25 3hu3 s ILE 102 Cb -0.11 -1.34 0.01 0.00 0.13 0.00 0.00 42.46 41.15 3hu3 s ILE 102 CO 0.09 0.26 0.24 0.00 -1.91 0.00 0.00 174.94 173.62 3hu3 s GLN 103 N -0.93 0.75 0.64 3.50 -2.07 -0.77 -4.83 119.66 115.95 3hu3 s GLN 103 Ca 0.07 -0.61 -0.18 0.00 -1.82 0.00 0.00 55.36 52.82 3hu3 s GLN 103 Cb -0.08 0.32 -0.02 0.00 -1.09 0.00 0.00 33.01 32.14 3hu3 s GLN 103 CO 0.01 -0.23 1.21 -2.30 -1.32 0.00 0.00 175.29 172.66 3hu3 n PRO 104 N 0.58 1.05 -3.47 9.60 -0.02 -1.26 -0.81 135.00 140.67 3hu3 n PRO 104 Ca -0.18 0.41 -0.26 0.00 -2.02 0.00 0.00 63.50 61.44 3hu3 n PRO 104 Cb 0.59 -2.45 -0.09 0.00 -0.02 0.00 0.00 33.50 31.54 3hu3 n PRO 104 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hu3 h PRO 106 N 4.84 0.00 0.00 0.00 0.14 -1.94 -3.35 132.00 131.69 3hu3 h PRO 106 Ca 0.17 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.31 3hu3 h PRO 106 Cb 0.81 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.95 3hu3 h PRO 106 CO 0.58 0.18 0.00 -0.40 0.14 0.00 0.00 178.00 178.50 3hu3 n ASP 107 N -3.21 0.00 -4.63 1.44 5.68 -1.26 -4.91 116.55 109.66 3hu3 n ASP 107 Ca 0.02 -0.89 -0.43 0.00 -0.50 0.00 0.00 54.79 52.99 3hu3 n ASP 107 Cb 0.51 -0.02 -0.02 0.00 -1.14 0.00 0.00 41.12 40.45 3hu3 n ASP 107 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3hu3 s VAL 108 N -2.04 3.85 0.22 2.12 0.11 -1.26 -5.01 120.40 118.39 3hu3 s VAL 108 Ca 0.44 0.96 -0.09 0.00 -2.93 0.00 0.00 61.98 60.36 3hu3 s VAL 108 Cb 0.21 -3.86 -0.07 0.00 -1.53 0.00 0.00 36.38 31.13 3hu3 s VAL 108 CO 0.35 -0.35 0.52 -0.54 -3.33 0.00 0.00 175.10 171.76 3hu3 s LYS 109 N 4.48 3.77 0.39 1.54 -0.14 -1.26 -4.78 119.74 123.74 3hu3 s LYS 109 Ca 0.66 0.21 -0.27 0.00 -1.36 0.00 0.00 55.97 55.22 3hu3 s LYS 109 Cb -0.22 -2.68 -0.11 0.00 -1.68 0.00 0.00 37.83 33.14 3hu3 s LYS 109 CO 0.27 0.34 1.28 0.66 -0.76 0.00 0.00 175.35 177.14 3hu3 n TYR 110 N -0.12 2.21 -2.53 3.18 4.01 -1.26 -1.55 117.16 121.11 3hu3 n TYR 110 Ca 0.00 0.52 -0.39 0.00 -0.16 0.00 0.00 57.90 57.87 3hu3 n TYR 110 Cb 0.52 -2.40 -0.04 0.00 -0.31 0.00 0.00 39.34 37.11 3hu3 n TYR 110 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3hu3 s GLY 111 N -0.43 2.96 -0.10 2.72 0.00 0.21 -4.66 107.32 108.02 3hu3 s GLY 111 Ca 0.58 0.80 -0.03 0.00 0.00 0.00 0.00 44.72 46.07 3hu3 s GLY 111 CO 0.60 1.34 -0.06 0.50 0.00 0.00 0.00 173.10 175.48 3hu3 h LYS 112 N 3.38 0.00 -3.66 2.90 1.57 -0.85 -3.36 116.57 116.55 3hu3 h LYS 112 Ca -0.47 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.17 3hu3 h LYS 112 Cb 1.21 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.33 3hu3 h LYS 112 CO 0.65 0.00 -0.51 -0.98 -0.57 0.00 0.00 179.45 178.05 3hu3 s ARG 113 N -1.70 0.54 0.11 3.15 1.70 -1.20 -1.16 118.95 120.40 3hu3 s ARG 113 Ca -0.05 -0.58 0.05 0.00 -0.47 0.00 0.00 55.73 54.68 3hu3 s ARG 113 Cb 0.01 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.57 3hu3 s ARG 113 CO 0.08 -0.13 -0.12 0.96 -1.08 0.00 0.00 175.30 175.00 3hu3 s ILE 114 N -2.01 1.16 -0.24 4.99 -4.36 -0.04 -1.16 121.20 119.54 3hu3 s ILE 114 Ca -0.10 -1.65 0.00 0.00 -0.26 0.00 0.00 60.65 58.65 3hu3 s ILE 114 Cb -0.04 -1.42 0.06 0.00 1.25 0.00 0.00 42.46 42.31 3hu3 s ILE 114 CO -0.02 -0.45 -0.03 -2.28 0.24 0.00 0.00 174.94 172.40 3hu3 s HIS 115 N -2.18 2.31 0.14 1.37 2.46 0.11 -1.00 115.29 118.50 3hu3 s HIS 115 Ca 0.07 -1.74 0.09 0.00 0.47 0.00 0.00 55.06 53.94 3hu3 s HIS 115 Cb -0.05 -1.61 -0.04 0.00 -0.13 0.00 0.00 32.58 30.76 3hu3 s HIS 115 CO 0.02 -0.78 -0.14 0.14 -2.47 0.00 0.00 174.74 171.51 3hu3 s VAL 116 N 1.42 3.04 0.01 0.89 -7.23 0.82 0.13 120.40 119.48 3hu3 s VAL 116 Ca -0.04 -1.53 0.03 0.00 -1.81 0.00 0.00 61.98 58.64 3hu3 s VAL 116 Cb -0.19 -2.44 -0.01 0.00 0.56 0.00 0.00 36.38 34.30 3hu3 s VAL 116 CO -0.08 0.02 -0.11 -0.76 -0.31 0.00 0.00 175.10 173.87 3hu3 s LEU 117 N -2.40 2.09 0.40 1.32 1.43 0.49 -3.94 118.68 118.06 3hu3 s LEU 117 Ca 0.21 -0.29 -0.25 0.00 -1.03 0.00 0.00 54.13 52.77 3hu3 s LEU 117 Cb -0.10 -0.49 -0.09 0.00 0.03 0.00 0.00 46.19 45.54 3hu3 s LEU 117 CO 0.12 0.06 1.10 -2.16 0.23 0.00 0.00 176.35 175.70 3hu3 s PRO 118 N -0.63 4.12 -0.12 1.29 0.04 -1.26 -0.37 135.00 138.07 3hu3 s PRO 118 Ca 0.02 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.40 3hu3 s PRO 118 Cb -0.06 -2.60 -0.01 0.00 0.04 0.00 0.00 34.50 31.87 3hu3 s PRO 118 CO 0.00 -0.21 1.10 0.42 0.04 0.00 0.00 177.00 178.35 3hu3 s ILE 119 N -1.55 4.54 0.54 0.56 -1.09 0.54 -1.20 121.20 123.54 3hu3 s ILE 119 Ca 0.57 1.84 0.44 0.00 -2.23 0.00 0.00 60.65 61.27 3hu3 s ILE 119 Cb -0.26 -4.18 0.65 0.00 -1.58 0.00 0.00 42.46 37.09 3hu3 s ILE 119 CO 0.32 -0.05 1.67 -2.24 -1.23 0.00 0.00 174.94 173.41 3hu3 h ASP 120 N 7.41 0.02 -0.29 3.58 2.03 -0.31 0.13 116.42 128.99 3hu3 h ASP 120 Ca -0.29 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 3hu3 h ASP 120 Cb 1.13 0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.64 3hu3 h ASP 120 CO 0.90 -0.01 0.00 -0.90 -1.03 0.00 0.00 179.24 178.20 3hu3 n ASP 121 N -4.08 2.39 -0.18 4.15 5.68 -1.26 -3.66 116.55 119.58 3hu3 n ASP 121 Ca 0.36 -1.86 0.06 0.00 -0.50 0.00 0.00 54.79 52.86 3hu3 n ASP 121 Cb 1.67 -0.19 -0.03 0.00 -1.14 0.00 0.00 41.12 41.43 3hu3 n ASP 121 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3hu3 n THR 122 N 0.80 0.00 -0.18 2.12 -2.24 0.03 -4.55 114.28 110.25 3hu3 n THR 122 Ca 0.17 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 3hu3 n THR 122 Cb 0.43 1.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.75 3hu3 n THR 122 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 3hu3 n VAL 123 N -0.64 0.77 -1.80 2.28 0.24 -1.24 -4.65 118.33 113.30 3hu3 n VAL 123 Ca 0.04 -0.79 -0.42 0.00 -2.04 0.00 0.00 64.34 61.13 3hu3 n VAL 123 Cb 0.25 0.62 -0.03 0.00 -1.47 0.00 0.00 33.84 33.21 3hu3 n VAL 123 CO 0.00 0.00 0.00 -1.83 -2.14 0.00 0.00 176.83 172.86 3hu3 s GLU 124 N -0.77 4.16 0.00 7.34 -1.05 -1.24 -2.02 118.70 125.11 3hu3 s GLU 124 Ca 0.00 2.46 0.00 0.00 -0.15 0.00 0.00 54.97 57.28 3hu3 s GLU 124 Cb 0.00 -4.04 0.00 0.00 -0.44 0.00 0.00 34.13 29.65 3hu3 s GLU 124 CO 0.00 -0.90 0.00 0.41 0.95 0.00 0.00 175.26 175.72 3hu3 n GLY 125 N 4.36 1.02 1.89 -3.83 0.00 -1.26 -4.94 105.19 102.43 3hu3 n GLY 125 Ca 0.19 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 3hu3 n GLY 125 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3hu3 n ILE 126 N -0.92 0.00 -3.75 -0.61 5.41 -0.86 -4.91 119.36 113.72 3hu3 n ILE 126 Ca 0.00 0.00 -0.26 0.00 1.00 0.00 0.00 62.75 63.49 3hu3 n ILE 126 Cb 0.17 -0.27 -0.17 0.00 -0.71 0.00 0.00 39.64 38.65 3hu3 n ILE 126 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 3hu3 s THR 127 N 4.66 0.45 0.00 1.39 -4.23 -1.26 -5.06 115.64 111.59 3hu3 s THR 127 Ca 0.73 -0.24 0.00 0.00 -1.18 0.00 0.00 61.69 61.00 3hu3 s THR 127 Cb -0.71 -0.80 0.00 0.00 1.34 0.00 0.00 72.50 72.33 3hu3 s THR 127 CO 0.28 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.98 3hu3 n GLY 128 N 5.10 2.09 3.70 3.99 0.00 -1.26 -4.99 105.19 113.83 3hu3 n GLY 128 Ca -0.08 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 3hu3 n GLY 128 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hu3 s ASN 129 N 0.00 6.48 0.21 1.61 3.84 -1.26 -4.92 114.94 120.90 3hu3 s ASN 129 Ca 0.00 2.71 -0.04 0.00 0.21 0.00 0.00 52.86 55.74 3hu3 s ASN 129 Cb 0.00 -2.58 0.16 0.00 -0.55 0.00 0.00 41.25 38.28 3hu3 s ASN 129 CO 0.00 -0.94 1.60 -0.07 -2.79 0.00 0.00 177.10 174.90 3hu3 h LEU 130 N 7.69 0.77 0.00 3.21 3.38 -1.97 -1.81 115.31 126.58 3hu3 h LEU 130 Ca -0.44 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.23 3hu3 h LEU 130 Cb 1.21 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3hu3 h LEU 130 CO 0.94 1.01 -0.00 0.15 0.09 0.00 0.00 178.44 180.63 3hu3 h PHE 131 N 0.63 -0.00 -0.17 1.13 3.57 -1.96 -2.10 116.94 118.04 3hu3 h PHE 131 Ca 0.07 -0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.42 3hu3 h PHE 131 Cb 0.81 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.56 3hu3 h PHE 131 CO 0.04 0.24 -0.49 0.93 -2.23 0.00 0.00 178.31 176.81 3hu3 h GLU 132 N -0.25 0.63 0.02 1.11 4.39 -1.95 0.29 114.58 118.81 3hu3 h GLU 132 Ca -0.00 -0.45 -0.25 0.00 0.34 0.00 0.00 59.36 59.00 3hu3 h GLU 132 Cb 0.25 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.94 3hu3 h GLU 132 CO 0.00 1.07 -1.28 0.28 -1.16 0.00 0.00 179.01 177.92 3hu3 h VAL 133 N 0.30 1.39 0.00 3.13 2.07 -1.44 -3.40 116.25 118.30 3hu3 h VAL 133 Ca -0.01 -3.12 0.00 0.00 0.82 0.00 0.00 66.70 64.38 3hu3 h VAL 133 Cb 1.11 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 33.60 3hu3 h VAL 133 CO 0.11 0.81 -0.27 -1.22 0.02 0.00 0.00 177.57 177.02 3hu3 n TYR 134 N -3.29 0.00 -0.04 1.57 4.02 -0.82 -4.48 117.16 114.12 3hu3 n TYR 134 Ca -0.07 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.68 3hu3 n TYR 134 Cb 0.99 -0.14 -0.09 0.00 -0.02 0.00 0.00 39.34 40.09 3hu3 n TYR 134 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 3hu3 h LEU 135 N -0.27 0.35 0.07 7.72 3.38 -1.23 -2.31 115.31 123.03 3hu3 h LEU 135 Ca 0.00 -0.59 0.02 0.00 0.09 0.00 0.00 57.88 57.40 3hu3 h LEU 135 Cb 0.27 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 3hu3 h LEU 135 CO 0.00 0.88 -0.27 0.50 0.09 0.00 0.00 178.44 179.64 3hu3 h LYS 136 N -0.16 -0.43 -0.18 1.13 3.64 -0.68 -0.27 116.57 119.62 3hu3 h LYS 136 Ca -0.00 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3hu3 h LYS 136 Cb 0.83 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 3hu3 h LYS 136 CO 0.05 -0.29 0.05 -1.35 -2.27 0.00 0.00 179.45 175.64 3hu3 h PRO 137 N -0.45 0.24 -0.09 1.90 0.11 -1.76 0.52 132.00 132.48 3hu3 h PRO 137 Ca 0.04 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.10 3hu3 h PRO 137 Cb 0.50 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.56 3hu3 h PRO 137 CO -0.19 0.23 -0.05 -0.92 -0.21 0.00 0.00 178.00 176.87 3hu3 h TYR 138 N 0.25 0.21 0.00 0.65 3.20 -0.85 -3.29 116.97 117.14 3hu3 h TYR 138 Ca 0.06 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3hu3 h TYR 138 Cb 0.10 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.32 3hu3 h TYR 138 CO 0.00 0.55 -0.40 1.19 -1.64 0.00 0.00 178.16 177.87 3hu3 n PHE 139 N -4.74 0.51 -1.47 -3.82 3.72 -0.16 -4.83 117.46 106.66 3hu3 n PHE 139 Ca -0.07 0.15 -0.51 0.00 -0.05 0.00 0.00 57.45 56.97 3hu3 n PHE 139 Cb 0.27 -0.65 -0.07 0.00 -0.94 0.00 0.00 39.48 38.09 3hu3 n PHE 139 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3hu3 n LEU 140 N -2.00 2.21 -0.17 4.37 7.94 0.17 -2.17 117.00 127.35 3hu3 n LEU 140 Ca 0.04 0.49 -0.02 0.00 -1.11 0.00 0.00 56.01 55.41 3hu3 n LEU 140 Cb 0.41 -1.26 -0.01 0.00 0.53 0.00 0.00 43.42 43.10 3hu3 n LEU 140 CO 0.34 -0.68 -0.02 -0.62 -1.11 0.00 0.00 177.39 175.30 3hu3 n GLU 141 N 7.93 -1.94 0.14 1.96 -0.58 -1.26 -4.81 120.64 122.08 3hu3 n GLU 141 Ca 0.39 0.53 0.12 0.00 -0.42 0.00 0.00 57.16 57.78 3hu3 n GLU 141 Cb 0.22 -4.85 0.06 0.00 -0.57 0.00 0.00 31.44 26.30 3hu3 n GLU 141 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hu3 h ALA 142 N 0.02 0.67 -6.32 0.62 0.00 -1.74 -3.48 119.26 109.02 3hu3 h ALA 142 Ca -0.04 -0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.40 3hu3 h ALA 142 Cb 0.94 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 3hu3 h ALA 142 CO 0.06 0.00 -0.86 0.66 0.00 0.00 0.00 179.25 179.12 3hu3 n TYR 143 N -2.82 -1.79 -2.29 0.00 4.02 -1.25 -4.91 117.16 108.13 3hu3 n TYR 143 Ca 0.01 0.79 -0.42 0.00 -0.01 0.00 0.00 57.90 58.28 3hu3 n TYR 143 Cb 0.54 -4.00 -0.03 0.00 -0.02 0.00 0.00 39.34 35.83 3hu3 n TYR 143 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 3hu3 s ARG 144 N -6.33 4.39 0.21 -0.72 0.52 -1.25 -4.63 118.95 111.14 3hu3 s ARG 144 Ca 0.05 1.95 -0.30 0.00 -0.52 0.00 0.00 55.73 56.91 3hu3 s ARG 144 Cb -0.03 -3.27 -0.08 0.00 0.52 0.00 0.00 34.95 32.10 3hu3 s ARG 144 CO 0.86 -0.29 1.12 -1.25 0.02 0.00 0.00 175.30 175.75 3hu3 s PRO 145 N 0.65 4.59 0.05 3.54 0.04 -1.26 -0.04 135.00 142.57 3hu3 s PRO 145 Ca 0.60 1.77 0.00 0.00 0.04 0.00 0.00 61.00 63.41 3hu3 s PRO 145 Cb -0.34 -3.24 -0.03 0.00 0.04 0.00 0.00 34.50 30.93 3hu3 s PRO 145 CO 0.32 0.09 -0.04 0.96 0.04 0.00 0.00 177.00 178.37 3hu3 s ILE 146 N -0.51 0.31 0.01 0.56 -4.36 -0.43 -4.85 121.20 111.93 3hu3 s ILE 146 Ca 0.48 -1.41 0.05 0.00 -0.26 0.00 0.00 60.65 59.51 3hu3 s ILE 146 Cb -0.31 -0.97 -0.02 0.00 1.25 0.00 0.00 42.46 42.42 3hu3 s ILE 146 CO 0.37 -0.71 -0.14 -0.60 0.24 0.00 0.00 174.94 174.10 3hu3 s ARG 147 N -2.69 1.07 0.15 0.37 3.52 -1.26 -2.23 118.95 117.87 3hu3 s ARG 147 Ca -0.03 -0.62 -0.34 0.00 -0.13 0.00 0.00 55.73 54.61 3hu3 s ARG 147 Cb -0.01 -1.06 -0.15 0.00 -1.56 0.00 0.00 34.95 32.16 