#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hu1 h SER 13 N 0.00 0.02 0.00 1.45 4.64 -2.05 -3.36 113.55 114.25 3hu1 h SER 13 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3hu1 h SER 13 Cb 0.00 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3hu1 h SER 13 CO 0.00 1.03 0.00 1.07 -0.87 0.00 0.00 176.83 178.06 3hu1 n THR 14 N -3.15 0.00 -0.16 2.95 5.66 -1.26 -4.18 114.28 114.14 3hu1 n THR 14 Ca -0.12 0.00 0.27 0.00 -3.05 0.00 0.00 64.05 61.15 3hu1 n THR 14 Cb 1.02 -0.68 0.71 0.00 -1.55 0.00 0.00 70.33 69.83 3hu1 n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hu1 h ALA 15 N 2.50 2.79 -0.13 1.79 0.00 -2.00 -1.88 119.26 122.33 3hu1 h ALA 15 Ca 0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 3hu1 h ALA 15 Cb 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3hu1 h ALA 15 CO 0.00 -1.04 -0.29 0.97 0.00 0.00 0.00 179.25 178.89 3hu1 h ILE 16 N 0.02 1.26 0.00 0.00 2.10 -1.93 -3.15 117.51 115.80 3hu1 h ILE 16 Ca 0.41 -1.22 -0.06 0.00 1.08 0.00 0.00 64.86 65.07 3hu1 h ILE 16 Cb 1.62 1.49 -0.01 0.00 -1.09 0.00 0.00 36.82 38.83 3hu1 h ILE 16 CO -0.01 0.37 -0.27 -0.07 -1.08 0.00 0.00 178.15 177.08 3hu1 h LEU 17 N 0.22 0.00 -9.74 2.19 3.38 -1.68 -3.46 115.31 106.21 3hu1 h LEU 17 Ca 0.03 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.45 3hu1 h LEU 17 Cb 0.63 0.00 0.09 0.00 0.09 0.00 0.00 40.66 41.47 3hu1 h LEU 17 CO 0.05 0.27 0.80 1.17 0.09 0.00 0.00 178.44 180.82 3hu1 n LYS 18 N -3.34 2.51 -0.10 1.13 4.81 -1.19 -4.94 118.16 117.03 3hu1 n LYS 18 Ca 0.01 0.89 -0.10 0.00 -0.87 0.00 0.00 58.31 58.24 3hu1 n LYS 18 Cb 0.50 -2.63 0.05 0.00 0.02 0.00 0.00 35.03 32.97 3hu1 n LYS 18 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 3hu1 h GLN 19 N 4.49 0.83 -2.75 1.64 7.50 -1.91 -3.50 115.11 121.41 3hu1 h GLN 19 Ca -0.47 -0.37 0.00 0.00 0.50 0.00 0.00 58.65 58.31 3hu1 h GLN 19 Cb 1.24 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 28.75 3hu1 h GLN 19 CO 0.77 1.01 -0.64 1.63 -1.50 0.00 0.00 178.83 180.10 3hu1 n LYS 20 N -4.09 -3.50 -2.77 1.46 4.01 -1.26 -4.94 118.16 107.08 3hu1 n LYS 20 Ca -0.01 2.53 -0.42 0.00 -0.51 0.00 0.00 58.31 59.90 3hu1 n LYS 20 Cb 0.47 -2.78 -0.03 0.00 -0.51 0.00 0.00 35.03 32.18 3hu1 n LYS 20 CO 0.00 0.00 0.00 -0.80 -1.11 0.00 0.00 177.40 175.49 3hu1 s ASN 21 N -1.66 7.22 0.10 4.39 0.01 -1.26 -5.00 114.94 118.73 3hu1 s ASN 21 Ca 0.00 1.48 0.05 0.00 -0.71 0.00 0.00 52.86 53.68 3hu1 s ASN 21 Cb 0.00 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 39.10 3hu1 s ASN 21 CO 0.00 -0.34 -0.13 -0.13 -1.51 0.00 0.00 177.10 174.99 3hu1 s ARG 22 N 1.55 0.91 0.30 -0.60 1.81 -1.26 -5.05 118.95 116.61 3hu1 s ARG 22 Ca 0.47 -1.11 0.05 0.00 -1.72 0.00 0.00 55.73 53.41 3hu1 s ARG 22 Cb -0.19 -0.81 0.80 0.00 -0.45 0.00 0.00 34.95 34.30 3hu1 s ARG 22 CO 0.21 0.16 1.64 -1.35 -0.68 0.00 0.00 175.30 175.27 3hu1 h PRO 23 N 3.83 0.18 -0.21 3.54 0.10 -2.01 -2.82 132.00 134.62 3hu1 h PRO 23 Ca -0.40 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 65.69 3hu1 h PRO 23 Cb 1.19 -0.04 0.00 0.00 0.10 0.00 0.00 31.00 32.25 3hu1 h PRO 23 CO 0.47 0.12 0.00 0.27 0.10 0.00 0.00 178.00 178.96 3hu1 n ASN 24 N -5.24 2.61 -4.45 -2.05 6.94 -1.26 -4.81 115.26 107.00 3hu1 n ASN 24 Ca 0.24 -1.85 -0.44 0.00 -0.02 0.00 0.00 54.58 52.51 3hu1 n ASN 24 Cb 0.76 -0.13 -0.06 0.00 -2.36 0.00 0.00 39.78 38.00 3hu1 n ASN 24 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 3hu1 s ARG 25 N -1.75 3.15 0.09 -3.83 3.52 -1.07 -2.00 118.95 117.07 3hu1 s ARG 25 Ca 0.35 -0.83 0.10 0.00 -0.13 0.00 0.00 55.73 55.22 3hu1 s ARG 25 Cb 0.20 -4.11 -0.03 0.00 -1.56 0.00 0.00 34.95 29.45 3hu1 s ARG 25 CO 0.30 -1.32 -0.27 -0.51 -0.81 0.00 0.00 175.30 172.70 3hu1 s LEU 26 N 2.90 2.25 0.14 -0.88 1.43 -0.76 -4.70 118.68 119.06 3hu1 s LEU 26 Ca 0.17 -0.68 -0.28 0.00 -1.03 0.00 0.00 54.13 52.32 3hu1 s LEU 26 Cb -0.19 -1.25 -0.07 0.00 0.03 0.00 0.00 46.19 44.72 3hu1 s LEU 26 CO 0.12 0.21 0.86 -0.63 0.23 0.00 0.00 176.35 177.15 3hu1 s ILE 27 N -0.94 4.42 -0.11 -0.59 1.01 -0.85 -1.19 121.20 122.95 3hu1 s ILE 27 Ca 0.13 1.87 -0.27 0.00 0.00 0.00 0.00 60.65 62.38 3hu1 s ILE 27 Cb -0.10 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 3hu1 s ILE 27 CO 0.04 0.42 0.89 0.68 0.00 0.00 0.00 174.94 176.97 3hu1 s VAL 28 N -0.59 4.87 0.27 2.92 -7.23 -0.58 -0.38 120.40 119.69 3hu1 s VAL 28 Ca 0.41 1.79 0.11 0.00 -1.81 0.00 0.00 61.98 62.48 3hu1 s VAL 28 Cb -0.23 -4.20 -0.05 0.00 0.56 0.00 0.00 36.38 32.46 3hu1 s VAL 28 CO 0.28 0.07 -0.13 -0.62 -0.31 0.00 0.00 175.10 174.39 3hu1 s ASP 29 N 1.06 3.94 0.36 4.85 3.68 0.15 -1.66 116.67 129.06 3hu1 s ASP 29 Ca 0.43 -0.88 -0.28 0.00 2.13 0.00 0.00 52.55 53.95 3hu1 s ASP 29 Cb -0.18 -0.50 -0.10 0.00 -1.45 0.00 0.00 42.92 40.69 3hu1 s ASP 29 CO 0.17 0.03 1.33 -0.70 0.13 0.00 0.00 175.17 176.13 3hu1 s GLU 30 N -3.53 4.22 0.34 4.34 2.56 -1.26 -2.35 118.70 123.02 3hu1 s GLU 30 Ca 0.30 2.26 -0.25 0.00 0.00 0.00 0.00 54.97 57.27 3hu1 s GLU 30 Cb -0.06 -2.98 -0.10 0.00 2.00 0.00 0.00 34.13 33.00 3hu1 s GLU 30 CO 0.17 -0.31 0.96 0.00 -0.56 0.00 0.00 175.26 175.51 3hu1 s ALA 31 N -1.17 3.18 -0.08 6.30 0.00 -1.22 -4.51 121.76 124.25 3hu1 s ALA 31 Ca 0.51 0.53 -0.05 0.00 0.00 0.00 0.00 51.96 52.96 3hu1 s ALA 31 Cb -0.40 -3.19 -0.27 0.00 0.00 0.00 0.00 23.12 19.26 3hu1 s ALA 31 CO 0.54 0.12 0.52 -0.84 0.00 0.00 0.00 175.76 176.09 3hu1 h ILE 32 N 2.48 0.77 -3.62 0.00 3.07 -1.95 -3.45 117.51 114.81 3hu1 h ILE 32 Ca -0.47 -2.47 -0.60 0.00 1.55 0.00 0.00 64.86 62.87 3hu1 h ILE 32 Cb 1.19 2.58 -0.11 0.00 -0.27 0.00 0.00 36.82 40.21 3hu1 h ILE 32 CO 0.64 0.84 0.56 0.21 -1.05 0.00 0.00 178.15 179.35 3hu1 s ASN 33 N -6.98 6.47 -0.23 2.16 3.84 -1.26 -4.96 114.94 113.99 3hu1 s ASN 33 Ca -0.18 0.05 0.07 0.00 0.21 0.00 0.00 52.86 53.01 3hu1 s ASN 33 Cb 0.07 -2.44 0.53 0.00 -0.55 0.00 0.00 41.25 38.85 3hu1 s ASN 33 CO 0.80 -1.05 1.49 -0.62 -2.79 0.00 0.00 177.10 174.93 3hu1 n GLU 34 N 7.15 2.91 -2.68 0.43 1.02 -1.26 -4.67 120.64 123.53 3hu1 n GLU 34 Ca 0.05 -2.16 -0.39 0.00 -0.02 0.00 0.00 57.16 54.64 3hu1 n GLU 34 Cb 0.48 -1.94 -0.06 0.00 -0.02 0.00 0.00 31.44 29.90 3hu1 n GLU 34 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3hu1 s ASP 35 N -0.57 7.46 0.57 1.62 2.15 -1.26 -4.96 116.67 121.67 3hu1 s ASP 35 Ca 0.39 2.01 0.33 0.00 0.43 0.00 0.00 52.55 55.71 3hu1 s ASP 35 Cb 0.31 -2.61 1.68 0.00 -0.30 0.00 0.00 42.92 42.00 3hu1 s ASP 35 CO 0.10 0.02 2.13 0.78 -0.17 0.00 0.00 175.17 178.02 3hu1 h ASN 36 N 3.81 0.00 -0.11 -0.34 2.35 -1.94 -3.03 115.58 116.32 3hu1 h ASN 36 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 3hu1 h ASN 36 Cb 1.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.57 3hu1 h ASN 36 CO 0.67 0.06 0.00 -1.20 -1.65 0.00 0.00 177.43 175.31 3hu1 n SER 37 N -3.37 2.40 -4.36 5.81 7.64 -1.26 -4.71 113.62 115.78 3hu1 n SER 37 Ca -0.02 -1.80 -0.32 0.00 1.01 0.00 0.00 58.87 57.74 3hu1 n SER 37 Cb 0.21 -0.06 -0.15 0.00 -1.01 0.00 0.00 64.21 63.20 3hu1 n SER 37 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3hu1 s VAL 38 N -1.88 2.63 0.01 0.44 0.11 -1.15 0.04 120.40 120.60 3hu1 s VAL 38 Ca 0.34 -0.85 0.06 0.00 -2.93 0.00 0.00 61.98 58.59 3hu1 s VAL 38 Cb 0.20 -2.02 -0.02 0.00 -1.53 0.00 0.00 36.38 33.01 3hu1 s VAL 38 CO 0.31 0.56 -0.18 0.68 -3.33 0.00 0.00 175.10 173.14 3hu1 s VAL 39 N -0.16 1.42 -0.08 2.04 -7.23 -0.88 -4.64 120.40 110.86 3hu1 s VAL 39 Ca -0.02 -0.89 0.00 0.00 -1.81 0.00 0.00 61.98 59.27 3hu1 s VAL 39 Cb -0.14 -1.20 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 3hu1 s VAL 39 CO 0.04 0.30 -0.08 -0.44 -0.31 0.00 0.00 175.10 174.61 3hu1 s SER 40 N -0.69 4.57 0.06 4.85 0.01 -0.33 -1.83 113.70 120.35 3hu1 s SER 40 Ca 0.06 -0.07 0.03 0.00 1.31 0.00 0.00 55.95 57.28 3hu1 s SER 40 Cb -0.07 -1.27 -0.03 0.00 0.21 0.00 0.00 66.02 64.86 3hu1 s SER 40 CO 0.00 0.32 -0.10 -0.76 0.41 0.00 0.00 173.24 173.11 3hu1 s LEU 41 N -0.54 2.30 0.54 2.44 1.43 -0.75 -1.50 118.68 122.60 3hu1 s LEU 41 Ca 0.08 -0.64 -0.21 0.00 -1.03 0.00 0.00 54.13 52.33 3hu1 s LEU 41 Cb -0.12 -0.30 -0.05 0.00 0.03 0.00 0.00 46.19 45.75 3hu1 s LEU 41 CO 0.02 -0.18 1.26 -0.94 0.23 0.00 0.00 176.35 176.73 3hu1 s SER 42 N -1.85 5.49 0.24 2.29 1.04 -1.25 -0.71 113.70 118.95 3hu1 s SER 42 Ca -0.04 2.52 -0.06 0.00 0.48 0.00 0.00 55.95 58.86 3hu1 s SER 42 Cb -0.08 -2.62 0.31 0.00 0.10 0.00 0.00 66.02 63.74 3hu1 s SER 42 CO 0.01 -1.40 1.87 -0.61 0.98 0.00 0.00 173.24 174.09 3hu1 h GLN 43 N 1.44 1.03 -0.71 4.02 5.75 -1.91 -2.65 115.11 122.09 3hu1 h GLN 43 Ca -0.50 -0.06 0.02 0.00 -0.15 0.00 0.00 58.65 57.95 3hu1 h GLN 43 Cb 1.29 -0.23 -0.04 0.00 1.07 0.00 0.00 27.48 29.56 3hu1 h GLN 43 CO 0.57 0.68 0.47 -1.35 -2.65 0.00 0.00 178.83 176.56 3hu1 h PRO 44 N 1.06 0.89 -0.11 -2.39 0.11 -1.96 -2.78 132.00 126.83 3hu1 h PRO 44 Ca 0.37 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.30 3hu1 h PRO 44 Cb 0.09 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 3hu1 h PRO 44 CO -0.15 0.59 -0.48 -0.22 -0.21 0.00 0.00 178.00 177.53 3hu1 h LYS 45 N 0.91 0.27 -0.34 1.05 1.63 -1.78 -2.78 116.57 115.54 3hu1 h LYS 45 Ca 0.27 -0.15 -0.12 0.00 -0.85 0.00 0.00 60.65 59.80 3hu1 h LYS 45 Cb -0.03 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.59 3hu1 h LYS 45 CO -0.07 0.70 -0.27 0.52 -3.45 0.00 0.00 179.45 176.88 3hu1 h MET 46 N 0.22 0.69 -0.05 1.90 2.86 -1.20 -2.78 114.93 116.56 3hu1 h MET 46 Ca 0.01 -0.29 -0.14 0.00 -2.06 0.00 0.00 59.70 57.21 3hu1 h MET 46 Cb 0.93 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 3hu1 h MET 46 CO 0.08 0.89 -0.61 -0.44 1.06 0.00 0.00 176.91 177.88 3hu1 h ASP 47 N 0.60 0.22 -0.11 1.22 3.45 -1.51 0.30 116.42 120.59 3hu1 h ASP 47 Ca 0.08 -0.13 -0.11 0.00 0.43 0.00 0.00 57.03 57.30 3hu1 h ASP 47 Cb 0.77 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.46 3hu1 h ASP 47 CO 0.06 0.77 -0.30 -0.08 -1.57 0.00 0.00 179.24 178.13 3hu1 h GLU 48 N 0.14 0.58 -0.54 3.56 4.81 -1.33 -3.08 114.58 118.72 3hu1 h GLU 48 Ca -0.01 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 3hu1 h GLU 48 Cb 1.11 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.47 3hu1 h GLU 48 CO 0.09 0.81 0.00 1.28 -0.73 0.00 0.00 179.01 180.47 3hu1 n LEU 49 N -4.09 3.49 -3.88 1.64 4.77 -1.06 -4.97 117.00 112.91 3hu1 n LEU 49 Ca -0.01 -1.64 -0.33 0.00 -0.03 0.00 0.00 56.01 54.01 3hu1 n LEU 49 Cb 0.45 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 41.20 3hu1 n LEU 49 CO 0.44 0.82 -0.16 0.00 -1.33 0.00 0.00 177.39 177.15 3hu1 n GLN 50 N 1.45 -1.66 -3.85 3.23 6.02 -1.11 -4.95 117.38 116.51 3hu1 n GLN 50 Ca 0.21 0.35 -0.36 0.00 -0.01 0.00 0.00 57.00 57.19 3hu1 n GLN 50 Cb 0.58 -3.91 -0.13 0.00 1.02 0.00 0.00 30.24 27.80 3hu1 n GLN 50 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3hu1 s LEU 51 N -6.87 4.06 0.70 1.08 1.43 0.10 -5.03 118.68 114.15 3hu1 s LEU 51 Ca 0.31 -1.21 -0.11 0.00 -1.03 0.00 0.00 54.13 52.08 3hu1 s LEU 51 Cb -0.13 -1.77 0.01 0.00 0.03 0.00 0.00 46.19 44.33 3hu1 s LEU 51 CO 0.90 -0.28 1.06 -0.36 0.23 0.00 0.00 176.35 177.90 3hu1 s PHE 52 N 1.31 3.09 0.26 0.29 2.99 -1.26 -4.53 117.98 120.13 3hu1 s PHE 52 Ca -0.04 1.40 -0.30 0.00 0.00 0.00 0.00 56.93 58.00 3hu1 s PHE 52 Cb -0.20 -2.90 -0.10 0.00 0.00 0.00 0.00 43.02 39.82 3hu1 s PHE 52 CO 0.01 -1.28 1.44 0.50 -0.00 0.00 0.00 175.22 175.89 3hu1 s ARG 53 N -5.05 4.26 -0.78 0.44 3.52 -1.26 -3.14 118.95 116.94 3hu1 s ARG 53 Ca 0.58 2.32 0.00 0.00 -0.13 0.00 0.00 55.73 58.50 3hu1 s ARG 53 Cb -0.14 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.15 3hu1 s ARG 53 CO 0.55 -0.42 0.00 0.41 -0.81 0.00 0.00 175.30 175.03 3hu1 n GLY 54 N 2.10 0.71 3.77 8.12 0.00 0.20 -5.01 105.19 115.09 3hu1 n GLY 54 Ca 0.06 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 3hu1 n GLY 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu1 s ASP 55 N -2.84 7.40 0.10 1.61 1.01 -1.19 -4.74 116.67 118.02 3hu1 s ASP 55 Ca 0.00 1.82 -0.31 0.00 0.71 0.00 0.00 52.55 54.77 3hu1 s ASP 55 Cb 0.00 -2.57 -0.07 0.00 1.01 0.00 0.00 42.92 41.29 3hu1 s ASP 55 CO 0.00 0.02 1.32 0.42 0.21 0.00 0.00 175.17 177.14 3hu1 s THR 56 N -1.45 3.57 0.12 -1.27 -4.23 -1.26 -1.25 115.64 109.87 3hu1 s THR 56 Ca 0.46 1.13 0.07 0.00 -1.18 0.00 0.00 61.69 62.17 3hu1 s THR 56 Cb -0.21 -3.73 -0.04 0.00 1.34 0.00 0.00 72.50 69.87 3hu1 s THR 56 CO 0.26 0.09 -0.18 0.68 -0.54 0.00 0.00 174.62 174.93 3hu1 s VAL 57 N 1.07 1.58 -0.21 2.29 -7.23 0.72 -2.50 120.40 116.12 3hu1 s VAL 57 Ca 0.62 -1.68 -0.05 0.00 -1.81 0.00 0.00 61.98 59.07 3hu1 s VAL 57 Cb -0.34 -1.58 -0.02 0.00 0.56 0.00 0.00 36.38 35.00 3hu1 s VAL 57 CO 0.30 -0.25 -0.01 -0.22 -0.31 0.00 0.00 175.10 174.61 3hu1 s LEU 58 N -2.26 3.12 -0.15 1.32 2.96 0.22 -1.73 118.68 122.17 3hu1 s LEU 58 Ca 0.09 -0.28 -0.05 0.00 -0.22 0.00 0.00 54.13 53.67 3hu1 s LEU 58 Cb -0.07 -1.80 -0.03 0.00 0.50 0.00 0.00 46.19 44.78 3hu1 s LEU 58 CO 0.04 0.02 0.02 -0.76 -1.32 0.00 0.00 176.35 174.35 3hu1 s LEU 59 N 1.28 3.60 -0.17 -0.68 1.43 -0.19 -0.70 118.68 123.26 3hu1 s LEU 59 Ca 0.04 0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.16 3hu1 s LEU 59 Cb -0.15 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.18 3hu1 s LEU 59 CO 0.00 0.23 -0.08 -0.54 0.23 0.00 0.00 176.35 176.20 3hu1 s LYS 60 N -0.00 3.47 0.00 1.70 1.02 -0.83 -1.97 119.74 123.13 3hu1 s LYS 60 Ca 0.04 -0.62 0.00 0.00 0.02 0.00 0.00 55.97 55.41 3hu1 s LYS 60 Cb -0.13 -2.83 0.00 0.00 -0.52 0.00 0.00 37.83 34.35 3hu1 s LYS 60 CO 0.02 0.10 0.00 0.41 -0.92 0.00 0.00 175.35 174.95 3hu1 n GLY 61 N 3.92 2.86 3.94 -3.33 0.00 0.09 -2.24 105.19 110.43 3hu1 n GLY 61 Ca -0.18 -1.74 -0.24 0.00 0.00 0.00 0.00 46.02 43.86 3hu1 n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu1 s LYS 62 N 4.67 3.43 -1.54 1.61 1.02 -0.83 -4.63 119.74 123.48 3hu1 s LYS 62 Ca 0.00 -0.37 -0.11 0.00 0.02 0.00 0.00 55.97 55.50 3hu1 s LYS 62 Cb 0.00 -2.66 0.08 0.00 -0.52 0.00 0.00 37.83 34.74 3hu1 s LYS 62 CO 0.00 0.10 0.81 1.63 -0.92 0.00 0.00 175.35 176.97 3hu1 n LYS 63 N -1.81 -4.45 -1.24 1.68 5.02 -1.26 -2.05 118.16 114.04 3hu1 n LYS 63 Ca -0.04 0.51 -0.08 0.00 -2.02 0.00 0.00 58.31 56.67 3hu1 n LYS 63 Cb 0.56 -5.19 -0.04 0.00 -0.02 0.00 0.00 35.03 30.35 3hu1 n LYS 63 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3hu1 n ARG 64 N -4.51 -1.21 -3.05 1.97 3.00 -1.26 -4.77 116.66 106.84 3hu1 n ARG 64 Ca -0.05 0.73 -0.35 0.00 -0.00 0.00 0.00 57.85 58.19 3hu1 n ARG 64 Cb 0.56 -4.84 -0.06 0.00 0.00 0.00 0.00 32.46 28.12 3hu1 n ARG 64 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3hu1 s ARG 65 N -2.46 4.22 0.06 -0.14 1.81 -0.87 -4.94 118.95 116.64 3hu1 s ARG 65 Ca 0.00 0.89 0.01 0.00 -1.72 0.00 0.00 55.73 54.91 3hu1 s ARG 65 Cb 0.00 -2.68 -0.03 0.00 -0.45 0.00 0.00 34.95 31.79 3hu1 s ARG 65 CO 0.00 0.27 -0.06 -1.21 -0.68 0.00 0.00 175.30 173.62 3hu1 s GLU 66 N -2.39 0.63 -0.08 3.54 2.02 -1.26 -0.73 118.70 120.43 3hu1 s GLU 66 Ca 0.49 -1.03 -0.09 0.00 0.02 0.00 0.00 54.97 54.36 3hu1 s GLU 66 Cb -0.14 -0.14 0.02 0.00 0.10 0.00 0.00 34.13 33.97 3hu1 s GLU 66 CO 0.20 -0.01 0.24 0.00 0.02 0.00 0.00 175.26 175.70 3hu1 s ALA 67 N -2.61 -0.59 -0.26 5.21 0.00 -0.83 -4.67 121.76 118.01 3hu1 s ALA 67 Ca 0.00 0.59 -0.09 0.00 0.00 0.00 0.00 51.96 52.46 3hu1 s ALA 67 Cb -0.02 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 3hu1 s ALA 67 CO -0.03 -0.13 0.13 0.14 0.00 0.00 0.00 175.76 175.86 3hu1 s VAL 68 N -0.09 4.82 0.39 0.00 -7.23 -1.26 -1.02 120.40 116.00 3hu1 s VAL 68 Ca -0.02 -0.00 0.05 0.00 -1.81 0.00 0.00 61.98 60.20 3hu1 s VAL 68 Cb -0.02 -3.27 -0.07 0.00 0.56 0.00 0.00 36.38 33.58 3hu1 s VAL 68 CO 0.01 0.31 0.03 0.00 -0.31 0.00 0.00 175.10 175.13 3hu1 s ILE 70 N -2.90 3.63 -0.11 0.00 2.07 0.11 -0.20 121.20 123.79 3hu1 s ILE 70 Ca 0.33 -0.45 -0.14 0.00 -1.41 0.00 0.00 60.65 58.97 3hu1 s ILE 70 Cb 0.09 -2.57 -0.05 0.00 0.13 0.00 0.00 42.46 40.06 3hu1 s ILE 70 CO 0.16 0.50 0.34 0.54 -1.91 0.00 0.00 174.94 174.58 3hu1 s VAL 71 N 0.35 5.23 0.11 4.00 0.11 -0.38 -2.07 120.40 127.74 3hu1 s VAL 71 Ca -0.06 0.67 0.05 0.00 -2.93 0.00 0.00 61.98 59.70 3hu1 s VAL 71 Cb -0.15 -3.67 -0.04 0.00 -1.53 0.00 0.00 36.38 31.00 3hu1 s VAL 71 CO 0.04 0.44 -0.13 -0.76 -3.33 0.00 0.00 175.10 171.37 3hu1 s LEU 72 N -0.02 2.40 -0.08 2.54 1.43 -0.76 0.61 118.68 124.81 3hu1 s LEU 72 Ca 0.20 -0.80 -0.24 0.00 -1.03 0.00 0.00 54.13 52.26 3hu1 s LEU 72 Cb -0.14 -0.46 -0.03 0.00 0.03 0.00 0.00 46.19 45.59 3hu1 s LEU 72 CO 0.07 -0.18 0.72 -0.94 0.23 0.00 0.00 176.35 176.25 3hu1 s SER 73 N -2.41 7.00 -0.01 2.29 1.04 -1.26 -1.81 113.70 118.54 3hu1 s SER 73 Ca 0.07 1.20 0.05 0.00 0.48 0.00 0.00 55.95 57.75 3hu1 s SER 73 Cb -0.04 -2.42 -0.01 0.00 0.10 0.00 0.00 66.02 63.64 3hu1 s SER 73 CO 0.02 -0.15 -0.15 -0.62 0.98 0.00 0.00 173.24 173.31 3hu1 s ASP 74 N 0.85 1.81 -0.18 7.02 2.15 0.11 -4.89 116.67 123.54 3hu1 s ASP 74 Ca 0.38 -0.30 0.09 0.00 0.43 0.00 0.00 52.55 53.15 3hu1 s ASP 74 Cb -0.18 -0.19 -0.22 0.00 -0.30 0.00 0.00 42.92 42.02 3hu1 s ASP 74 CO 0.18 0.18 0.13 0.47 -0.17 0.00 0.00 175.17 175.96 3hu1 n ASP 75 N 2.62 1.03 0.23 -0.34 8.00 -1.26 -3.76 116.55 123.07 3hu1 n ASP 75 Ca -0.15 0.06 0.16 0.00 0.71 0.00 0.00 54.79 55.57 3hu1 n ASP 75 Cb 0.55 0.14 0.69 0.00 -0.02 0.00 0.00 41.12 42.48 3hu1 n ASP 75 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hu1 h THR 76 N 0.01 0.00 -3.62 -3.53 1.03 -1.98 -3.44 112.91 101.38 3hu1 h THR 76 Ca -0.49 -0.29 -0.51 0.00 -0.01 0.00 0.00 66.41 65.10 3hu1 h THR 76 Cb 2.08 1.15 -0.01 0.00 -1.07 0.00 0.00 68.15 70.29 3hu1 h THR 76 CO 0.01 0.00 0.38 0.00 -0.01 0.00 0.00 175.52 175.91 3hu1 s SER 78 N -0.35 4.31 0.11 0.00 0.01 -1.26 -4.51 113.70 112.01 3hu1 s SER 78 Ca 0.46 1.56 -0.28 0.00 1.31 0.00 0.00 55.95 59.00 3hu1 s SER 78 Cb -0.25 -2.29 -0.09 0.00 0.21 0.00 0.00 66.02 63.60 3hu1 s SER 78 CO 0.32 -2.12 1.63 0.44 0.41 0.00 0.00 173.24 173.91 3hu1 h ASP 79 N -1.19 -0.85 -0.44 2.44 3.45 -1.97 -3.14 116.42 114.72 3hu1 h ASP 79 Ca -0.46 0.10 -0.12 0.00 0.43 0.00 0.00 57.03 56.97 3hu1 h ASP 79 Cb 1.25 0.32 -0.07 0.00 -0.56 0.00 0.00 39.33 40.27 3hu1 h ASP 79 CO 0.55 -0.39 0.16 -1.84 -1.57 0.00 0.00 179.24 176.15 3hu1 n GLU 80 N -5.41 2.66 -4.40 3.56 -0.00 -1.26 -4.62 120.64 111.17 3hu1 n GLU 80 Ca -0.07 -1.81 -0.27 0.00 -0.00 0.00 0.00 57.16 55.01 3hu1 n GLU 80 Cb 0.32 -1.85 -0.12 0.00 -0.00 0.00 0.00 31.44 29.79 3hu1 n GLU 80 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 3hu1 s LYS 81 N -1.99 1.57 -0.06 3.44 1.02 -1.19 -2.00 119.74 120.54 3hu1 s LYS 81 Ca 0.32 -1.48 0.03 0.00 0.02 0.00 0.00 55.97 54.87 3hu1 s LYS 81 Cb 0.26 -1.89 0.00 0.00 -0.52 0.00 0.00 37.83 35.69 3hu1 s LYS 81 CO 0.08 0.41 -0.15 -1.50 -0.92 0.00 0.00 175.35 173.27 3hu1 s ILE 82 N -1.62 1.30 -0.20 2.17 2.07 0.49 -4.54 121.20 120.86 3hu1 s ILE 82 Ca 0.21 -0.61 -0.10 0.00 -1.41 0.00 0.00 60.65 58.74 3hu1 s ILE 82 Cb -0.08 -1.15 -0.05 0.00 0.13 0.00 0.00 42.46 41.31 3hu1 s ILE 82 CO 0.10 0.39 0.12 -0.13 -1.91 0.00 0.00 174.94 173.51 3hu1 s ARG 83 N 0.35 4.15 -0.14 3.50 0.52 -0.56 0.34 118.95 127.10 3hu1 s ARG 83 Ca -0.10 -0.24 -0.22 0.00 -0.52 0.00 0.00 55.73 54.65 3hu1 s ARG 83 Cb -0.14 -3.40 0.05 0.00 0.52 0.00 0.00 34.95 31.99 3hu1 s ARG 83 CO 0.03 0.28 0.56 0.00 0.02 0.00 0.00 175.30 176.19 3hu1 s MET 84 N 0.40 0.77 0.52 3.54 0.23 -0.99 -1.19 119.30 122.58 3hu1 s MET 84 Ca 0.07 0.50 -0.09 0.00 -1.03 0.00 0.00 55.69 55.14 3hu1 s MET 84 Cb -0.11 0.37 0.12 0.00 -1.53 0.00 0.00 34.83 33.68 3hu1 s MET 84 CO -0.01 -0.16 0.56 0.27 -2.03 0.00 0.00 175.02 173.65 3hu1 n ASN 85 N 2.04 -0.77 -0.17 -1.18 0.23 -1.26 -3.40 115.26 110.75 3hu1 n ASN 85 Ca -0.16 -1.01 -0.04 0.00 -0.53 0.00 0.00 54.58 52.84 3hu1 n ASN 85 Cb 0.56 -0.47 0.14 0.00 -2.08 0.00 0.00 39.78 37.93 3hu1 n ASN 85 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 3hu1 h ARG 86 N 0.00 0.92 -0.14 -3.83 3.08 -1.98 -2.13 114.38 110.30 3hu1 h ARG 86 Ca -0.20 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 59.67 3hu1 h ARG 86 Cb 0.57 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 3hu1 h ARG 86 CO 0.13 0.83 0.01 0.28 -1.07 0.00 0.00 179.97 180.15 3hu1 h VAL 87 N 0.88 0.91 -0.31 2.04 2.07 -1.93 0.61 116.25 120.52 3hu1 h VAL 87 Ca 0.19 -0.02 -0.08 0.00 0.82 0.00 0.00 66.70 67.61 3hu1 h VAL 87 Cb 0.34 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 3hu1 h VAL 87 CO 0.00 0.01 -0.10 0.58 0.02 0.00 0.00 177.57 178.08 3hu1 h VAL 88 N 0.06 1.29 -0.99 2.57 2.07 -1.83 -1.62 116.25 117.79 3hu1 h VAL 88 Ca 0.07 -1.17 0.04 0.00 0.82 0.00 0.00 66.70 66.46 3hu1 h VAL 88 Cb 0.07 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 3hu1 h VAL 88 CO -0.11 0.38 0.65 0.03 0.02 0.00 0.00 177.57 178.54 3hu1 h ARG 89 N 0.38 1.20 -0.44 1.57 3.08 -1.11 -1.59 114.38 117.48 3hu1 h ARG 89 Ca 0.07 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3hu1 h ARG 89 Cb 0.61 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 3hu1 h ARG 89 CO 0.04 0.80 0.22 -0.91 -1.07 0.00 0.00 179.97 179.04 3hu1 h ASN 90 N 1.24 0.56 0.41 7.04 4.21 0.51 -0.85 115.58 128.70 3hu1 h ASN 90 Ca 0.40 -0.12 -0.06 0.00 1.21 0.00 0.00 56.30 57.73 3hu1 h ASN 90 Cb 0.02 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.07 3hu1 h ASN 90 CO -0.13 0.52 -0.27 0.78 -1.29 0.00 0.00 177.43 177.04 3hu1 h ASN 91 N 0.56 0.00 0.01 5.81 -0.26 -0.90 -1.82 115.58 118.99 3hu1 h ASN 91 Ca 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 3hu1 h ASN 91 Cb 0.10 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.36 3hu1 h ASN 91 CO -0.02 0.27 -0.08 0.18 -1.06 0.00 0.00 177.43 176.71 3hu1 n LEU 92 N -3.92 1.99 -3.91 1.61 4.77 -0.63 -4.22 117.00 112.69 3hu1 n LEU 92 Ca -0.02 -0.66 -0.27 0.00 -0.03 0.00 0.00 56.01 55.03 3hu1 n LEU 92 Cb 0.35 -0.02 0.01 0.00 -2.33 0.00 0.00 43.42 41.43 3hu1 n LEU 92 CO 0.36 0.34 -0.06 0.54 -1.33 0.00 0.00 177.39 177.24 3hu1 n ARG 93 N 0.43 -4.40 -4.55 3.23 5.12 -0.63 -1.96 116.66 113.91 3hu1 n ARG 93 Ca 0.15 0.52 -0.26 0.00 -1.93 0.00 0.00 57.85 56.34 3hu1 n ARG 93 Cb 0.45 -5.08 -0.14 0.00 -1.16 0.00 0.00 32.46 26.53 3hu1 n ARG 93 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3hu1 s VAL 94 N -3.59 1.75 0.31 1.55 -7.23 -0.42 -4.51 120.40 108.26 3hu1 s VAL 94 Ca 0.30 -1.34 0.07 0.00 -1.81 0.00 0.00 61.98 59.20 3hu1 s VAL 94 Cb -0.15 -1.54 -0.03 0.00 0.56 0.00 0.00 36.38 35.22 3hu1 s VAL 94 CO 0.85 0.14 0.26 -0.83 -0.31 0.00 0.00 175.10 175.21 3hu1 s GLY 95 N -1.44 1.67 0.09 2.32 0.00 -1.26 -4.48 107.32 104.22 3hu1 s GLY 95 Ca 0.08 -1.59 -0.35 0.00 0.00 0.00 0.00 44.72 42.86 3hu1 s GLY 95 CO 0.03 -1.55 1.50 1.04 0.00 0.00 0.00 173.10 174.12 3hu1 n LEU 96 N -1.31 2.44 0.00 0.66 4.32 -1.26 -1.68 117.00 120.17 3hu1 n LEU 96 Ca -0.04 1.09 0.00 0.00 -0.02 0.00 0.00 56.01 57.05 3hu1 n LEU 96 Cb 0.59 -1.30 0.00 0.00 -1.62 0.00 0.00 43.42 41.09 3hu1 n LEU 96 CO 0.43 -0.62 0.00 0.61 -1.22 0.00 0.00 177.39 176.59 3hu1 n GLY 97 N 3.12 2.70 3.78 -0.72 0.00 -0.66 -4.98 105.19 108.43 3hu1 n GLY 97 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 3hu1 n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu1 s ASP 98 N -1.37 6.45 0.14 1.61 1.01 -0.68 -4.61 116.67 119.23 3hu1 s ASP 98 Ca 0.00 2.08 -0.18 0.00 0.71 0.00 0.00 52.55 55.16 3hu1 s ASP 98 Cb 0.00 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.28 3hu1 s ASP 98 CO 0.00 -0.71 0.61 0.68 0.21 0.00 0.00 175.17 175.96 3hu1 s VAL 99 N -1.72 4.73 0.09 -1.27 -7.23 -1.26 -1.53 120.40 112.21 3hu1 s VAL 99 Ca 0.62 1.09 0.03 0.00 -1.81 0.00 0.00 61.98 61.92 3hu1 s VAL 99 Cb -0.22 -3.83 -0.04 0.00 0.56 0.00 0.00 36.38 32.85 3hu1 s VAL 99 CO 0.27 0.34 -0.09 0.27 -0.31 0.00 0.00 175.10 175.59 3hu1 s ILE 100 N -1.36 0.83 0.08 -0.62 -5.25 -0.33 -4.88 121.20 109.67 3hu1 s ILE 100 Ca 0.36 -1.70 -0.19 0.00 -0.99 0.00 0.00 60.65 58.13 3hu1 s ILE 100 Cb -0.17 -1.41 -0.07 0.00 2.95 0.00 0.00 42.46 43.76 3hu1 s ILE 100 CO 0.20 -0.65 0.57 -0.44 -1.79 0.00 0.00 174.94 172.82 3hu1 s SER 101 N -2.59 7.05 -0.11 4.36 0.01 -0.95 -1.83 113.70 119.65 3hu1 s SER 101 Ca 0.07 1.26 0.04 0.00 1.31 0.00 0.00 55.95 58.62 3hu1 s SER 101 Cb -0.01 -2.36 -0.00 0.00 0.21 0.00 0.00 66.02 63.87 3hu1 s SER 101 CO -0.01 0.27 -0.23 -0.51 0.41 0.00 0.00 173.24 173.16 3hu1 s ILE 102 N -1.12 2.13 -0.03 1.44 2.07 -0.84 -1.96 121.20 122.88 3hu1 s ILE 102 Ca 0.29 -0.99 0.04 0.00 -1.41 0.00 0.00 60.65 58.58 3hu1 s ILE 102 Cb -0.19 -1.82 -0.00 0.00 0.13 0.00 0.00 42.46 40.57 3hu1 s ILE 102 CO 0.19 0.56 -0.13 -1.58 -1.91 0.00 0.00 174.94 172.06 3hu1 s GLN 103 N 0.38 1.28 0.40 3.50 0.74 0.13 -4.84 119.66 121.24 3hu1 s GLN 103 Ca -0.17 -0.47 -0.27 0.00 0.05 0.00 0.00 55.36 54.50 3hu1 s GLN 103 Cb -0.18 -1.17 -0.09 0.00 1.10 0.00 0.00 33.01 32.67 3hu1 s GLN 103 CO 0.08 0.23 1.38 -1.25 -0.55 0.00 0.00 175.29 175.17 3hu1 s PRO 104 N -0.06 3.99 -0.40 1.67 0.04 -1.26 -0.61 135.00 138.38 3hu1 s PRO 104 Ca 0.00 2.33 0.09 0.00 0.04 0.00 0.00 61.00 63.46 3hu1 s PRO 104 Cb -0.08 -2.83 0.29 0.00 0.04 0.00 0.00 34.50 31.91 3hu1 s PRO 104 CO 0.01 -0.53 0.61 0.00 0.04 0.00 0.00 177.00 177.12 3hu1 n PRO 106 N 0.97 1.40 0.23 0.00 -0.05 -1.26 -4.12 135.00 132.18 3hu1 n PRO 106 Ca 0.23 -0.60 0.12 0.00 -0.05 0.00 0.00 63.50 63.19 3hu1 n PRO 106 Cb 0.56 -1.37 0.49 0.00 -0.05 0.00 0.00 33.50 33.14 3hu1 n PRO 106 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 175.50 175.01 3hu1 h ASP 107 N 1.25 0.00 -2.01 3.54 3.45 -1.94 -3.47 116.42 117.25 3hu1 h ASP 107 Ca 0.00 0.00 -0.59 0.00 0.43 0.00 0.00 57.03 56.87 3hu1 h ASP 107 Cb 0.27 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.05 3hu1 h ASP 107 CO 0.00 0.17 1.27 0.52 -1.57 0.00 0.00 179.24 179.63 3hu1 n VAL 108 N -3.31 0.54 -1.70 -1.35 0.31 -1.26 -4.99 118.33 106.58 3hu1 n VAL 108 Ca 0.00 -0.22 -0.32 0.00 -0.01 0.00 0.00 64.34 63.80 3hu1 n VAL 108 Cb 0.41 -2.15 0.04 0.00 -0.91 0.00 0.00 33.84 31.23 3hu1 n VAL 108 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3hu1 s LYS 109 N 5.00 2.94 0.17 5.55 1.02 -1.26 -4.85 119.74 128.30 3hu1 s LYS 109 Ca 0.96 1.13 -0.30 0.00 0.02 0.00 0.00 55.97 57.77 3hu1 s LYS 109 Cb -0.55 -1.98 -0.08 0.00 -0.52 0.00 0.00 37.83 34.70 3hu1 s LYS 109 CO 0.45 -1.11 1.19 0.71 -0.92 0.00 0.00 175.35 175.67 3hu1 s TYR 110 N -2.74 3.44 0.34 3.18 1.51 -1.26 -1.83 117.35 119.99 3hu1 s TYR 110 Ca 0.61 1.42 -0.29 0.00 -1.01 0.00 0.00 57.07 57.81 3hu1 s TYR 110 Cb -0.16 -3.41 -0.11 0.00 -0.11 0.00 0.00 41.96 38.17 3hu1 s TYR 110 CO 0.47 -1.16 1.39 0.20 -1.11 0.00 0.00 175.55 175.34 3hu1 s GLY 111 N 0.23 2.89 -0.11 0.71 0.00 0.74 -4.82 107.32 106.96 3hu1 s GLY 111 Ca 0.53 1.38 -0.09 0.00 0.00 0.00 0.00 44.72 46.54 3hu1 s GLY 111 CO 0.35 2.08 -0.18 1.17 0.00 0.00 0.00 173.10 176.53 3hu1 n LYS 112 N 0.88 0.33 -4.00 2.90 3.00 -1.26 -3.76 118.16 116.26 3hu1 n LYS 112 Ca 0.01 0.30 -0.18 0.00 -0.00 0.00 0.00 58.31 58.45 3hu1 n LYS 112 Cb 0.41 -1.28 -0.16 0.00 0.00 0.00 0.00 35.03 34.00 3hu1 n LYS 112 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 3hu1 s ARG 113 N -2.06 0.44 0.07 1.64 0.52 -1.26 -1.84 118.95 116.46 3hu1 s ARG 113 Ca -0.15 0.02 0.09 0.00 -0.52 0.00 0.00 55.73 55.17 3hu1 s ARG 113 Cb 0.02 -0.56 -0.03 0.00 0.52 0.00 0.00 34.95 34.89 3hu1 s ARG 113 CO 0.22 -0.11 -0.24 0.96 0.02 0.00 0.00 175.30 176.14 3hu1 s ILE 114 N 0.93 1.99 -0.23 1.52 -4.36 -0.78 -0.66 121.20 119.60 3hu1 s ILE 114 Ca -0.10 -1.45 0.02 0.00 -0.26 0.00 0.00 60.65 58.85 3hu1 s ILE 114 Cb -0.13 -1.73 0.05 0.00 1.25 0.00 0.00 42.46 41.89 3hu1 s ILE 114 CO -0.01 0.20 -0.12 -2.28 0.24 0.00 0.00 174.94 172.97 3hu1 s HIS 115 N -0.92 2.93 0.10 1.37 2.46 -0.88 -0.88 115.29 119.48 3hu1 s HIS 115 Ca 0.10 -2.02 0.08 0.00 0.47 0.00 0.00 55.06 53.70 3hu1 s HIS 115 Cb -0.10 -1.83 -0.04 0.00 -0.13 0.00 0.00 32.58 30.48 3hu1 s HIS 115 CO 0.03 -0.83 -0.17 0.14 -2.47 0.00 0.00 174.74 171.44 3hu1 s VAL 116 N 1.22 2.89 -0.02 0.89 -7.23 -0.14 -0.36 120.40 117.64 3hu1 s VAL 116 Ca -0.05 -1.42 -0.02 0.00 -1.81 0.00 0.00 61.98 58.68 3hu1 s VAL 116 Cb -0.18 -2.31 0.00 0.00 0.56 0.00 0.00 36.38 34.46 3hu1 s VAL 116 CO -0.07 0.15 0.06 -0.76 -0.31 0.00 0.00 175.10 174.17 3hu1 s LEU 117 N -2.01 1.78 0.58 1.32 1.43 -0.84 -4.09 118.68 116.86 3hu1 s LEU 117 Ca 0.18 0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 53.20 3hu1 s LEU 117 Cb -0.11 0.22 -0.04 0.00 0.03 0.00 0.00 46.19 46.29 3hu1 s LEU 117 CO 0.09 -0.05 1.04 -2.16 0.23 0.00 0.00 176.35 175.50 3hu1 s PRO 118 N -0.10 3.47 -0.21 1.29 0.04 -1.26 -0.60 135.00 137.63 3hu1 s PRO 118 Ca -0.01 1.08 -0.24 0.00 0.04 0.00 0.00 61.00 61.87 3hu1 s PRO 118 Cb -0.01 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 3hu1 s PRO 118 CO 0.00 -0.67 0.78 0.42 0.04 0.00 0.00 177.00 177.56 3hu1 s ILE 119 N -2.60 4.90 0.26 0.56 1.09 0.50 -1.56 121.20 124.33 3hu1 s ILE 119 Ca 0.61 1.48 -0.10 0.00 -1.10 0.00 0.00 60.65 61.54 3hu1 s ILE 119 Cb -0.14 -4.08 0.39 0.00 -1.06 0.00 0.00 42.46 37.58 3hu1 s ILE 119 CO 0.38 -0.00 1.57 -2.24 -0.10 0.00 0.00 174.94 174.55 3hu1 h ASP 120 N 7.56 -0.92 1.07 3.58 2.03 -1.36 -1.73 116.42 126.66 3hu1 h ASP 120 Ca -0.27 0.28 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 3hu1 h ASP 120 Cb 1.12 0.59 0.00 0.00 -0.83 0.00 0.00 39.33 40.21 3hu1 h ASP 120 CO 0.83 -0.30 0.00 -2.24 -1.03 0.00 0.00 179.24 176.50 3hu1 h ASP 121 N -0.01 0.00 -0.47 4.15 2.03 -1.94 -2.40 116.42 117.79 3hu1 h ASP 121 Ca 0.43 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.73 3hu1 h ASP 121 Cb 0.66 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.16 3hu1 h ASP 121 CO -0.95 0.00 0.00 0.35 -1.03 0.00 0.00 179.24 177.61 3hu1 n THR 122 N -2.96 1.86 -1.05 1.15 -2.24 -0.65 -4.35 114.28 106.03 3hu1 n THR 122 Ca 0.01 -1.02 0.00 0.00 -2.27 0.00 0.00 64.05 60.77 3hu1 n THR 122 Cb 0.32 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 3hu1 n THR 122 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 3hu1 n VAL 123 N 0.62 0.06 -2.29 2.28 3.14 -0.90 -4.55 118.33 116.69 3hu1 n VAL 123 Ca 0.21 -0.06 -0.42 0.00 -2.96 0.00 0.00 64.34 61.11 3hu1 n VAL 123 Cb 0.88 0.92 -0.03 0.00 -1.06 0.00 0.00 33.84 34.56 3hu1 n VAL 123 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 3hu1 s GLU 124 N -0.07 4.33 0.00 1.45 2.02 -1.25 -4.72 118.70 120.46 3hu1 s GLU 124 Ca 0.00 1.89 0.00 0.00 0.02 0.00 0.00 54.97 56.89 3hu1 s GLU 124 Cb 0.00 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.76 3hu1 s GLU 124 CO 0.00 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.22 3hu1 n GLY 125 N 3.49 -1.07 2.19 -1.39 0.00 -1.26 -5.08 105.19 102.06 3hu1 n GLY 125 Ca 0.12 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 45.04 3hu1 n GLY 125 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3hu1 n ILE 126 N 1.26 -7.10 -0.03 -0.61 0.13 -1.26 -5.01 119.36 106.74 3hu1 n ILE 126 Ca 0.00 1.68 -0.11 0.00 -1.10 0.00 0.00 62.75 63.22 3hu1 n ILE 126 Cb 0.00 -3.91 -0.10 0.00 -0.84 0.00 0.00 39.64 34.79 3hu1 n ILE 126 CO 0.00 0.00 0.00 0.74 2.80 0.00 0.00 176.55 180.09 3hu1 h THR 127 N 4.16 1.30 0.00 9.51 2.02 -1.98 -3.48 112.91 124.44 3hu1 h THR 127 Ca 0.00 -1.73 0.00 0.00 0.77 0.00 0.00 66.41 65.45 3hu1 h THR 127 Cb 0.00 2.