3hu3 s ARG 147 CO -0.04 0.28 1.35 1.17 -0.81 0.00 0.00 175.30 177.25 3hu3 n LYS 148 N 2.37 1.48 -0.10 5.12 4.81 0.84 -1.37 118.16 131.32 3hu3 n LYS 148 Ca -0.16 0.53 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 3hu3 n LYS 148 Cb 0.55 -2.16 0.00 0.00 0.02 0.00 0.00 35.03 33.43 3hu3 n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hu3 n GLY 149 N 2.52 0.94 3.75 3.14 0.00 0.12 -5.02 105.19 110.64 3hu3 n GLY 149 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3hu3 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu3 s ASP 150 N -2.78 6.65 -0.10 1.61 1.01 -0.47 -4.81 116.67 117.78 3hu3 s ASP 150 Ca 0.00 2.70 -0.02 0.00 0.71 0.00 0.00 52.55 55.94 3hu3 s ASP 150 Cb 0.00 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 3hu3 s ASP 150 CO 0.00 -0.68 -0.04 -0.63 0.21 0.00 0.00 175.17 174.03 3hu3 s ILE 151 N -0.28 3.95 -0.06 0.77 -1.09 -1.26 -0.91 121.20 122.32 3hu3 s ILE 151 Ca 0.57 -0.37 -0.11 0.00 -2.23 0.00 0.00 60.65 58.51 3hu3 s ILE 151 Cb -0.42 -2.67 0.02 0.00 -1.58 0.00 0.00 42.46 37.82 3hu3 s ILE 151 CO 0.46 0.56 0.27 0.72 -1.23 0.00 0.00 174.94 175.73 3hu3 s PHE 152 N -0.41 -0.21 -0.05 3.97 -0.71 -0.19 -4.87 117.98 115.51 3hu3 s PHE 152 Ca 0.07 0.46 -0.04 0.00 -1.04 0.00 0.00 56.93 56.38 3hu3 s PHE 152 Cb -0.12 0.08 -0.04 0.00 -1.21 0.00 0.00 43.02 41.73 3hu3 s PHE 152 CO 0.02 -0.25 0.15 -1.17 -1.34 0.00 0.00 175.22 172.62 3hu3 s LEU 153 N -0.59 4.28 -0.01 -1.99 2.96 -1.26 -0.70 118.68 121.37 3hu3 s LEU 153 Ca -0.07 0.36 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 3hu3 s LEU 153 Cb -0.04 -2.33 0.01 0.00 0.50 0.00 0.00 46.19 44.33 3hu3 s LEU 153 CO 0.02 0.32 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.65 3hu3 s VAL 154 N -1.18 0.34 -0.12 1.68 1.01 -0.32 -4.98 120.40 116.83 3hu3 s VAL 154 Ca 0.21 -0.12 -0.15 0.00 0.00 0.00 0.00 61.98 61.92 3hu3 s VAL 154 Cb -0.12 -0.33 -0.05 0.00 0.00 0.00 0.00 36.38 35.88 3hu3 s VAL 154 CO 0.12 0.13 0.37 -1.00 0.00 0.00 0.00 175.10 174.72 3hu3 s HIS 155 N 0.28 3.53 -0.06 5.22 3.76 -1.26 -1.08 115.29 125.68 3hu3 s HIS 155 Ca -0.03 0.77 -0.02 0.00 -0.15 0.00 0.00 55.06 55.63 3hu3 s HIS 155 Cb -0.06 -2.39 0.04 0.00 1.11 0.00 0.00 32.58 31.27 3hu3 s HIS 155 CO -0.00 0.30 0.13 0.20 -0.85 0.00 0.00 174.74 174.51 3hu3 s GLY 156 N 0.20 0.03 0.00 -2.22 0.00 0.58 -4.86 107.32 101.04 3hu3 s GLY 156 Ca 0.21 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.48 3hu3 s GLY 156 CO 0.08 1.18 0.00 0.61 0.00 0.00 0.00 173.10 174.97 3hu3 n GLY 157 N 4.62 3.07 2.10 0.20 0.00 -1.26 -2.08 105.19 111.84 3hu3 n GLY 157 Ca -0.18 -0.11 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 3hu3 n GLY 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3hu3 n MET 158 N 14.00 3.16 -4.20 1.61 0.00 -1.26 -4.94 117.12 125.49 3hu3 n MET 158 Ca 0.00 -3.02 -0.12 0.00 0.00 0.00 0.00 57.70 54.56 3hu3 n MET 158 Cb 0.00 -2.20 -0.10 0.00 0.00 0.00 0.00 33.22 30.92 3hu3 n MET 158 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 3hu3 s ARG 159 N -3.08 0.92 -0.04 0.03 3.52 -0.88 -5.15 118.95 114.27 3hu3 s ARG 159 Ca 0.55 -1.39 0.04 0.00 -0.13 0.00 0.00 55.73 54.80 3hu3 s ARG 159 Cb 0.45 -0.28 -0.00 0.00 -1.56 0.00 0.00 34.95 33.56 3hu3 s ARG 159 CO 0.13 -0.03 -0.15 0.00 -0.81 0.00 0.00 175.30 174.44 3hu3 s ALA 160 N -3.59 1.38 -0.02 6.12 0.00 -1.26 -0.31 121.76 124.08 3hu3 s ALA 160 Ca 0.15 -0.60 0.04 0.00 0.00 0.00 0.00 51.96 51.55 3hu3 s ALA 160 Cb 0.05 -0.47 -0.01 0.00 0.00 0.00 0.00 23.12 22.69 3hu3 s ALA 160 CO -0.02 0.24 -0.14 0.08 0.00 0.00 0.00 175.76 175.92 3hu3 s VAL 161 N 0.10 1.14 -0.20 0.00 1.01 -0.24 -4.87 120.40 117.34 3hu3 s VAL 161 Ca -0.04 -0.58 -0.10 0.00 0.00 0.00 0.00 61.98 61.25 3hu3 s VAL 161 Cb -0.11 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.25 3hu3 s VAL 161 CO 0.02 0.33 0.13 -0.70 0.00 0.00 0.00 175.10 174.88 3hu3 s GLU 162 N -0.11 4.18 0.18 2.72 2.12 -1.26 -1.17 118.70 125.36 3hu3 s GLU 162 Ca 0.01 -0.22 0.10 0.00 0.36 0.00 0.00 54.97 55.22 3hu3 s GLU 162 Cb -0.08 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.85 3hu3 s GLU 162 CO 0.00 0.29 -0.17 -0.06 -0.54 0.00 0.00 175.26 174.79 3hu3 s PHE 163 N 0.38 2.48 -0.09 5.30 0.08 0.12 -0.34 117.98 125.90 3hu3 s PHE 163 Ca 0.08 -0.29 0.04 0.00 0.12 0.00 0.00 56.93 56.88 3hu3 s PHE 163 Cb -0.11 -1.23 -0.01 0.00 -0.57 0.00 0.00 43.02 41.10 3hu3 s PHE 163 CO -0.02 0.49 -0.22 0.21 -0.10 0.00 0.00 175.22 175.58 3hu3 s LYS 164 N -2.67 2.92 -0.26 0.44 2.20 0.50 -1.02 119.74 121.85 3hu3 s LYS 164 Ca 0.22 -0.84 -0.29 0.00 -0.36 0.00 0.00 55.97 54.70 3hu3 s LYS 164 Cb -0.09 -2.32 -0.01 0.00 -1.51 0.00 0.00 37.83 33.90 3hu3 s LYS 164 CO 0.12 0.28 1.46 0.08 -0.36 0.00 0.00 175.35 176.93 3hu3 s VAL 165 N 0.12 3.92 -0.19 4.02 1.01 -0.08 -0.38 120.40 128.81 3hu3 s VAL 165 Ca -0.11 1.03 0.07 0.00 0.00 0.00 0.00 61.98 62.98 3hu3 s VAL 165 Cb -0.16 -3.94 -0.22 0.00 0.00 0.00 0.00 36.38 32.07 3hu3 s VAL 165 CO 0.06 -0.39 0.07 0.52 0.00 0.00 0.00 175.10 175.36 3hu3 n VAL 166 N 6.32 1.52 -3.70 2.92 0.31 0.12 -0.70 118.33 125.11 3hu3 n VAL 166 Ca 0.17 -0.71 -0.14 0.00 -0.01 0.00 0.00 64.34 63.65 3hu3 n VAL 166 Cb 0.46 -1.10 -0.08 0.00 -0.91 0.00 0.00 33.84 32.20 3hu3 n VAL 166 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 3hu3 s GLU 167 N -2.53 0.72 0.10 5.55 2.56 -0.87 -4.77 118.70 119.47 3hu3 s GLU 167 Ca -0.21 0.05 0.04 0.00 0.00 0.00 0.00 54.97 54.85 3hu3 s GLU 167 Cb 0.08 0.33 -0.04 0.00 2.00 0.00 0.00 34.13 36.50 3hu3 s GLU 167 CO 0.73 -0.19 -0.11 0.95 -0.56 0.00 0.00 175.26 176.08 3hu3 s THR 168 N -1.01 1.01 -0.20 -1.70 -4.23 -1.26 0.07 115.64 108.33 3hu3 s THR 168 Ca -0.10 -1.69 -0.04 0.00 -1.18 0.00 0.00 61.69 58.67 3hu3 s THR 168 Cb -0.04 -1.43 0.08 0.00 1.34 0.00 0.00 72.50 72.45 3hu3 s THR 168 CO 0.05 -0.56 0.16 -0.62 -0.54 0.00 0.00 174.62 173.11 3hu3 s ASP 169 N -2.52 1.96 0.78 3.99 2.15 -0.31 -3.52 116.67 119.21 3hu3 s ASP 169 Ca 0.07 -0.49 -0.13 0.00 0.43 0.00 0.00 52.55 52.43 3hu3 s ASP 169 Cb -0.03 0.06 0.07 0.00 -0.30 0.00 0.00 42.92 42.72 3hu3 s ASP 169 CO 0.00 -0.35 1.15 -2.84 -0.17 0.00 0.00 175.17 172.97 3hu3 s PRO 170 N 2.23 1.95 -0.01 4.34 0.02 -1.26 -0.12 135.00 142.15 3hu3 s PRO 170 Ca 0.05 1.53 0.05 0.00 0.02 0.00 0.00 61.00 62.66 3hu3 s PRO 170 Cb -0.16 -1.83 -0.03 0.00 0.02 0.00 0.00 34.50 32.50 3hu3 s PRO 170 CO -0.13 -1.93 -0.16 0.45 -0.33 0.00 0.00 177.00 174.90 3hu3 s SER 171 N -2.55 3.93 0.00 2.53 0.15 -1.23 -3.77 113.70 112.76 3hu3 s SER 171 Ca 0.69 -0.30 0.23 0.00 0.70 0.00 0.00 55.95 57.27 3hu3 s SER 171 Cb -0.24 -0.74 0.42 0.00 -1.71 0.00 0.00 66.02 63.75 3hu3 s SER 171 CO 0.50 0.30 1.39 -0.81 1.20 0.00 0.00 173.24 175.83 3hu3 n PRO 172 N 1.95 2.49 -4.05 5.44 -0.04 -1.26 -5.07 135.00 134.46 3hu3 n PRO 172 Ca -0.16 -2.28 -0.08 0.00 -0.04 0.00 0.00 63.50 60.93 3hu3 n PRO 172 Cb 0.52 -1.51 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 3hu3 n PRO 172 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3hu3 s TYR 173 N -1.46 0.42 0.34 0.54 -0.85 -1.25 -0.11 117.35 114.98 3hu3 s TYR 173 Ca 0.38 -0.88 -0.18 0.00 -0.52 0.00 0.00 57.07 55.87 3hu3 s TYR 173 Cb 0.22 -0.31 0.04 0.00 0.38 0.00 0.00 41.96 42.29 3hu3 s TYR 173 CO 0.31 -0.33 0.75 0.00 -1.52 0.00 0.00 175.55 174.77 3hu3 s ILE 175 N -3.06 5.40 -0.93 0.00 -1.09 -0.60 -1.31 121.20 119.60 3hu3 s ILE 175 Ca 0.14 0.33 -0.20 0.00 -2.23 0.00 0.00 60.65 58.69 3hu3 s ILE 175 Cb -0.05 -3.49 0.11 0.00 -1.58 0.00 0.00 42.46 37.45 3hu3 s ILE 175 CO 0.09 0.54 1.19 -0.69 -1.23 0.00 0.00 174.94 174.84 3hu3 s VAL 176 N -0.49 4.52 0.78 2.92 1.01 0.95 0.65 120.40 130.74 3hu3 s VAL 176 Ca 0.15 -1.31 -0.11 0.00 0.00 0.00 0.00 61.98 60.70 3hu3 s VAL 176 Cb -0.12 -4.84 0.07 0.00 0.00 0.00 0.00 36.38 31.49 3hu3 s VAL 176 CO 0.04 -1.60 1.15 0.00 0.00 0.00 0.00 175.10 174.68 3hu3 s ALA 177 N 3.29 2.74 0.53 5.51 0.00 -1.26 -3.78 121.76 128.80 3hu3 s ALA 177 Ca 0.35 -0.64 0.25 0.00 0.00 0.00 0.00 51.96 51.92 3hu3 s ALA 177 Cb -0.04 -2.93 1.41 0.00 0.00 0.00 0.00 23.12 21.56 3hu3 s ALA 177 CO -0.08 -1.57 2.00 -1.35 0.00 0.00 0.00 175.76 174.76 3hu3 h PRO 178 N -0.95 0.00 -0.12 0.00 0.11 -1.95 -2.24 132.00 126.84 3hu3 h PRO 178 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hu3 h PRO 178 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3hu3 h PRO 178 CO 0.65 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.19 3hu3 n ASP 179 N -4.33 1.58 -4.72 -2.05 8.00 -1.26 -4.89 116.55 108.88 3hu3 n ASP 179 Ca 0.09 -1.64 -0.41 0.00 0.71 0.00 0.00 54.79 53.54 3hu3 n ASP 179 Cb 0.59 -0.08 -0.04 0.00 -0.02 0.00 0.00 41.12 41.58 3hu3 n ASP 179 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3hu3 s THR 180 N -1.85 4.93 -0.04 -3.53 2.01 -0.85 -4.90 115.64 111.41 3hu3 s THR 180 Ca 0.34 1.76 -0.28 0.00 0.31 0.00 0.00 61.69 63.82 3hu3 s THR 180 Cb 0.18 -4.18 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 3hu3 s THR 180 CO 0.28 0.22 0.89 -0.69 -0.69 0.00 0.00 174.62 174.63 3hu3 s VAL 181 N 0.81 4.91 -0.31 3.82 1.01 -0.30 -4.91 120.40 125.42 3hu3 s VAL 181 Ca 0.45 1.85 -0.05 0.00 0.00 0.00 0.00 61.98 64.23 3hu3 s VAL 181 Cb -0.20 -4.23 0.03 0.00 0.00 0.00 0.00 36.38 31.99 3hu3 s VAL 181 CO 0.23 0.16 0.07 -0.63 0.00 0.00 0.00 175.10 174.93 3hu3 s ILE 182 N 1.13 3.61 -0.20 2.22 1.01 -1.26 -0.86 121.20 126.86 3hu3 s ILE 182 Ca 0.47 -1.07 -0.12 0.00 0.00 0.00 0.00 60.65 59.92 3hu3 s ILE 182 Cb -0.19 -2.99 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 3hu3 s ILE 182 CO 0.23 -0.08 0.24 -1.00 0.00 0.00 0.00 174.94 174.33 3hu3 s HIS 183 N 1.39 3.40 -0.06 3.97 3.76 -0.17 -4.96 115.29 122.62 3hu3 s HIS 183 Ca -0.01 0.45 0.14 0.00 -0.15 0.00 0.00 55.06 55.49 3hu3 s HIS 183 Cb -0.19 -2.31 0.27 0.00 1.11 0.00 0.00 32.58 31.47 3hu3 s HIS 183 CO 0.01 0.17 1.12 0.00 -0.85 0.00 0.00 174.74 175.20 3hu3 s GLU 185 N -1.02 4.00 0.00 0.00 1.03 -1.26 -4.81 118.70 116.65 3hu3 s GLU 185 Ca 0.24 0.51 0.00 0.00 0.03 0.00 0.00 54.97 55.75 3hu3 s GLU 185 Cb 0.25 -3.06 0.00 0.00 -0.80 0.00 0.00 34.13 30.51 3hu3 s GLU 185 CO -0.07 0.56 0.00 0.41 -1.33 0.00 0.00 175.26 174.83 3hu3 n GLY 186 N 1.21 0.96 3.71 -3.83 0.00 -1.26 -5.00 105.19 100.98 3hu3 n GLY 186 Ca -0.08 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 3hu3 n GLY 186 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hu3 s GLU 187 N -1.10 4.48 0.46 1.61 2.56 -1.26 -4.99 118.70 120.46 3hu3 s GLU 187 Ca 0.00 1.61 -0.24 0.00 0.00 0.00 0.00 54.97 56.34 3hu3 s GLU 187 Cb 0.00 -3.41 -0.09 0.00 2.00 0.00 0.00 34.13 32.64 3hu3 s GLU 187 CO 0.00 -0.18 1.22 -2.30 -0.56 0.00 0.00 175.26 173.44 3hu3 n PRO 188 N 3.99 1.72 -2.21 4.30 -0.02 -1.26 -4.92 135.00 136.60 3hu3 n PRO 188 Ca 0.08 0.62 -0.41 0.00 -2.02 0.00 0.00 63.50 61.77 3hu3 n PRO 188 Cb 0.48 -2.35 -0.03 0.00 -0.02 0.00 0.00 33.50 31.59 3hu3 n PRO 188 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3hu3 s ILE 189 N -1.25 3.05 0.20 4.25 1.01 -0.34 -4.64 121.20 123.48 3hu3 s ILE 189 Ca 0.64 0.95 -0.30 0.00 0.00 0.00 0.00 60.65 61.95 3hu3 s ILE 189 Cb -0.49 -3.61 -0.08 0.00 0.01 0.00 0.00 42.46 38.29 3hu3 s ILE 189 CO 0.55 0.18 1.13 -0.54 0.00 0.00 0.00 174.94 176.26 3hu3 s LYS 190 N -0.88 4.58 0.28 2.79 1.02 -1.26 0.41 119.74 126.68 3hu3 s LYS 190 Ca 0.52 1.78 -0.02 0.00 0.02 0.00 0.00 55.97 58.28 3hu3 s LYS 190 Cb -0.37 -3.25 0.43 0.00 -0.52 0.00 0.00 37.83 34.12 3hu3 s LYS 190 CO 0.44 0.06 1.91 -0.09 -0.92 0.00 0.00 175.35 176.75 3hu3 h ARG 191 N 4.84 1.12 -0.81 1.68 9.65 -1.94 -2.64 114.38 126.28 3hu3 h ARG 191 Ca -0.45 -0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.35 3hu3 h ARG 191 Cb 1.21 -0.25 -0.04 0.00 -1.39 0.00 0.00 29.97 29.50 3hu3 h ARG 191 CO 0.72 0.74 0.45 0.93 2.80 0.00 0.00 179.97 185.61 3hu3 h GLU 192 N 1.15 1.11 -0.14 0.20 5.08 -1.98 0.36 114.58 120.37 3hu3 h GLU 192 Ca 0.40 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.64 3hu3 h GLU 192 Cb 0.11 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3hu3 h GLU 192 CO -0.14 0.81 0.07 -0.44 -1.00 0.00 0.00 179.01 178.30 3hu3 h ASP 193 N 1.12 0.19 0.74 1.42 3.32 -1.88 -1.20 116.42 120.14 3hu3 h ASP 193 Ca 0.29 -0.14 -0.15 0.00 0.02 0.00 0.00 57.03 57.05 3hu3 h ASP 193 Cb 0.01 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 3hu3 h ASP 193 CO -0.05 0.27 -0.72 -0.08 -1.72 0.00 0.00 179.24 176.95 3hu3 h GLU 194 N 0.10 0.00 -0.26 3.56 4.57 -1.21 -1.79 114.58 119.54 3hu3 h GLU 194 Ca 0.05 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.11 3hu3 h GLU 194 Cb 0.14 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 3hu3 h GLU 194 CO -0.01 0.72 -0.33 0.93 -1.18 0.00 0.00 179.01 179.15 3hu3 h GLU 195 N 0.00 0.55 -0.54 1.92 4.39 -0.26 0.18 114.58 120.82 3hu3 h GLU 195 Ca -0.01 -0.24 -0.07 0.00 0.34 0.00 0.00 59.36 59.38 3hu3 h GLU 195 Cb 1.29 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.90 3hu3 h GLU 195 CO 0.09 0.81 0.07 1.49 -1.16 0.00 0.00 179.01 180.31 3hu3 h GLU 196 N 0.47 0.87 -0.30 2.33 4.81 -0.93 -2.35 114.58 119.48 3hu3 h GLU 196 Ca 0.05 -0.21 -0.08 0.00 -0.13 0.00 0.00 59.36 58.99 3hu3 h GLU 196 Cb 0.79 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 3hu3 h GLU 196 CO 0.06 0.82 -0.13 1.03 -0.73 0.00 0.00 179.01 180.06 3hu3 h SER 197 N 0.82 0.63 -0.56 1.04 0.87 -0.97 -3.00 113.55 112.38 3hu3 h SER 197 Ca 0.17 -0.40 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 3hu3 h SER 197 Cb 0.39 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 3hu3 h SER 197 CO 0.01 0.89 0.37 0.25 -0.53 0.00 0.00 176.83 177.82 3hu3 h LEU 198 N 0.37 0.65 -3.74 2.23 6.46 -0.42 -1.78 115.31 119.08 3hu3 h LEU 198 Ca 0.07 -0.02 -0.48 0.00 -0.12 0.00 0.00 57.88 57.33 3hu3 h LEU 198 Cb 0.65 -0.16 -0.27 0.00 -0.73 0.00 0.00 40.66 40.14 3hu3 h LEU 198 CO 0.04 0.48 0.13 0.59 -0.62 0.00 0.00 178.44 179.07 3hu3 n ASN 199 N -4.44 4.89 -4.69 1.25 3.02 -0.90 -5.01 115.26 109.37 3hu3 n ASN 199 Ca 0.05 -3.76 -0.39 0.00 -0.03 0.00 0.00 54.58 50.46 3hu3 n ASN 199 Cb 0.05 -0.70 0.04 0.00 -0.61 0.00 0.00 39.78 38.57 3hu3 n ASN 199 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hu3 n GLU 200 N -0.96 1.42 -2.02 3.52 1.02 -0.67 -4.91 120.64 118.04 3hu3 n GLU 200 Ca 0.49 0.53 -0.42 0.00 -0.02 0.00 0.00 57.16 57.74 3hu3 n GLU 200 Cb 0.99 -2.39 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 3hu3 n GLU 200 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3hu3 s VAL 201 N -1.35 3.09 0.54 2.62 1.01 -1.26 -5.04 120.40 120.01 3hu3 s VAL 201 Ca 0.72 0.65 0.02 0.00 0.00 0.00 0.00 61.98 63.37 3hu3 s VAL 201 Cb -0.44 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 32.54 3hu3 s VAL 201 CO 0.49 0.02 0.17 -0.83 0.00 0.00 0.00 175.10 174.96 3hu3 s GLY 202 N 1.78 2.81 0.54 4.51 0.00 -1.26 -4.02 107.32 111.68 3hu3 s GLY 202 Ca 0.70 -0.54 0.30 0.00 0.00 0.00 0.00 44.72 45.18 3hu3 s GLY 202 CO 0.31 -2.11 1.91 -0.97 0.00 0.00 0.00 173.10 172.24 3hu3 h TYR 203 N 1.04 0.00 0.00 1.90 0.05 -1.97 -0.11 116.97 117.89 3hu3 h TYR 203 Ca -0.41 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.37 3hu3 h TYR 203 Cb 1.32 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.06 3hu3 h TYR 203 CO 1.39 0.00 0.00 -0.44 -1.05 0.00 0.00 178.16 178.06 3hu3 h ASP 204 N 0.00 0.00 -0.16 3.88 3.32 -2.00 -2.70 116.42 118.77 3hu3 h ASP 204 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3hu3 h ASP 204 Cb 1.57 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.12 3hu3 h ASP 204 CO -0.00 0.00 0.00 0.47 -1.72 0.00 0.00 179.24 177.99 3hu3 n ASP 205 N -3.06 1.04 -4.16 6.45 8.00 -0.05 -4.74 116.55 120.03 3hu3 n ASP 205 Ca 0.00 -1.83 -0.35 0.00 0.71 0.00 0.00 54.79 53.33 3hu3 n ASP 205 Cb 0.28 -0.11 -0.14 0.00 -0.02 0.00 0.00 41.12 41.13 3hu3 n ASP 205 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3hu3 s ILE 206 N -1.79 2.89 0.13 0.53 1.01 -1.02 -4.99 121.20 117.96 3hu3 s ILE 206 Ca 0.20 -1.38 0.02 0.00 0.00 0.00 0.00 60.65 59.49 3hu3 s ILE 206 Cb 0.11 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 39.89 3hu3 s ILE 206 CO 0.15 -0.07 0.26 -0.83 0.00 0.00 0.00 174.94 174.45 3hu3 s GLY 207 N 1.24 1.80 -1.22 6.18 0.00 -1.26 -4.59 107.32 109.47 3hu3 s GLY 207 Ca -0.05 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 43.67 3hu3 s GLY 207 CO -0.02 -1.00 0.00 0.61 0.00 0.00 0.00 173.10 172.69 3hu3 n GLY 208 N -0.37 1.25 1.46 0.20 0.00 -1.25 -4.83 105.19 101.65 3hu3 n GLY 208 Ca -0.07 -0.41 0.02 0.00 0.00 0.00 0.00 46.02 45.56 3hu3 n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu3 h ARG 210 N 1.26 0.39 -0.64 0.00 2.43 -1.89 -1.52 114.38 114.41 3hu3 h ARG 210 Ca -0.13 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.02 3hu3 h ARG 210 Cb 1.57 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 31.00 3hu3 h ARG 210 CO 0.12 0.26 0.39 0.87 -1.51 0.00 0.00 179.97 180.10 3hu3 h LYS 211 N 0.40 0.85 0.03 0.20 1.57 -2.00 -2.65 116.57 114.97 3hu3 h LYS 211 Ca 0.17 -0.07 -0.27 0.00 -1.87 0.00 0.00 60.65 58.62 3hu3 h LYS 211 Cb 0.09 -0.18 0.02 0.00 0.08 0.00 0.00 32.23 32.24 3hu3 h LYS 211 CO -0.13 0.59 -1.08 1.96 -0.57 0.00 0.00 179.45 180.22 3hu3 h GLN 212 N 0.87 0.66 -0.17 3.15 7.50 -1.81 -2.09 115.11 123.22 3hu3 h GLN 212 Ca 0.23 -0.74 -0.04 0.00 0.50 0.00 0.00 58.65 58.60 3hu3 h GLN 212 Cb -0.05 0.22 -0.01 0.00 0.05 0.00 0.00 27.48 27.69 3hu3 h GLN 212 CO -0.05 1.32 -0.07 -0.07 -1.50 0.00 0.00 178.83 178.47 3hu3 h LEU 213 N 0.35 0.23 -0.21 1.46 3.38 -1.12 0.12 115.31 119.53 3hu3 h LEU 213 Ca -0.14 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 3hu3 h LEU 213 Cb 1.74 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.43 3hu3 h LEU 213 CO 0.21 0.34 -0.43 0.00 0.09 0.00 0.00 178.44 178.65 3hu3 h ALA 214 N 1.69 0.33 -0.99 1.53 0.00 -1.46 -0.10 119.26 120.26 3hu3 h ALA 214 Ca 0.05 -0.46 0.12 0.00 0.00 0.00 0.00 54.91 54.62 3hu3 h ALA 214 Cb 0.28 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 3hu3 h ALA 214 CO 0.01 0.45 0.62 1.96 0.00 0.00 0.00 179.25 182.30 3hu3 h GLN 215 N 0.34 0.94 -0.20 0.00 4.20 -0.59 -1.52 115.11 118.28 3hu3 h GLN 215 Ca 0.00 -0.06 -0.14 0.00 0.06 0.00 0.00 58.65 58.52 3hu3 h GLN 215 Cb 1.03 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.60 3hu3 h GLN 215 CO 0.09 0.62 -0.42 0.82 -0.67 0.00 0.00 178.83 179.28 3hu3 h ILE 216 N 0.97 1.32 -0.59 2.54 2.04 -0.49 -1.53 117.51 121.77 3hu3 h ILE 216 Ca 0.48 -1.64 -0.05 0.00 1.00 0.00 0.00 64.86 64.65 3hu3 h ILE 216 Cb 0.49 1.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.40 3hu3 h ILE 216 CO -0.25 0.51 0.17 0.11 0.00 0.00 0.00 178.15 178.70 3hu3 h LYS 217 N 0.33 0.90 -0.04 2.37 1.57 -0.84 0.67 116.57 121.54 3hu3 h LYS 217 Ca 0.01 -0.18 -0.17 0.00 -1.87 0.00 0.00 60.65 58.44 3hu3 h LYS 217 Cb 1.02 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 3hu3 h LYS 217 CO 0.09 0.79 -0.73 1.05 -0.57 0.00 0.00 179.45 180.08 3hu3 h GLU 218 N 0.87 0.24 0.00 3.15 4.11 -1.14 0.16 114.58 121.97 3hu3 h GLU 218 Ca 0.20 -0.20 -0.03 0.00 0.07 0.00 0.00 59.36 59.39 3hu3 h GLU 218 Cb 0.27 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3hu3 h GLU 218 CO -0.01 0.87 -1.59 -1.33 0.07 0.00 0.00 179.01 177.02 3hu3 n MET 219 N -3.78 0.64 0.02 1.06 2.81 -0.59 -4.36 117.12 112.93 3hu3 n MET 219 Ca -0.03 -0.04 -0.01 0.00 -1.81 0.00 0.00 57.70 55.81 3hu3 n MET 219 Cb 0.70 -1.66 -0.00 0.00 -0.71 0.00 0.00 33.22 31.55 3hu3 n MET 219 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3hu3 n VAL 220 N -2.49 1.20 -0.05 2.03 0.31 0.22 -4.73 118.33 114.83 3hu3 n VAL 220 Ca -0.04 0.34 -0.15 0.00 -0.01 0.00 0.00 64.34 64.48 3hu3 n VAL 220 Cb 0.61 -1.68 -0.07 0.00 -0.91 0.00 0.00 33.84 31.78 3hu3 n VAL 220 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hu3 h GLU 221 N -0.17 0.54 -0.25 5.55 4.57 -1.45 -3.14 114.58 120.23 3hu3 h GLU 221 Ca 0.00 -0.38 -0.01 0.00 -1.18 0.00 0.00 59.36 57.79 3hu3 h GLU 221 Cb 0.17 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 3hu3 h GLU 221 CO 0.00 1.00 0.13 1.25 -1.18 0.00 0.00 179.01 180.20 3hu3 h LEU 222 N 0.18 0.32 -1.84 1.64 5.85 -0.91 -0.94 115.31 119.60 3hu3 h LEU 222 Ca -0.01 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 3hu3 h LEU 222 Cb 1.02 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 3hu3 h LEU 222 CO 0.09 0.34 -0.12 1.55 -0.34 0.00 0.00 178.44 179.96 3hu3 h PRO 223 N 0.28 0.00 0.07 5.25 0.13 -1.76 0.44 132.00 136.41 3hu3 h PRO 223 Ca 0.09 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.95 3hu3 h PRO 223 Cb 0.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.21 3hu3 h PRO 223 CO -0.01 0.12 -1.27 -0.07 -0.23 0.00 0.00 178.00 176.53 3hu3 h LEU 224 N 0.00 0.24 0.00 1.56 3.38 -1.39 -3.13 115.31 115.96 3hu3 h LEU 224 Ca -0.00 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 3hu3 h LEU 224 Cb 0.39 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3hu3 h LEU 224 CO 0.01 1.23 -0.09 -0.09 0.09 0.00 0.00 178.44 179.59 3hu3 h ARG 225 N 0.04 0.00 -2.21 1.13 2.43 -1.02 -3.42 114.38 111.34 3hu3 h ARG 225 Ca -0.13 0.00 -0.60 0.00 -0.81 0.00 0.00 59.98 58.44 3hu3 h ARG 225 Cb 1.92 0.00 -0.42 0.00 -0.42 0.00 0.00 29.97 31.05 3hu3 h ARG 225 CO 0.16 0.89 -0.60 0.72 -1.51 0.00 0.00 179.97 179.63 3hu3 n HIS 226 N -4.62 3.71 0.30 2.20 8.25 0.13 -4.89 115.22 120.30 3hu3 n HIS 226 Ca -0.10 -4.13 0.18 0.00 -0.26 0.00 0.00 57.72 53.41 3hu3 n HIS 226 Cb 0.44 -0.55 0.90 0.00 1.12 0.00 0.00 29.99 31.91 3hu3 n HIS 226 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3hu3 h PRO 227 N 3.96 0.00 -0.41 -0.41 0.13 -1.74 -2.53 132.00 131.00 3hu3 h PRO 227 Ca 0.19 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.28 3hu3 h PRO 227 Cb 0.63 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.74 3hu3 h PRO 227 CO 0.83 0.03 0.11 0.00 -0.23 0.00 0.00 178.00 178.75 3hu3 h ALA 228 N 1.97 1.44 -0.48 -0.56 0.00 -1.90 -1.29 119.26 118.44 3hu3 h ALA 228 Ca -0.00 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.81 3hu3 h ALA 228 Cb 0.28 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3hu3 h ALA 228 CO 0.00 0.41 0.22 1.25 0.00 0.00 0.00 179.25 181.14 3hu3 h LEU 229 N 0.59 0.30 -0.04 0.00 5.85 -1.85 0.19 115.31 120.34 3hu3 h LEU 229 Ca 0.14 0.03 -0.26 0.00 0.84 0.00 0.00 57.88 58.63 3hu3 h LEU 229 Cb 0.20 -0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.23 3hu3 h LEU 229 CO -0.01 0.21 -1.00 -0.26 -0.34 0.00 0.00 178.44 177.05 3hu3 h PHE 230 N 0.44 1.03 -0.28 1.25 -1.00 -1.61 -3.11 116.94 113.66 3hu3 h PHE 230 Ca 0.21 -0.54 0.02 0.00 2.81 0.00 0.00 57.97 60.48 3hu3 h PHE 230 Cb 0.15 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 39.56 3hu3 h PHE 230 CO -0.12 1.38 0.11 0.87 -1.61 0.00 0.00 178.31 178.94 3hu3 h LYS 231 N 0.41 0.24 -0.44 1.51 1.57 -1.06 -0.98 116.57 117.82 3hu3 h LYS 231 Ca -0.12 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.74 3hu3 h LYS 231 Cb 1.65 -0.05 -0.09 0.00 0.08 0.00 0.00 32.23 33.81 3hu3 h LYS 231 CO 0.20 0.16 -0.24 0.00 -0.57 0.00 0.00 179.45 178.99 3hu3 h ALA 232 N 1.16 0.04 0.00 3.86 0.00 -0.59 -1.19 119.26 122.54 3hu3 h ALA 232 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3hu3 h ALA 232 Cb 0.07 0.57 0.00 0.00 0.00 0.00 0.00 17.79 18.43 3hu3 h ALA 232 CO -0.11 -0.61 -0.12 1.51 0.00 0.00 0.00 179.25 179.93 3hu3 n ILE 233 N -5.40 0.43 -2.02 0.00 3.06 -1.18 -4.96 119.36 109.29 3hu3 n ILE 233 Ca 0.03 -0.22 0.00 0.00 -2.50 0.00 0.00 62.75 60.05 3hu3 n ILE 233 Cb 0.32 -0.46 0.00 0.00 0.54 0.00 0.00 39.64 40.03 3hu3 n ILE 233 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3hu3 n GLY 234 N 1.35 0.74 3.10 4.50 0.00 -0.45 -5.09 105.19 109.34 3hu3 n GLY 234 Ca 0.05 -0.53 -0.24 0.00 0.00 0.00 0.00 46.02 45.31 3hu3 n GLY 234 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu3 s VAL 235 N -2.84 1.21 -0.25 1.61 0.11 -0.44 -5.03 120.40 114.77 3hu3 s VAL 235 Ca 0.00 -0.61 -0.21 0.00 -2.93 0.00 0.00 61.98 58.23 3hu3 s VAL 235 Cb 0.00 -1.04 -0.02 0.00 -1.53 0.00 0.00 36.38 33.79 3hu3 s VAL 235 CO 0.00 0.35 0.66 -0.54 -3.33 0.00 0.00 175.10 172.24 3hu3 s LYS 236 N 0.01 4.13 0.47 1.54 1.02 -1.26 -4.34 119.74 121.31 3hu3 s LYS 236 Ca -0.02 0.61 -0.22 0.00 0.02 0.00 0.00 55.97 56.36 3hu3 s LYS 236 Cb -0.10 -3.64 -0.07 0.00 -0.52 0.00 0.00 37.83 33.50 3hu3 s LYS 236 CO 0.01 -0.41 1.13 -1.25 -0.92 0.00 0.00 175.35 173.91 3hu3 s PRO 237 N 2.50 3.72 0.51 -1.68 0.04 -1.26 -4.98 135.00 133.85 3hu3 s PRO 237 Ca 0.28 1.67 -0.23 0.00 0.04 0.00 0.00 61.00 62.75 3hu3 s PRO 237 Cb -0.15 -2.31 -0.06 0.00 0.04 0.00 0.00 34.50 32.02 3hu3 s PRO 237 CO 0.08 -0.56 1.39 -2.14 0.04 0.00 0.00 177.00 175.82 3hu3 s PRO 238 N -2.85 3.35 0.00 0.56 0.02 -1.26 -4.95 135.00 129.87 3hu3 s PRO 238 Ca 0.65 2.33 0.15 0.00 0.02 0.00 0.00 61.00 64.15 3hu3 s PRO 238 Cb -0.26 -2.42 0.12 0.00 0.02 0.00 0.00 34.50 31.97 3hu3 s PRO 238 CO 0.31 -1.06 0.98 2.89 -0.33 0.00 0.00 177.00 179.79 3hu3 n ARG 239 N -0.70 1.10 -3.81 5.54 1.85 -1.26 -4.94 116.66 114.43 3hu3 n ARG 239 Ca 0.08 -1.40 -0.26 0.00 -1.00 0.00 0.00 57.85 55.27 3hu3 n ARG 239 Cb 0.44 -1.28 -0.17 0.00 -1.05 0.00 0.00 32.46 30.39 3hu3 n ARG 239 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 3hu3 s GLY 240 N -1.23 0.70 -0.21 2.89 0.00 -1.13 -0.47 107.32 