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.75 3hu1 h THR 127 CO 0.00 0.40 0.00 0.61 0.37 0.00 0.00 175.52 176.90 3hu1 n GLY 128 N 1.21 0.26 3.62 2.16 0.00 -1.26 -3.68 105.19 107.50 3hu1 n GLY 128 Ca -0.08 0.60 -0.02 0.00 0.00 0.00 0.00 46.02 46.52 3hu1 n GLY 128 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hu1 s ASN 129 N -4.00 -1.07 0.24 1.61 3.84 -1.26 -5.08 114.94 109.22 3hu1 s ASN 129 Ca 0.00 1.54 0.01 0.00 0.21 0.00 0.00 52.86 54.61 3hu1 s ASN 129 Cb 0.00 2.15 0.27 0.00 -0.55 0.00 0.00 41.25 43.12 3hu1 s ASN 129 CO 0.00 -0.22 1.61 -0.07 -2.79 0.00 0.00 177.10 175.63 3hu1 h LEU 130 N 7.90 0.49 -0.23 3.21 3.38 -1.97 -1.75 115.31 126.34 3hu1 h LEU 130 Ca -0.19 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.48 3hu1 h LEU 130 Cb 1.11 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 3hu1 h LEU 130 CO 0.11 0.86 -0.14 0.15 0.09 0.00 0.00 178.44 179.51 3hu1 h PHE 131 N 0.38 0.59 -0.01 1.13 3.04 -1.96 -2.83 116.94 117.28 3hu1 h PHE 131 Ca 0.03 -0.15 -0.00 0.00 3.98 0.00 0.00 57.97 61.82 3hu1 h PHE 131 Cb 0.90 -0.13 -0.00 0.00 2.56 0.00 0.00 35.95 39.28 3hu1 h PHE 131 CO 0.03 0.80 -0.01 1.49 -2.02 0.00 0.00 178.31 178.60 3hu1 h GLU 132 N 0.22 0.02 -0.17 1.11 4.57 -1.96 0.47 114.58 118.83 3hu1 h GLU 132 Ca 0.05 -0.01 -0.20 0.00 -1.18 0.00 0.00 59.36 58.02 3hu1 h GLU 132 Cb 0.65 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.25 3hu1 h GLU 132 CO 0.04 0.53 -0.67 0.28 -1.18 0.00 0.00 179.01 178.01 3hu1 h VAL 133 N -0.50 1.29 0.00 0.32 2.07 -1.48 -3.41 116.25 114.54 3hu1 h VAL 133 Ca 0.00 -1.88 -0.05 0.00 0.82 0.00 0.00 66.70 65.59 3hu1 h VAL 133 Cb 0.53 1.96 -0.01 0.00 -1.52 0.00 0.00 31.29 32.25 3hu1 h VAL 133 CO 0.00 0.60 -0.77 -1.22 0.02 0.00 0.00 177.57 176.20 3hu1 n TYR 134 N -4.02 0.00 -0.02 1.57 4.01 -1.10 -4.71 117.16 112.89 3hu1 n TYR 134 Ca -0.07 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.52 3hu1 n TYR 134 Cb 0.69 -0.31 -0.11 0.00 -0.31 0.00 0.00 39.34 39.30 3hu1 n TYR 134 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3hu1 h LEU 135 N -0.52 0.30 -0.39 7.72 3.38 -1.30 -3.05 115.31 121.45 3hu1 h LEU 135 Ca -0.07 -0.73 0.04 0.00 0.09 0.00 0.00 57.88 57.20 3hu1 h LEU 135 Cb 0.68 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.30 3hu1 h LEU 135 CO -0.04 0.99 0.17 0.50 0.09 0.00 0.00 178.44 180.15 3hu1 h LYS 136 N -0.36 0.35 0.00 1.13 3.64 -1.15 -1.16 116.57 119.01 3hu1 h LYS 136 Ca -0.03 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 3hu1 h LYS 136 Cb 1.02 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.76 3hu1 h LYS 136 CO 0.06 0.23 -0.19 -1.00 -2.27 0.00 0.00 179.45 176.28 3hu1 h PRO 137 N 0.36 0.00 -0.24 1.90 0.13 -1.79 -0.92 132.00 131.43 3hu1 h PRO 137 Ca 0.17 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.14 3hu1 h PRO 137 Cb 0.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.24 3hu1 h PRO 137 CO -0.15 0.19 -0.51 -0.92 -0.23 0.00 0.00 178.00 176.38 3hu1 h TYR 138 N 0.00 0.84 0.01 1.56 3.20 -1.30 -3.38 116.97 117.90 3hu1 h TYR 138 Ca -0.00 -0.29 -0.36 0.00 3.14 0.00 0.00 58.73 61.22 3hu1 h TYR 138 Cb 0.54 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 38.59 3hu1 h TYR 138 CO 0.00 1.05 -2.22 1.19 -1.64 0.00 0.00 178.16 176.54 3hu1 n PHE 139 N -3.99 0.37 -1.69 -3.82 3.72 -0.49 -4.85 117.46 106.71 3hu1 n PHE 139 Ca -0.03 0.11 -0.55 0.00 -0.05 0.00 0.00 57.45 56.93 3hu1 n PHE 139 Cb 0.59 -1.06 -0.07 0.00 -0.94 0.00 0.00 39.48 38.01 3hu1 n PHE 139 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3hu1 n LEU 140 N -3.02 2.45 0.00 4.37 7.94 -0.37 -1.91 117.00 126.47 3hu1 n LEU 140 Ca -0.32 1.07 0.00 0.00 -1.11 0.00 0.00 56.01 55.64 3hu1 n LEU 140 Cb 1.08 -1.19 0.00 0.00 0.53 0.00 0.00 43.42 43.84 3hu1 n LEU 140 CO 0.39 -0.47 0.00 -0.62 -1.11 0.00 0.00 177.39 175.59 3hu1 n GLU 141 N 5.06 -1.03 0.16 1.96 -0.58 -1.26 -4.78 120.64 120.18 3hu1 n GLU 141 Ca 0.24 0.25 0.10 0.00 -0.42 0.00 0.00 57.16 57.34 3hu1 n GLU 141 Cb 0.17 -4.72 0.09 0.00 -0.57 0.00 0.00 31.44 26.41 3hu1 n GLU 141 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3hu1 h ALA 142 N 0.00 0.79 -6.32 0.62 0.00 -1.68 -3.49 119.26 109.19 3hu1 h ALA 142 Ca 0.00 -0.10 -0.46 0.00 0.00 0.00 0.00 54.91 54.35 3hu1 h ALA 142 Cb 0.51 0.01 0.04 0.00 0.00 0.00 0.00 17.79 18.34 3hu1 h ALA 142 CO 0.00 0.12 -0.92 0.66 0.00 0.00 0.00 179.25 179.12 3hu1 n TYR 143 N -2.97 -1.81 -2.61 0.00 4.01 -1.22 -4.93 117.16 107.63 3hu1 n TYR 143 Ca 0.02 0.56 -0.42 0.00 -0.16 0.00 0.00 57.90 57.90 3hu1 n TYR 143 Cb 0.58 -3.59 -0.03 0.00 -0.31 0.00 0.00 39.34 35.99 3hu1 n TYR 143 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3hu1 s ARG 144 N -6.20 4.53 -0.12 -0.72 0.52 -1.20 -4.65 118.95 111.11 3hu1 s ARG 144 Ca 0.29 1.55 -0.27 0.00 -0.52 0.00 0.00 55.73 56.78 3hu1 s ARG 144 Cb -0.11 -3.41 -0.02 0.00 0.52 0.00 0.00 34.95 31.94 3hu1 s ARG 144 CO 0.87 -0.10 0.89 -1.25 0.02 0.00 0.00 175.30 175.74 3hu1 s PRO 145 N 0.90 4.38 0.03 3.54 0.05 -1.26 0.29 135.00 142.92 3hu1 s PRO 145 Ca 0.54 1.17 0.04 0.00 0.05 0.00 0.00 61.00 62.80 3hu1 s PRO 145 Cb -0.24 -3.54 -0.02 0.00 0.05 0.00 0.00 34.50 30.75 3hu1 s PRO 145 CO 0.29 -0.26 -0.13 0.96 0.05 0.00 0.00 177.00 177.91 3hu1 s ILE 146 N 1.86 1.05 0.07 0.56 -4.36 -0.80 -4.73 121.20 114.84 3hu1 s ILE 146 Ca 0.43 -0.89 0.05 0.00 -0.26 0.00 0.00 60.65 59.98 3hu1 s ILE 146 Cb -0.18 -0.94 -0.04 0.00 1.25 0.00 0.00 42.46 42.56 3hu1 s ILE 146 CO 0.16 0.05 -0.03 -0.60 0.24 0.00 0.00 174.94 174.75 3hu1 s ARG 147 N -0.96 2.46 0.21 0.37 3.52 -1.26 -2.44 118.95 120.84 3hu1 s ARG 147 Ca 0.02 -0.85 -0.32 0.00 -0.13 0.00 0.00 55.73 54.45 3hu1 s ARG 147 Cb -0.07 -2.49 -0.13 0.00 -1.56 0.00 0.00 34.95 30.70 3hu1 s ARG 147 CO 0.01 0.55 1.50 1.17 -0.81 0.00 0.00 175.30 177.72 3hu1 n LYS 148 N 0.81 2.14 -0.56 5.12 4.81 -0.50 -2.24 118.16 127.74 3hu1 n LYS 148 Ca -0.12 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 3hu1 n LYS 148 Cb 0.52 -2.49 0.00 0.00 0.02 0.00 0.00 35.03 33.08 3hu1 n LYS 148 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hu1 n GLY 149 N 2.78 0.77 3.74 3.14 0.00 0.14 -5.00 105.19 110.76 3hu1 n GLY 149 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 3hu1 n GLY 149 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hu1 s ASP 150 N -2.87 6.80 -0.23 1.61 1.01 -0.95 -4.75 116.67 117.28 3hu1 s ASP 150 Ca 0.00 2.48 -0.07 0.00 0.71 0.00 0.00 52.55 55.68 3hu1 s ASP 150 Cb 0.00 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.29 3hu1 s ASP 150 CO 0.00 -0.61 0.06 -0.63 0.21 0.00 0.00 175.17 174.19 3hu1 s ILE 151 N 0.26 4.31 0.02 0.77 1.09 -1.26 -0.22 121.20 126.17 3hu1 s ILE 151 Ca 0.59 -0.18 0.03 0.00 -1.10 0.00 0.00 60.65 59.99 3hu1 s ILE 151 Cb -0.39 -2.99 -0.02 0.00 -1.06 0.00 0.00 42.46 38.01 3hu1 s ILE 151 CO 0.38 0.37 -0.09 0.72 -0.10 0.00 0.00 174.94 176.22 3hu1 s PHE 152 N 1.32 0.82 -0.14 3.97 -0.71 0.66 -4.81 117.98 119.09 3hu1 s PHE 152 Ca 0.05 -0.30 -0.11 0.00 -1.04 0.00 0.00 56.93 55.53 3hu1 s PHE 152 Cb -0.15 -0.50 -0.05 0.00 -1.21 0.00 0.00 43.02 41.12 3hu1 s PHE 152 CO 0.03 -0.02 0.22 -1.17 -1.34 0.00 0.00 175.22 172.94 3hu1 s LEU 153 N -0.86 4.30 -0.08 -1.99 2.96 -1.26 -0.41 118.68 121.34 3hu1 s LEU 153 Ca -0.01 0.47 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 3hu1 s LEU 153 Cb -0.06 -2.24 0.02 0.00 0.50 0.00 0.00 46.19 44.41 3hu1 s LEU 153 CO 0.00 0.23 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.49 3hu1 s VAL 154 N -0.15 0.97 0.18 1.68 1.01 -0.49 -4.98 120.40 118.61 3hu1 s VAL 154 Ca 0.15 -0.32 -0.26 0.00 0.00 0.00 0.00 61.98 61.55 3hu1 s VAL 154 Cb -0.13 -0.95 -0.08 0.00 0.00 0.00 0.00 36.38 35.22 3hu1 s VAL 154 CO 0.03 0.34 0.80 -0.13 0.00 0.00 0.00 175.10 176.14 3hu1 s ARG 155 N 1.21 4.59 -0.44 2.72 0.52 -1.26 -1.05 118.95 125.24 3hu1 s ARG 155 Ca -0.05 1.19 0.07 0.00 -0.52 0.00 0.00 55.73 56.43 3hu1 s ARG 155 Cb -0.14 -3.23 0.24 0.00 0.52 0.00 0.00 34.95 32.33 3hu1 s ARG 155 CO -0.02 0.55 0.53 0.41 0.02 0.00 0.00 175.30 176.79 3hu1 n GLY 156 N 1.51 3.11 6.00 -3.53 0.00 -0.79 -4.93 105.19 106.56 3hu1 n GLY 156 Ca -0.05 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3hu1 n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hu1 n GLY 157 N 1.54 0.80 0.36 -0.02 0.00 -1.26 -4.20 105.19 102.42 3hu1 n GLY 157 Ca 0.24 0.47 -0.10 0.00 0.00 0.00 0.00 46.02 46.62 3hu1 n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu1 h MET 158 N 0.00 -0.15 -3.52 1.61 -0.00 -2.02 -3.47 114.93 107.38 3hu1 h MET 158 Ca 0.00 0.01 -0.14 0.00 -0.00 0.00 0.00 59.70 59.57 3hu1 h MET 158 Cb 0.00 0.03 -0.04 0.00 -0.00 0.00 0.00 31.60 31.60 3hu1 h MET 158 CO 0.00 -0.10 0.06 -0.98 -0.00 0.00 0.00 176.91 175.89 3hu1 s ARG 159 N -5.11 2.09 -0.12 -0.10 1.70 -1.26 -5.17 118.95 110.98 3hu1 s ARG 159 Ca -0.11 -1.59 -0.02 0.00 -0.47 0.00 0.00 55.73 53.54 3hu1 s ARG 159 Cb 0.08 0.54 -0.03 0.00 -0.57 0.00 0.00 34.95 34.98 3hu1 s ARG 159 CO 0.51 -0.93 -0.05 0.00 -1.08 0.00 0.00 175.30 173.75 3hu1 s ALA 160 N -2.65 3.00 -0.09 7.88 0.00 -1.26 -1.89 121.76 126.75 3hu1 s ALA 160 Ca 0.22 -0.84 0.04 0.00 0.00 0.00 0.00 51.96 51.38 3hu1 s ALA 160 Cb -0.03 -1.43 -0.01 0.00 0.00 0.00 0.00 23.12 21.65 3hu1 s ALA 160 CO 0.16 0.35 -0.22 0.08 0.00 0.00 0.00 175.76 176.13 3hu1 s VAL 161 N -0.09 2.28 -0.05 0.00 1.01 -0.22 -4.94 120.40 118.40 3hu1 s VAL 161 Ca 0.02 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 60.83 3hu1 s VAL 161 Cb -0.13 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 3hu1 s VAL 161 CO 0.03 0.56 0.59 -1.61 0.00 0.00 0.00 175.10 174.67 3hu1 s GLU 162 N 0.16 4.35 0.11 2.72 2.02 -1.26 -1.39 118.70 125.40 3hu1 s GLU 162 Ca -0.12 0.70 0.10 0.00 0.02 0.00 0.00 54.97 55.67 3hu1 s GLU 162 Cb -0.16 -3.39 -0.04 0.00 0.10 0.00 0.00 34.13 30.64 3hu1 s GLU 162 CO 0.07 0.24 -0.26 -0.06 0.02 0.00 0.00 175.26 175.27 3hu1 s PHE 163 N 0.25 2.34 -0.10 1.61 0.08 0.45 -0.37 117.98 122.24 3hu1 s PHE 163 Ca 0.31 -0.37 0.01 0.00 0.12 0.00 0.00 56.93 57.00 3hu1 s PHE 163 Cb -0.17 -1.29 -0.02 0.00 -0.57 0.00 0.00 43.02 40.96 3hu1 s PHE 163 CO 0.16 0.29 -0.12 0.21 -0.10 0.00 0.00 175.22 175.66 3hu1 s LYS 164 N -1.87 3.06 -0.64 0.44 2.20 0.23 -0.25 119.74 122.90 3hu1 s LYS 164 Ca 0.14 -0.67 -0.27 0.00 -0.36 0.00 0.00 55.97 54.81 3hu1 s LYS 164 Cb -0.10 -2.56 0.03 0.00 -1.51 0.00 0.00 37.83 33.69 3hu1 s LYS 164 CO 0.05 0.39 1.20 0.08 -0.36 0.00 0.00 175.35 176.71 3hu1 s VAL 165 N -0.10 3.94 -0.06 4.02 1.01 0.69 -1.98 120.40 127.92 3hu1 s VAL 165 Ca -0.01 0.62 -0.15 0.00 0.00 0.00 0.00 61.98 62.44 3hu1 s VAL 165 Cb -0.14 -4.79 -0.30 0.00 0.00 0.00 0.00 36.38 31.15 3hu1 s VAL 165 CO 0.03 -1.53 0.72 0.58 0.00 0.00 0.00 175.10 174.90 3hu1 h VAL 166 N 6.09 1.12 -3.99 2.92 2.07 -1.03 0.41 116.25 123.83 3hu1 h VAL 166 Ca -0.26 -2.51 -0.19 0.00 0.82 0.00 0.00 66.70 64.56 3hu1 h VAL 166 Cb 1.06 2.86 -0.21 0.00 -1.52 0.00 0.00 31.29 33.48 3hu1 h VAL 166 CO 1.22 0.77 -0.71 -0.70 0.02 0.00 0.00 177.57 178.17 3hu1 s GLU 167 N -2.52 0.38 -0.02 1.57 2.56 -1.07 -4.73 118.70 114.86 3hu1 s GLU 167 Ca -0.16 -0.68 0.01 0.00 0.00 0.00 0.00 54.97 54.14 3hu1 s GLU 167 Cb 0.04 0.02 0.02 0.00 2.00 0.00 0.00 34.13 36.21 3hu1 s GLU 167 CO 0.83 -0.03 -0.01 0.99 -0.56 0.00 0.00 175.26 176.49 3hu1 s THR 168 N -1.57 0.19 0.11 -1.70 2.01 -1.26 -2.06 115.64 111.36 3hu1 s THR 168 Ca -0.13 0.04 -0.08 0.00 0.31 0.00 0.00 61.69 61.83 3hu1 s THR 168 Cb -0.09 -0.27 -0.20 0.00 0.01 0.00 0.00 72.50 71.96 3hu1 s THR 168 CO -0.01 0.13 1.27 -0.78 -0.69 0.00 0.00 174.62 174.54 3hu1 h ASP 169 N 7.04 0.67 -3.08 3.53 3.58 -1.29 -3.40 116.42 123.47 3hu1 h ASP 169 Ca -0.40 -0.53 -0.56 0.00 0.42 0.00 0.00 57.03 55.96 3hu1 h ASP 169 Cb 1.14 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.96 3hu1 h ASP 169 CO 0.48 1.33 0.71 -2.84 -2.88 0.00 0.00 179.24 176.05 3hu1 s PRO 170 N -3.30 4.34 0.00 0.28 0.02 -1.26 -4.93 135.00 130.15 3hu1 s PRO 170 Ca -0.07 1.63 0.00 0.00 0.02 0.00 0.00 61.00 62.58 3hu1 s PRO 170 Cb 0.08 -3.58 0.00 0.00 0.02 0.00 0.00 34.50 31.02 3hu1 s PRO 170 CO 0.89 -0.47 0.00 0.43 -0.33 0.00 0.00 177.00 177.52 3hu1 n SER 171 N 5.39 0.00 -0.11 2.53 7.64 -1.26 -3.46 113.62 124.35 3hu1 n SER 171 Ca 0.11 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.83 3hu1 n SER 171 Cb 0.46 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.53 3hu1 n SER 171 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3hu1 n PRO 172 N -0.34 0.67 -4.06 1.43 -0.05 -1.26 -4.65 135.00 126.74 3hu1 n PRO 172 Ca 0.00 0.13 -0.09 0.00 -0.05 0.00 0.00 63.50 63.50 3hu1 n PRO 172 Cb 0.00 -1.55 -0.11 0.00 -0.05 0.00 0.00 33.50 31.79 3hu1 n PRO 172 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 175.50 176.97 3hu1 s TYR 173 N -2.52 0.49 0.20 0.54 -0.85 -1.22 -1.41 117.35 112.58 3hu1 s TYR 173 Ca -0.27 -0.79 -0.17 0.00 -0.52 0.00 0.00 57.07 55.31 3hu1 s TYR 173 Cb 0.08 -0.33 0.03 0.00 0.38 0.00 0.00 41.96 42.11 3hu1 s TYR 173 CO 0.68 -0.25 0.53 0.00 -1.52 0.00 0.00 175.55 174.99 3hu1 s ILE 175 N -3.89 4.95 -0.84 0.00 1.01 -0.76 -1.91 121.20 119.76 3hu1 s ILE 175 Ca 0.10 1.22 -0.21 0.00 0.00 0.00 0.00 60.65 61.77 3hu1 s ILE 175 Cb -0.01 -3.92 0.10 0.00 0.01 0.00 0.00 42.46 38.63 3hu1 s ILE 175 CO -0.02 0.40 1.12 -0.69 0.00 0.00 0.00 174.94 175.76 3hu1 s VAL 176 N -0.04 4.44 0.57 2.92 1.01 0.14 -0.19 120.40 129.26 3hu1 s VAL 176 Ca 0.31 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 3hu1 s VAL 176 Cb -0.18 -4.79 0.01 0.00 0.00 0.00 0.00 36.38 31.42 3hu1 s VAL 176 CO 0.16 -1.56 0.86 0.00 0.00 0.00 0.00 175.10 174.56 3hu1 s ALA 177 N 3.57 3.39 0.47 5.51 0.00 -1.26 -3.22 121.76 130.22 3hu1 s ALA 177 Ca 0.31 -0.78 0.31 0.00 0.00 0.00 0.00 51.96 51.80 3hu1 s ALA 177 Cb -0.08 -2.51 1.41 0.00 0.00 0.00 0.00 23.12 21.94 3hu1 s ALA 177 CO -0.02 -0.75 1.70 -1.35 0.00 0.00 0.00 175.76 175.34 3hu1 h PRO 178 N -0.09 0.13 -0.46 0.00 0.10 -1.96 -2.23 132.00 127.50 3hu1 h PRO 178 Ca -0.45 -0.01 0.02 0.00 0.10 0.00 0.00 66.00 65.65 3hu1 h PRO 178 Cb 1.26 -0.03 -0.02 0.00 0.10 0.00 0.00 31.00 32.31 3hu1 h PRO 178 CO 0.60 0.09 0.31 -0.44 0.10 0.00 0.00 178.00 178.65 3hu1 h ASP 179 N 0.14 0.49 -2.53 -2.05 5.19 -1.94 -3.44 116.42 112.28 3hu1 h ASP 179 Ca 0.72 -0.01 -0.55 0.00 -0.62 0.00 0.00 57.03 56.56 3hu1 h ASP 179 Cb 2.37 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 41.76 3hu1 h ASP 179 CO -0.24 0.35 1.18 -0.89 -3.12 0.00 0.00 179.24 176.52 3hu1 s THR 180 N -5.51 3.42 -0.23 0.35 2.01 -0.84 -4.93 115.64 109.91 3hu1 s THR 180 Ca -0.08 0.49 -0.29 0.00 0.31 0.00 0.00 61.69 62.12 3hu1 s THR 180 Cb 0.18 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 69.31 3hu1 s THR 180 CO 0.74 -0.11 1.15 -0.69 -0.69 0.00 0.00 174.62 175.02 3hu1 s VAL 181 N 4.99 4.46 -0.49 3.82 1.01 -0.77 -4.93 120.40 128.49 3hu1 s VAL 181 Ca 0.79 1.74 -0.16 0.00 0.00 0.00 0.00 61.98 64.35 3hu1 s VAL 181 Cb -0.33 -4.20 0.07 0.00 0.00 0.00 0.00 36.38 31.93 3hu1 s VAL 181 CO 0.33 -0.24 0.46 -0.63 0.00 0.00 0.00 175.10 175.03 3hu1 s ILE 182 N 3.49 5.14 -0.06 2.22 1.01 -1.26 -1.86 121.20 129.87 3hu1 s ILE 182 Ca 0.49 -0.95 -0.15 0.00 0.00 0.00 0.00 60.65 60.05 3hu1 s ILE 182 Cb -0.17 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.06 3hu1 s ILE 182 CO 0.12 -0.66 0.38 -1.00 0.00 0.00 0.00 174.94 173.78 3hu1 s HIS 183 N 1.90 3.63 -0.37 3.97 3.76 -0.06 -5.01 115.29 123.12 3hu1 s HIS 183 Ca 0.07 