107.88 3hu3 s GLY 240 Ca 0.18 -0.50 0.02 0.00 0.00 0.00 0.00 44.72 44.41 3hu3 s GLY 240 CO 0.19 1.10 -0.15 -0.42 0.00 0.00 0.00 173.10 173.82 3hu3 s ILE 241 N 1.82 1.99 -0.31 0.90 1.09 0.11 -2.51 121.20 124.29 3hu3 s ILE 241 Ca 0.03 -1.16 -0.15 0.00 -1.10 0.00 0.00 60.65 58.26 3hu3 s ILE 241 Cb -0.14 -1.95 -0.02 0.00 -1.06 0.00 0.00 42.46 39.29 3hu3 s ILE 241 CO -0.07 0.28 0.37 -0.22 -0.10 0.00 0.00 174.94 175.20 3hu3 s LEU 242 N 1.26 4.25 -0.02 2.97 2.96 -0.32 -0.69 118.68 129.08 3hu3 s LEU 242 Ca -0.01 -0.00 -0.24 0.00 -0.22 0.00 0.00 54.13 53.66 3hu3 s LEU 242 Cb -0.16 -2.38 -0.04 0.00 0.50 0.00 0.00 46.19 44.11 3hu3 s LEU 242 CO -0.09 -0.27 0.73 -0.76 -1.32 0.00 0.00 176.35 174.63 3hu3 s LEU 243 N 2.05 4.38 0.06 -0.68 1.43 0.90 -0.27 118.68 126.54 3hu3 s LEU 243 Ca 0.13 1.30 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 3hu3 s LEU 243 Cb -0.16 -3.15 -0.03 0.00 0.03 0.00 0.00 46.19 42.88 3hu3 s LEU 243 CO 0.11 -0.05 -0.05 -0.72 0.23 0.00 0.00 176.35 175.87 3hu3 s TYR 244 N 0.41 0.59 0.00 0.29 -0.85 -0.52 -1.25 117.35 116.01 3hu3 s TYR 244 Ca 0.38 -0.82 0.00 0.00 -0.52 0.00 0.00 57.07 56.11 3hu3 s TYR 244 Cb -0.19 -0.38 0.00 0.00 0.38 0.00 0.00 41.96 41.77 3hu3 s TYR 244 CO 0.20 -0.23 0.00 0.41 -1.52 0.00 0.00 175.55 174.41 3hu3 n GLY 245 N 0.61 0.08 3.64 5.49 0.00 -1.10 -0.13 105.19 113.79 3hu3 n GLY 245 Ca -0.17 -1.24 -0.29 0.00 0.00 0.00 0.00 46.02 44.32 3hu3 n GLY 245 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hu3 s PRO 246 N -2.00 0.53 0.33 1.61 0.04 -1.26 -4.16 135.00 130.09 3hu3 s PRO 246 Ca 0.00 0.93 -0.26 0.00 0.04 0.00 0.00 61.00 61.70 3hu3 s PRO 246 Cb 0.00 -1.72 -0.13 0.00 0.04 0.00 0.00 34.50 32.69 3hu3 s PRO 246 CO 0.00 -2.77 0.94 -2.30 0.04 0.00 0.00 177.00 172.90 3hu3 n PRO 247 N -4.26 1.21 -1.04 0.56 -0.02 -1.26 -3.32 135.00 126.87 3hu3 n PRO 247 Ca 0.07 0.43 -0.01 0.00 -2.02 0.00 0.00 63.50 61.96 3hu3 n PRO 247 Cb 0.55 -1.82 -0.01 0.00 -0.02 0.00 0.00 33.50 32.20 3hu3 n PRO 247 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hu3 n GLY 248 N 1.31 0.49 0.02 -1.23 0.00 -1.26 -4.91 105.19 99.61 3hu3 n GLY 248 Ca 0.10 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 45.98 3hu3 n GLY 248 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hu3 n THR 249 N -2.83 0.00 0.00 2.61 -2.24 -1.21 -1.02 114.28 109.59 3hu3 n THR 249 Ca -0.01 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 3hu3 n THR 249 Cb 0.11 -0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.25 3hu3 n THR 249 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hu3 n GLY 250 N 1.46 1.64 0.16 3.38 0.00 -1.26 -4.72 105.19 105.84 3hu3 n GLY 250 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 3hu3 n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hu3 h LYS 251 N 0.00 -0.29 -0.50 1.61 1.57 -1.93 -1.51 116.57 115.53 3hu3 h LYS 251 Ca 0.00 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 3hu3 h LYS 251 Cb 0.00 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 3hu3 h LYS 251 CO 0.00 0.04 0.18 1.15 -0.57 0.00 0.00 179.45 180.25 3hu3 h THR 252 N -0.65 1.22 -0.47 -0.16 2.02 -1.99 -2.34 112.91 110.55 3hu3 h THR 252 Ca -0.03 -0.72 0.09 0.00 0.77 0.00 0.00 66.41 66.52 3hu3 h THR 252 Cb 0.46 0.75 -0.09 0.00 -1.74 0.00 0.00 68.15 67.54 3hu3 h THR 252 CO 0.05 0.27 -0.08 0.25 0.37 0.00 0.00 175.52 176.38 3hu3 h LEU 253 N 0.67 -0.36 -0.80 2.58 5.85 -1.98 0.15 115.31 121.42 3hu3 h LEU 253 Ca 0.16 0.13 0.06 0.00 0.84 0.00 0.00 57.88 59.08 3hu3 h LEU 253 Cb 0.24 0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.47 3hu3 h LEU 253 CO -0.01 -0.13 0.48 0.40 -0.34 0.00 0.00 178.44 178.85 3hu3 h ILE 254 N 0.03 1.01 -0.42 4.05 2.04 -1.11 0.66 117.51 123.77 3hu3 h ILE 254 Ca 0.23 -0.30 0.04 0.00 1.00 0.00 0.00 64.86 65.83 3hu3 h ILE 254 Cb 0.35 0.05 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 3hu3 h ILE 254 CO -0.45 0.16 0.19 0.00 0.00 0.00 0.00 178.15 178.05 3hu3 h ALA 255 N 1.39 0.52 -0.53 1.87 0.00 -0.75 0.19 119.26 121.96 3hu3 h ALA 255 Ca 0.36 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.31 3hu3 h ALA 255 Cb 0.19 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3hu3 h ALA 255 CO -0.18 -0.17 0.34 0.00 0.00 0.00 0.00 179.25 179.23 3hu3 h ARG 256 N 0.39 0.66 -0.34 0.00 2.47 -0.42 -0.52 114.38 116.62 3hu3 h ARG 256 Ca 0.19 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.85 3hu3 h ARG 256 Cb 0.12 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.27 3hu3 h ARG 256 CO -0.15 0.43 0.17 0.00 0.56 0.00 0.00 179.97 180.98 3hu3 h ALA 257 N 1.22 0.44 0.07 0.04 0.00 -0.43 -1.86 119.26 118.73 3hu3 h ALA 257 Ca 0.21 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hu3 h ALA 257 Cb -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3hu3 h ALA 257 CO -0.07 -0.01 -0.04 0.28 0.00 0.00 0.00 179.25 179.41 3hu3 h VAL 258 N 0.42 0.97 -0.89 0.00 2.07 -0.52 -0.38 116.25 117.92 3hu3 h VAL 258 Ca 0.12 -0.15 0.24 0.00 0.82 0.00 0.00 66.70 67.73 3hu3 h VAL 258 Cb 0.11 1.07 -0.14 0.00 -1.52 0.00 0.00 31.29 30.81 3hu3 h VAL 258 CO -0.02 0.04 0.31 0.00 0.02 0.00 0.00 177.57 177.93 3hu3 h ALA 259 N 0.76 1.38 0.00 1.67 0.00 -1.00 0.13 119.26 122.21 3hu3 h ALA 259 Ca -0.01 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3hu3 h ALA 259 Cb 0.14 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3hu3 h ALA 259 CO 0.02 -0.44 -0.67 -0.91 0.00 0.00 0.00 179.25 177.25 3hu3 h ASN 260 N 0.28 0.00 0.00 0.00 2.35 -0.90 -3.38 115.58 113.93 3hu3 h ASN 260 Ca 0.57 -0.21 -0.24 0.00 -0.55 0.00 0.00 56.30 55.88 3hu3 h ASN 260 Cb 1.15 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.47 3hu3 h ASN 260 CO -0.61 0.10 -1.90 -0.62 -1.65 0.00 0.00 177.43 172.75 3hu3 n GLU 261 N -2.15 1.82 -2.14 0.81 -0.58 -0.19 -3.75 120.64 114.46 3hu3 n GLU 261 Ca 0.03 -0.01 -0.36 0.00 -0.42 0.00 0.00 57.16 56.40 3hu3 n GLU 261 Cb 0.45 -1.34 0.02 0.00 -0.57 0.00 0.00 31.44 29.99 3hu3 n GLU 261 CO 0.00 0.00 0.00 -0.08 -0.48 0.00 0.00 177.13 176.57 3hu3 s THR 262 N -2.33 2.89 -0.91 2.62 -1.32 0.39 -4.58 115.64 112.40 3hu3 s THR 262 Ca -0.06 0.57 0.28 0.00 -1.21 0.00 0.00 61.69 61.26 3hu3 s THR 262 Cb 0.04 -3.24 0.22 0.00 -1.51 0.00 0.00 72.50 68.01 3hu3 s THR 262 CO 0.54 -0.11 1.80 0.61 -2.21 0.00 0.00 174.62 175.26 3hu3 n GLY 263 N 0.36 -1.53 3.90 6.08 0.00 -1.26 -4.91 105.19 107.83 3hu3 n GLY 263 Ca 0.12 -0.11 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3hu3 n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu3 s ALA 264 N -3.04 2.98 0.38 4.61 0.00 -1.26 -5.06 121.76 120.37 3hu3 s ALA 264 Ca 0.12 -0.50 -0.27 0.00 0.00 0.00 0.00 51.96 51.31 3hu3 s ALA 264 Cb 0.17 -2.89 -0.10 0.00 0.00 0.00 0.00 23.12 20.30 3hu3 s ALA 264 CO 0.58 -1.12 1.38 0.12 0.00 0.00 0.00 175.76 176.71 3hu3 s PHE 265 N -3.29 2.79 -0.07 0.00 5.36 -0.93 -4.89 117.98 116.95 3hu3 s PHE 265 Ca 0.58 1.32 0.02 0.00 -0.96 0.00 0.00 56.93 57.89 3hu3 s PHE 265 Cb -0.11 -3.81 0.01 0.00 -0.34 0.00 0.00 43.02 38.77 3hu3 s PHE 265 CO 0.49 -2.39 -0.11 0.12 -1.46 0.00 0.00 175.22 171.88 3hu3 s PHE 266 N -1.17 1.41 -0.20 10.12 2.19 -1.26 -0.47 117.98 128.59 3hu3 s PHE 266 Ca 0.53 -0.53 0.00 0.00 0.33 0.00 0.00 56.93 57.26 3hu3 s PHE 266 Cb -0.42 -1.05 0.05 0.00 -1.31 0.00 0.00 43.02 40.29 3hu3 s PHE 266 CO 0.56 -0.29 -0.06 0.12 1.83 0.00 0.00 175.22 177.37 3hu3 s PHE 267 N 0.78 2.16 -0.03 10.12 2.19 -0.41 -4.99 117.98 127.81 3hu3 s PHE 267 Ca -0.12 -1.50 -0.26 0.00 0.33 0.00 0.00 56.93 55.38 3hu3 s PHE 267 Cb -0.15 -1.51 -0.04 0.00 -1.31 0.00 0.00 43.02 40.01 3hu3 s PHE 267 CO 0.02 -0.72 0.81 -1.17 1.83 0.00 0.00 175.22 176.00 3hu3 s LEU 268 N 1.48 4.35 -0.23 6.12 2.96 -1.26 -1.43 118.68 130.67 3hu3 s LEU 268 Ca -0.03 1.39 0.00 0.00 -0.22 0.00 0.00 54.13 55.28 3hu3 s LEU 268 Cb -0.17 -3.28 0.03 0.00 0.50 0.00 0.00 46.19 43.27 3hu3 s LEU 268 CO -0.07 -0.15 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.06 3hu3 s ILE 269 N 0.78 2.47 -0.23 6.68 1.01 0.18 -4.94 121.20 127.14 3hu3 s ILE 269 Ca 0.43 -1.12 -0.16 0.00 0.00 0.00 0.00 60.65 59.80 3hu3 s ILE 269 Cb -0.19 -2.23 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 3hu3 s ILE 269 CO 0.22 0.26 0.42 0.21 0.00 0.00 0.00 174.94 176.06 3hu3 s ASN 270 N 1.27 6.38 0.08 3.58 3.84 -1.26 -0.33 114.94 128.50 3hu3 s ASN 270 Ca -0.00 0.45 -0.24 0.00 0.21 0.00 0.00 52.86 53.28 3hu3 s ASN 270 Cb -0.16 -2.24 -0.09 0.00 -0.55 0.00 0.00 41.25 38.21 3hu3 s ASN 270 CO -0.07 -0.16 1.39 1.23 -2.79 0.00 0.00 177.10 176.70 3hu3 h GLY 271 N 8.18 -1.22 1.94 1.21 0.00 -1.15 -1.62 103.07 110.40 3hu3 h GLY 271 Ca -0.33 0.67 0.01 0.00 0.00 0.00 0.00 47.33 47.67 3hu3 h GLY 271 CO 0.69 -0.32 0.02 -2.55 0.00 0.00 0.00 176.54 174.39 3hu3 h PRO 272 N -0.44 0.00 -0.30 4.80 0.11 -1.83 -2.31 132.00 132.02 3hu3 h PRO 272 Ca 0.02 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.05 3hu3 h PRO 272 Cb 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 3hu3 h PRO 272 CO -0.29 0.00 -0.12 1.49 -0.21 0.00 0.00 178.00 178.87 3hu3 h GLU 273 N 0.00 0.61 0.17 1.05 4.81 -1.73 -1.13 114.58 118.36 3hu3 h GLU 273 Ca 0.01 -0.26 -0.01 0.00 -0.13 0.00 0.00 59.36 58.98 3hu3 h GLU 273 Cb 0.06 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 3hu3 h GLU 273 CO -0.00 0.83 -0.09 0.82 -0.73 0.00 0.00 179.01 179.84 3hu3 h ILE 274 N 0.37 0.80 0.00 2.32 1.08 -0.91 -3.04 117.51 118.12 3hu3 h ILE 274 Ca 0.07 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.54 3hu3 h ILE 274 Cb 0.63 0.80 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 3hu3 h ILE 274 CO 0.04 0.00 0.05 0.24 -0.69 0.00 0.00 178.15 177.79 3hu3 h MET 275 N -0.25 0.00 -0.00 2.37 2.86 -1.35 -1.65 114.93 116.91 3hu3 h MET 275 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3hu3 h MET 275 Cb 0.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.86 3hu3 h MET 275 CO 0.02 0.00 -0.06 -1.13 1.06 0.00 0.00 176.91 176.80 3hu3 n SER 276 N -2.94 0.12 -4.94 1.22 3.41 -0.43 -4.92 113.62 105.14 3hu3 n SER 276 Ca -0.03 0.04 -0.25 0.00 -0.26 0.00 0.00 58.87 58.37 3hu3 n SER 276 Cb 0.11 -0.29 0.03 0.00 -0.26 0.00 0.00 64.21 63.80 3hu3 n SER 276 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3hu3 s LYS 277 N -2.76 2.77 0.68 4.33 -0.14 -0.62 -5.05 119.74 118.95 3hu3 s LYS 277 Ca 0.21 -0.27 -0.16 0.00 -1.36 0.00 0.00 55.97 54.39 3hu3 s LYS 277 Cb 0.19 -2.35 0.01 0.00 -1.68 0.00 0.00 37.83 34.01 3hu3 s LYS 277 CO 0.51 -0.71 1.23 -0.51 -0.76 0.00 0.00 175.35 175.11 3hu3 s LEU 278 N -4.91 3.45 0.09 3.17 1.43 -1.26 -4.68 118.68 115.97 3hu3 s LEU 278 Ca 0.54 2.42 -0.33 0.00 -1.03 0.00 0.00 54.13 55.74 3hu3 s LEU 278 Cb -0.10 -4.60 -0.12 0.00 0.03 0.00 0.00 46.19 41.40 3hu3 s LEU 278 CO 0.42 -2.06 1.75 0.00 0.23 0.00 0.00 176.35 176.69 3hu3 n ALA 279 N -2.30 1.59 0.00 4.21 0.00 -1.26 -0.51 120.51 122.24 3hu3 n ALA 279 Ca 0.14 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3hu3 n ALA 279 Cb 0.50 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.47 3hu3 n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hu3 n GLY 280 N 3.97 3.01 0.16 0.00 0.00 -1.26 -4.83 105.19 106.24 3hu3 n GLY 280 Ca 0.19 -0.69 -0.19 0.00 0.00 0.00 0.00 46.02 45.32 3hu3 n GLY 280 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hu3 h GLU 281 N 0.00 0.55 -0.01 1.61 4.81 -1.14 -2.48 114.58 117.92 3hu3 h GLU 281 Ca 0.00 -0.70 0.03 0.00 -0.13 0.00 0.00 59.36 58.56 3hu3 h GLU 281 Cb 0.00 0.23 -0.05 0.00 0.63 0.00 0.00 28.75 29.56 3hu3 h GLU 281 CO 0.00 1.30 -0.31 0.77 -0.73 0.00 0.00 179.01 180.04 3hu3 h SER 282 N 0.25 -0.92 -0.34 1.04 0.02 -1.70 0.81 113.55 112.71 3hu3 h SER 282 Ca -0.15 0.12 0.01 0.00 -0.84 0.00 0.00 61.79 60.92 3hu3 h SER 282 Cb 1.84 0.37 -0.02 0.00 0.14 0.00 0.00 62.40 64.73 3hu3 h SER 282 CO 0.22 -0.37 0.22 -0.33 -1.14 0.00 0.00 176.83 175.43 3hu3 h GLU 283 N -0.45 0.44 -0.30 3.45 3.07 -1.87 -2.19 114.58 116.72 3hu3 h GLU 283 Ca 0.06 -0.03 0.03 0.00 -0.50 0.00 0.00 59.36 58.93 3hu3 h GLU 283 Cb 0.54 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.32 3hu3 h GLU 283 CO -0.26 0.29 0.10 1.03 -1.40 0.00 0.00 179.01 178.77 3hu3 h SER 284 N 0.46 0.10 -1.01 1.42 0.87 -1.18 -1.75 113.55 112.46 3hu3 h SER 284 Ca 0.13 0.03 0.01 0.00 -1.23 0.00 0.00 61.79 60.73 3hu3 h SER 284 Cb -0.04 0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 61.89 3hu3 h SER 284 CO -0.03 0.09 0.67 0.78 -0.53 0.00 0.00 176.83 177.80 3hu3 h ASN 285 N 0.23 1.15 -0.90 6.23 -0.26 -0.67 -0.38 115.58 120.98 3hu3 h ASN 285 Ca 0.14 -0.03 0.02 0.00 -0.56 0.00 0.00 56.30 55.87 3hu3 h ASN 285 Cb 0.11 -0.29 -0.05 0.00 -1.06 0.00 0.00 38.32 37.04 3hu3 h ASN 285 CO -0.15 0.83 0.59 -0.07 -1.06 0.00 0.00 177.43 177.57 3hu3 h LEU 286 N 1.36 1.00 -0.39 1.61 3.38 -1.10 -1.38 115.31 119.79 3hu3 h LEU 286 Ca 0.37 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.24 3hu3 h LEU 286 Cb -0.15 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.35 3hu3 h LEU 286 CO -0.08 0.71 -0.08 0.03 0.09 0.00 0.00 178.44 179.11 3hu3 h ARG 287 N 1.18 0.74 -0.70 1.13 3.08 -0.42 -2.60 114.38 116.78 3hu3 h ARG 287 Ca 0.34 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 3hu3 h ARG 287 Cb -0.08 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 3hu3 h ARG 287 CO -0.09 0.87 0.14 0.87 -1.07 0.00 0.00 179.97 180.69 3hu3 h LYS 288 N 0.55 1.13 -0.18 0.04 1.57 -0.99 -0.53 116.57 118.16 3hu3 h LYS 288 Ca 0.10 -0.29 0.05 0.00 -1.87 0.00 0.00 60.65 58.64 3hu3 h LYS 288 Cb 0.59 -0.14 -0.05 0.00 0.08 0.00 0.00 32.23 32.70 3hu3 h LYS 288 CO 0.03 1.01 -0.15 0.00 -0.57 0.00 0.00 179.45 179.78 3hu3 h ALA 289 N 1.08 -0.02 -0.56 3.86 0.00 -1.16 -0.11 119.26 122.35 3hu3 h ALA 289 Ca 0.22 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 3hu3 h ALA 289 Cb 0.41 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3hu3 h ALA 289 CO 0.01 -0.58 0.07 0.74 0.00 0.00 0.00 179.25 179.48 3hu3 h PHE 290 N -0.16 1.02 -0.69 0.00 -1.00 -1.11 -2.23 116.94 112.78 3hu3 h PHE 290 Ca 0.11 -0.15 -0.01 0.00 2.81 0.00 0.00 57.97 60.73 3hu3 h PHE 290 Cb 0.33 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.58 3hu3 h PHE 290 CO -0.29 0.90 0.40 0.93 -1.61 0.00 0.00 178.31 178.65 3hu3 h GLU 291 N 0.84 0.95 -0.48 1.51 5.08 -0.90 -0.93 114.58 120.64 3hu3 h GLU 291 Ca 0.17 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 3hu3 h GLU 291 Cb 0.45 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 3hu3 h GLU 291 CO 0.02 0.68 0.08 0.93 -1.00 0.00 0.00 179.01 179.72 3hu3 h GLU 292 N 0.94 0.80 -0.07 2.33 4.39 -0.92 -0.86 114.58 121.19 3hu3 h GLU 292 Ca 0.25 -0.21 0.02 0.00 0.34 0.00 0.00 59.36 59.76 3hu3 h GLU 292 Cb -0.01 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.52 3hu3 h GLU 292 CO -0.04 0.80 -0.08 0.00 -1.16 0.00 0.00 179.01 178.53 3hu3 h ALA 293 N 0.96 -0.03 -0.19 3.43 0.00 -1.20 -1.85 119.26 120.39 3hu3 h ALA 293 Ca 0.15 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3hu3 h ALA 293 Cb 0.39 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3hu3 h ALA 293 CO 0.01 -0.55 -0.02 0.93 0.00 0.00 0.00 179.25 179.62 3hu3 h GLU 294 N -0.11 0.03 0.00 0.00 5.08 -1.02 -1.26 114.58 117.31 3hu3 h GLU 294 Ca 0.06 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3hu3 h GLU 294 Cb 0.19 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 3hu3 h GLU 294 CO -0.14 0.02 -0.08 -0.22 -1.00 0.00 0.00 179.01 177.60 3hu3 h LYS 295 N 0.03 0.00 -0.31 2.33 3.64 -1.03 -2.87 116.57 118.36 3hu3 h LYS 295 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3hu3 h LYS 295 Cb 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3hu3 h LYS 295 CO -0.17 0.08 0.00 0.09 -2.27 0.00 0.00 179.45 177.18 3hu3 n ASN 296 N -4.32 4.16 -4.74 4.20 3.02 -0.71 -5.02 115.26 111.85 3hu3 n ASN 296 Ca -0.03 -2.97 -0.38 0.00 -0.03 0.00 0.00 54.58 51.17 3hu3 n ASN 296 Cb 0.16 -0.56 0.05 0.00 -0.61 0.00 0.00 39.78 38.82 3hu3 n ASN 296 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hu3 s ALA 297 N -2.76 2.63 0.26 5.41 0.00 -0.52 -4.33 121.76 122.45 3hu3 s ALA 297 Ca 0.44 1.26 -0.30 0.00 0.00 0.00 0.00 51.96 53.36 3hu3 s ALA 297 Cb 0.35 -3.55 -0.11 0.00 0.00 0.00 0.00 23.12 19.81 3hu3 s ALA 297 CO 0.10 -1.44 1.50 -2.14 0.00 0.00 0.00 175.76 173.78 3hu3 s PRO 298 N -3.12 4.21 0.02 0.00 0.02 -1.26 -5.04 135.00 129.84 3hu3 s PRO 298 Ca 0.76 2.41 -0.04 0.00 0.02 0.00 0.00 61.00 64.15 3hu3 s PRO 298 Cb -0.38 -3.08 -0.01 0.00 0.02 0.00 0.00 34.50 31.05 3hu3 s PRO 298 CO 0.43 -0.50 0.06 0.00 -0.33 0.00 0.00 177.00 176.66 3hu3 s ALA 299 N 0.01 -0.05 -0.11 -1.55 0.00 -0.76 -2.20 121.76 117.09 3hu3 s ALA 299 Ca 0.61 -0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.09 3hu3 s ALA 299 Cb -0.44 0.18 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 3hu3 s ALA 299 CO 0.45 -0.24 -0.15 0.42 0.00 0.00 0.00 175.76 176.23 3hu3 s ILE 300 N -2.00 2.86 -0.17 0.00 1.01 0.38 -1.78 121.20 121.50 3hu3 s ILE 300 Ca -0.10 -0.74 -0.06 0.00 0.00 0.00 0.00 60.65 59.74 3hu3 s ILE 300 Cb -0.05 -2.17 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 3hu3 s ILE 300 CO -0.02 0.54 0.04 -0.63 0.00 0.00 0.00 174.94 174.86 3hu3 s ILE 301 N 0.20 4.56 -0.19 2.92 1.01 -0.11 -1.28 121.20 128.31 3hu3 s ILE 301 Ca -0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 60.65 60.42 3hu3 s ILE 301 Cb -0.16 -3.04 -0.00 0.00 0.01 0.00 0.00 42.46 39.28 3hu3 s ILE 301 CO 0.06 0.48 -0.11 0.12 0.00 0.00 0.00 174.94 175.49 3hu3 s PHE 302 N 0.29 2.87 -0.47 3.97 2.19 -0.51 0.90 117.98 127.20 3hu3 s PHE 302 Ca 0.02 -1.05 -0.07 0.00 0.33 0.00 0.00 56.93 56.16 3hu3 s PHE 302 Cb -0.13 -1.99 0.12 0.00 -1.31 0.00 0.00 43.02 39.72 3hu3 s PHE 302 CO 0.01 -0.53 0.32 0.42 1.83 0.00 0.00 175.22 177.26 3hu3 s ILE 303 N 1.15 3.89 0.26 3.12 1.01 0.64 0.51 121.20 131.79 3hu3 s ILE 303 Ca 0.01 -2.00 -0.23 0.00 0.00 0.00 0.00 60.65 58.43 3hu3 s ILE 303 Cb -0.14 -3.59 -0.09 0.00 0.01 0.00 0.00 42.46 38.65 3hu3 s ILE 303 CO -0.03 -0.76 0.82 -0.62 0.00 0.00 0.00 174.94 174.34 3hu3 s ASP 304 N 2.20 7.21 -1.15 3.58 2.15 0.55 -1.99 116.67 129.23 3hu3 s ASP 304 Ca 0.08 1.62 -0.14 0.00 0.43 0.00 0.00 52.55 54.54 3hu3 s ASP 304 Cb -0.24 -2.50 -0.02 0.00 -0.30 0.00 0.00 42.92 39.86 3hu3 s ASP 304 CO -0.02 0.01 0.80 -0.62 -0.17 0.00 0.00 175.17 175.16 3hu3 n GLU 305 N 0.74 -2.07 -0.30 4.34 1.02 -0.89 -0.79 120.64 122.69 3hu3 n GLU 305 Ca -0.01 0.58 0.10 0.00 -0.02 0.00 0.00 57.16 57.81 3hu3 n GLU 305 Cb 0.50 -4.70 0.34 0.00 -0.02 0.00 0.00 31.44 27.56 3hu3 n GLU 305 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3hu3 h LEU 306 N -1.70 0.74 -1.94 -4.62 5.85 -1.01 -2.12 115.31 110.51 3hu3 h LEU 306 Ca -0.64 0.04 0.17 0.00 0.84 0.00 0.00 57.88 58.29 3hu3 h LEU 306 Cb 1.35 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.25 3hu3 h LEU 306 CO 0.49 0.38 0.44 -2.24 -0.34 0.00 0.00 178.44 177.17 3hu3 h ASP 307 N 0.79 0.05 -0.66 1.25 2.03 -1.87 -1.15 116.42 116.86 3hu3 h ASP 307 Ca 0.46 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.72 3hu3 h ASP 307 Cb 0.65 -0.01 -0.03 0.00 -0.83 0.00 0.00 39.33 39.11 3hu3 h ASP 307 CO -0.23 0.03 0.25 0.00 -1.03 0.00 0.00 179.24 178.26 3hu3 h ALA 308 N 1.69 0.85 0.00 4.15 0.00 -1.74 -3.19 119.26 121.03 3hu3 h ALA 308 Ca 0.30 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hu3 h ALA 308 Cb 1.11 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3hu3 h ALA 308 CO -0.02 0.49 -1.20 0.44 0.00 0.00 0.00 179.25 178.96 3hu3 n ILE 309 N -4.39 0.03 -2.61 0.00 -5.35 -0.65 -4.67 119.36 101.73 3hu3 n ILE 309 Ca 0.05 -0.15 -0.14 0.00 -0.27 0.00 0.00 62.75 62.24 3hu3 n ILE 309 Cb 0.18 0.61 0.02 0.00 -1.74 0.00 0.00 39.64 38.72 3hu3 n ILE 309 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hu3 n ALA 310 N -1.72 3.86 -1.68 -1.28 0.00 -0.53 -3.80 120.51 115.36 3hu3 n ALA 310 Ca 0.02 -3.45 -0.30 0.00 0.00 0.00 0.00 53.44 49.70 3hu3 n ALA 310 Cb 0.40 -0.81 0.06 0.00 0.00 0.00 0.00 19.45 19.10 3hu3 n ALA 310 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hu3 s PRO 311 N -3.28 2.58 -0.14 0.00 0.04 -1.21 -1.41 135.00 131.58 3hu3 s PRO 311 Ca 0.33 0.65 -0.40 0.00 0.04 0.00 0.00 61.00 61.62 3hu3 s PRO 311 Cb 0.44 -1.97 -0.17 0.00 0.04 0.00 0.00 34.50 32.83 3hu3 s PRO 311 CO -0.03 -1.27 1.49 1.63 0.04 0.00 0.00 177.00 178.86 3hu3 n LYS 312 N -3.20 0.83 -0.10 4.56 5.02 -1.06 -4.23 118.16 119.98 3hu3 n LYS 312 Ca 0.07 0.30 -0.02 0.00 -2.02 0.00 0.00 58.31 56.64 3hu3 n LYS 312 Cb 0.56 -1.92 -0.01 0.00 -0.02 0.00 0.00 35.03 33.64 3hu3 n LYS 312 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hu3 n ARG 313 N 3.65 0.23 0.00 1.97 1.74 -1.26 -0.92 116.66 122.06 3hu3 n ARG 313 Ca 0.23 -0.25 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 3hu3 n ARG 313 Cb 0.12 -1.69 0.00 0.00 -1.02 0.00 0.00 32.46 29.86 3hu3 n ARG 313 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 3hu3 n GLU 314 N 3.49 0.00 -0.81 5.56 -0.00 -1.26 -4.89 120.64 122.73 3hu3 n GLU 314 Ca 0.05 0.00 -0.15 0.00 -0.00 0.00 0.00 57.16 57.06 3hu3 n GLU 314 Cb 0.07 -0.15 0.13 0.00 -0.00 0.00 0.00 31.44 31.48 3hu3 n GLU 314 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 3hu3 n LYS 315 N -0.96 1.98 -3.75 3.44 4.81 -0.10 -4.58 118.16 119.01 3hu3 n LYS 315 Ca 0.00 -2.04 -0.27 0.00 -0.87 0.00 0.00 58.31 55.13 3hu3 n LYS 315 Cb 0.00 -1.81 -0.17 0.00 0.02 0.00 0.00 35.03 33.07 3hu3 n LYS 315 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 3hu3 s THR 316 N -2.23 0.56 -0.33 3.15 -4.23 -1.24 -4.89 115.64 106.42 3hu3 s THR 316 Ca 0.38 -0.52 0.27 0.00 -1.18 0.00 0.00 61.69 60.64 3hu3 s THR 316 Cb 0.32 -1.02 0.34 0.00 1.34 0.00 0.00 72.50 73.48 3hu3 s THR 316 CO 0.08 -0.15 1.77 0.45 -0.54 0.00 0.00 174.62 176.22 3hu3 h HIS 317 N 8.24 0.00 -3.46 3.99 3.86 -1.96 -3.45 115.15 122.37 3hu3 h HIS 317 Ca -0.17 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.50 3hu3 h HIS 317 Cb 1.12 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.56 3hu3 h HIS 317 CO 0.31 0.00 0.26 0.20 0.86 0.00 0.00 177.93 179.56 3hu3 s GLY 318 N -4.01 2.86 0.25 2.45 0.00 -1.26 -4.95 107.32 102.66 3hu3 s GLY 318 Ca 0.06 0.41 -0.05 0.00 0.00 0.00 0.00 44.72 45.13 3hu3 s GLY 318 CO 0.58 1.35 1.88 0.83 0.00 0.00 0.00 173.10 177.74 3hu3 h GLU 319 N 6.05 1.17 -0.32 2.90 5.08 -2.00 -1.85 114.58 125.61 3hu3 h GLU 319 Ca -0.43 -0.14 -0.14 0.00 -1.00 0.00 0.00 59.36 57.66 3hu3 h GLU 319 Cb 1.21 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 3hu3 h GLU 319 CO 0.73 0.86 -0.36 0.28 -1.00 0.00 0.00 179.01 179.52 3hu3 h VAL 320 N 1.18 1.28 -0.37 3.13 2.07 -1.99 -1.50 116.25 120.05 3hu3 h VAL 320 Ca 0.30 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.30 3hu3 h VAL 320 Cb 0.03 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3hu3 h VAL 320 CO -0.05 0.49 0.20 -0.33 0.02 0.00 0.00 177.57 177.90 3hu3 h GLU 321 N 0.60 0.52 -0.49 1.57 5.08 -1.86 -1.43 114.58 118.57 3hu3 h GLU 321 Ca 0.06 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3hu3 h GLU 321 Cb 0.89 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 3hu3 h GLU 321 CO 0.08 0.44 0.06 0.00 -1.00 0.00 0.00 179.01 178.58 3hu3 h ARG 322 N 0.47 0.78 -0.57 2.33 3.08 -1.27 -2.81 114.38 116.40 3hu3 h ARG 322 Ca 0.13 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3hu3 h ARG 322 Cb 0.07 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 3hu3 h ARG 322 CO -0.02 0.75 0.33 -0.09 -1.07 0.00 0.00 179.97 179.87 3hu3 h ARG 323 N 0.74 0.78 -0.63 0.04 2.43 -1.01 -1.46 114.38 115.27 3hu3 h ARG 323 Ca 0.15 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.16 3hu3 h ARG 323 Cb 0.37 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 3hu3 h ARG 323 CO 0.01 0.58 0.06 0.82 -1.51 0.00 0.00 179.97 179.92 3hu3 h ILE 324 N 0.76 1.26 -0.52 1.20 2.04 -1.16 0.69 117.51 121.79 3hu3 h ILE 324 Ca 0.20 -1.09 0.01 0.00 1.00 0.00 0.00 64.86 64.98 3hu3 h ILE 324 Cb 0.01 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 3hu3 h ILE 324 CO -0.04 0.40 0.33 0.58 0.00 0.00 0.00 178.15 179.43 3hu3 h VAL 325 N 0.99 1.11 -0.82 1.67 2.07 -1.37 -2.27 116.25 117.63 3hu3 h VAL 325 Ca 0.19 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.49 3hu3 h VAL 325 Cb 0.50 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 3hu3 h VAL 325 CO 0.02 0.12 0.54 0.28 0.02 0.00 0.00 177.57 178.55 3hu3 h SER 326 N 0.67 0.91 -0.90 0.57 0.02 -0.96 -2.37 113.55 111.49 3hu3 h SER 326 Ca 0.20 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 3hu3 h SER 326 Cb -0.05 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 3hu3 h SER 326 CO -0.06 0.65 0.58 -0.61 -1.14 0.00 0.00 176.83 176.25 3hu3 h GLN 327 N 1.08 1.20 -0.27 3.45 5.75 -0.49 -1.34 115.11 124.49 3hu3 h GLN 327 Ca 0.31 -0.09 -0.09 0.00 -0.15 0.00 0.00 58.65 58.64 3hu3 h GLN 327 Cb -0.07 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.21 3hu3 h GLN 327 CO -0.08 0.81 -0.16 1.25 -2.65 0.00 0.00 178.83 178.00 3hu3 h LEU 328 N 1.23 0.61 -0.73 -2.39 5.85 -1.26 -1.53 115.31 117.09 3hu3 h LEU 328 Ca 0.33 -0.43 0.10 0.00 0.84 0.00 0.00 57.88 58.72 3hu3 h LEU 328 Cb -0.11 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 40.67 3hu3 h LEU 328 CO -0.07 0.91 0.37 -0.07 -0.34 0.00 0.00 178.44 179.23 3hu3 h LEU 