0.87 0.13 0.00 -0.15 0.00 0.00 55.06 55.98 3hu1 s HIS 183 Cb -0.23 -2.31 0.38 0.00 1.11 0.00 0.00 32.58 31.52 3hu1 s HIS 183 CO 0.08 0.50 0.80 0.00 -0.85 0.00 0.00 174.74 175.26 3hu1 h GLU 185 N 2.99 -0.20 0.00 0.00 5.08 -1.96 -3.48 114.58 117.01 3hu1 h GLU 185 Ca 0.06 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3hu1 h GLU 185 Cb 1.00 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.30 3hu1 h GLU 185 CO 0.52 -0.14 0.00 0.41 -1.00 0.00 0.00 179.01 178.80 3hu1 n GLY 186 N 0.82 -3.01 3.78 -3.84 0.00 -1.26 -5.02 105.19 96.66 3hu1 n GLY 186 Ca -0.03 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.34 3hu1 n GLY 186 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hu1 s GLU 187 N -1.60 3.40 0.15 1.61 2.02 -1.26 -4.99 118.70 118.02 3hu1 s GLU 187 Ca 0.00 1.49 -0.31 0.00 0.02 0.00 0.00 54.97 56.17 3hu1 s GLU 187 Cb 0.00 -2.02 -0.11 0.00 0.10 0.00 0.00 34.13 32.10 3hu1 s GLU 187 CO 0.00 -0.79 1.79 -2.14 0.02 0.00 0.00 175.26 174.15 3hu1 s PRO 188 N -3.42 4.14 0.13 0.39 0.02 -1.26 -4.88 135.00 130.12 3hu1 s PRO 188 Ca 0.70 2.59 -0.31 0.00 0.02 0.00 0.00 61.00 64.00 3hu1 s PRO 188 Cb -0.21 -3.45 -0.10 0.00 0.02 0.00 0.00 34.50 30.76 3hu1 s PRO 188 CO 0.28 -0.81 1.77 0.42 -0.33 0.00 0.00 177.00 178.32 3hu1 s ILE 189 N 2.30 2.53 0.27 2.83 -1.09 -0.60 -4.68 121.20 122.76 3hu1 s ILE 189 Ca 0.79 0.13 -0.29 0.00 -2.23 0.00 0.00 60.65 59.04 3hu1 s ILE 189 Cb -0.47 -3.08 -0.10 0.00 -1.58 0.00 0.00 42.46 37.23 3hu1 s ILE 189 CO 0.35 0.00 1.31 -0.54 -1.23 0.00 0.00 174.94 174.83 3hu1 s LYS 190 N 2.39 4.38 0.14 2.79 1.02 -1.26 -1.04 119.74 128.16 3hu1 s LYS 190 Ca 0.78 2.14 -0.19 0.00 0.02 0.00 0.00 55.97 58.72 3hu1 s LYS 190 Cb -0.46 -3.13 -0.00 0.00 -0.52 0.00 0.00 37.83 33.72 3hu1 s LYS 190 CO 0.35 -0.21 1.69 -0.09 -0.92 0.00 0.00 175.35 176.17 3hu1 h ARG 191 N 4.36 -0.01 -0.36 1.68 9.65 -1.93 -2.86 114.38 124.91 3hu1 h ARG 191 Ca -0.47 0.00 0.03 0.00 -1.10 0.00 0.00 59.98 58.44 3hu1 h ARG 191 Cb 1.22 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.78 3hu1 h ARG 191 CO 0.72 -0.01 0.24 0.93 2.80 0.00 0.00 179.97 184.65 3hu1 h GLU 192 N -0.01 0.37 -0.07 0.20 5.08 -1.98 -0.11 114.58 118.06 3hu1 h GLU 192 Ca 0.12 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3hu1 h GLU 192 Cb 0.19 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 3hu1 h GLU 192 CO -0.25 0.25 0.03 -0.44 -1.00 0.00 0.00 179.01 177.60 3hu1 h ASP 193 N 0.39 0.09 0.92 1.42 3.45 -1.91 0.55 116.42 121.32 3hu1 h ASP 193 Ca 0.15 -0.12 -0.10 0.00 0.43 0.00 0.00 57.03 57.39 3hu1 h ASP 193 Cb 0.11 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 38.84 3hu1 h ASP 193 CO -0.03 0.18 -0.45 -0.33 -1.57 0.00 0.00 179.24 177.04 3hu1 h GLU 194 N -0.02 0.00 0.01 3.56 4.39 -1.27 -0.40 114.58 120.85 3hu1 h GLU 194 Ca 0.02 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.53 3hu1 h GLU 194 Cb 0.12 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 3hu1 h GLU 194 CO -0.00 0.45 -0.89 0.93 -1.16 0.00 0.00 179.01 178.34 3hu1 h GLU 195 N 0.00 0.15 0.00 2.33 4.39 -1.01 -1.91 114.58 118.52 3hu1 h GLU 195 Ca -0.00 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.52 3hu1 h GLU 195 Cb 1.04 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 3hu1 h GLU 195 CO 0.06 0.94 0.00 -1.91 -1.16 0.00 0.00 179.01 176.94 3hu1 n GLU 196 N -3.62 0.08 0.06 2.33 2.13 0.18 -1.25 120.64 120.55 3hu1 n GLU 196 Ca -0.03 0.13 -0.20 0.00 0.66 0.00 0.00 57.16 57.72 3hu1 n GLU 196 Cb 0.82 -1.60 -0.15 0.00 0.27 0.00 0.00 31.44 30.78 3hu1 n GLU 196 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3hu1 h SER 197 N 0.00 0.50 0.08 4.31 0.87 -0.95 -3.25 113.55 115.11 3hu1 h SER 197 Ca 0.00 -0.77 -0.12 0.00 -1.23 0.00 0.00 61.79 59.67 3hu1 h SER 197 Cb 0.50 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 3hu1 h SER 197 CO 0.00 1.65 -0.39 -0.07 -0.53 0.00 0.00 176.83 177.49 3hu1 h LEU 198 N 0.09 0.42 -1.56 2.23 3.38 -1.26 -3.20 115.31 115.42 3hu1 h LEU 198 Ca -0.32 -0.18 0.23 0.00 0.09 0.00 0.00 57.88 57.70 3hu1 h LEU 198 Cb 2.06 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 42.63 3hu1 h LEU 198 CO 0.16 0.78 0.63 0.78 0.09 0.00 0.00 178.44 180.87 3hu1 h ASN 199 N 0.34 0.35 -1.24 -0.43 4.21 -1.27 -3.46 115.58 114.08 3hu1 h ASN 199 Ca 0.03 0.04 -0.75 0.00 1.21 0.00 0.00 56.30 56.84 3hu1 h ASN 199 Cb 0.84 -0.02 0.06 0.00 -1.12 0.00 0.00 38.32 38.08 3hu1 h ASN 199 CO 0.07 0.12 0.15 -0.62 -1.29 0.00 0.00 177.43 175.86 3hu1 n GLU 200 N -4.49 0.38 -2.53 0.81 1.02 -1.21 -4.86 120.64 109.76 3hu1 n GLU 200 Ca 0.21 0.14 -0.42 0.00 -0.02 0.00 0.00 57.16 57.06 3hu1 n GLU 200 Cb 0.78 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 30.52 3hu1 n GLU 200 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3hu1 s VAL 201 N 0.08 4.32 0.41 2.62 1.01 -1.26 -5.05 120.40 122.51 3hu1 s VAL 201 Ca 0.87 1.68 0.01 0.00 0.00 0.00 0.00 61.98 64.54 3hu1 s VAL 201 Cb -1.14 -4.07 -0.00 0.00 0.00 0.00 0.00 36.38 31.16 3hu1 s VAL 201 CO 0.54 0.14 0.04 0.61 0.00 0.00 0.00 175.10 176.43 3hu1 n GLY 202 N 3.06 3.56 0.30 4.51 0.00 -1.26 -4.09 105.19 111.27 3hu1 n GLY 202 Ca 0.08 -2.26 0.17 0.00 0.00 0.00 0.00 46.02 44.00 3hu1 n GLY 202 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hu1 h TYR 203 N 1.34 0.00 0.00 1.61 0.99 -1.95 -0.51 116.97 118.44 3hu1 h TYR 203 Ca -0.33 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.40 3hu1 h TYR 203 Cb 1.07 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.80 3hu1 h TYR 203 CO 0.00 0.03 0.00 -0.44 -0.00 0.00 0.00 178.16 177.75 3hu1 h ASP 204 N 0.00 0.00 -0.02 3.88 5.19 -2.01 -2.91 116.42 120.55 3hu1 h ASP 204 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3hu1 h ASP 204 Cb 0.12 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.63 3hu1 h ASP 204 CO 0.00 0.00 0.00 0.47 -3.12 0.00 0.00 179.24 176.59 3hu1 n ASP 205 N -3.09 1.48 -4.25 6.45 9.92 -0.20 -4.81 116.55 122.06 3hu1 n ASP 205 Ca -0.00 -1.50 -0.35 0.00 -0.53 0.00 0.00 54.79 52.41 3hu1 n ASP 205 Cb 0.26 -0.01 -0.14 0.00 -0.64 0.00 0.00 41.12 40.59 3hu1 n ASP 205 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 3hu1 s ILE 206 N -1.99 3.01 0.12 0.53 1.10 -1.10 -5.00 121.20 117.88 3hu1 s ILE 206 Ca 0.38 -0.73 0.04 0.00 -0.51 0.00 0.00 60.65 59.83 3hu1 s ILE 206 Cb 0.21 -2.41 -0.04 0.00 0.15 0.00 0.00 42.46 40.37 3hu1 s ILE 206 CO 0.33 0.37 0.11 -0.83 -2.11 0.00 0.00 174.94 172.81 3hu1 s GLY 207 N 1.40 1.87 -1.46 1.50 0.00 -1.26 -4.69 107.32 104.68 3hu1 s GLY 207 Ca 0.04 -1.11 -0.11 0.00 0.00 0.00 0.00 44.72 43.54 3hu1 s GLY 207 CO -0.05 -1.10 1.03 0.61 0.00 0.00 0.00 173.10 173.59 3hu1 n GLY 208 N 0.06 -0.50 0.67 0.20 0.00 -1.26 -4.84 105.19 99.52 3hu1 n GLY 208 Ca -0.08 0.21 0.01 0.00 0.00 0.00 0.00 46.02 46.15 3hu1 n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hu1 h ARG 210 N 0.17 -0.06 -0.95 0.00 3.08 -1.92 0.56 114.38 115.26 3hu1 h ARG 210 Ca -0.04 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.08 3hu1 h ARG 210 Cb 1.49 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 31.48 3hu1 h ARG 210 CO 0.02 -0.04 0.61 -0.22 -1.07 0.00 0.00 179.97 179.26 3hu1 h LYS 211 N -0.07 1.06 0.02 0.04 3.64 -2.00 -1.96 116.57 117.30 3hu1 h LYS 211 Ca 0.21 -0.06 -0.27 0.00 -1.27 0.00 0.00 60.65 59.26 3hu1 h LYS 211 Cb 0.39 -0.24 0.02 0.00 -0.41 0.00 0.00 32.23 31.99 3hu1 h LYS 211 CO -0.48 0.70 -1.06 1.96 -2.27 0.00 0.00 179.45 178.31 3hu1 h GLN 212 N 1.10 0.66 -0.69 1.90 7.50 -1.62 -2.63 115.11 121.33 3hu1 h GLN 212 Ca 0.41 -0.73 -0.02 0.00 0.50 0.00 0.00 58.65 58.82 3hu1 h GLN 212 Cb 0.18 0.21 -0.03 0.00 0.05 0.00 0.00 27.48 27.89 3hu1 h GLN 212 CO -0.18 1.31 0.35 -0.07 -1.50 0.00 0.00 178.83 178.74 3hu1 h LEU 213 N 0.36 0.86 -0.50 1.46 3.38 -0.61 -0.99 115.31 119.27 3hu1 h LEU 213 Ca -0.13 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.77 3hu1 h LEU 213 Cb 1.71 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 42.22 3hu1 h LEU 213 CO 0.20 0.71 0.33 0.00 0.09 0.00 0.00 178.44 179.77 3hu1 h ALA 214 N 1.42 0.64 -0.75 1.53 0.00 -1.31 -0.83 119.26 119.95 3hu1 h ALA 214 Ca 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3hu1 h ALA 214 Cb 0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3hu1 h ALA 214 CO -0.04 0.07 0.37 1.96 0.00 0.00 0.00 179.25 181.62 3hu1 h GLN 215 N 0.66 1.07 -0.38 0.00 4.20 -1.04 -1.07 115.11 118.55 3hu1 h GLN 215 Ca 0.19 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.69 3hu1 h GLN 215 Cb -0.06 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.51 3hu1 h GLN 215 CO -0.05 0.82 -0.01 0.82 -0.67 0.00 0.00 178.83 179.74 3hu1 h ILE 216 N 1.05 1.26 -0.07 2.54 2.04 -0.89 0.03 117.51 123.46 3hu1 h ILE 216 Ca 0.26 -1.02 -0.05 0.00 1.00 0.00 0.00 64.86 65.06 3hu1 h ILE 216 Cb 0.09 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 3hu1 h ILE 216 CO -0.04 0.34 -0.17 0.11 0.00 0.00 0.00 178.15 178.40 3hu1 h LYS 217 N 0.49 0.11 -0.13 2.37 1.57 -0.87 0.26 116.57 120.37 3hu1 h LYS 217 Ca 0.11 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 3hu1 h LYS 217 Cb 0.48 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 3hu1 h LYS 217 CO 0.02 0.28 -0.16 0.93 -0.57 0.00 0.00 179.45 179.95 3hu1 h GLU 218 N 0.10 0.33 0.00 3.15 5.08 -0.63 0.18 114.58 122.80 3hu1 h GLU 218 Ca 0.02 -0.19 -0.12 0.00 -1.00 0.00 0.00 59.36 58.08 3hu1 h GLU 218 Cb 0.36 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 3hu1 h GLU 218 CO 0.02 0.75 -1.33 -1.33 -1.00 0.00 0.00 179.01 176.12 3hu1 n MET 219 N -4.56 0.62 -0.01 2.33 2.81 -0.06 -4.26 117.12 114.00 3hu1 n MET 219 Ca -0.07 0.18 -0.04 0.00 -1.81 0.00 0.00 57.70 55.96 3hu1 n MET 219 Cb 0.37 -1.80 -0.01 0.00 -0.71 0.00 0.00 33.22 31.07 3hu1 n MET 219 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3hu1 n VAL 220 N -2.80 1.24 -0.03 2.03 0.31 0.89 -4.69 118.33 115.28 3hu1 n VAL 220 Ca -0.07 0.25 -0.13 0.00 -0.01 0.00 0.00 64.34 64.38 3hu1 n VAL 220 Cb 0.75 -1.84 -0.08 0.00 -0.91 0.00 0.00 33.84 31.76 3hu1 n VAL 220 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3hu1 h GLU 221 N -0.37 0.15 -0.32 5.55 4.57 -1.43 -3.21 114.58 119.51 3hu1 h GLU 221 Ca -0.03 -0.06 0.02 0.00 -1.18 0.00 0.00 59.36 58.11 3hu1 h GLU 221 Cb 0.49 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.05 3hu1 h GLU 221 CO -0.02 0.51 0.16 1.25 -1.18 0.00 0.00 179.01 179.72 3hu1 h LEU 222 N -0.22 0.23 -0.99 1.64 5.85 -0.83 -0.94 115.31 120.05 3hu1 h LEU 222 Ca 0.02 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3hu1 h LEU 222 Cb 0.46 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 3hu1 h LEU 222 CO 0.01 0.17 -0.06 -0.65 -0.34 0.00 0.00 178.44 177.57 3hu1 h PRO 223 N 0.33 0.00 0.16 5.25 0.11 -1.74 -0.41 132.00 135.70 3hu1 h PRO 223 Ca 0.13 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.91 3hu1 h PRO 223 Cb 0.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.16 3hu1 h PRO 223 CO -0.10 0.06 -1.64 -0.07 -0.21 0.00 0.00 178.00 176.04 3hu1 h LEU 224 N 0.00 0.53 0.23 2.35 3.38 -1.51 -3.16 115.31 117.13 3hu1 h LEU 224 Ca -0.00 -0.75 -0.33 0.00 0.09 0.00 0.00 57.88 56.88 3hu1 h LEU 224 Cb 0.70 -0.17 0.03 0.00 0.09 0.00 0.00 40.66 41.31 3hu1 h LEU 224 CO 0.01 1.63 -1.51 0.03 0.09 0.00 0.00 178.44 178.69 3hu1 h ARG 225 N 0.09 0.48 -2.13 1.13 2.47 -1.21 -3.40 114.38 111.82 3hu1 h ARG 225 Ca -0.29 -0.83 -0.58 0.00 -1.26 0.00 0.00 59.98 57.02 3hu1 h ARG 225 Cb 2.07 0.31 -0.41 0.00 -1.65 0.00 0.00 29.97 30.29 3hu1 h ARG 225 CO 0.18 1.39 -0.78 0.72 0.56 0.00 0.00 179.97 182.04 3hu1 n HIS 226 N -3.67 2.26 0.27 3.04 8.25 -0.16 -4.92 115.22 120.28 3hu1 n HIS 226 Ca -0.17 -3.94 0.11 0.00 -0.26 0.00 0.00 57.72 53.45 3hu1 n HIS 226 Cb 1.09 -0.48 0.72 0.00 1.12 0.00 0.00 29.99 32.44 3hu1 n HIS 226 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3hu1 h PRO 227 N 4.00 0.00 -0.95 -0.41 0.13 -1.72 -2.82 132.00 130.22 3hu1 h PRO 227 Ca 0.15 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 65.45 3hu1 h PRO 227 Cb 0.73 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.78 3hu1 h PRO 227 CO 0.70 0.07 0.60 0.00 -0.23 0.00 0.00 178.00 179.14 3hu1 h ALA 228 N 1.93 1.82 -0.09 -0.56 0.00 -1.91 -1.50 119.26 118.95 3hu1 h ALA 228 Ca -0.00 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3hu1 h ALA 228 Cb 0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3hu1 h ALA 228 CO 0.01 -0.12 0.05 -0.07 0.00 0.00 0.00 179.25 179.12 3hu1 h LEU 229 N 0.70 0.08 -0.18 0.00 3.38 -1.88 0.15 115.31 117.55 3hu1 h LEU 229 Ca 0.51 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.30 3hu1 h LEU 229 Cb 0.85 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.59 3hu1 h LEU 229 CO -0.27 0.06 -0.58 -0.26 0.09 0.00 0.00 178.44 177.49 3hu1 h PHE 230 N 0.11 0.92 -0.81 1.13 -1.00 -1.61 -2.11 116.94 113.57 3hu1 h PHE 230 Ca 0.04 -0.38 -0.01 0.00 2.81 0.00 0.00 57.97 60.43 3hu1 h PHE 230 Cb -0.00 -0.16 -0.04 0.00 3.61 0.00 0.00 35.95 39.36 3hu1 h PHE 230 CO -0.08 1.18 0.46 -0.22 -1.61 0.00 0.00 178.31 178.04 3hu1 h LYS 231 N 0.41 1.13 -0.29 1.51 3.11 -1.20 -1.59 116.57 119.65 3hu1 h LYS 231 Ca -0.02 -0.12 -0.13 0.00 -2.81 0.00 0.00 60.65 57.57 3hu1 h LYS 231 Cb 1.20 -0.22 -0.00 0.00 -1.00 0.00 0.00 32.23 32.20 3hu1 h LYS 231 CO 0.12 0.82 -0.31 0.00 -2.81 0.00 0.00 179.45 177.27 3hu1 h ALA 232 N 1.24 0.43 0.00 5.00 0.00 -0.68 -2.98 119.26 122.28 3hu1 h ALA 232 Ca 0.29 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 3hu1 h ALA 232 Cb 0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3hu1 h ALA 232 CO -0.05 0.47 -0.38 0.97 0.00 0.00 0.00 179.25 180.26 3hu1 h ILE 233 N 0.47 1.04 0.00 0.00 2.10 -1.27 -3.47 117.51 116.37 3hu1 h ILE 233 Ca 0.04 -1.42 0.00 0.00 1.08 0.00 0.00 64.86 64.56 3hu1 h ILE 233 Cb 0.89 1.82 0.00 0.00 -1.09 0.00 0.00 36.82 38.44 3hu1 h ILE 233 CO 0.08 0.37 0.00 0.61 -1.08 0.00 0.00 178.15 178.13 3hu1 n GLY 234 N -0.07 1.04 2.86 8.18 0.00 -0.75 -5.11 105.19 111.34 3hu1 n GLY 234 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 3hu1 n GLY 234 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hu1 s VAL 235 N -2.00 0.12 0.18 1.61 1.01 -0.67 -5.05 120.40 115.60 3hu1 s VAL 235 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 61.69 3hu1 s VAL 235 Cb 0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 36.38 36.15 3hu1 s VAL 235 CO 0.00 0.07 0.92 -0.54 0.00 0.00 0.00 175.10 175.54 3hu1 s LYS 236 N 0.35 4.76 0.17 2.72 1.02 -1.26 -4.01 119.74 123.49 3hu1 s LYS 236 Ca -0.03 1.41 -0.30 0.00 0.02 0.00 0.00 55.97 57.07 3hu1 s LYS 236 Cb -0.05 -3.31 -0.07 0.00 -0.52 0.00 0.00 37.83 33.88 3hu1 s LYS 236 CO -0.01 0.43 0.98 -1.25 -0.92 0.00 0.00 175.35 174.58 3hu1 s PRO 237 N -0.78 4.73 0.33 -1.68 0.04 -1.26 -5.01 135.00 131.37 3hu1 s PRO 237 Ca 0.42 1.52 -0.29 0.00 0.04 0.00 0.00 61.00 62.69 3hu1 s PRO 237 Cb -0.25 -3.32 -0.11 0.00 0.04 0.00 0.00 34.50 30.86 3hu1 s PRO 237 CO 0.30 0.29 1.56 -2.14 0.04 0.00 0.00 177.00 177.06 3hu1 s PRO 238 N -0.51 4.10 0.00 0.56 0.02 -1.26 -4.94 135.00 132.97 3hu1 s PRO 238 Ca 0.45 2.60 0.10 0.00 0.02 0.00 0.00 61.00 64.17 3hu1 s PRO 238 Cb -0.25 -2.99 0.08 0.00 0.02 0.00 0.00 34.50 31.35 3hu1 s PRO 238 CO 0.32 -0.61 0.81 2.89 -0.33 0.00 0.00 177.00 180.08 3hu1 n ARG 239 N 1.47 0.38 -3.66 5.54 1.85 -1.26 -4.94 116.66 116.03 3hu1 n ARG 239 Ca 0.05 -1.09 -0.18 0.00 -1.00 0.00 0.00 57.85 55.63 3hu1 n ARG 239 Cb 0.38 -1.19 -0.16 0.00 -1.05 0.00 0.00 32.46 30.44 3hu1 n ARG 239 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 3hu1 s GLY 240 N -0.82 0.10 -0.12 