329 N 0.32 0.47 -0.70 2.25 4.07 -1.20 0.14 115.31 120.66 3hu3 h LEU 329 Ca 0.06 0.06 -0.08 0.00 0.08 0.00 0.00 57.88 58.00 3hu3 h LEU 329 Cb 0.69 -0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.39 3hu3 h LEU 329 CO 0.05 0.26 0.13 0.74 -1.08 0.00 0.00 178.44 178.53 3hu3 h THR 330 N 0.61 1.26 -0.28 0.22 2.02 -1.07 -1.73 112.91 113.94 3hu3 h THR 330 Ca 0.37 -1.03 -0.14 0.00 0.77 0.00 0.00 66.41 66.38 3hu3 h THR 330 Cb 0.40 0.60 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 3hu3 h THR 330 CO -0.28 0.39 -0.39 -0.07 0.37 0.00 0.00 175.52 175.54 3hu3 h LEU 331 N 1.06 0.69 -0.12 2.58 3.38 -0.62 0.12 115.31 122.41 3hu3 h LEU 331 Ca 0.21 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 3hu3 h LEU 331 Cb 0.43 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3hu3 h LEU 331 CO 0.01 1.00 0.00 0.24 0.09 0.00 0.00 178.44 179.79 3hu3 h MET 332 N 0.54 0.20 -0.45 1.13 2.86 -0.59 -2.89 114.93 115.73 3hu3 h MET 332 Ca 0.05 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3hu3 h MET 332 Cb 0.91 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.52 3hu3 h MET 332 CO 0.08 0.44 0.17 -0.44 1.06 0.00 0.00 176.91 178.22 3hu3 h ASP 333 N -0.06 0.58 0.68 1.22 3.32 -1.29 -3.13 116.42 117.75 3hu3 h ASP 333 Ca 0.03 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.02 3hu3 h ASP 333 Cb 0.35 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.75 3hu3 h ASP 333 CO 0.01 0.54 0.00 0.61 -1.72 0.00 0.00 179.24 178.68 3hu3 n GLY 334 N -1.12 -1.24 3.56 2.75 0.00 0.42 -4.64 105.19 104.92 3hu3 n GLY 334 Ca 0.03 0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3hu3 n GLY 334 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hu3 s LEU 335 N -4.38 3.29 0.70 0.99 1.43 -1.17 -4.97 118.68 114.56 3hu3 s LEU 335 Ca 0.04 0.02 -0.17 0.00 -1.03 0.00 0.00 54.13 53.00 3hu3 s LEU 335 Cb 0.09 -2.75 -0.04 0.00 0.03 0.00 0.00 46.19 43.52 3hu3 s LEU 335 CO 0.38 -1.91 0.57 0.29 0.23 0.00 0.00 176.35 175.91 3hu3 n LYS 336 N 9.05 0.37 0.27 1.70 5.02 -1.26 -4.86 118.16 128.44 3hu3 n LYS 336 Ca 0.11 0.16 0.11 0.00 -2.02 0.00 0.00 58.31 56.67 3hu3 n LYS 336 Cb 0.50 -1.85 0.73 0.00 -0.02 0.00 0.00 35.03 34.39 3hu3 n LYS 336 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 3hu3 h GLN 337 N -0.24 0.00 -0.63 1.97 7.50 -1.96 -1.90 115.11 119.85 3hu3 h GLN 337 Ca -0.46 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.69 3hu3 h GLN 337 Cb 1.36 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.89 3hu3 h GLN 337 CO 0.44 0.07 0.00 2.89 -1.50 0.00 0.00 178.83 180.73 3hu3 n ARG 338 N -4.02 4.20 0.23 1.46 -4.01 -1.26 -4.44 116.66 108.82 3hu3 n ARG 338 Ca -0.03 -2.91 0.12 0.00 -1.04 0.00 0.00 57.85 54.00 3hu3 n ARG 338 Cb 0.16 -2.06 0.34 0.00 -3.04 0.00 0.00 32.46 27.86 3hu3 n ARG 338 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 3hu3 h ALA 339 N 4.03 0.96 -5.95 2.89 0.00 -1.68 -3.47 119.26 116.04 3hu3 h ALA 339 Ca 0.00 -0.09 -0.40 0.00 0.00 0.00 0.00 54.91 54.42 3hu3 h ALA 339 Cb 1.67 -0.02 0.09 0.00 0.00 0.00 0.00 17.79 19.54 3hu3 h ALA 339 CO 0.35 0.12 -0.76 0.72 0.00 0.00 0.00 179.25 179.69 3hu3 n HIS 340 N -3.16 -2.35 -4.38 0.00 8.25 -1.26 -4.76 115.22 107.55 3hu3 n HIS 340 Ca 0.02 0.93 -0.28 0.00 -0.26 0.00 0.00 57.72 58.14 3hu3 n HIS 340 Cb 0.48 -4.68 -0.17 0.00 1.12 0.00 0.00 29.99 26.74 3hu3 n HIS 340 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3hu3 s VAL 341 N -3.41 1.36 -0.13 1.59 1.01 -1.26 -1.84 120.40 117.72 3hu3 s VAL 341 Ca 0.31 -0.56 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 3hu3 s VAL 341 Cb -0.15 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.95 3hu3 s VAL 341 CO 0.77 0.41 -0.05 -0.63 0.00 0.00 0.00 175.10 175.60 3hu3 s ILE 342 N 1.05 3.81 -0.26 2.22 -1.09 -0.73 -4.91 121.20 121.30 3hu3 s ILE 342 Ca -0.06 -0.40 -0.08 0.00 -2.23 0.00 0.00 60.65 57.88 3hu3 s ILE 342 Cb -0.15 -2.64 -0.03 0.00 -1.58 0.00 0.00 42.46 38.06 3hu3 s ILE 342 CO -0.02 0.52 0.10 -0.69 -1.23 0.00 0.00 174.94 173.63 3hu3 s VAL 343 N 0.07 4.60 0.14 2.92 1.01 0.38 -0.94 120.40 128.59 3hu3 s VAL 343 Ca -0.01 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.92 3hu3 s VAL 343 Cb -0.14 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 3hu3 s VAL 343 CO 0.03 0.32 0.27 -0.04 0.00 0.00 0.00 175.10 175.68 3hu3 s MET 344 N 1.62 3.41 0.14 2.72 -1.94 0.26 -0.71 119.30 124.80 3hu3 s MET 344 Ca 0.06 -0.59 -0.07 0.00 -1.71 0.00 0.00 55.69 53.38 3hu3 s MET 344 Cb -0.15 -2.96 -0.02 0.00 2.01 0.00 0.00 34.83 33.71 3hu3 s MET 344 CO 0.06 0.53 0.21 0.00 -0.01 0.00 0.00 175.02 175.80 3hu3 s ALA 345 N -1.72 0.16 0.04 3.03 0.00 0.13 -0.26 121.76 123.15 3hu3 s ALA 345 Ca 0.34 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.33 3hu3 s ALA 345 Cb -0.11 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 3hu3 s ALA 345 CO 0.28 -0.58 -0.04 0.00 0.00 0.00 0.00 175.76 175.42 3hu3 s ALA 346 N -3.96 0.35 -0.07 0.00 0.00 -0.84 -0.07 121.76 117.16 3hu3 s ALA 346 Ca 0.16 -0.79 -0.29 0.00 0.00 0.00 0.00 51.96 51.03 3hu3 s ALA 346 Cb 0.05 0.15 0.07 0.00 0.00 0.00 0.00 23.12 23.38 3hu3 s ALA 346 CO -0.02 -0.17 0.66 -0.08 0.00 0.00 0.00 175.76 176.15 3hu3 s THR 347 N -2.04 0.00 -2.21 0.00 -1.32 -0.38 -0.68 115.64 109.02 3hu3 s THR 347 Ca -0.09 -0.02 0.21 0.00 -1.21 0.00 0.00 61.69 60.58 3hu3 s THR 347 Cb -0.06 -0.98 0.36 0.00 -1.51 0.00 0.00 72.50 70.32 3hu3 s THR 347 CO -0.03 -0.01 1.32 -0.46 -2.21 0.00 0.00 174.62 173.23 3hu3 n ASN 348 N 1.14 3.23 -3.23 8.08 0.23 -1.26 -2.70 115.26 120.75 3hu3 n ASN 348 Ca -0.19 -1.94 -0.24 0.00 -0.53 0.00 0.00 54.58 51.69 3hu3 n ASN 348 Cb 0.57 -0.21 -0.07 0.00 -2.08 0.00 0.00 39.78 37.99 3hu3 n ASN 348 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3hu3 n ARG 349 N 1.29 1.07 0.12 -3.83 1.74 -1.26 -4.73 116.66 111.06 3hu3 n ARG 349 Ca 0.17 -3.50 0.00 0.00 -0.77 0.00 0.00 57.85 53.75 3hu3 n ARG 349 Cb 0.55 -1.42 0.29 0.00 -1.02 0.00 0.00 32.46 30.86 3hu3 n ARG 349 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3hu3 h PRO 350 N 3.98 0.19 0.00 5.56 0.13 -1.95 -2.54 132.00 137.37 3hu3 h PRO 350 Ca 0.09 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 3hu3 h PRO 350 Cb 0.84 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.96 3hu3 h PRO 350 CO 0.53 0.50 0.00 0.09 -0.23 0.00 0.00 178.00 178.89 3hu3 n ASN 351 N -4.10 0.00 -0.47 1.44 3.02 -1.26 -2.03 115.26 111.85 3hu3 n ASN 351 Ca -0.01 -0.02 0.11 0.00 -0.03 0.00 0.00 54.58 54.63 3hu3 n ASN 351 Cb 0.41 -0.26 0.07 0.00 -0.61 0.00 0.00 39.78 39.39 3hu3 n ASN 351 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3hu3 n SER 352 N -1.26 1.90 -4.77 6.41 7.64 -0.95 -4.92 113.62 117.67 3hu3 n SER 352 Ca 0.09 -1.43 -0.40 0.00 1.01 0.00 0.00 58.87 58.14 3hu3 n SER 352 Cb 0.13 0.40 -0.06 0.00 -1.01 0.00 0.00 64.21 63.67 3hu3 n SER 352 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3hu3 s ILE 353 N -2.46 4.45 -0.18 0.44 1.01 -0.86 -2.56 121.20 121.04 3hu3 s ILE 353 Ca 0.20 1.70 -0.38 0.00 0.00 0.00 0.00 60.65 62.17 3hu3 s ILE 353 Cb 0.18 -4.14 -0.15 0.00 0.01 0.00 0.00 42.46 38.37 3hu3 s ILE 353 CO 0.55 0.48 1.75 -0.67 0.00 0.00 0.00 174.94 177.05 3hu3 n ASP 354 N 1.89 2.66 0.10 3.58 -0.08 -0.50 -4.60 116.55 119.59 3hu3 n ASP 354 Ca -0.05 1.05 0.17 0.00 -1.51 0.00 0.00 54.79 54.45 3hu3 n ASP 354 Cb 0.49 -1.22 0.70 0.00 2.34 0.00 0.00 41.12 43.43 3hu3 n ASP 354 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hu3 h PRO 355 N 7.52 0.00 -0.39 -0.67 0.11 -1.93 -1.26 132.00 135.37 3hu3 h PRO 355 Ca -0.47 0.00 0.07 0.00 0.11 0.00 0.00 66.00 65.71 3hu3 h PRO 355 Cb 1.30 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.39 3hu3 h PRO 355 CO 0.94 0.00 0.27 0.00 -0.21 0.00 0.00 178.00 179.00 3hu3 h ALA 356 N 1.79 2.07 0.00 -0.75 0.00 -2.00 -0.66 119.26 119.72 3hu3 h ALA 356 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3hu3 h ALA 356 Cb 0.70 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3hu3 h ALA 356 CO -0.00 -0.16 0.00 1.28 0.00 0.00 0.00 179.25 180.37 3hu3 n LEU 357 N -4.47 0.22 -1.10 0.00 4.77 -0.48 -3.16 117.00 112.78 3hu3 n LEU 357 Ca 0.05 0.54 0.08 0.00 -0.03 0.00 0.00 56.01 56.66 3hu3 n LEU 357 Cb 0.30 -0.50 0.26 0.00 -2.33 0.00 0.00 43.42 41.15 3hu3 n LEU 357 CO 0.35 -0.26 0.73 0.54 -1.33 0.00 0.00 177.39 177.41 3hu3 n ARG 358 N -1.73 3.14 -2.57 3.23 1.74 -0.25 -1.23 116.66 118.98 3hu3 n ARG 358 Ca 0.04 -2.55 -0.34 0.00 -0.77 0.00 0.00 57.85 54.23 3hu3 n ARG 358 Cb 0.24 -1.61 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 3hu3 n ARG 358 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3hu3 s ARG 359 N -1.55 3.86 -0.11 5.56 1.81 -1.19 -4.57 118.95 122.77 3hu3 s ARG 359 Ca 0.39 1.35 -0.15 0.00 -1.72 0.00 0.00 55.73 55.61 3hu3 s ARG 359 Cb 0.24 -2.14 -0.07 0.00 -0.45 0.00 0.00 34.95 32.54 3hu3 s ARG 359 CO 0.21 -0.38 0.47 0.34 -0.68 0.00 0.00 175.30 175.26 3hu3 n PHE 360 N -0.86 0.45 -0.40 -0.53 -0.00 -1.26 -0.97 117.46 113.89 3hu3 n PHE 360 Ca 0.09 0.37 0.00 0.00 -0.00 0.00 0.00 57.45 57.91 3hu3 n PHE 360 Cb 0.52 -0.72 0.00 0.00 -0.00 0.00 0.00 39.48 39.28 3hu3 n PHE 360 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3hu3 n GLY 361 N 1.04 0.97 0.00 7.13 0.00 -1.26 -4.97 105.19 108.09 3hu3 n GLY 361 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3hu3 n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu3 n ARG 362 N -2.00 0.00 -2.81 1.61 1.74 -0.14 -4.85 116.66 110.20 3hu3 n ARG 362 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 3hu3 n ARG 362 Cb 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.42 3hu3 n ARG 362 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3hu3 s PHE 363 N 3.22 3.06 -0.73 -1.55 0.08 -0.37 -2.84 117.98 118.85 3hu3 s PHE 363 Ca 0.00 -1.50 0.08 0.00 0.12 0.00 0.00 56.93 55.63 3hu3 s PHE 363 Cb 0.00 -4.43 0.22 0.00 -0.57 0.00 0.00 43.02 38.24 3hu3 s PHE 363 CO 0.00 -1.60 1.17 -0.40 -0.10 0.00 0.00 175.22 174.29 3hu3 n ASP 364 N 7.02 2.65 -4.24 1.36 5.68 -1.12 -4.36 116.55 123.54 3hu3 n ASP 364 Ca 0.32 -1.96 -0.18 0.00 -0.50 0.00 0.00 54.79 52.47 3hu3 n ASP 364 Cb 0.47 -0.17 -0.11 0.00 -1.14 0.00 0.00 41.12 40.18 3hu3 n ASP 364 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 3hu3 s ARG 365 N -0.98 1.03 -0.02 0.11 1.81 -1.04 -5.01 118.95 114.85 3hu3 s ARG 365 Ca 0.17 -1.25 -0.04 0.00 -1.72 0.00 0.00 55.73 52.90 3hu3 s ARG 365 Cb 0.09 -0.90 0.00 0.00 -0.45 0.00 0.00 34.95 33.69 3hu3 s ARG 365 CO 0.12 0.17 0.09 -1.21 -0.68 0.00 0.00 175.30 173.79 3hu3 s GLU 366 N -2.70 0.25 -0.10 3.54 2.02 -1.26 -1.18 118.70 119.26 3hu3 s GLU 366 Ca 0.09 -0.15 -0.01 0.00 0.02 0.00 0.00 54.97 54.92 3hu3 s GLU 366 Cb -0.05 0.11 0.03 0.00 0.10 0.00 0.00 34.13 34.32 3hu3 s GLU 366 CO 0.03 -0.05 -0.02 0.08 0.02 0.00 0.00 175.26 175.33 3hu3 s VAL 367 N -0.62 0.60 -0.51 2.63 1.01 0.62 -4.93 120.40 119.21 3hu3 s VAL 367 Ca -0.07 -0.11 -0.26 0.00 0.00 0.00 0.00 61.98 61.54 3hu3 s VAL 367 Cb -0.04 -0.77 0.03 0.00 0.00 0.00 0.00 36.38 35.60 3hu3 s VAL 367 CO 0.00 0.22 1.00 -0.62 0.00 0.00 0.00 175.10 175.70 3hu3 s ASP 368 N 1.87 6.45 -0.89 3.32 -1.08 -1.26 -1.44 116.67 123.64 3hu3 s ASP 368 Ca 0.04 0.00 -0.15 0.00 -0.52 0.00 0.00 52.55 51.92 3hu3 s ASP 368 Cb -0.13 -2.47 0.19 0.00 -1.46 0.00 0.00 42.92 39.05 3hu3 s ASP 368 CO -0.06 -1.20 0.93 -0.63 0.52 0.00 0.00 175.17 174.72 3hu3 s ILE 369 N 4.09 5.34 0.00 4.11 -1.09 0.82 -4.95 121.20 129.52 3hu3 s ILE 369 Ca 0.37 -2.26 0.00 0.00 -2.23 0.00 0.00 60.65 56.53 3hu3 s ILE 369 Cb -0.10 -4.59 0.00 0.00 -1.58 0.00 0.00 42.46 36.19 3hu3 s ILE 369 CO 0.25 -1.21 0.00 0.61 -1.23 0.00 0.00 174.94 173.35 3hu3 n GLY 370 N 4.37 3.99 3.70 6.18 0.00 -1.26 -4.08 105.19 118.09 3hu3 n GLY 370 Ca 0.19 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 3hu3 n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hu3 s ILE 371 N 2.01 4.53 0.76 -0.61 1.01 -1.26 -4.90 121.20 122.74 3hu3 s ILE 371 Ca 0.00 1.82 -0.11 0.00 0.00 0.00 0.00 60.65 62.36 3hu3 s ILE 371 Cb 0.00 -4.17 0.05 0.00 0.01 0.00 0.00 42.46 38.35 3hu3 s ILE 371 CO 0.00 0.06 1.08 -2.16 0.00 0.00 0.00 174.94 173.92 3hu3 s PRO 372 N 1.69 2.41 0.15 2.79 0.04 -1.26 -5.07 135.00 135.74 3hu3 s PRO 372 Ca 0.53 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.59 3hu3 s PRO 372 Cb -0.23 -1.93 0.03 0.00 0.04 0.00 0.00 34.50 32.42 3hu3 s PRO 372 CO 0.23 -1.49 0.21 -0.40 0.04 0.00 0.00 177.00 175.59 3hu3 n ASP 373 N -3.40 0.30 -0.28 6.66 5.68 -1.26 -4.82 116.55 119.43 3hu3 n ASP 373 Ca 0.08 -1.25 -0.06 0.00 -0.50 0.00 0.00 54.79 53.06 3hu3 n ASP 373 Cb 0.54 -0.13 0.06 0.00 -1.14 0.00 