2.89 0.00 -1.09 -1.44 107.32 106.84 3hu1 s GLY 240 Ca 0.12 0.42 0.03 0.00 0.00 0.00 0.00 44.72 45.28 3hu1 s GLY 240 CO 0.12 1.60 -0.22 -0.42 0.00 0.00 0.00 173.10 174.18 3hu1 s ILE 241 N 2.25 1.99 -0.23 0.90 1.09 -0.07 -2.75 121.20 124.39 3hu1 s ILE 241 Ca 0.04 -0.95 -0.02 0.00 -1.10 0.00 0.00 60.65 58.62 3hu1 s ILE 241 Cb -0.12 -1.75 0.01 0.00 -1.06 0.00 0.00 42.46 39.54 3hu1 s ILE 241 CO -0.05 0.54 -0.08 -0.22 -0.10 0.00 0.00 174.94 175.03 3hu1 s LEU 242 N 0.69 2.93 -0.11 2.97 2.96 -0.10 -1.13 118.68 126.90 3hu1 s LEU 242 Ca -0.10 -0.69 -0.21 0.00 -0.22 0.00 0.00 54.13 52.91 3hu1 s LEU 242 Cb -0.16 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.84 3hu1 s LEU 242 CO 0.01 -0.07 0.58 -0.76 -1.32 0.00 0.00 176.35 174.79 3hu1 s LEU 243 N 1.37 4.27 0.07 -0.68 1.43 0.89 -0.90 118.68 125.12 3hu1 s LEU 243 Ca 0.03 0.95 0.00 0.00 -1.03 0.00 0.00 54.13 54.09 3hu1 s LEU 243 Cb -0.15 -2.87 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 3hu1 s LEU 243 CO -0.06 -0.09 -0.05 -0.72 0.23 0.00 0.00 176.35 175.67 3hu1 s TYR 244 N 0.90 0.71 0.00 0.29 -0.85 -0.63 -1.77 117.35 116.00 3hu1 s TYR 244 Ca 0.31 -0.98 0.00 0.00 -0.52 0.00 0.00 57.07 55.88 3hu1 s TYR 244 Cb -0.16 -0.45 0.00 0.00 0.38 0.00 0.00 41.96 41.72 3hu1 s TYR 244 CO 0.13 -0.25 0.00 0.41 -1.52 0.00 0.00 175.55 174.32 3hu1 n GLY 245 N 0.06 0.99 3.59 5.49 0.00 -1.21 -0.14 105.19 113.97 3hu1 n GLY 245 Ca -0.13 -1.11 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 3hu1 n GLY 245 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hu1 s PRO 246 N -2.00 0.08 0.25 1.61 0.02 -1.26 -4.20 135.00 129.50 3hu1 s PRO 246 Ca 0.00 1.15 -0.31 0.00 0.02 0.00 0.00 61.00 61.86 3hu1 s PRO 246 Cb 0.00 -1.65 -0.13 0.00 0.02 0.00 0.00 34.50 32.75 3hu1 s PRO 246 CO 0.00 -3.14 1.52 -2.30 -0.33 0.00 0.00 177.00 172.75 3hu1 n PRO 247 N -4.55 2.35 -1.48 5.54 -0.02 -1.26 -3.52 135.00 132.07 3hu1 n PRO 247 Ca 0.07 0.84 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3hu1 n PRO 247 Cb 0.53 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 3hu1 n PRO 247 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hu1 n GLY 248 N 2.48 0.38 0.11 -1.23 0.00 -1.26 -4.94 105.19 100.73 3hu1 n GLY 248 Ca 0.12 -0.99 0.04 0.00 0.00 0.00 0.00 46.02 45.19 3hu1 n GLY 248 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3hu1 h THR 249 N 0.00 0.36 0.00 2.61 1.35 -1.88 -1.60 112.91 113.75 3hu1 h THR 249 Ca 0.00 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 64.19 3hu1 h THR 249 Cb 0.48 1.91 0.00 0.00 -1.73 0.00 0.00 68.15 68.81 3hu1 h THR 249 CO 0.00 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 3hu1 n GLY 250 N 1.30 0.94 0.09 5.82 0.00 -1.26 -4.68 105.19 107.39 3hu1 n GLY 250 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 3hu1 n GLY 250 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hu1 h LYS 251 N 0.00 -0.10 -0.45 1.61 1.57 -1.94 0.16 116.57 117.41 3hu1 h LYS 251 Ca 0.00 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 3hu1 h LYS 251 Cb 0.00 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 3hu1 h LYS 251 CO 0.00 0.23 -0.00 1.15 -0.57 0.00 0.00 179.45 180.26 3hu1 h THR 252 N -0.44 1.24 -0.65 -0.16 2.02 -1.99 -1.20 112.91 111.73 3hu1 h THR 252 Ca -0.01 -0.97 0.02 0.00 0.77 0.00 0.00 66.41 66.21 3hu1 h THR 252 Cb 0.38 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 67.64 3hu1 h THR 252 CO 0.02 0.34 0.42 0.25 0.37 0.00 0.00 175.52 176.92 3hu1 h LEU 253 N 0.70 0.70 -0.64 2.58 5.85 -1.92 -0.89 115.31 121.69 3hu1 h LEU 253 Ca 0.14 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 3hu1 h LEU 253 Cb 0.44 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 3hu1 h LEU 253 CO 0.02 0.50 0.24 0.40 -0.34 0.00 0.00 178.44 179.26 3hu1 h ILE 254 N 0.84 1.24 -0.63 4.05 2.04 0.19 -1.11 117.51 124.12 3hu1 h ILE 254 Ca 0.25 -0.78 0.05 0.00 1.00 0.00 0.00 64.86 65.38 3hu1 h ILE 254 Cb -0.04 0.54 -0.05 0.00 -0.74 0.00 0.00 36.82 36.53 3hu1 h ILE 254 CO -0.08 0.30 0.36 0.00 0.00 0.00 0.00 178.15 178.73 3hu1 h ALA 255 N 1.10 0.84 -0.36 1.87 0.00 -0.64 0.30 119.26 122.35 3hu1 h ALA 255 Ca 0.21 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 3hu1 h ALA 255 Cb 0.23 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3hu1 h ALA 255 CO -0.01 0.05 -0.27 0.00 0.00 0.00 0.00 179.25 179.02 3hu1 h ARG 256 N 0.68 0.75 -0.04 0.00 2.47 -0.95 -1.12 114.38 116.18 3hu1 h ARG 256 Ca 0.27 -0.32 -0.00 0.00 -1.26 0.00 0.00 59.98 58.67 3hu1 h ARG 256 Cb 0.13 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 28.42 3hu1 h ARG 256 CO -0.16 0.93 0.01 0.00 0.56 0.00 0.00 179.97 181.32 3hu1 h ALA 257 N 1.05 0.05 0.03 0.04 0.00 0.10 -1.83 119.26 118.70 3hu1 h ALA 257 Ca 0.08 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3hu1 h ALA 257 Cb 0.78 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 3hu1 h ALA 257 CO 0.06 -0.32 -0.18 0.28 0.00 0.00 0.00 179.25 179.10 3hu1 h VAL 258 N -0.18 0.57 -0.85 0.00 2.07 -0.48 0.32 116.25 117.70 3hu1 h VAL 258 Ca 0.01 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.75 3hu1 h VAL 258 Cb 0.26 0.57 -0.13 0.00 -1.52 0.00 0.00 31.29 30.47 3hu1 h VAL 258 CO 0.00 0.00 0.24 0.00 0.02 0.00 0.00 177.57 177.83 3hu1 h ALA 259 N 0.58 1.23 0.00 1.67 0.00 -1.04 0.52 119.26 122.22 3hu1 h ALA 259 Ca 0.05 0.21 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 3hu1 h ALA 259 Cb 0.37 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3hu1 h ALA 259 CO -0.15 -0.43 -0.65 -0.91 0.00 0.00 0.00 179.25 177.11 3hu1 h ASN 260 N 0.24 0.00 0.08 0.00 -0.26 -0.20 -3.35 115.58 112.10 3hu1 h ASN 260 Ca 0.53 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.27 3hu1 h ASN 260 Cb 1.02 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.28 3hu1 h ASN 260 CO -0.61 0.15 -1.17 -0.62 -1.06 0.00 0.00 177.43 174.12 3hu1 n GLU 261 N -2.93 0.17 -3.64 0.81 -0.58 0.96 -4.08 120.64 111.35 3hu1 n GLU 261 Ca 0.00 -0.04 -0.31 0.00 -0.42 0.00 0.00 57.16 56.39 3hu1 n GLU 261 Cb 0.61 -1.52 -0.05 0.00 -0.57 0.00 0.00 31.44 29.92 3hu1 n GLU 261 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3hu1 s THR 262 N -3.13 5.14 0.34 2.62 -4.23 -0.45 -4.58 115.64 111.35 3hu1 s THR 262 Ca 0.04 0.08 0.14 0.00 -1.18 0.00 0.00 61.69 60.77 3hu1 s THR 262 Cb 0.15 -3.63 0.09 0.00 1.34 0.00 0.00 72.50 70.46 3hu1 s THR 262 CO 0.86 0.02 1.80 1.23 -0.54 0.00 0.00 174.62 177.98 3hu1 h GLY 263 N 2.76 0.00 -2.38 3.99 0.00 -1.94 -3.45 103.07 102.05 3hu1 h GLY 263 Ca -0.46 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.35 3hu1 h GLY 263 CO 0.72 0.00 0.48 0.00 0.00 0.00 0.00 176.54 177.75 3hu1 s ALA 264 N -4.04 2.75 0.25 3.60 0.00 -1.26 -5.01 121.76 118.05 3hu1 s ALA 264 Ca -0.02 0.99 -0.30 0.00 0.00 0.00 0.00 51.96 52.62 3hu1 s ALA 264 Cb 0.14 -3.42 -0.11 0.00 0.00 0.00 0.00 23.12 19.73 3hu1 s ALA 264 CO 0.72 -0.94 1.51 0.12 0.00 0.00 0.00 175.76 177.17 3hu1 s PHE 265 N -1.58 2.93 -0.09 0.00 5.36 -0.94 -4.87 117.98 118.79 3hu1 s PHE 265 Ca 0.71 0.88 0.04 0.00 -0.96 0.00 0.00 56.93 57.60 3hu1 s PHE 265 Cb -0.30 -3.92 -0.01 0.00 -0.34 0.00 0.00 43.02 38.45 3hu1 s PHE 265 CO 0.34 -3.11 -0.21 0.12 -1.46 0.00 0.00 175.22 170.91 3hu1 s PHE 266 N 0.15 2.59 -0.15 10.12 5.36 -1.26 -0.19 117.98 134.59 3hu1 s PHE 266 Ca 0.62 -0.72 0.00 0.00 -0.96 0.00 0.00 56.93 55.87 3hu1 s PHE 266 Cb -0.44 -1.69 0.03 0.00 -0.34 0.00 0.00 43.02 40.57 3hu1 s PHE 266 CO 0.43 -0.22 -0.12 0.12 -1.46 0.00 0.00 175.22 173.97 3hu1 s PHE 267 N 0.03 2.08 -0.10 10.12 2.19 0.10 -4.97 117.98 127.43 3hu1 s PHE 267 Ca -0.08 -1.20 -0.14 0.00 0.33 0.00 0.00 56.93 55.85 3hu1 s PHE 267 Cb -0.15 -1.54 -0.05 0.00 -1.31 0.00 0.00 43.02 39.98 3hu1 s PHE 267 CO 0.05 -0.66 0.33 -1.17 1.83 0.00 0.00 175.22 175.61 3hu1 s LEU 268 N 1.51 4.34 -0.13 6.12 2.96 -1.26 -0.26 118.68 131.96 3hu1 s LEU 268 Ca 0.04 0.68 0.00 0.00 -0.22 0.00 0.00 54.13 54.63 3hu1 s LEU 268 Cb -0.13 -2.44 0.02 0.00 0.50 0.00 0.00 46.19 44.14 3hu1 s LEU 268 CO -0.10 0.20 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.37 3hu1 s ILE 269 N -0.19 1.40 -0.13 6.68 1.01 0.57 -4.96 121.20 125.59 3hu1 s ILE 269 Ca 0.20 -0.54 -0.18 0.00 0.00 0.00 0.00 60.65 60.12 3hu1 s ILE 269 Cb -0.14 -1.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 3hu1 s ILE 269 CO 0.08 0.43 0.49 0.20 0.00 0.00 0.00 174.94 176.14 3hu1 s ASN 270 N 1.42 6.67 0.16 3.58 0.01 -1.26 -0.14 114.94 125.38 3hu1 s ASN 270 Ca 0.02 0.80 -0.28 0.00 -0.71 0.00 0.00 52.86 52.69 3hu1 s ASN 270 Cb -0.13 -2.29 -0.02 0.00 0.41 0.00 0.00 41.25 39.22 3hu1 s ASN 270 CO -0.08 -0.03 1.55 1.23 -1.51 0.00 0.00 177.10 178.26 3hu1 h GLY 271 N 6.93 -0.67 1.59 0.66 0.00 -0.09 -1.85 103.07 109.64 3hu1 h GLY 271 Ca -0.40 0.68 -0.07 0.00 0.00 0.00 0.00 47.33 47.54 3hu1 h GLY 271 CO 0.75 -0.08 -0.14 -2.55 0.00 0.00 0.00 176.54 174.52 3hu1 h PRO 272 N -0.17 0.49 -0.19 4.80 0.11 -1.83 -2.18 132.00 133.03 3hu1 h PRO 272 Ca 0.16 -0.15 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 3hu1 h PRO 272 Cb 0.52 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 3hu1 h PRO 272 CO -0.79 0.63 0.08 1.49 -0.21 0.00 0.00 178.00 179.20 3hu1 h GLU 273 N 0.45 0.26 0.05 1.05 4.22 -1.80 -1.54 114.58 117.28 3hu1 h GLU 273 Ca 0.08 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.49 3hu1 h GLU 273 Cb 0.51 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3hu1 h GLU 273 CO 0.03 0.22 -0.02 0.82 -2.18 0.00 0.00 179.01 177.88 3hu1 h ILE 274 N 0.27 1.27 0.00 2.32 1.08 -0.93 -3.33 117.51 118.19 3hu1 h ILE 274 Ca 0.07 -1.58 0.00 0.00 -0.39 0.00 0.00 64.86 62.96 3hu1 h ILE 274 Cb 0.06 2.23 0.00 0.00 -3.07 0.00 0.00 36.82 36.04 3hu1 h ILE 274 CO -0.01 0.37 0.00 0.23 -0.69 0.00 0.00 178.15 178.05 3hu1 n MET 275 N -4.78 0.05 0.11 2.37 2.81 -0.86 -1.78 117.12 115.05 3hu1 n MET 275 Ca -0.08 0.26 0.13 0.00 -1.81 0.00 0.00 57.70 56.20 3hu1 n MET 275 Cb 0.32 -1.50 0.35 0.00 -0.71 0.00 0.00 33.22 31.68 3hu1 n MET 275 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 3hu1 h SER 276 N 0.00 0.00 -3.47 7.83 4.64 -1.40 -3.47 113.55 117.68 3hu1 h SER 276 Ca 0.00 -0.03 -0.50 0.00 -0.47 0.00 0.00 61.79 60.79 3hu1 h SER 276 Cb 0.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.26 3hu1 h SER 276 CO 0.00 0.01 0.01 -0.54 -0.87 0.00 0.00 176.83 175.45 3hu1 s LYS 277 N -3.12 3.69 0.58 4.77 1.02 -0.73 -5.06 119.74 120.88 3hu1 s LYS 277 Ca 0.10 0.24 -0.18 0.00 0.02 0.00 0.00 55.97 56.14 3hu1 s LYS 277 Cb 0.12 -2.49 -0.07 0.00 -0.52 0.00 0.00 37.83 34.86 3hu1 s LYS 277 CO 0.62 0.04 0.67 1.28 -0.92 0.00 0.00 175.35 177.05 3hu1 n LEU 278 N -1.31 1.77 -4.68 3.17 4.77 -1.26 -4.67 117.00 114.79 3hu1 n LEU 278 Ca 0.00 0.76 -0.47 0.00 -0.03 0.00 0.00 56.01 56.28 3hu1 n LEU 278 Cb 0.54 -1.25 -0.04 0.00 -2.33 0.00 0.00 43.42 40.34 3hu1 n LEU 278 CO 0.48 -2.65 1.34 0.00 -1.33 0.00 0.00 177.39 175.24 3hu1 n ALA 279 N -1.70 1.19 0.00 -1.18 0.00 -1.26 -2.00 120.51 115.56 3hu1 n ALA 279 Ca 0.12 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.93 3hu1 n ALA 279 Cb 0.47 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.49 3hu1 n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hu1 n GLY 280 N 3.90 2.42 0.33 0.00 0.00 -1.26 -4.70 105.19 105.88 3hu1 n GLY 280 Ca 0.20 -0.49 0.19 0.00 0.00 0.00 0.00 46.02 45.91 3hu1 n GLY 280 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hu1 h GLU 281 N 0.00 0.00 -0.01 1.61 4.81 -1.87 0.14 114.58 119.26 3hu1 h GLU 281 Ca 0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 3hu1 h GLU 281 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3hu1 h GLU 281 CO 0.00 0.00 -0.20 0.66 -0.73 0.00 0.00 179.01 178.74 3hu1 h SER 282 N 0.00 0.19 -0.80 1.04 4.64 -1.67 -2.95 113.55 114.00 3hu1 h SER 282 Ca 0.03 -0.75 0.04 0.00 -0.47 0.00 0.00 61.79 60.63 3hu1 h SER 282 Cb 0.30 -0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 62.29 3hu1 h SER 282 CO -0.00 0.92 0.53 -0.33 -0.87 0.00 0.00 176.83 177.08 3hu1 h GLU 283 N -0.52 0.94 -0.31 4.77 3.07 -1.45 -1.82 114.58 119.27 3hu1 h GLU 283 Ca -0.02 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.78 3hu1 h GLU 283 Cb 0.94 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 28.63 3hu1 h GLU 283 CO 0.04 0.62 0.18 1.03 -1.40 0.00 0.00 179.01 179.48 3hu1 h SER 284 N 0.97 0.38 -0.37 1.42 0.87 -0.91 -2.02 113.55 113.89 3hu1 h SER 284 Ca 0.32 -0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.79 3hu1 h SER 284 Cb 0.07 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 3hu1 h SER 284 CO -0.10 0.34 0.16 0.78 -0.53 0.00 0.00 176.83 177.48 3hu1 h ASN 285 N 0.39 0.56 -0.41 6.23 -0.26 -1.17 -0.38 115.58 120.54 3hu1 h ASN 285 Ca 0.11 -0.06 -0.04 0.00 -0.56 0.00 0.00 56.30 55.75 3hu1 h ASN 285 Cb 0.03 -0.14 -0.02 0.00 -1.06 0.00 0.00 38.32 37.13 3hu1 h ASN 285 CO -0.02 0.52 0.10 -0.07 -1.06 0.00 0.00 177.43 176.90 3hu1 h LEU 286 N 0.61 0.62 -0.31 1.61 3.38 -1.17 -0.95 115.31 119.09 3hu1 h LEU 286 Ca 0.15 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3hu1 h LEU 286 Cb 0.15 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3hu1 h LEU 286 CO -0.01 0.69 0.12 0.03 0.09 0.00 0.00 178.44 179.35 3hu1 h ARG 287 N 0.52 0.47 -0.44 1.13 3.08 -1.12 -2.82 114.38 115.21 3hu1 h ARG 287 Ca 0.13 -0.09 0.01 0.00 0.07 0.00 0.00 59.98 60.10 3hu1 h ARG 287 Cb 0.31 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 3hu1 h ARG 287 CO 0.00 0.49 0.29 -0.22 -1.07 0.00 0.00 179.97 179.46 3hu1 h LYS 288 N 0.36 0.53 0.13 0.04 1.63 -0.96 0.19 116.57 118.49 3hu1 h LYS 288 Ca 0.10 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.87 3hu1 h LYS 288 Cb 0.20 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.71 3hu1 h LYS 288 CO -0.01 0.35 -0.06 0.00 -3.45 0.00 0.00 179.45 176.28 3hu1 h ALA 289 N 1.73 -0.17 -0.21 5.00 0.00 -1.08 -1.79 119.26 122.74 3hu1 h ALA 289 Ca 0.17 -0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 3hu1 h ALA 289 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hu1 h ALA 289 CO -0.04 -0.56 -0.58 0.74 0.00 0.00 0.00 179.25 178.81 3hu1 h PHE 290 N -0.26 0.99 -0.81 0.00 -1.00 -0.75 -1.67 116.94 113.45 3hu1 h PHE 290 Ca -0.02 -0.39 -0.01 0.00 2.81 0.00 0.00 57.97 60.36 3hu1 h PHE 290 Cb 0.21 -0.17 -0.04 0.00 3.61 0.00 0.00 35.95 39.56 3hu1 h PHE 290 CO -0.04 1.20 0.46 0.93 -1.61 0.00 0.00 178.31 179.25 3hu1 h GLU 291 N 0.50 1.10 0.06 1.51 5.08 -0.79 -1.23 114.58 120.81 3hu1 h GLU 291 Ca -0.01 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 3hu1 h GLU 291 Cb 1.20 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.23 3hu1 h GLU 291 CO 0.13 0.79 -0.03 1.49 -1.00 0.00 0.00 179.01 180.39 3hu1 h GLU 292 N 1.12 -0.07 -0.97 2.33 4.57 -1.09 -1.23 114.58 119.24 3hu1 h GLU 292 Ca 0.29 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.50 3hu1 h GLU 292 Cb -0.01 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 28.54 3hu1 h GLU 292 CO -0.05 0.27 0.63 0.00 -1.18 0.00 0.00 179.01 178.68 3hu1 h ALA 293 N 0.50 1.26 -0.86 2.92 0.00 -1.23 0.30 119.26 122.15 3hu1 h ALA 293 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3hu1 h ALA 293 Cb 0.37 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3hu1 h ALA 293 CO 0.01 0.55 0.45 0.93 0.00 0.00 0.00 179.25 181.19 3hu1 h GLU 294 N 1.25 1.22 -0.16 0.00 5.08 -1.17 -3.00 114.58 117.80 3hu1 h GLU 294 Ca 0.38 -0.16 -0.13 0.00 -1.00 0.00 0.00 59.36 58.45 3hu1 h GLU 294 Cb -0.05 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 28.96 3hu1 h GLU 294 CO -0.11 0.91 -0.45 -0.22 -1.00 0.00 0.00 179.01 178.14 3hu1 h LYS 295 N 1.21 0.39 -4.09 2.33 3.64 -0.14 -3.40 116.57 116.51 3hu1 h LYS 295 Ca 0.30 -0.21 -0.74 0.00 -1.27 0.00 0.00 60.65 58.74 3hu1 h LYS 295 Cb 0.06 0.01 -0.29 0.00 -0.41 0.00 0.00 32.23 31.60 3hu1 h LYS 295 CO -0.04 0.77 -0.28 -0.80 -2.27 0.00 0.00 179.45 176.82 3hu1 s ASN 296 N -6.87 5.87 0.70 4.20 -0.87 -0.01 -5.05 114.94 112.91 3hu1 s ASN 296 Ca -0.06 -2.18 0.00 0.00 -1.57 0.00 0.00 52.86 49.05 3hu1 s ASN 296 Cb 0.13 -2.04 0.00 0.00 -0.02 0.00 0.00 41.25 39.31 3hu1 s ASN 296 CO 0.80 -0.64 0.00 0.00 -2.57 0.00 0.00 177.10 174.69 3hu1 n ALA 297 N 4.57 -0.78 -1.62 0.60 0.00 -1.26 -4.19 120.51 117.83 3hu1 n ALA 297 Ca -0.02 0.09 -0.49 0.00 0.00 0.00 0.00 53.44 53.01 3hu1 n ALA 297 Cb 0.41 -0.26 -0.05 0.00 0.00 0.00 0.00 19.45 19.55 3hu1 n ALA 297 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hu1 n PRO 298 N -2.10 1.53 -4.02 0.00 -0.01 -1.26 -4.85 135.00 124.29 3hu1 n PRO 298 Ca 0.00 0.55 -0.10 0.00 -0.01 0.00 0.00 63.50 63.94 3hu1 n PRO 298 Cb 0.12 -2.22 -0.11 0.00 -0.01 0.00 0.00 33.50 31.29 3hu1 n PRO 298 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 3hu1 s ALA 299 N 0.51 0.29 -0.15 3.55 0.00 -0.91 -2.22 121.76 122.84 3hu1 s ALA 299 Ca 0.80 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 52.06 3hu1 s ALA 299 Cb -0.84 0.14 0.01 0.00 0.00 0.00 0.00 23.12 22.43 3hu1 s ALA 299 CO 0.45 -0.15 -0.19 0.42 0.00 0.00 0.00 175.76 176.28 3hu1 s ILE 300 N -1.75 2.29 -0.24 0.00 1.01 0.73 -2.18 121.20 121.06 3hu1 s ILE 300 Ca -0.11 -0.90 -0.08 0.00 0.00 0.00 0.00 60.65 59.56 3hu1 s ILE 300 Cb -0.08 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.42 3hu1 s ILE 300 CO -0.02 0.54 0.09 -0.63 0.00 0.00 0.00 174.94 174.92 3hu1 s ILE 301 N 0.83 4.58 -0.28 2.92 1.01 -0.71 0.02 121.20 129.57 3hu1 s ILE 301 Ca -0.06 -0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.45 3hu1 s ILE 301 Cb -0.15 -3.13 0.01 0.00 0.01 0.00 0.00 42.46 39.19 3hu1 s ILE 301 CO -0.01 0.34 0.04 0.12 0.00 0.00 0.00 174.94 175.43 3hu1 s PHE 302 N 1.43 3.11 -0.53 3.97 5.36 0.64 0.31 117.98 132.27 3hu1 s PHE 302 Ca 0.06 -1.03 -0.16 0.00 -0.96 0.00 0.00 56.93 54.84 3hu1 s PHE 302 Cb -0.15 -2.21 0.12 0.00 -0.34 0.00 0.00 43.02 40.44 3hu1 s PHE 302 CO 0.05 -0.58 0.49 0.42 -1.46 0.00 0.00 175.22 174.13 3hu1 s ILE 303 N 1.48 5.20 0.14 3.12 1.01 -0.12 -0.32 121.20 131.72 3hu1 s ILE 303 Ca 0.03 -1.41 -0.22 0.00 0.00 0.00 0.00 60.65 59.04 3hu1 s ILE 303 Cb -0.17 -4.31 -0.08 0.00 0.01 0.00 0.00 42.46 37.92 3hu1 s ILE 303 CO 0.01 -0.83 0.70 -0.62 0.00 0.00 0.00 174.94 174.20 3hu1 s ASP 304 N 3.44 7.24 -1.11 3.58 2.15 0.80 -2.26 116.67 130.51 3hu1 s ASP 304 Ca 0.04 1.49 -0.15 0.00 0.43 0.00 0.00 52.55 54.35 3hu1 s ASP 304 Cb -0.29 -2.44 -0.03 0.00 -0.30 0.00 0.00 42.92 39.86 3hu1 s ASP 304 CO 0.04 0.21 0.84 -0.62 -0.17 0.00 0.00 175.17 175.46 3hu1 n GLU 305 N 1.50 -1.64 -0.25 4.34 1.02 -0.90 0.50 120.64 125.21 3hu1 n GLU 305 Ca -0.07 0.60 0.13 0.00 -0.02 0.00 0.00 57.16 57.80 3hu1 n GLU 305 Cb 0.50 -4.73 0.40 0.00 -0.02 0.00 0.00 31.44 27.59 3hu1 n GLU 305 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3hu1 h LEU 306 N -1.61 0.60 -2.26 -4.62 5.85 -1.19 -2.91 115.31 109.18 3hu1 h LEU 306 Ca -0.65 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.11 3hu1 h LEU 306 Cb 1.34 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.29 3hu1 h LEU 306 CO 0.47 0.30 0.00 -2.24 -0.34 0.00 0.00 178.44 176.63 3hu1 h ASP 307 N 0.64 0.00 0.46 1.25 3.04 -1.87 -0.78 116.42 119.16 3hu1 h ASP 307 Ca 0.44 0.00 -0.19 0.00 -3.24 0.00 0.00 57.03 54.04 3hu1 h ASP 307 Cb 0.76 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.04 3hu1 h ASP 307 CO -0.19 0.00 -0.81 0.00 -2.04 0.00 0.00 179.24 176.20 3hu1 h ALA 308 N 2.00 0.58 0.00 4.15 0.00 -1.87 -3.34 119.26 120.78 3hu1 h ALA 308 Ca 0.00 -0.67 -0.07 0.00 0.00 0.00 0.00 54.91 54.17 3hu1 h ALA 308 Cb 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3hu1 h ALA 308 CO 0.00 0.85 -2.03 0.44 0.00 0.00 0.00 179.25 178.50 3hu1 n ILE 309 N -3.74 0.25 -3.09 0.00 -5.35 -0.39 -4.74 119.36 102.31 3hu1 n ILE 309 Ca -0.04 -0.55 -0.23 0.00 -0.27 0.00 0.00 62.75 61.66 3hu1 n ILE 309 Cb 0.76 -0.07 -0.04 0.00 -1.74 0.00 0.00 39.64 38.54 3hu1 n ILE 309 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hu1 n ALA 310 N -2.32 3.43 -1.92 -1.28 0.00 -0.67 -4.18 120.51 113.57 3hu1 n ALA 310 Ca -0.09 -4.11 -0.28 0.00 0.00 0.00 0.00 53.44 48.96 3hu1 n ALA 310 Cb 0.66 -0.83 0.11 0.00 0.00 0.00 0.00 19.45 19.39 3hu1 n ALA 310 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hu1 s PRO 311 N -2.86 1.70 -0.38 0.00 0.05 -1.25 -2.51 135.00 129.76 3hu1 s PRO 311 Ca 0.44 -0.17 -0.28 0.00 0.05 0.00 0.00 61.00 61.04 3hu1 s PRO 311 Cb 0.29 -2.00 -0.07 0.00 0.05 0.00 0.00 34.50 32.77 3hu1 s PRO 311 CO -0.11 -1.68 2.33 1.63 0.05 0.00 0.00 177.00 179.22 3hu1 n LYS 312 N -3.29 1.40 -0.46 4.56 5.02 -0.67 -3.95 118.16 120.77 3hu1 n LYS 312 Ca 0.10 0.25 0.38 0.00 -2.02 0.00 0.00 58.31 57.03 3hu1 n LYS 312 Cb 0.60 -3.20 0.69 0.00 -0.02 0.00 0.00 35.03 33.10 3hu1 n LYS 312 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hu1 h ARG 313 N 16.74 0.09 -0.82 1.97 3.08 -1.92 0.39 114.38 133.91 3hu1 h ARG 313 Ca -0.31 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 59.81 3hu1 h ARG 313 Cb 1.26 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 31.23 3hu1 h ARG 313 CO 1.07 0.06 0.49 1.05 -1.07 0.00 0.00 179.97 181.57 3hu1 h GLU 314 N 0.09 0.85 -2.70 0.04 4.11 -2.02 -3.34 114.58 111.61 3hu1 h GLU 314 Ca 0.77 -0.05 -0.61 0.00 0.07 0.00 0.00 59.36 59.54 3hu1 h GLU 314 Cb 2.63 -0.19 -0.42 0.00 0.50 0.00 0.00 28.75 31.28 3hu1 h GLU 314 CO -0.24 0.56 -0.61 1.17 0.07 0.00 0.00 179.01 179.96 3hu1 n LYS 315 N -4.68 2.00 -3.64 1.06 4.81 0.14 -5.00 118.16 112.84 3hu1 n LYS 315 Ca 0.12 -4.48 -0.01 0.00 -0.87 0.00 0.00 58.31 53.08 3hu1 n LYS 315 Cb 0.21 -2.22 -0.04 0.00 0.02 0.00 0.00 35.03 32.99 3hu1 n LYS 315 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 3hu1 s THR 316 N -1.78 -1.00 0.03 3.15 -1.32 -1.24 -4.59 115.64 108.90 3hu1 s THR 316 Ca 0.31 0.00 -0.22 0.00 -1.21 0.00 0.00 61.69 60.57 3hu1 s THR 316 Cb 0.04 -1.00 -0.15 0.00 -1.51 0.00 0.00 72.50 69.88 3hu1 s THR 316 CO -0.11 0.00 1.38 0.45 -2.21 0.00 0.00 174.62 174.13 3hu1 h HIS 317 N 8.00 0.28 -3.92 9.09 3.86 -1.94 -3.45 115.15 127.05 3hu1 h HIS 317 Ca -0.18 -0.07 -0.46 0.00 -1.16 0.00 0.00 60.37 58.50 3hu1 h HIS 317 Cb 1.10 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.49 3hu1 h HIS 317 CO 0.16 0.59 0.33 0.20 0.86 0.00 0.00 177.93 180.07 3hu1 s GLY 318 N -3.22 2.64 0.18 2.45 0.00 -1.26 -4.99 107.32 103.12 3hu1 s GLY 318 Ca -0.15 0.45 -0.08 0.00 0.00 0.00 0.00 44.72 44.95 3hu1 s GLY 318 CO 0.72 0.83 1.56 0.83 0.00 0.00 0.00 173.10 177.04 3hu1 h GLU 319 N 2.73 0.89 -0.66 2.90 5.08 -2.00 -2.45 114.58 121.07 3hu1 h GLU 319 Ca -0.48 -0.40 -0.02 0.00 -1.00 0.00 0.00 59.36 57.47 3hu1 h GLU 319 Cb 1.19 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 3hu1 h GLU 319 CO 0.64 1.05 0.34 0.28 -1.00 0.00 0.00 179.01 180.32 3hu1 h VAL 320 N 0.76 1.20 -0.43 3.13 2.07 -1.98 0.44 116.25 121.44 3hu1 h VAL 320 Ca 0.09 -0.53 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 3hu1 h VAL 320 Cb 0.83 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 3hu1 h VAL 320 CO 0.07 0.23 -0.08 -0.33 0.02 0.00 0.00 177.57 177.48 3hu1 h GLU 321 N 0.92 0.82 -0.42 1.57 5.08 -1.92 -1.23 114.58 119.40 3hu1 h GLU 321 Ca 0.23 -0.30 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 3hu1 h GLU 321 Cb 0.05 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3hu1 h GLU 321 CO -0.04 0.93 -0.15 0.00 -1.00 0.00 0.00 179.01 178.75 3hu1 h ARG 322 N 0.65 0.79 -0.34 2.33 3.08 -1.17 -3.12 114.38 116.60 3hu1 h ARG 322 Ca 0.11 -0.28 -0.09 0.00 0.07 0.00 0.00 59.98 59.79 3hu1 h ARG 322 Cb 0.61 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.59 3hu1 h ARG 322 CO 0.04 0.89 -0.15 -0.09 -1.07 0.00 0.00 179.97 179.59 3hu1 h ARG 323 N 0.70 0.61 -0.31 0.04 2.43 -0.55 -2.80 114.38 114.50 3hu1 h ARG 323 Ca 0.11 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 3hu1 h ARG 323 Cb 0.65 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3hu1 h ARG 323 CO 0.05 0.73 0.17 0.82 -1.51 0.00 0.00 179.97 180.23 3hu1 h ILE 324 N 0.55 1.13 -0.57 1.20 5.03 -1.18 -0.46 117.51 123.22 3hu1 h ILE 324 Ca 0.09 -0.36 0.01 0.00 -0.12 0.00 0.00 64.86 64.48 3hu1 h ILE 324 Cb 0.57 0.81 -0.03 0.00 -3.03 0.00 0.00 36.82 35.14 3hu1 h ILE 324 CO 0.04 0.14 0.37 0.58 -0.68 0.00 0.00 178.15 178.59 3hu1 h VAL 325 N 0.38 1.13 -0.77 1.67 2.07 -1.47 -0.89 116.25 118.37 3hu1 h VAL 325 Ca 0.11 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.37 3hu1 h VAL 325 Cb 0.07 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.12 3hu1 h VAL 325 CO -0.02 0.14 0.48 0.28 0.02 0.00 0.00 177.57 178.47 3hu1 h SER 326 N 0.75 0.90 -0.71 0.57 0.02 -1.43 -2.09 113.55 111.57 3hu1 h SER 326 Ca 0.21 -0.05 0.08 0.00 -0.84 0.00 0.00 61.79 61.19 3hu1 h SER 326 Cb -0.07 -0.23 -0.07 0.00 0.14 0.00 0.00 62.40 62.17 3hu1 h SER 326 CO -0.05 0.69 0.37 -0.61 -1.14 0.00 0.00 176.83 176.09 3hu1 h GLN 327 N 1.04 0.63 -0.03 3.45 5.75 -0.21 -2.31 115.11 123.44 3hu1 h GLN 327 Ca 0.28 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.73 3hu1 h GLN 327 Cb -0.07 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 28.34 3hu1 h GLN 327 CO -0.05 0.42 -0.02 1.25 -2.65 0.00 0.00 178.83 177.78 3hu1 h LEU 328 N 0.65 0.07 -0.72 -2.39 5.85 -0.85 -2.65 115.31 115.27 3hu1 h LEU 328 Ca 0.34 -0.43 0.12 0.00 0.84 0.00 0.00 57.88 58.75 3hu1 h LEU 328 Cb 0.31 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.24 3hu1 h LEU 328 CO -0.24 0.48 0.30 -0.07 -0.34 0.00 0.00 178.44 178.57 3hu1 h LEU 329 N -0.35 0.31 -1.00 2.25 3.38 -1.33 -0.43 115.31 118.15 3hu1 h LEU 329 Ca 0.01 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 3hu1 h LEU 329 Cb 0.46 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3hu1 h LEU 329 CO 0.00 0.15 0.31 0.74 0.09 0.00 0.00 178.44 179.73 3hu1 h THR 330 N 0.48 1.23 -0.22 0.22 2.02 -1.39 -2.40 112.91 112.85 3hu1 h THR 330 Ca 0.38 -0.70 -0.20 0.00 0.77 0.00 0.00 66.41 66.66 3hu1 h THR 330 Cb 0.52 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 3hu1 h THR 330 CO -0.35 0.29 -0.65 -0.07 0.37 0.00 0.00 175.52 175.10 3hu1 h LEU 331 N 1.01 0.93 -0.78 2.58 3.38 -0.99 0.66 115.31 122.12 3hu1 h LEU 331 Ca 0.24 -0.55 0.08 0.00 0.09 0.00 0.00 57.88 57.74 3hu1 h LEU 331 Cb 0.15 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.56 3hu1 h LEU 331 CO -0.03 1.35 0.44 0.24 0.09 0.00 0.00 178.44 180.53 3hu1 h MET 332 N 0.59 0.74 0.00 1.13 2.86 -0.88 -2.24 114.93 117.14 3hu1 h MET 332 Ca -0.02 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3hu1 h MET 332 Cb 1.27 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.76 3hu1 h MET 332 CO 0.14 0.49 -0.70 -0.44 1.06 0.00 0.00 176.91 177.46 3hu1 h ASP 333 N 0.76 0.00 0.78 1.22 3.32 -1.41 -3.31 116.42 117.79 3hu1 h ASP 333 Ca 0.37 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.31 3hu1 h ASP 333 Cb 0.30 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 3hu1 h ASP 333 CO -0.23 0.03 -0.18 1.23 -1.72 0.00 0.00 179.24 178.37 3hu1 h GLY 334 N 4.17 0.00 -5.65 2.75 0.00 -0.26 -3.42 103.07 100.66 3hu1 h GLY 334 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 3hu1 h GLY 334 CO 0.00 0.00 0.98 1.08 0.00 0.00 0.00 176.54 178.60 3hu1 s LEU 335 N -6.84 4.01 0.69 3.11 1.43 -1.06 -5.04 118.68 114.98 3hu1 s LEU 335 Ca -0.00 1.51 -0.11 0.00 -1.03 0.00 0.00 54.13 54.49 3hu1 s LEU 335 Cb 0.11 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.79 3hu1 s LEU 335 CO 0.61 -0.99 1.06 -0.54 0.23 0.00 0.00 176.35 176.72 3hu1 s LYS 336 N 4.02 3.01 0.20 1.70 1.02 -1.26 -5.00 119.74 123.42 3hu1 s LYS 336 Ca 0.59 0.80 -0.16 0.00 0.02 0.00 0.00 55.97 57.23 3hu1 s LYS 336 Cb -0.21 -2.01 0.19 0.00 -0.52 0.00 0.00 37.83 35.29 3hu1 s LYS 336 CO 0.22 -1.01 1.62 1.96 -0.92 0.00 0.00 175.35 177.21 3hu1 h GLN 337 N -0.65 -0.06 0.00 1.68 1.08 -1.98 -2.53 115.11 112.66 3hu1 h GLN 337 Ca -0.44 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 3hu1 h GLN 337 Cb 1.22 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.66 3hu1 h GLN 337 CO 0.59 -0.04 0.00 2.89 -0.95 0.00 0.00 178.83 181.32 3hu1 n ARG 338 N -5.43 0.21 0.09 1.46 -4.01 -1.26 -2.59 116.66 105.13 3hu1 n ARG 338 Ca 0.06 0.00 -0.06 0.00 -1.04 0.00 0.00 57.85 56.81 3hu1 n ARG 338 Cb 0.33 -1.32 0.09 0.00 -3.04 0.00 0.00 32.46 28.52 3hu1 n ARG 338 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 3hu1 h ALA 339 N 2.07 0.76 -6.00 2.89 0.00 -1.84 -3.48 119.26 113.66 3hu1 h ALA 339 Ca 0.00 -0.60 -0.39 0.00 0.00 0.00 0.00 54.91 53.92 3hu1 h ALA 339 Cb 0.00 -0.08 0.10 0.00 0.00 0.00 0.00 17.79 17.81 3hu1 h ALA 339 CO 0.00 0.79 -0.88 0.72 0.00 0.00 0.00 179.25 179.88 3hu1 n HIS 340 N -3.80 -2.03 -4.08 0.00 8.25 -1.07 -4.80 115.22 107.70 3hu1 n HIS 340 Ca -0.03 0.69 -0.25 0.00 -0.26 0.00 0.00 57.72 57.87 3hu1 n HIS 340 Cb 0.67 -3.94 -0.17 0.00 1.12 0.00 0.00 29.99 27.68 3hu1 n HIS 340 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3hu1 s VAL 341 N -3.53 0.97 -0.13 1.59 1.01 -1.26 -2.13 120.40 116.92 3hu1 s VAL 341 Ca 0.30 -0.29 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 3hu1 s VAL 341 Cb -0.08 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 3hu1 s VAL 341 CO 0.82 0.35 -0.00 -0.63 0.00 0.00 0.00 175.10 175.63 3hu1 s ILE 342 N 1.42 4.23 -0.26 2.22 -1.09 -0.93 -4.94 121.20 121.86 3hu1 s ILE 342 Ca -0.01 -0.25 -0.09 0.00 -2.23 0.00 0.00 60.65 58.07 3hu1 s ILE 342 Cb -0.13 -2.83 -0.04 0.00 -1.58 0.00 0.00 42.46 37.87 3hu1 s ILE 342 CO -0.05 0.53 0.13 -0.69 -1.23 0.00 0.00 174.94 173.64 3hu1 s VAL 343 N -0.17 4.88 0.11 2.92 1.01 -0.52 -1.73 120.40 126.90 3hu1 s VAL 343 Ca 0.05 0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.08 3hu1 s VAL 343 Cb -0.13 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 3hu1 s VAL 343 CO 0.02 0.31 0.14 -0.04 0.00 0.00 0.00 175.10 175.53 3hu1 s MET 344 N 1.54 3.01 -0.03 2.72 -1.94 0.15 -0.89 119.30 123.86 3hu1 s MET 344 Ca 0.06 -0.71 -0.17 0.00 -1.71 0.00 0.00 55.69 53.16 3hu1 s MET 344 Cb -0.15 -2.76 0.03 0.00 2.01 0.00 0.00 34.83 33.96 3hu1 s MET 344 CO 0.07 0.54 0.37 0.00 -0.01 0.00 0.00 175.02 175.98 3hu1 s ALA 345 N -1.57 -0.93 0.09 3.03 0.00 -0.28 -0.94 121.76 121.16 3hu1 s ALA 345 Ca 0.31 0.54 0.08 0.00 0.00 0.00 0.00 51.96 52.89 3hu1 s ALA 345 Cb -0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 3hu1 s ALA 345 CO 0.24 -0.27 -0.21 0.00 0.00 0.00 0.00 175.76 175.53 3hu1 s ALA 346 N -1.13 1.77 -0.09 0.00 0.00 -0.96 -0.08 121.76 121.28 3hu1 s ALA 346 Ca -0.12 -1.19 -0.31 0.00 0.00 0.00 0.00 51.96 50.35 3hu1 s ALA 346 Cb -0.04 -0.26 0.09 0.00 0.00 0.00 0.00 23.12 22.90 3hu1 s ALA 346 CO 0.05 0.36 0.77 -0.08 0.00 0.00 0.00 175.76 176.85 3hu1 s THR 347 N -1.08 0.00 -2.05 0.00 -1.32 -0.73 -1.00 115.64 109.47 3hu1 s THR 347 Ca 0.06 0.00 0.20 0.00 -1.21 0.00 0.00 61.69 60.74 3hu1 s THR 347 Cb -0.10 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 69.95 3hu1 s THR 347 CO 0.04 0.00 1.03 -0.46 -2.21 0.00 0.00 174.62 173.02 3hu1 n ASN 348 N 0.92 2.15 -3.32 8.08 0.23 -1.26 -3.28 115.26 118.78 3hu1 n ASN 348 Ca -0.17 -1.58 -0.25 0.00 -0.53 0.00 0.00 54.58 52.05 3hu1 n ASN 348 Cb 0.57 0.30 -0.08 0.00 -2.08 0.00 0.00 39.78 38.49 3hu1 n ASN 348 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 