0.00 41.12 40.44 3hu3 n ASP 373 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hu3 h ALA 374 N -0.41 0.99 -0.60 2.12 0.00 -1.98 0.21 119.26 119.60 3hu3 h ALA 374 Ca -0.07 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 3hu3 h ALA 374 Cb 0.26 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 3hu3 h ALA 374 CO 0.08 0.64 0.16 1.15 0.00 0.00 0.00 179.25 181.28 3hu3 h THR 375 N 1.11 1.24 -0.02 0.00 2.02 -1.95 -1.92 112.91 113.39 3hu3 h THR 375 Ca 0.25 -0.84 -0.23 0.00 0.77 0.00 0.00 66.41 66.37 3hu3 h THR 375 Cb 0.24 0.60 0.01 0.00 -1.74 0.00 0.00 68.15 67.26 3hu3 h THR 375 CO -0.02 0.32 -0.92 1.23 0.37 0.00 0.00 175.52 176.50 3hu3 h GLY 376 N 1.01 0.55 0.95 2.16 0.00 -1.75 -2.33 103.07 103.66 3hu3 h GLY 376 Ca 0.20 -0.92 0.04 0.00 0.00 0.00 0.00 47.33 46.65 3hu3 h GLY 376 CO -0.00 0.81 0.60 3.21 0.00 0.00 0.00 176.54 181.16 3hu3 h ARG 377 N 0.29 1.09 -0.32 4.80 3.08 -0.47 -0.98 114.38 121.86 3hu3 h ARG 377 Ca -0.08 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.85 3hu3 h ARG 377 Cb 1.55 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 31.34 3hu3 h ARG 377 CO 0.17 0.72 -0.01 1.25 -1.07 0.00 0.00 179.97 181.02 3hu3 h LEU 378 N 1.12 0.57 -0.48 3.04 5.85 -1.27 0.37 115.31 124.52 3hu3 h LEU 378 Ca 0.37 -0.32 0.08 0.00 0.84 0.00 0.00 57.88 58.85 3hu3 h LEU 378 Cb 0.05 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 40.86 3hu3 h LEU 378 CO -0.12 0.75 0.07 -0.33 -0.34 0.00 0.00 178.44 178.48 3hu3 h GLU 379 N 0.38 0.19 -0.57 1.25 5.08 -1.06 -0.51 114.58 119.34 3hu3 h GLU 379 Ca 0.09 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 3hu3 h GLU 379 Cb 0.47 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 3hu3 h GLU 379 CO 0.02 0.13 0.07 0.82 -1.00 0.00 0.00 179.01 179.04 3hu3 h ILE 380 N 0.20 1.26 -0.19 3.13 2.04 -0.86 -1.79 117.51 121.29 3hu3 h ILE 380 Ca 0.24 -1.02 -0.07 0.00 1.00 0.00 0.00 64.86 65.01 3hu3 h ILE 380 Cb 0.33 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3hu3 h ILE 380 CO -0.34 0.37 -0.21 -0.07 0.00 0.00 0.00 178.15 177.90 3hu3 h LEU 381 N 0.85 0.32 -0.59 1.44 3.38 -0.47 -1.97 115.31 118.28 3hu3 h LEU 381 Ca 0.17 -0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 3hu3 h LEU 381 Cb 0.45 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3hu3 h LEU 381 CO 0.02 0.55 -0.35 1.56 0.09 0.00 0.00 178.44 180.31 3hu3 h GLN 382 N 0.30 0.74 -0.29 1.13 4.20 -0.75 -2.62 115.11 117.82 3hu3 h GLN 382 Ca 0.05 -0.36 -0.05 0.00 0.06 0.00 0.00 58.65 58.35 3hu3 h GLN 382 Cb 0.55 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 3hu3 h GLN 382 CO 0.04 0.97 -0.01 0.82 -0.67 0.00 0.00 178.83 179.98 3hu3 h ILE 383 N 0.61 1.26 -0.00 2.54 2.04 -1.03 -2.76 117.51 120.18 3hu3 h ILE 383 Ca 0.06 -0.97 0.00 0.00 1.00 0.00 0.00 64.86 64.95 3hu3 h ILE 383 Cb 0.89 1.33 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 3hu3 h ILE 383 CO 0.08 0.31 -0.03 1.41 0.00 0.00 0.00 178.15 179.92 3hu3 n HIS 384 N -4.57 0.00 0.16 1.37 8.25 -0.77 -2.98 115.22 116.68 3hu3 n HIS 384 Ca -0.03 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.48 3hu3 n HIS 384 Cb 0.27 -0.33 0.08 0.00 1.12 0.00 0.00 29.99 31.13 3hu3 n HIS 384 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 3hu3 n THR 385 N -1.31 0.43 0.07 1.59 -2.24 -0.99 -4.75 114.28 107.08 3hu3 n THR 385 Ca 0.12 -0.71 0.03 0.00 -2.27 0.00 0.00 64.05 61.22 3hu3 n THR 385 Cb 0.27 0.90 0.42 0.00 -2.10 0.00 0.00 70.33 69.82 3hu3 n THR 385 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3hu3 h LYS 386 N 1.78 0.37 -0.52 -0.78 2.10 -1.38 -0.02 116.57 118.12 3hu3 h LYS 386 Ca 0.00 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.60 3hu3 h LYS 386 Cb 0.52 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 3hu3 h LYS 386 CO 0.00 0.35 0.00 0.09 -2.00 0.00 0.00 179.45 177.89 3hu3 n ASN 387 N -4.38 4.26 -4.76 7.07 3.02 -1.26 -4.94 115.26 114.27 3hu3 n ASN 387 Ca 0.01 -2.47 -0.34 0.00 -0.03 0.00 0.00 54.58 51.75 3hu3 n ASN 387 Cb 0.16 -0.51 -0.08 0.00 -0.61 0.00 0.00 39.78 38.75 3hu3 n ASN 387 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 3hu3 s MET 388 N -1.87 3.09 -0.56 3.52 1.75 -0.02 -5.06 119.30 120.15 3hu3 s MET 388 Ca 0.44 -0.41 -0.27 0.00 -1.25 0.00 0.00 55.69 54.20 3hu3 s MET 388 Cb 0.29 -2.88 0.03 0.00 2.84 0.00 0.00 34.83 35.11 3hu3 s MET 388 CO 0.20 0.68 1.14 0.15 -0.65 0.00 0.00 175.02 176.54 3hu3 s LYS 389 N -1.36 3.50 -0.11 4.11 1.02 -1.26 -4.99 119.74 120.65 3hu3 s LYS 389 Ca 0.19 0.19 -0.05 0.00 0.02 0.00 0.00 55.97 56.32 3hu3 s LYS 389 Cb -0.12 -4.01 -0.04 0.00 -0.52 0.00 0.00 37.83 33.15 3hu3 s LYS 389 CO 0.09 -1.60 0.08 -0.51 -0.92 0.00 0.00 175.35 172.49 3hu3 s LEU 390 N 4.69 4.06 1.01 3.17 1.43 -1.26 -1.23 118.68 130.55 3hu3 s LEU 390 Ca 0.41 0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 53.72 3hu3 s LEU 390 Cb -0.08 -1.97 0.20 0.00 0.03 0.00 0.00 46.19 44.37 3hu3 s LEU 390 CO 0.25 0.40 1.09 0.00 0.23 0.00 0.00 176.35 178.32 3hu3 s ALA 391 N -0.96 0.84 -0.10 4.21 0.00 0.38 -4.84 121.76 121.29 3hu3 s ALA 391 Ca 0.14 -0.35 0.21 0.00 0.00 0.00 0.00 51.96 51.96 3hu3 s ALA 391 Cb -0.12 -3.12 0.48 0.00 0.00 0.00 0.00 23.12 20.36 3hu3 s ALA 391 CO 0.03 -2.92 1.64 -0.44 0.00 0.00 0.00 175.76 174.07 3hu3 h ASP 392 N -1.96 0.00 0.94 0.00 3.32 -1.99 -3.13 116.42 113.61 3hu3 h ASP 392 Ca -0.55 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.50 3hu3 h ASP 392 Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 3hu3 h ASP 392 CO 0.57 0.28 0.00 -0.90 -1.72 0.00 0.00 179.24 177.48 3hu3 n ASP 393 N -3.25 0.06 -4.62 6.45 5.75 -1.26 -4.83 116.55 114.85 3hu3 n ASP 393 Ca 0.02 0.51 -0.43 0.00 -0.01 0.00 0.00 54.79 54.88 3hu3 n ASP 393 Cb 0.57 -0.52 -0.03 0.00 -1.03 0.00 0.00 41.12 40.10 3hu3 n ASP 393 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3hu3 s VAL 394 N -3.01 3.10 -0.41 2.12 1.01 -1.18 -4.56 120.40 117.46 3hu3 s VAL 394 Ca 0.12 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.15 3hu3 s VAL 394 Cb 0.17 -3.11 0.09 0.00 0.00 0.00 0.00 36.38 33.53 3hu3 s VAL 394 CO 0.49 -0.05 0.23 -0.62 0.00 0.00 0.00 175.10 175.15 3hu3 s ASP 395 N 6.53 5.44 0.25 3.32 2.15 -1.26 -4.97 116.67 128.13 3hu3 s ASP 395 Ca 0.93 -1.73 0.08 0.00 0.43 0.00 0.00 52.55 52.26 3hu3 s ASP 395 Cb -0.35 -1.91 0.27 0.00 -0.30 0.00 0.00 42.92 40.63 3hu3 s ASP 395 CO 0.37 -0.54 1.56 -0.07 -0.17 0.00 0.00 175.17 176.32 3hu3 h LEU 396 N 8.25 0.08 -1.04 -1.34 3.38 -1.99 -2.44 115.31 120.21 3hu3 h LEU 396 Ca -0.19 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 3hu3 h LEU 396 Cb 1.07 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 3hu3 h LEU 396 CO 0.73 0.72 0.07 -0.08 0.09 0.00 0.00 178.44 179.97 3hu3 h GLU 397 N 0.05 0.76 -0.43 1.13 4.81 -1.95 0.41 114.58 119.36 3hu3 h GLU 397 Ca -0.01 -0.17 -0.14 0.00 -0.13 0.00 0.00 59.36 58.91 3hu3 h GLU 397 Cb 1.17 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 3hu3 h GLU 397 CO 0.09 0.72 -0.29 0.37 -0.73 0.00 0.00 179.01 179.17 3hu3 h GLN 398 N 0.73 0.94 -0.54 1.92 5.75 -1.94 0.47 115.11 122.44 3hu3 h GLN 398 Ca 0.16 -0.44 -0.02 0.00 -0.15 0.00 0.00 58.65 58.20 3hu3 h GLN 398 Cb 0.34 -0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.85 3hu3 h GLN 398 CO 0.01 1.10 0.24 0.28 -2.65 0.00 0.00 178.83 177.81 3hu3 h VAL 399 N 0.79 1.21 -0.35 2.39 2.07 -0.89 -2.74 116.25 118.73 3hu3 h VAL 399 Ca 0.09 -0.61 0.06 0.00 0.82 0.00 0.00 66.70 67.07 3hu3 h VAL 399 Cb 0.87 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 3hu3 h VAL 399 CO 0.08 0.24 -0.02 0.00 0.02 0.00 0.00 177.57 177.88 3hu3 h ALA 400 N 1.08 0.30 0.00 1.67 0.00 0.34 -2.22 119.26 120.43 3hu3 h ALA 400 Ca 0.18 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 3hu3 h ALA 400 Cb 0.15 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hu3 h ALA 400 CO -0.02 -0.42 -0.01 -0.91 0.00 0.00 0.00 179.25 177.90 3hu3 h ASN 401 N 0.07 0.00 -0.63 0.00 2.35 -0.77 -2.91 115.58 113.68 3hu3 h ASN 401 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3hu3 h ASN 401 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 3hu3 h ASN 401 CO -0.30 0.01 0.00 -0.62 -1.65 0.00 0.00 177.43 174.86 3hu3 n GLU 402 N -3.97 3.17 -2.15 0.81 1.02 -0.85 -4.44 120.64 114.24 3hu3 n GLU 402 Ca -0.03 -2.69 -0.24 0.00 -0.02 0.00 0.00 57.16 54.18 3hu3 n GLU 402 Cb 0.09 -1.67 0.02 0.00 -0.02 0.00 0.00 31.44 29.85 3hu3 n GLU 402 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3hu3 n THR 403 N 1.21 2.45 -1.95 2.62 -2.24 -1.10 -5.06 114.28 110.21 3hu3 n THR 403 Ca 0.23 -4.35 -0.41 0.00 -2.27 0.00 0.00 64.05 57.26 3hu3 n THR 403 Cb 0.72 -1.10 -0.01 0.00 -2.10 0.00 0.00 70.33 67.84 3hu3 n THR 403 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3hu3 s HIS 404 N -3.59 2.83 0.00 4.78 5.04 -1.26 -1.69 115.29 121.40 3hu3 s HIS 404 Ca 0.50 1.22 0.00 0.00 -1.54 0.00 0.00 55.06 55.23 3hu3 s HIS 404 Cb 0.41 -3.87 0.00 0.00 0.04 0.00 0.00 32.58 29.16 3hu3 s HIS 404 CO -0.02 -2.56 0.00 0.41 -2.34 0.00 0.00 174.74 170.23 3hu3 n GLY 405 N 0.94 2.48 3.75 1.59 0.00 -1.26 -5.03 105.19 107.66 3hu3 n GLY 405 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 3hu3 n GLY 405 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hu3 s HIS 406 N -2.47 3.40 0.49 1.61 4.02 -0.68 -4.99 115.29 116.67 3hu3 s HIS 406 Ca 0.00 1.49 0.08 0.00 1.02 0.00 0.00 55.06 57.66 3hu3 s HIS 406 Cb 0.00 -3.44 0.04 0.00 -1.02 0.00 0.00 32.58 28.16 3hu3 s HIS 406 CO 0.00 -1.16 0.63 0.14 1.02 0.00 0.00 174.74 175.37 3hu3 s VAL 407 N -0.57 2.53 0.30 -0.90 -7.23 -1.26 -4.41 120.40 108.85 3hu3 s VAL 407 Ca 0.50 -1.07 0.04 0.00 -1.81 0.00 0.00 61.98 59.64 3hu3 s VAL 407 Cb -0.34 -2.60 0.31 0.00 0.56 0.00 0.00 36.38 34.31 3hu3 s VAL 407 CO 0.41 0.00 1.65 1.23 -0.31 0.00 0.00 175.10 178.08 3hu3 h GLY 408 N 0.50 1.46 1.63 2.32 0.00 -1.82 -0.42 103.07 106.74 3hu3 h GLY 408 Ca -0.36 -0.06 -0.11 0.00 0.00 0.00 0.00 47.33 46.79 3hu3 h GLY 408 CO 0.45 -0.38 -0.37 0.00 0.00 0.00 0.00 176.54 176.24 3hu3 h ALA 409 N 1.79 1.01 -0.12 3.60 0.00 -1.43 -1.31 119.26 122.80 3hu3 h ALA 409 Ca 0.58 -0.41 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 3hu3 h ALA 409 Cb 1.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 3hu3 h ALA 409 CO -0.65 0.60 -0.39 -0.44 0.00 0.00 0.00 179.25 178.38 3hu3 h ASP 410 N 0.35 0.26 -0.23 0.00 3.32 -1.39 -2.00 116.42 116.73 3hu3 h ASP 410 Ca 0.04 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 56.82 3hu3 h ASP 410 Cb 0.81 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.29 3hu3 h ASP 410 CO 0.07 0.64 -0.47 -0.07 -1.72 0.00 0.00 179.24 177.68 3hu3 h LEU 411 N 0.22 0.82 -0.87 1.55 3.38 -1.00 -1.49 115.31 117.91 3hu3 h LEU 411 Ca 0.02 -0.55 -0.05 0.00 0.09 0.00 0.00 57.88 57.40 3hu3 h LEU 411 Cb 0.79 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 3hu3 h LEU 411 CO 0.06 1.22 0.28 0.00 0.09 0.00 0.00 178.44 180.09 3hu3 h ALA 412 N 0.63 1.09 -0.43 1.53 0.00 -1.23 -1.02 119.26 119.83 3hu3 h ALA 412 Ca 0.01 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 3hu3 h ALA 412 Cb 1.08 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3hu3 h ALA 412 CO 0.11 0.64 0.02 0.00 0.00 0.00 0.00 179.25 180.02 3hu3 h ALA 413 N 1.22 0.57 -0.52 0.00 0.00 -1.35 -1.57 119.26 117.62 3hu3 h ALA 413 Ca 0.25 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 54.96 3hu3 h ALA 413 Cb 0.23 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 3hu3 h ALA 413 CO -0.02 0.34 0.23 1.25 0.00 0.00 0.00 179.25 181.06 3hu3 h LEU 414 N 0.58 0.30 -0.52 0.00 5.85 -1.05 -0.63 115.31 119.85 3hu3 h LEU 414 Ca 0.12 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3hu3 h LEU 414 Cb 0.45 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.45 3hu3 h LEU 414 CO 0.02 0.21 0.27 0.00 -0.34 0.00 0.00 178.44 178.59 3hu3 h SER 416 N 0.69 1.08 -0.46 0.00 0.02 -1.05 -1.96 113.55 111.87 3hu3 h SER 416 Ca 0.18 -0.14 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 3hu3 h SER 416 Cb 0.08 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 3hu3 h SER 416 CO -0.03 0.93 0.00 -0.33 -1.14 0.00 0.00 176.83 176.26 3hu3 h GLU 417 N 1.17 0.81 -0.66 3.45 4.39 -0.83 0.10 114.58 123.02 3hu3 h GLU 417 Ca 0.28 -0.26 0.02 0.00 0.34 0.00 0.00 59.36 59.74 3hu3 h GLU 417 Cb 0.15 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.69 3hu3 h GLU 417 CO -0.03 0.86 0.42 0.00 -1.16 0.00 0.00 179.01 179.10 3hu3 h ALA 418 N 0.92 0.85 -0.39 3.43 0.00 -1.18 0.71 119.26 123.60 3hu3 h ALA 418 Ca 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3hu3 h ALA 418 Cb 0.50 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3hu3 