3hu1 n ARG 349 N 0.39 1.08 0.28 -3.83 1.85 -1.26 -4.71 116.66 110.46 3hu1 n ARG 349 Ca 0.09 -3.60 0.13 0.00 -1.00 0.00 0.00 57.85 53.47 3hu1 n ARG 349 Cb 0.44 -1.58 0.83 0.00 -1.05 0.00 0.00 32.46 31.10 3hu1 n ARG 349 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 3hu1 h PRO 350 N 4.40 0.00 0.00 2.89 0.13 -1.94 -2.13 132.00 135.35 3hu1 h PRO 350 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3hu1 h PRO 350 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 3hu1 h PRO 350 CO 0.54 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.40 3hu1 n ASN 351 N -4.06 0.00 -0.58 1.44 3.02 -1.26 -2.80 115.26 111.01 3hu1 n ASN 351 Ca -0.03 -0.76 0.09 0.00 -0.03 0.00 0.00 54.58 53.84 3hu1 n ASN 351 Cb 0.09 -0.02 0.05 0.00 -0.61 0.00 0.00 39.78 39.28 3hu1 n ASN 351 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3hu1 n SER 352 N -1.02 2.17 -4.76 6.41 3.41 -0.80 -4.97 113.62 114.05 3hu1 n SER 352 Ca 0.19 -1.58 -0.40 0.00 -0.26 0.00 0.00 58.87 56.82 3hu1 n SER 352 Cb 0.10 0.17 -0.06 0.00 -0.26 0.00 0.00 64.21 64.16 3hu1 n SER 352 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hu1 s ILE 353 N -1.63 4.43 -0.12 -1.33 1.01 -1.12 -1.66 121.20 120.78 3hu1 s ILE 353 Ca 0.18 1.77 -0.39 0.00 0.00 0.00 0.00 60.65 62.21 3hu1 s ILE 353 Cb 0.14 -4.17 -0.16 0.00 0.01 0.00 0.00 42.46 38.27 3hu1 s ILE 353 CO 0.29 0.46 1.54 -0.67 0.00 0.00 0.00 174.94 176.56 3hu1 n ASP 354 N 1.98 1.93 0.30 3.58 -0.08 -1.04 -4.65 116.55 118.57 3hu1 n ASP 354 Ca -0.04 1.10 0.15 0.00 -1.51 0.00 0.00 54.79 54.50 3hu1 n ASP 354 Cb 0.49 -1.14 0.92 0.00 2.34 0.00 0.00 41.12 43.72 3hu1 n ASP 354 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3hu1 h PRO 355 N 5.83 0.00 0.00 -0.67 0.11 -1.94 -2.09 132.00 133.24 3hu1 h PRO 355 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 3hu1 h PRO 355 Cb 1.33 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.44 3hu1 h PRO 355 CO 0.87 0.02 -0.04 0.00 -0.21 0.00 0.00 178.00 178.64 3hu1 h ALA 356 N 1.98 1.50 0.00 -0.75 0.00 -2.00 -1.01 119.26 118.98 3hu1 h ALA 356 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hu1 h ALA 356 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3hu1 h ALA 356 CO 0.00 0.05 0.00 -0.07 0.00 0.00 0.00 179.25 179.23 3hu1 h LEU 357 N 0.00 0.00 -2.61 0.00 3.38 -1.74 -3.15 115.31 111.19 3hu1 h LEU 357 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hu1 h LEU 357 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3hu1 h LEU 357 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.07 3hu1 n ARG 358 N -2.72 2.56 -1.48 1.13 1.74 -0.39 -1.33 116.66 116.17 3hu1 n ARG 358 Ca 0.04 -2.26 -0.29 0.00 -0.77 0.00 0.00 57.85 54.56 3hu1 n ARG 358 Cb 0.43 -1.43 0.12 0.00 -1.02 0.00 0.00 32.46 30.56 3hu1 n ARG 358 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3hu1 s ARG 359 N -1.10 1.40 0.07 5.56 3.00 -1.19 -4.28 118.95 122.42 3hu1 s ARG 359 Ca 0.35 0.47 -0.35 0.00 0.00 0.00 0.00 55.73 56.20 3hu1 s ARG 359 Cb 0.19 -1.85 -0.14 0.00 0.00 0.00 0.00 34.95 33.14 3hu1 s ARG 359 CO 0.25 -2.06 1.59 0.34 0.00 0.00 0.00 175.30 175.43 3hu1 n PHE 360 N -3.70 2.10 0.00 -0.53 7.35 -1.26 -2.01 117.46 119.41 3hu1 n PHE 360 Ca 0.07 0.32 0.00 0.00 -0.76 0.00 0.00 57.45 57.07 3hu1 n PHE 360 Cb 0.58 -2.51 0.00 0.00 0.35 0.00 0.00 39.48 37.89 3hu1 n PHE 360 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3hu1 n GLY 361 N 3.44 2.77 0.00 7.13 0.00 -1.26 -4.99 105.19 112.28 3hu1 n GLY 361 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3hu1 n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hu1 n ARG 362 N -0.36 0.00 -2.34 1.61 1.74 -0.85 -4.68 116.66 111.79 3hu1 n ARG 362 Ca 0.00 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.65 3hu1 n ARG 362 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 3hu1 n ARG 362 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 3hu1 n PHE 363 N 0.00 3.04 0.50 -1.55 3.72 -0.44 -2.68 117.46 120.04 3hu1 n PHE 363 Ca 0.00 -2.82 0.08 0.00 -0.05 0.00 0.00 57.45 54.66 3hu1 n PHE 363 Cb 0.00 -1.98 0.22 0.00 -0.94 0.00 0.00 39.48 36.78 3hu1 n PHE 363 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3hu1 n ASP 364 N 4.01 2.55 -4.07 4.37 3.85 -1.13 -4.43 116.55 121.69 3hu1 n ASP 364 Ca 0.40 -1.99 -0.17 0.00 -0.71 0.00 0.00 54.79 52.32 3hu1 n ASP 364 Cb 0.37 -0.31 -0.13 0.00 -1.35 0.00 0.00 41.12 39.69 3hu1 n ASP 364 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 3hu1 s ARG 365 N -1.37 0.71 -0.03 0.11 1.81 -1.11 -4.99 118.95 114.08 3hu1 s ARG 365 Ca 0.32 -0.59 0.02 0.00 -1.72 0.00 0.00 55.73 53.75 3hu1 s ARG 365 Cb 0.17 -0.65 0.01 0.00 -0.45 0.00 0.00 34.95 34.03 3hu1 s ARG 365 CO 0.22 0.16 -0.07 -1.21 -0.68 0.00 0.00 175.30 173.72 3hu1 s GLU 366 N -0.94 0.82 -0.18 3.54 2.02 -1.26 -0.92 118.70 121.78 3hu1 s GLU 366 Ca -0.01 -0.22 0.01 0.00 0.02 0.00 0.00 54.97 54.77 3hu1 s GLU 366 Cb -0.07 -0.79 0.02 0.00 0.10 0.00 0.00 34.13 33.40 3hu1 s GLU 366 CO 0.01 0.06 -0.18 0.08 0.02 0.00 0.00 175.26 175.24 3hu1 s VAL 367 N 0.35 2.01 -0.63 2.63 1.01 -0.08 -4.93 120.40 120.76 3hu1 s VAL 367 Ca -0.05 -0.97 -0.24 0.00 0.00 0.00 0.00 61.98 60.72 3hu1 s VAL 367 Cb -0.09 -1.86 0.05 0.00 0.00 0.00 0.00 36.38 34.49 3hu1 s VAL 367 CO 0.00 0.48 1.00 -0.62 0.00 0.00 0.00 175.10 175.95 3hu1 s ASP 368 N 1.30 6.23 -1.17 3.32 2.15 -1.26 -1.61 116.67 125.64 3hu1 s ASP 368 Ca 0.04 -0.68 -0.17 0.00 0.43 0.00 0.00 52.55 52.17 3hu1 s ASP 368 Cb -0.14 -2.44 0.11 0.00 -0.30 0.00 0.00 42.92 40.15 3hu1 s ASP 368 CO -0.12 -1.41 1.49 -0.63 -0.17 0.00 0.00 175.17 174.33 3hu1 s ILE 369 N 4.23 4.52 0.00 4.11 -1.09 0.80 -4.95 121.20 128.83 3hu1 s ILE 369 Ca 0.27 -1.96 0.00 0.00 -2.23 0.00 0.00 60.65 56.73 3hu1 s ILE 369 Cb -0.14 -5.01 0.00 0.00 -1.58 0.00 0.00 42.46 35.73 3hu1 s ILE 369 CO 0.14 -1.78 0.00 0.61 -1.23 0.00 0.00 174.94 172.68 3hu1 n GLY 370 N 5.16 0.02 3.71 6.18 0.00 -1.26 -4.21 105.19 114.79 3hu1 n GLY 370 Ca 0.38 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 3hu1 n GLY 370 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hu1 s ILE 371 N 0.57 4.63 0.59 -0.61 1.09 -1.26 -4.89 121.20 121.32 3hu1 s ILE 371 Ca 0.00 1.89 -0.18 0.00 -1.10 0.00 0.00 60.65 61.26 3hu1 s ILE 371 Cb 0.00 -4.21 -0.03 0.00 -1.06 0.00 0.00 42.46 37.15 3hu1 s ILE 371 CO 0.00 0.15 1.18 -2.16 -0.10 0.00 0.00 174.94 174.01 3hu1 s PRO 372 N 0.99 3.01 0.90 2.79 0.04 -1.26 -5.06 135.00 136.41 3hu1 s PRO 372 Ca 0.54 1.73 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 3hu1 s PRO 372 Cb -0.23 -1.95 0.19 0.00 0.04 0.00 0.00 34.50 32.55 3hu1 s PRO 372 CO 0.28 -1.15 1.24 0.16 0.04 0.00 0.00 177.00 177.57 3hu1 s ASP 373 N -1.75 3.34 0.28 6.66 -4.77 -1.26 -4.82 116.67 114.35 3hu1 s ASP 373 Ca 0.75 -0.04 0.01 0.00 -3.30 0.00 0.00 52.55 49.97 3hu1 s ASP 373 Cb -0.28 -0.03 0.54 0.00 -1.09 0.00 0.00 42.92 42.06 3hu1 s ASP 373 CO 0.33 -2.56 1.84 0.00 0.70 0.00 0.00 175.17 175.47 3hu1 h ALA 374 N -1.35 1.50 -0.10 2.11 0.00 -1.95 -0.96 119.26 118.52 3hu1 h ALA 374 Ca -0.41 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 3hu1 h ALA 374 Cb 1.23 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 3hu1 h ALA 374 CO 0.35 0.23 0.02 1.15 0.00 0.00 0.00 179.25 181.00 3hu1 h THR 375 N 1.00 1.21 -0.97 0.00 2.02 -1.94 -2.85 112.91 111.38 3hu1 h THR 375 Ca 0.49 -0.66 0.01 0.00 0.77 0.00 0.00 66.41 67.02 3hu1 h THR 375 Cb 0.47 1.47 -0.05 0.00 -1.74 0.00 0.00 68.15 68.30 3hu1 h THR 375 CO -0.26 0.19 0.64 1.23 0.37 0.00 0.00 175.52 177.69 3hu1 h GLY 376 N -0.07 1.36 1.09 2.16 0.00 -1.78 -2.48 103.07 103.36 3hu1 h GLY 376 Ca 0.03 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 3hu1 h GLY 376 CO 0.00 0.50 0.49 3.21 0.00 0.00 0.00 176.54 180.74 3hu1 h ARG 377 N 1.31 1.19 -0.81 4.80 3.08 -1.09 -1.89 114.38 120.97 3hu1 h ARG 377 Ca 0.35 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 60.27 3hu1 h ARG 377 Cb -0.15 -0.24 -0.04 0.00 0.08 0.00 0.00 29.97 29.62 3hu1 h ARG 377 CO -0.08 0.86 0.46 1.25 -1.07 0.00 0.00 179.97 181.39 3hu1 h LEU 378 N 1.20 0.99 -0.25 3.04 5.85 -1.22 -1.81 115.31 123.12 3hu1 h LEU 378 Ca 0.31 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.95 3hu1 h LEU 378 Cb -0.01 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 3hu1 h LEU 378 CO -0.05 0.79 0.14 -0.33 -0.34 0.00 0.00 178.44 178.65 3hu1 h GLU 379 N 1.12 0.29 -0.78 1.25 5.08 -1.16 -1.15 114.58 119.23 3hu1 h GLU 379 Ca 0.29 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.63 3hu1 h GLU 379 Cb 0.00 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 3hu1 h GLU 379 CO -0.05 0.19 0.51 0.82 -1.00 0.00 0.00 179.01 179.48 3hu1 h ILE 380 N 0.30 1.20 -0.13 3.13 2.04 -1.04 0.58 117.51 123.60 3hu1 h ILE 380 Ca 0.10 -0.39 -0.08 0.00 1.00 0.00 0.00 64.86 65.48 3hu1 h ILE 380 Cb -0.00 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 3hu1 h ILE 380 CO -0.04 0.20 -0.30 -0.07 0.00 0.00 0.00 178.15 177.93 3hu1 h LEU 381 N 1.06 0.24 -0.25 1.44 3.38 -1.01 0.80 115.31 120.97 3hu1 h LEU 381 Ca 0.28 -0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.97 3hu1 h LEU 381 Cb -0.10 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 40.59 3hu1 h LEU 381 CO -0.06 0.54 -0.71 1.56 0.09 0.00 0.00 178.44 179.86 3hu1 h GLN 382 N 0.21 0.75 -0.35 1.13 4.20 -0.17 -2.63 115.11 118.24 3hu1 h GLN 382 Ca 0.03 -0.57 -0.07 0.00 0.06 0.00 0.00 58.65 58.10 3hu1 h GLN 382 Cb 0.65 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 3hu1 h GLN 382 CO 0.05 1.19 -0.04 0.82 -0.67 0.00 0.00 178.83 180.18 3hu1 h ILE 383 N 0.53 1.27 -0.25 2.54 2.04 -0.26 -3.02 117.51 120.37 3hu1 h ILE 383 Ca -0.03 -1.06 -0.10 0.00 1.00 0.00 0.00 64.86 64.67 3hu1 h ILE 383 Cb 1.32 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 3hu1 h ILE 383 CO 0.14 0.35 -0.27 0.45 0.00 0.00 0.00 178.15 178.82 3hu1 h HIS 384 N 0.45 0.54 -0.31 1.37 3.86 -0.91 -3.14 115.15 117.02 3hu1 h HIS 384 Ca 0.10 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3hu1 h HIS 384 Cb 0.52 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.86 3hu1 h HIS 384 CO 0.04 0.71 0.00 0.25 0.86 0.00 0.00 177.93 179.79 3hu1 n THR 385 N -4.11 0.39 0.31 2.45 -2.24 -0.99 -4.32 114.28 105.77 3hu1 n THR 385 Ca -0.01 -0.58 0.20 0.00 -2.27 0.00 0.00 64.05 61.39 3hu1 n THR 385 Cb 0.42 0.69 1.05 0.00 -2.10 0.00 0.00 70.33 70.39 3hu1 n THR 385 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 3hu1 h LYS 386 N 3.44 0.00 -0.01 -0.78 2.10 -1.48 -0.02 116.57 119.82 3hu1 h LYS 386 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3hu1 h LYS 386 Cb 0.76 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.09 3hu1 h LYS 386 CO 0.00 0.00 -0.09 0.09 -2.00 0.00 0.00 179.45 177.45 3hu1 n ASN 387 N -3.29 1.50 -4.83 7.07 3.02 -1.26 -5.01 115.26 112.46 3hu1 n ASN 387 Ca -0.02 -1.25 -0.36 0.00 -0.03 0.00 0.00 54.58 52.92 3hu1 n ASN 387 Cb 0.16 0.22 -0.06 0.00 -0.61 0.00 0.00 39.78 39.49 3hu1 n ASN 387 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3hu1 s MET 388 N -1.04 4.09 -0.33 3.52 -1.94 -0.02 -5.05 119.30 118.53 3hu1 s MET 388 Ca 0.10 0.63 -0.25 0.00 -1.71 0.00 0.00 55.69 54.46 3hu1 s MET 388 Cb 0.08 -2.99 0.01 0.00 2.01 0.00 0.00 34.83 33.94 3hu1 s MET 388 CO 0.17 0.49 0.87 0.15 -0.01 0.00 0.00 175.02 176.70 3hu1 s LYS 389 N -1.78 3.92 0.15 2.03 -0.14 -1.26 -5.00 119.74 117.66 3hu1 s LYS 389 Ca 0.37 0.63 0.09 0.00 -1.36 0.00 0.00 55.97 55.70 3hu1 s LYS 389 Cb -0.16 -3.76 -0.04 0.00 -1.68 0.00 0.00 37.83 32.18 3hu1 s LYS 389 CO 0.20 -0.81 -0.17 -0.51 -0.76 0.00 0.00 175.35 173.29 3hu1 s LEU 390 N 3.23 2.71 0.48 3.17 1.43 -1.26 -0.92 118.68 127.52 3hu1 s LEU 390 Ca 0.36 -0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 52.81 3hu1 s LEU 390 Cb -0.13 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 3hu1 s LEU 390 CO 0.15 0.15 0.74 0.00 0.23 0.00 0.00 176.35 177.62 3hu1 s ALA 391 N -1.39 3.56 0.25 4.21 0.00 -0.76 -4.83 121.76 122.80 3hu1 s ALA 391 Ca 0.20 -0.83 -0.03 0.00 0.00 0.00 0.00 51.96 51.30 3hu1 s ALA 391 Cb -0.10 -2.35 0.50 0.00 0.00 0.00 0.00 23.12 21.18 3hu1 s ALA 391 CO 0.11 -0.43 1.71 -0.44 0.00 0.00 0.00 175.76 176.71 3hu1 h ASP 392 N 0.27 0.20 0.82 0.00 5.19 -2.01 -2.96 116.42 117.91 3hu1 h ASP 392 Ca -0.47 0.13 0.00 0.00 -0.62 0.00 0.00 57.03 56.07 3hu1 h ASP 392 Cb 1.24 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.88 3hu1 h ASP 392 CO 0.60 0.04 0.00 -0.90 -3.12 0.00 0.00 179.24 175.86 3hu1 n ASP 393 N -5.06 0.21 -4.63 6.45 5.75 -1.26 -4.73 116.55 113.28 3hu1 n ASP 393 Ca 0.15 0.54 -0.43 0.00 -0.01 0.00 0.00 54.79 55.04 3hu1 n ASP 393 Cb 0.47 -0.59 -0.03 0.00 -1.03 0.00 0.00 41.12 39.95 3hu1 n ASP 393 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3hu1 s VAL 394 N -3.06 3.60 -0.40 2.12 1.01 -1.12 -4.63 120.40 117.91 3hu1 s VAL 394 Ca 0.09 0.67 -0.07 0.00 0.00 0.00 0.00 61.98 62.67 3hu1 s VAL 394 Cb 0.13 -3.62 0.08 0.00 0.00 0.00 0.00 36.38 32.97 3hu1 s VAL 394 CO 0.41 -0.27 0.21 -0.62 0.00 0.00 0.00 175.10 174.83 3hu1 s ASP 395 N 4.62 5.43 0.29 3.32 2.15 -1.26 -4.97 116.67 126.25 3hu1 s ASP 395 Ca 0.75 -1.59 0.05 0.00 0.43 0.00 0.00 52.55 52.19 3hu1 s ASP 395 Cb -0.26 -1.91 0.45 0.00 -0.30 0.00 0.00 42.92 40.90 3hu1 s ASP 395 CO 0.31 -0.49 1.72 -0.07 -0.17 0.00 0.00 175.17 176.46 3hu1 h LEU 396 N 8.26 0.34 -0.73 -1.34 3.38 -1.99 -2.53 115.31 120.70 3hu1 h LEU 396 Ca -0.20 -0.13 0.10 0.00 0.09 0.00 0.00 57.88 57.74 3hu1 h LEU 396 Cb 1.07 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.66 3hu1 h LEU 396 CO 0.71 0.66 0.36 -0.33 0.09 0.00 0.00 178.44 179.93 3hu1 h GLU 397 N 0.28 0.59 -0.00 1.13 5.08 -1.94 0.30 114.58 120.02 3hu1 h GLU 397 Ca 0.03 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3hu1 h GLU 397 Cb 0.74 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 3hu1 h GLU 397 CO 0.06 0.39 0.00 0.37 -1.00 0.00 0.00 179.01 178.83 3hu1 h GLN 398 N 0.61 0.00 -0.80 2.33 5.75 -1.93 -2.14 115.11 118.93 3hu1 h GLN 398 Ca 0.36 -0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.85 3hu1 h GLN 398 Cb 0.39 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 28.90 3hu1 h GLN 398 CO -0.28 0.05 0.46 0.28 -2.65 0.00 0.00 178.83 176.69 3hu1 h VAL 399 N -0.05 1.23 -0.93 2.39 2.07 -0.98 -1.02 116.25 118.97 3hu1 h VAL 399 Ca 0.00 -0.55 0.04 0.00 0.82 0.00 0.00 66.70 67.01 3hu1 h VAL 399 Cb 0.05 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 29.91 3hu1 h VAL 399 CO -0.00 0.25 0.61 0.00 0.02 0.00 0.00 177.57 178.45 3hu1 h ALA 400 N 1.24 1.42 -0.01 1.67 0.00 -0.27 -2.66 119.26 120.64 3hu1 h ALA 400 Ca 0.28 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.94 3hu1 h ALA 400 Cb -0.00 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 3hu1 h ALA 400 CO -0.05 0.49 -0.88 -0.91 0.00 0.00 0.00 179.25 177.90 3hu1 h ASN 401 N 1.15 0.44 0.70 0.00 2.35 -0.54 -3.05 115.58 116.62 3hu1 h ASN 401 Ca 0.37 -0.34 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3hu1 h ASN 401 Cb 0.03 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.27 3hu1 h ASN 401 CO -0.12 1.12 0.00 -0.62 -1.65 0.00 0.00 177.43 176.17 3hu1 n GLU 402 N -3.74 0.25 -2.42 0.81 1.02 -0.65 -4.33 120.64 111.58 3hu1 n GLU 402 Ca -0.05 0.02 -0.39 0.00 -0.02 0.00 0.00 57.16 56.72 3hu1 n GLU 402 Cb 0.80 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.74 3hu1 n GLU 402 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3hu1 n THR 403 N -1.37 4.85 -0.00 2.62 -2.24 -1.03 -4.93 114.28 112.19 3hu1 n THR 403 Ca 0.11 -5.35 -0.01 0.00 -2.27 0.00 0.00 64.05 56.53 3hu1 