h ALA 418 CO 0.02 0.19 0.21 0.00 0.00 0.00 0.00 179.25 179.67 3hu3 h ALA 419 N 1.27 0.50 -0.43 0.00 0.00 -1.03 -0.74 119.26 118.82 3hu3 h ALA 419 Ca 0.26 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3hu3 h ALA 419 Cb -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3hu3 h ALA 419 CO -0.09 0.03 0.06 -0.07 0.00 0.00 0.00 179.25 179.19 3hu3 h LEU 420 N 0.49 0.62 -0.51 0.00 3.38 -0.51 -1.60 115.31 117.18 3hu3 h LEU 420 Ca 0.14 -0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 3hu3 h LEU 420 Cb 0.07 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3hu3 h LEU 420 CO -0.02 0.65 -0.20 -0.61 0.09 0.00 0.00 178.44 178.35 3hu3 h GLN 421 N 0.64 1.00 -0.97 1.13 5.75 -0.59 0.03 115.11 122.10 3hu3 h GLN 421 Ca 0.14 -0.42 0.05 0.00 -0.15 0.00 0.00 58.65 58.27 3hu3 h GLN 421 Cb 0.31 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.76 3hu3 h GLN 421 CO 0.00 1.10 0.63 0.00 -2.65 0.00 0.00 178.83 177.91 3hu3 h ALA 422 N 0.89 1.32 -0.29 3.38 0.00 -0.40 -1.97 119.26 122.20 3hu3 h ALA 422 Ca 0.12 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 3hu3 h ALA 422 Cb 0.78 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3hu3 h ALA 422 CO 0.06 0.46 -0.27 0.82 0.00 0.00 0.00 179.25 180.32 3hu3 h ILE 423 N 1.17 1.30 -0.91 0.00 2.04 -1.10 -3.13 117.51 116.89 3hu3 h ILE 423 Ca 0.40 -1.43 0.17 0.00 1.00 0.00 0.00 64.86 65.00 3hu3 h ILE 423 Cb 0.09 1.58 -0.07 0.00 -0.74 0.00 0.00 36.82 37.67 3hu3 h ILE 423 CO -0.15 0.46 0.59 -0.09 0.00 0.00 0.00 178.15 178.96 3hu3 h ARG 424 N 0.43 0.59 0.00 2.37 2.43 -0.63 -0.44 114.38 119.14 3hu3 h ARG 424 Ca 0.05 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3hu3 h ARG 424 Cb 0.83 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 3hu3 h ARG 424 CO 0.07 0.39 0.00 1.63 -1.51 0.00 0.00 179.97 180.55 3hu3 n LYS 425 N -4.58 0.12 -0.10 0.20 5.02 -0.77 -1.99 118.16 116.06 3hu3 n LYS 425 Ca 0.19 0.19 0.05 0.00 -2.02 0.00 0.00 58.31 56.72 3hu3 n LYS 425 Cb 0.56 -1.50 0.10 0.00 -0.02 0.00 0.00 35.03 34.17 3hu3 n LYS 425 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3hu3 n LYS 426 N -1.38 2.05 0.00 1.97 4.76 -0.18 -4.60 118.16 120.78 3hu3 n LYS 426 Ca 0.05 -1.68 0.02 0.00 -2.87 0.00 0.00 58.31 53.83 3hu3 n LYS 426 Cb 0.14 -1.21 0.09 0.00 -1.84 0.00 0.00 35.03 32.20 3hu3 n LYS 426 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 3hu3 n MET 427 N 0.42 0.07 -0.28 1.97 2.81 -0.84 -0.19 117.12 121.09 3hu3 n MET 427 Ca 0.08 0.13 0.10 0.00 -1.81 0.00 0.00 57.70 56.21 3hu3 n MET 427 Cb 0.35 -1.50 0.27 0.00 -0.71 0.00 0.00 33.22 31.63 3hu3 n MET 427 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3hu3 n ASP 428 N -1.15 3.28 0.00 7.83 8.00 -1.26 -4.06 116.55 129.20 3hu3 n ASP 428 Ca 0.02 -1.98 0.00 0.00 0.71 0.00 0.00 54.79 53.54 3hu3 n ASP 428 Cb 0.02 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 3hu3 n ASP 428 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3hu3 n LEU 429 N 1.31 0.07 -4.43 0.64 4.77 0.74 -5.04 117.00 115.07 3hu3 n LEU 429 Ca 0.20 -0.08 -0.33 0.00 -0.03 0.00 0.00 56.01 55.77 3hu3 n LEU 429 Cb 0.53 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.49 3hu3 n LEU 429 CO 0.15 0.02 -0.44 -0.63 -1.33 0.00 0.00 177.39 175.15 3hu3 s ILE 430 N -0.02 3.13 -0.12 -0.08 1.01 -0.94 -4.74 121.20 119.44 3hu3 s ILE 430 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 59.99 3hu3 s ILE 430 Cb 0.00 -2.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.17 3hu3 s ILE 430 CO 0.00 0.55 -0.12 -0.62 0.00 0.00 0.00 174.94 174.75 3hu3 s ASP 431 N -0.13 4.09 0.38 3.58 2.15 -1.26 -4.85 116.67 120.63 3hu3 s ASP 431 Ca -0.01 -0.29 0.14 0.00 0.43 0.00 0.00 52.55 52.82 3hu3 s ASP 431 Cb -0.14 -1.50 0.96 0.00 -0.30 0.00 0.00 42.92 41.94 3hu3 s ASP 431 CO 0.03 0.20 1.83 0.25 -0.17 0.00 0.00 175.17 177.31 3hu3 h LEU 432 N 6.47 0.54 -0.28 -1.34 5.85 -1.99 -3.04 115.31 121.51 3hu3 h LEU 432 Ca -0.29 0.06 -0.12 0.00 0.84 0.00 0.00 57.88 58.36 3hu3 h LEU 432 Cb 1.20 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 3hu3 h LEU 432 CO 0.55 0.21 -0.59 -0.33 -0.34 0.00 0.00 178.44 177.95 3hu3 h GLU 433 N 0.54 0.00 -6.73 1.25 4.39 -2.00 -3.46 114.58 108.57 3hu3 h GLU 433 Ca 0.50 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 59.62 3hu3 h GLU 433 Cb 1.06 0.00 0.15 0.00 -0.10 0.00 0.00 28.75 29.86 3hu3 h GLU 433 CO -0.23 0.59 0.15 -0.25 -1.16 0.00 0.00 179.01 178.11 3hu3 n ASP 434 N -3.36 1.07 0.22 1.42 8.00 -1.15 -4.88 116.55 117.86 3hu3 n ASP 434 Ca 0.01 0.93 0.12 0.00 0.71 0.00 0.00 54.79 56.55 3hu3 n ASP 434 Cb 0.72 -1.37 0.23 0.00 -0.02 0.00 0.00 41.12 40.68 3hu3 n ASP 434 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3hu3 h GLU 435 N 1.10 0.00 -4.36 -1.24 4.39 -1.92 -3.45 114.58 109.10 3hu3 h GLU 435 Ca -0.47 0.00 -0.44 0.00 0.34 0.00 0.00 59.36 58.80 3hu3 h GLU 435 Cb 1.35 0.00 -0.33 0.00 -0.10 0.00 0.00 28.75 29.67 3hu3 h GLU 435 CO 0.54 0.07 -0.79 0.95 -1.16 0.00 0.00 179.01 178.62 3hu3 s THR 436 N -3.26 0.77 0.16 1.13 -4.23 -1.26 -5.13 115.64 103.82 3hu3 s THR 436 Ca 0.06 -0.30 -0.30 0.00 -1.18 0.00 0.00 61.69 59.97 3hu3 s THR 436 Cb 0.06 -0.72 -0.07 0.00 1.34 0.00 0.00 72.50 73.11 3hu3 s THR 436 CO 0.66 0.26 0.98 -0.63 -0.54 0.00 0.00 174.62 175.35 3hu3 s ILE 437 N 0.56 4.26 -0.05 2.99 -1.09 -1.26 -4.98 121.20 121.64 3hu3 s ILE 437 Ca -0.09 2.01 -0.36 0.00 -2.23 0.00 0.00 60.65 59.97 3hu3 s ILE 437 Cb -0.12 -4.28 -0.15 0.00 -1.58 0.00 0.00 42.46 36.33 3hu3 s ILE 437 CO 0.01 0.37 1.64 -0.67 -1.23 0.00 0.00 174.94 175.06 3hu3 n ASP 438 N 2.30 2.60 -0.25 3.58 2.03 -1.26 -4.85 116.55 120.70 3hu3 n ASP 438 Ca 0.01 1.06 0.05 0.00 0.52 0.00 0.00 54.79 56.43 3hu3 n ASP 438 Cb 0.48 -1.27 0.18 0.00 -0.72 0.00 0.00 41.12 39.79 3hu3 n ASP 438 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hu3 h ALA 439 N 6.75 1.01 0.00 -1.67 0.00 -1.99 -1.03 119.26 122.33 3hu3 h ALA 439 Ca -0.47 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3hu3 h ALA 439 Cb 1.30 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3hu3 h ALA 439 CO 0.89 -0.24 0.00 1.49 0.00 0.00 0.00 179.25 181.39 3hu3 h GLU 440 N 0.40 0.00 0.05 0.00 4.57 -1.99 0.24 114.58 117.86 3hu3 h GLU 440 Ca 0.40 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.47 3hu3 h GLU 440 Cb 0.63 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.23 3hu3 h GLU 440 CO -0.42 0.00 -0.47 0.28 -1.18 0.00 0.00 179.01 177.22 3hu3 h VAL 441 N 0.00 1.57 -0.25 0.32 2.07 -1.59 -3.17 116.25 115.21 3hu3 h VAL 441 Ca 0.00 -2.28 0.04 0.00 0.82 0.00 0.00 66.70 65.28 3hu3 h VAL 441 Cb 0.46 3.04 -0.04 0.00 -1.52 0.00 0.00 31.29 33.23 3hu3 h VAL 441 CO 0.00 0.63 0.00 0.24 0.02 0.00 0.00 177.57 178.47 3hu3 h MET 442 N -0.49 0.08 -0.19 1.57 2.86 -0.73 -3.02 114.93 115.00 3hu3 h MET 442 Ca -0.07 -0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 3hu3 h MET 442 Cb 1.30 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.92 3hu3 h MET 442 CO 0.09 0.05 -0.21 -0.91 1.06 0.00 0.00 176.91 176.99 3hu3 h ASN 443 N 0.08 0.34 -0.14 1.22 -0.26 -0.66 -3.22 115.58 112.94 3hu3 h ASN 443 Ca 0.12 -0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.76 3hu3 h ASN 443 Cb 0.15 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 3hu3 h ASN 443 CO -0.19 0.57 0.00 -1.54 -1.06 0.00 0.00 177.43 175.20 3hu3 n SER 444 N -4.17 2.78 -4.66 5.81 3.41 -1.18 -4.95 113.62 110.66 3hu3 n SER 444 Ca -0.00 -1.90 -0.42 0.00 -0.26 0.00 0.00 58.87 56.28 3hu3 n SER 444 Cb 0.35 -0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.20 3hu3 n SER 444 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hu3 s LEU 445 N -1.82 4.32 -0.01 1.04 1.43 -1.15 -4.98 118.68 117.51 3hu3 s LEU 445 Ca 0.33 2.21 -0.07 0.00 -1.03 0.00 0.00 54.13 55.57 3hu3 s LEU 445 Cb 0.21 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.89 3hu3 s LEU 445 CO 0.31 -0.89 0.14 0.00 0.23 0.00 0.00 176.35 176.13 3hu3 s ALA 446 N 3.74 -0.33 -0.06 4.21 0.00 -1.26 -4.85 121.76 123.20 3hu3 s ALA 446 Ca 0.71 -0.05 -0.19 0.00 0.00 0.00 0.00 51.96 52.44 3hu3 s ALA 446 Cb -0.33 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 22.79 3hu3 s ALA 446 CO 0.28 -0.19 0.52 0.08 0.00 0.00 0.00 175.76 176.46 3hu3 s VAL 447 N -1.14 5.07 0.35 0.00 1.01 -0.37 -4.85 120.40 120.48 3hu3 s VAL 447 Ca -0.12 1.06 0.08 0.00 0.00 0.00 0.00 61.98 63.00 3hu3 s VAL 447 Cb -0.07 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 3hu3 s VAL 447 CO 0.01 0.38 0.17 0.42 0.00 0.00 0.00 175.10 176.08 3hu3 s THR 448 N 0.17 2.93 0.31 3.92 -4.23 -1.26 -0.47 115.64 117.01 3hu3 s THR 448 Ca 0.28 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.14 3hu3 s THR 448 Cb -0.16 -2.99 0.27 0.00 1.34 0.00 0.00 72.50 70.96 3hu3 s THR 448 CO 0.13 -0.15 1.95 -0.03 -0.54 0.00 0.00 174.62 175.98 3hu3 h MET 449 N 1.49 0.99 -0.83 3.99 4.05 -1.93 -0.70 114.93 121.99 3hu3 h MET 449 Ca -0.43 -0.06 0.04 0.00 -0.28 0.00 0.00 59.70 58.97 3hu3 h MET 449 Cb 1.25 -0.22 -0.05 0.00 -0.80 0.00 0.00 31.60 31.78 3hu3 h MET 449 CO 0.63 0.65 0.52 -0.44 0.23 0.00 0.00 176.91 178.51 3hu3 h ASP 450 N 1.02 0.85 -0.77 1.39 3.32 -1.95 0.40 116.42 120.69 3hu3 h ASP 450 Ca 0.33 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.37 3hu3 h ASP 450 Cb 0.05 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 3hu3 h ASP 450 CO -0.10 0.57 0.40 0.44 -1.72 0.00 0.00 179.24 178.83 3hu3 h ASP 451 N 0.99 0.98 -0.45 6.45 3.32 -1.50 0.94 116.42 127.15 3hu3 h ASP 451 Ca 0.34 -0.09 -0.10 0.00 0.02 0.00 0.00 57.03 57.20 3hu3 h ASP 451 Cb 0.06 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 3hu3 h ASP 451 CO -0.13 0.81 -0.10 -0.26 -1.72 0.00 0.00 179.24 177.83 3hu3 h PHE 452 N 1.09 0.98 -0.34 4.55 0.04 -0.50 -2.14 116.94 120.62 3hu3 h PHE 452 Ca 0.27 -0.21 -0.09 0.00 2.80 0.00 0.00 57.97 60.75 3hu3 h PHE 452 Cb 0.06 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 3hu3 h PHE 452 CO 0.01 0.96 -0.14 0.00 -0.60 0.00 0.00 178.31 178.54 3hu3 h ARG 453 N 0.71 0.61 -0.47 1.51 3.08 0.19 0.13 114.38 120.14 3hu3 h ARG 453 Ca 0.12 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 59.87 3hu3 h ARG 453 Cb 0.64 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 3hu3 h ARG 453 CO 0.04 0.73 -0.12 2.35 -1.07 0.00 0.00 179.97 181.90 3hu3 h TRP 454 N 0.55 0.97 -0.27 3.04 7.01 -0.81 -2.37 115.95 124.08 3hu3 h TRP 454 Ca 0.09 -0.19 -0.10 0.00 2.11 0.00 0.00 58.89 60.80 3hu3 h TRP 454 Cb 0.57 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.38 3hu3 h TRP 454 CO 0.02 0.94 -0.23 0.00 -2.79 0.00 0.00 178.44 176.38 3hu3 h ALA 455 N 1.07 0.40 -1.12 2.65 0.00 -0.87 -2.85 119.26 118.54 3hu3 h ALA 455 Ca 0.13 -0.37 0.31 0.00 0.00 0.00 0.00 54.91 54.97 3hu3 h ALA 455 Cb 0.64 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 3hu3 h ALA 455 CO 0.04 0.36 0.76 -0.07 0.00 0.00 0.00 179.25 180.35 3hu3 h LEU 456 N 0.37 0.24 -0.52 0.00 3.38 -0.65 0.31 115.31 118.45 3hu3 h LEU 456 Ca 0.05 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 3hu3 h LEU 456 Cb 0.79 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 3hu3 h LEU 456 CO 0.06 0.03 -0.18 0.77 0.09 0.00 0.00 178.44 179.21 3hu3 h SER 457 N 0.20 0.00 0.00 -0.43 4.64 -1.20 -3.27 113.55 113.50 3hu3 h SER 457 Ca 0.60 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.92 3hu3 h SER 457 Cb 1.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.00 3hu3 h SER 457 CO -0.18 0.18 -1.54 0.00 -0.87 0.00 0.00 176.83 174.42 3hu3 n GLN 458 N -3.20 0.36 -2.38 4.77 1.13 0.78 -4.96 117.38 113.88 3hu3 n GLN 458 Ca 0.02 -0.11 -0.43 0.00 -1.94 0.00 0.00 57.00 54.54 3hu3 n GLN 458 Cb 0.52 -1.51 -0.02 0.00 0.11 0.00 0.00 30.24 29.33 3hu3 n GLN 458 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3hu3 s SER 459 N -3.83 6.92 -0.36 1.08 0.15 0.61 -5.00 113.70 113.28 3hu3 s SER 459 Ca -0.01 1.77 0.01 0.00 0.70 0.00 0.00 55.95 58.43 3hu3 s SER 459 Cb 0.15 -2.54 0.11 0.00 -1.71 0.00 0.00 66.02 62.03 3hu3 s SER 459 CO 0.89 -0.76 0.13 0.21 1.20 0.00 0.00 173.24 174.91 3hu3 s ASN 460 N 2.05 4.14 0.60 5.45 2.47 -1.26 -5.00 114.94 123.40 3hu3 s ASN 460 Ca 0.57 -2.07 0.36 0.00 0.42 0.00 0.00 52.86 52.14 3hu3 s ASN 460 Cb -0.23 -1.13 1.93 0.00 -1.45 0.00 0.00 41.25 40.37 3hu3 s ASN 460 CO 0.17 -0.36 2.23 -0.65 -3.72 0.00 0.00 177.10 174.77 3hu3 h PRO 461 N 7.57 0.00 0.00 0.43 0.11 -1.94 -3.52 132.00 134.65 3hu3 h PRO 461 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 3hu3 h PRO 461 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3hu3 h PRO 461 CO 0.50 0.03 0.00 0.43 -0.21 0.00 0.00 178.00 178.75