n THR 403 Cb 0.26 -1.42 -0.01 0.00 -2.10 0.00 0.00 70.33 67.06 3hu1 n THR 403 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3hu1 h HIS 404 N 3.63 -0.14 0.00 4.78 6.17 -1.81 -2.91 115.15 124.87 3hu1 h HIS 404 Ca 0.50 0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.59 3hu1 h HIS 404 Cb 0.27 0.06 0.00 0.00 2.52 0.00 0.00 27.41 30.26 3hu1 h HIS 404 CO 1.22 -0.05 0.00 0.41 0.71 0.00 0.00 177.93 180.22 3hu1 n GLY 405 N -1.04 -0.63 3.73 5.26 0.00 -1.26 -4.86 105.19 106.40 3hu1 n GLY 405 Ca -0.01 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 3hu1 n GLY 405 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hu1 s HIS 406 N -2.36 3.48 0.45 1.61 4.02 -1.10 -4.41 115.29 116.97 3hu1 s HIS 406 Ca 0.16 1.44 0.08 0.00 1.02 0.00 0.00 55.06 57.75 3hu1 s HIS 406 Cb 0.09 -3.38 0.01 0.00 -1.02 0.00 0.00 32.58 28.28 3hu1 s HIS 406 CO 0.19 -1.04 0.48 0.14 1.02 0.00 0.00 174.74 175.53 3hu1 s VAL 407 N 0.25 2.56 0.24 -0.90 -7.23 -1.26 -4.49 120.40 109.56 3hu1 s VAL 407 Ca 0.54 -1.23 -0.06 0.00 -1.81 0.00 0.00 61.98 59.41 3hu1 s VAL 407 Cb -0.31 -2.79 0.21 0.00 0.56 0.00 0.00 36.38 34.05 3hu1 s VAL 407 CO 0.34 0.00 1.71 1.23 -0.31 0.00 0.00 175.10 178.07 3hu1 h GLY 408 N 0.80 1.02 0.69 2.32 0.00 -1.82 -1.56 103.07 104.52 3hu1 h GLY 408 Ca -0.39 -0.09 0.06 0.00 0.00 0.00 0.00 47.33 46.91 3hu1 h GLY 408 CO 0.52 -0.12 0.49 0.00 0.00 0.00 0.00 176.54 177.43 3hu1 h ALA 409 N 1.54 1.12 -0.36 3.60 0.00 -1.65 0.76 119.26 124.28 3hu1 h ALA 409 Ca 0.39 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 3hu1 h ALA 409 Cb 0.60 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3hu1 h ALA 409 CO -0.43 0.21 -0.07 -0.44 0.00 0.00 0.00 179.25 178.52 3hu1 h ASP 410 N 0.89 0.58 0.19 0.00 3.32 -1.63 -1.45 116.42 118.32 3hu1 h ASP 410 Ca 0.36 -0.14 -0.24 0.00 0.02 0.00 0.00 57.03 57.03 3hu1 h ASP 410 Cb 0.19 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.60 3hu1 h ASP 410 CO -0.18 0.70 -0.96 -0.07 -1.72 0.00 0.00 179.24 177.00 3hu1 h LEU 411 N 0.56 0.68 -0.39 1.55 3.38 -0.82 -0.44 115.31 119.83 3hu1 h LEU 411 Ca 0.11 -0.54 0.01 0.00 0.09 0.00 0.00 57.88 57.55 3hu1 h LEU 411 Cb 0.47 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3hu1 h LEU 411 CO 0.02 1.34 0.23 0.00 0.09 0.00 0.00 178.44 180.12 3hu1 h ALA 412 N 0.62 0.49 -0.75 1.53 0.00 -0.75 -1.94 119.26 118.47 3hu1 h ALA 412 Ca -0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3hu1 h ALA 412 Cb 1.60 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.24 3hu1 h ALA 412 CO 0.18 -0.10 0.42 0.00 0.00 0.00 0.00 179.25 179.75 3hu1 h ALA 413 N 1.17 0.96 -0.35 0.00 0.00 -1.14 -1.46 119.26 118.44 3hu1 h ALA 413 Ca 0.15 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3hu1 h ALA 413 Cb -0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 3hu1 h ALA 413 CO -0.07 0.46 0.20 1.25 0.00 0.00 0.00 179.25 181.10 3hu1 h LEU 414 N 1.03 0.33 -0.97 0.00 5.85 -0.88 -1.91 115.31 118.75 3hu1 h LEU 414 Ca 0.27 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.97 3hu1 h LEU 414 Cb 0.01 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 3hu1 h LEU 414 CO -0.05 0.24 0.42 0.00 -0.34 0.00 0.00 178.44 178.71 3hu1 h SER 416 N 1.15 0.59 0.20 0.00 0.87 -0.88 -2.71 113.55 112.76 3hu1 h SER 416 Ca 0.28 -0.10 -0.12 0.00 -1.23 0.00 0.00 61.79 60.63 3hu1 h SER 416 Cb 0.07 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 3hu1 h SER 416 CO -0.04 0.51 -0.46 -0.33 -0.53 0.00 0.00 176.83 175.98 3hu1 h GLU 417 N 0.62 0.31 -0.71 2.24 4.39 -0.61 -0.05 114.58 120.77 3hu1 h GLU 417 Ca 0.16 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3hu1 h GLU 417 Cb 0.06 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.68 3hu1 h GLU 417 CO -0.03 0.71 0.32 0.00 -1.16 0.00 0.00 179.01 178.86 3hu1 h ALA 418 N 1.26 0.92 -0.30 3.43 0.00 -1.19 -1.74 119.26 121.64 3hu1 h ALA 418 Ca 0.02 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.60 3hu1 h ALA 418 Cb 0.91 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 3hu1 h ALA 418 CO 0.08 0.50 -0.47 0.00 0.00 0.00 0.00 179.25 179.35 3hu1 h ALA 419 N 1.16 0.59 -0.60 0.00 0.00 -0.98 -2.32 119.26 117.11 3hu1 h ALA 419 Ca 0.24 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3hu1 h ALA 419 Cb 0.15 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3hu1 h ALA 419 CO -0.03 0.68 0.24 1.25 0.00 0.00 0.00 179.25 181.39 3hu1 h LEU 420 N 0.64 0.80 -0.73 0.00 6.46 -0.92 -1.38 115.31 120.17 3hu1 h LEU 420 Ca 0.03 -0.10 -0.04 0.00 -0.12 0.00 0.00 57.88 57.65 3hu1 h LEU 420 Cb 1.06 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.75 3hu1 h LEU 420 CO 0.10 0.71 0.29 -0.61 -0.62 0.00 0.00 178.44 178.32 3hu1 h GLN 421 N 0.86 1.10 -0.21 1.25 5.75 -0.89 0.13 115.11 123.10 3hu1 h GLN 421 Ca 0.20 -0.20 -0.06 0.00 -0.15 0.00 0.00 58.65 58.45 3hu1 h GLN 421 Cb 0.17 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.52 3hu1 h GLN 421 CO -0.02 0.90 -0.12 0.00 -2.65 0.00 0.00 178.83 176.94 3hu1 h ALA 422 N 1.14 1.41 -0.22 3.38 0.00 -0.88 -1.02 119.26 123.06 3hu1 h ALA 422 Ca 0.24 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 3hu1 h ALA 422 Cb 0.22 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3hu1 h ALA 422 CO -0.02 0.41 -0.14 0.82 0.00 0.00 0.00 179.25 180.32 3hu1 h ILE 423 N 0.32 1.31 -0.94 0.00 2.04 -0.66 -3.02 117.51 116.56 3hu1 h ILE 423 Ca 0.06 -1.24 0.11 0.00 1.00 0.00 0.00 64.86 64.79 3hu1 h ILE 423 Cb 0.41 1.64 -0.07 0.00 -0.74 0.00 0.00 36.82 38.06 3hu1 h ILE 423 CO 0.02 0.38 0.60 0.03 0.00 0.00 0.00 178.15 179.19 3hu1 h ARG 424 N 0.19 0.90 0.00 2.37 3.08 -0.40 -2.01 114.38 118.51 3hu1 h ARG 424 Ca 0.05 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3hu1 h ARG 424 Cb 0.66 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 3hu1 h ARG 424 CO 0.04 0.60 -0.05 0.87 -1.07 0.00 0.00 179.97 180.35 3hu1 h LYS 425 N 0.93 0.00 -0.54 0.04 1.57 -1.08 -2.29 116.57 115.20 3hu1 h LYS 425 Ca 0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.23 3hu1 h LYS 425 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 3hu1 h LYS 425 CO -0.21 0.05 0.00 1.17 -0.57 0.00 0.00 179.45 179.89 3hu1 n LYS 426 N -3.26 2.81 -0.15 3.15 3.00 -0.79 -4.74 118.16 118.18 3hu1 n LYS 426 Ca -0.01 -2.36 -0.06 0.00 -0.00 0.00 0.00 58.31 55.88 3hu1 n LYS 426 Cb 0.24 -1.42 0.02 0.00 0.00 0.00 0.00 35.03 33.88 3hu1 n LYS 426 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.40 177.92 3hu1 h MET 427 N 3.15 0.56 0.00 1.64 2.86 -1.01 -2.85 114.93 119.28 3hu1 h MET 427 Ca 0.00 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3hu1 h MET 427 Cb 0.86 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.39 3hu1 h MET 427 CO 0.00 0.37 -0.04 0.38 1.06 0.00 0.00 176.91 178.68 3hu1 h ASP 428 N 0.58 0.00 -0.23 1.22 2.03 -1.85 -0.45 116.42 117.72 3hu1 h ASP 428 Ca 0.18 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.48 3hu1 h ASP 428 Cb -0.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.49 3hu1 h ASP 428 CO -0.07 0.04 0.00 0.18 -1.03 0.00 0.00 179.24 178.36 3hu1 n LEU 429 N -3.52 2.17 -4.32 0.15 4.32 -1.08 -4.85 117.00 109.87 3hu1 n LEU 429 Ca -0.02 -0.92 -0.27 0.00 -0.02 0.00 0.00 56.01 54.78 3hu1 n LEU 429 Cb 0.15 -0.15 -0.13 0.00 -1.62 0.00 0.00 43.42 41.67 3hu1 n LEU 429 CO 0.26 0.46 -0.54 -0.63 -1.22 0.00 0.00 177.39 175.72 3hu1 s ILE 430 N -1.71 1.95 0.02 -0.08 1.01 -0.18 -4.79 121.20 117.42 3hu1 s ILE 430 Ca 0.34 -1.49 -0.00 0.00 0.00 0.00 0.00 60.65 59.50 3hu1 s ILE 430 Cb 0.19 -1.71 -0.02 0.00 0.01 0.00 0.00 42.46 40.93 3hu1 s ILE 430 CO 0.27 0.14 -0.02 -0.62 0.00 0.00 0.00 174.94 174.71 3hu1 s ASP 431 N -1.63 0.19 0.15 3.58 2.15 -1.26 -4.90 116.67 114.95 3hu1 s ASP 431 Ca 0.10 -0.40 0.20 0.00 0.43 0.00 0.00 52.55 52.88 3hu1 s ASP 431 Cb -0.10 0.09 0.83 0.00 -0.30 0.00 0.00 42.92 43.44 3hu1 s ASP 431 CO 0.04 -0.25 1.60 -0.11 -0.17 0.00 0.00 175.17 176.28 3hu1 n LEU 432 N 1.86 0.39 -0.06 -1.34 7.94 -1.26 -4.00 117.00 120.52 3hu1 n LEU 432 Ca -0.22 0.60 -0.20 0.00 -1.11 0.00 0.00 56.01 55.07 3hu1 n LEU 432 Cb 0.56 -0.54 -0.13 0.00 0.53 0.00 0.00 43.42 43.84 3hu1 n LEU 432 CO 0.21 -0.43 -1.04 -0.62 -1.11 0.00 0.00 177.39 174.40 3hu1 n GLU 433 N -1.93 0.70 -1.81 1.96 -0.58 -1.26 -4.94 120.64 112.77 3hu1 n GLU 433 Ca 0.03 0.23 -0.38 0.00 -0.42 0.00 0.00 57.16 56.63 3hu1 n GLU 433 Cb 0.20 -1.63 0.05 0.00 -0.57 0.00 0.00 31.44 29.49 3hu1 n GLU 433 CO 0.00 0.00 0.00 0.16 -0.48 0.00 0.00 177.13 176.81 3hu1 s ASP 434 N -6.85 5.08 0.08 1.62 -4.77 -1.26 -4.98 116.67 105.60 3hu1 s ASP 434 Ca -0.29 2.67 -0.24 0.00 -3.30 0.00 0.00 52.55 51.39 3hu1 s ASP 434 Cb 0.08 -2.63 -0.16 0.00 -1.09 0.00 0.00 42.92 39.13 3hu1 s ASP 434 CO 0.68 -1.69 1.71 -0.08 0.70 0.00 0.00 175.17 176.49 3hu1 h GLU 435 N 1.13 -0.10 -6.30 2.11 4.81 -1.93 -3.45 114.58 110.86 3hu1 h GLU 435 Ca -0.51 0.01 -0.59 0.00 -0.13 0.00 0.00 59.36 58.14 3hu1 h GLU 435 Cb 1.31 0.02 -0.20 0.00 0.63 0.00 0.00 28.75 30.52 3hu1 h GLU 435 CO 0.56 -0.05 -0.82 0.95 -0.73 0.00 0.00 179.01 178.92 3hu1 s THR 436 N -6.11 1.99 0.16 0.32 -4.23 -1.26 -5.14 115.64 101.36 3hu1 s THR 436 Ca -0.14 -1.83 -0.22 0.00 -1.18 0.00 0.00 61.69 58.33 3hu1 s THR 436 Cb 0.06 -1.86 -0.08 0.00 1.34 0.00 0.00 72.50 71.96 3hu1 s THR 436 CO 0.66 -0.14 0.69 -0.63 -0.54 0.00 0.00 174.62 174.66 3hu1 s ILE 437 N -1.59 4.55 0.32 2.99 -1.09 -1.26 -5.03 121.20 120.08 3hu1 s ILE 437 Ca 0.14 1.41 -0.29 0.00 -2.23 0.00 0.00 60.65 59.68 3hu1 s ILE 437 Cb -0.08 -3.97 -0.12 0.00 -1.58 0.00 0.00 42.46 36.71 3hu1 s ILE 437 CO 0.07 0.43 1.39 -0.67 -1.23 0.00 0.00 174.94 174.92 3hu1 n ASP 438 N 1.33 3.06 -0.20 3.58 -0.08 -1.26 -4.95 116.55 118.03 3hu1 n ASP 438 Ca -0.06 1.19 -0.07 0.00 -1.51 0.00 0.00 54.79 54.34 3hu1 n ASP 438 Cb 0.50 -1.50 0.03 0.00 2.34 0.00 0.00 41.12 42.48 3hu1 n ASP 438 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hu1 h ALA 439 N 3.31 0.73 -0.51 -1.67 0.00 -2.00 -2.81 119.26 116.31 3hu1 h ALA 439 Ca -0.47 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.33 3hu1 h ALA 439 Cb 1.27 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 3hu1 h ALA 439 CO 0.68 0.28 0.33 1.49 0.00 0.00 0.00 179.25 182.03 3hu1 h GLU 440 N 0.76 0.67 -0.96 0.00 4.57 -2.01 -2.85 114.58 114.77 3hu1 h GLU 440 Ca 0.19 -0.05 0.06 0.00 -1.18 0.00 0.00 59.36 58.39 3hu1 h GLU 440 Cb 0.10 -0.15 -0.07 0.00 -0.16 0.00 0.00 28.75 28.48 3hu1 h GLU 440 CO -0.03 0.46 0.62 0.28 -1.18 0.00 0.00 179.01 179.16 3hu1 h VAL 441 N 0.69 1.08 -0.81 0.32 2.07 -1.91 -1.92 116.25 115.77 3hu1 h VAL 441 Ca 0.19 -0.38 -0.04 0.00 0.82 0.00 0.00 66.70 67.28 3hu1 h VAL 441 Cb -0.06 -0.14 -0.04 0.00 -1.52 0.00 0.00 31.29 29.53 3hu1 h VAL 441 CO -0.04 0.20 0.34 -0.03 0.02 0.00 0.00 177.57 178.06 3hu1 h MET 442 N 1.12 1.20 0.09 1.57 1.85 -1.28 -3.15 114.93 116.34 3hu1 h MET 442 Ca 0.42 -0.21 -0.27 0.00 -0.61 0.00 0.00 59.70 59.02 3hu1 h MET 442 Cb 0.16 -0.20 0.02 0.00 0.43 0.00 0.00 31.60 32.01 3hu1 h MET 442 CO -0.17 0.96 -1.16 -0.91 -0.40 0.00 0.00 176.91 175.23 3hu1 h ASN 443 N 1.18 0.66 0.59 1.39 2.35 -1.31 -3.26 115.58 117.19 3hu1 h ASN 443 Ca 0.27 -0.61 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 3hu1 h ASN 443 Cb 0.20 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.36 3hu1 h ASN 443 CO -0.02 1.44 0.00 -1.54 -1.65 0.00 0.00 177.43 175.65 3hu1 n SER 444 N -3.71 0.45 -4.60 5.81 3.41 -0.76 -4.75 113.62 109.47 3hu1 n SER 444 Ca -0.10 0.62 -0.42 0.00 -0.26 0.00 0.00 58.87 58.70 3hu1 n SER 444 Cb 0.95 -0.71 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 3hu1 n SER 444 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hu1 s LEU 445 N -4.01 3.46 -0.02 1.04 1.43 -1.20 -4.97 118.68 114.42 3hu1 s LEU 445 Ca 0.04 1.56 0.02 0.00 -1.03 0.00 0.00 54.13 54.73 3hu1 s LEU 445 Cb 0.09 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.88 3hu1 s LEU 445 CO 0.33 -1.92 -0.07 0.00 0.23 0.00 0.00 176.35 174.91 3hu1 s ALA 446 N 7.98 0.70 -0.28 4.21 0.00 -1.26 -4.80 121.76 128.31 3hu1 s ALA 446 Ca 0.91 -0.28 -0.25 0.00 0.00 0.00 0.00 51.96 52.34 3hu1 s ALA 446 Cb -0.27 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.60 3hu1 s ALA 446 CO 0.34 0.12 0.87 0.08 0.00 0.00 0.00 175.76 177.16 3hu1 s VAL 447 N 0.13 4.76 0.44 0.00 1.01 -0.10 -4.90 120.40 121.75 3hu1 s VAL 447 Ca -0.02 1.49 -0.00 0.00 0.00 0.00 0.00 61.98 63.45 3hu1 s VAL 447 Cb -0.07 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 3hu1 s VAL 447 CO 0.00 -0.21 0.67 0.42 0.00 0.00 0.00 175.10 175.98 3hu1 s THR 448 N 3.03 4.16 0.26 3.92 -4.23 -1.26 -1.83 115.64 119.69 3hu1 s THR 448 Ca 0.36 -0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 60.38 3hu1 s THR 448 Cb -0.14 -3.54 0.26 0.00 1.34 0.00 0.00 72.50 70.42 3hu1 s THR 448 CO 0.10 -0.39 1.88 -0.03 -0.54 0.00 0.00 174.62 175.65 3hu1 h MET 449 N 0.42 1.12 -0.88 3.99 4.05 -1.92 -2.48 114.93 119.24 3hu1 h MET 449 Ca -0.47 -0.07 0.15 0.00 -0.28 0.00 0.00 59.70 59.04 3hu1 h MET 449 Cb 1.25 -0.25 -0.10 0.00 -0.80 0.00 0.00 31.60 31.70 3hu1 h MET 449 CO 0.58 0.74 0.47 0.22 0.23 0.00 0.00 176.91 179.15 3hu1 h ASP 450 N 1.16 0.58 -0.35 1.39 3.58 -1.95 -0.41 116.42 120.40 3hu1 h ASP 450 Ca 0.41 0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.96 3hu1 h ASP 450 Cb 0.13 -0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.16 3hu1 h ASP 450 CO -0.16 0.24 0.23 0.44 -2.88 0.00 0.00 179.24 177.11 3hu1 h ASP 451 N 0.65 0.41 -0.88 2.28 3.32 -1.77 -1.60 116.42 118.84 3hu1 h ASP 451 Ca 0.48 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.53 3hu1 h ASP 451 Cb 0.68 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 40.08 3hu1 h ASP 451 CO -0.36 0.31 0.58 -0.26 -1.72 0.00 0.00 179.24 177.78 3hu1 h PHE 452 N 0.48 1.09 -0.02 4.55 -1.00 -1.19 0.78 116.94 121.62 3hu1 h PHE 452 Ca 0.13 0.03 -0.05 0.00 2.81 0.00 0.00 57.97 60.88 3hu1 h PHE 452 Cb -0.04 -0.37 -0.01 0.00 3.61 0.00 0.00 35.95 39.15 3hu1 h PHE 452 CO -0.05 0.66 -0.23 0.00 -1.61 0.00 0.00 178.31 177.08 3hu1 h ARG 453 N 1.15 0.03 -0.22 1.51 3.08 -0.78 0.34 114.38 119.50 3hu1 h ARG 453 Ca 0.33 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 60.22 3hu1 h ARG 453 Cb -0.08 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3hu1 h ARG 453 CO -0.09 0.26 -0.46 2.35 -1.07 0.00 0.00 179.97 180.96 3hu1 h TRP 454 N 0.03 0.89 -0.76 3.04 7.01 -0.36 -2.19 115.95 123.61 3hu1 h TRP 454 Ca 0.00 -0.33 -0.02 0.00 2.11 0.00 0.00 58.89 60.65 3hu1 h TRP 454 Cb 0.42 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 27.29 3hu1 h TRP 454 CO 0.00 1.11 0.38 0.00 -2.79 0.00 0.00 178.44 177.14 3hu1 h ALA 455 N 0.61 1.25 -0.39 2.65 0.00 -0.15 -2.92 119.26 120.32 3hu1 h ALA 455 Ca 0.00 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 3hu1 h ALA 455 Cb 1.07 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 3hu1 h ALA 455 CO 0.10 0.59 -0.16 -0.07 0.00 0.00 0.00 179.25 179.72 3hu1 h LEU 456 N 1.07 0.70 -1.93 0.00 3.38 -0.27 -2.29 115.31 115.97 3hu1 h LEU 456 Ca 0.26 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3hu1 h LEU 456 Cb 0.08 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 3hu1 h LEU 456 CO -0.04 0.87 -0.10 0.77 0.09 0.00 0.00 178.44 180.04 3hu1 h SER 457 N 0.64 0.00 0.16 -0.43 4.64 -1.20 -2.82 113.55 114.54 3hu1 h SER 457 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3hu1 h SER 457 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3hu1 h SER 457 CO 0.04 0.10 -1.23 0.00 -0.87 0.00 0.00 176.83 174.87 3hu1 n GLN 458 N -3.50 0.25 -0.75 4.77 1.13 -0.93 -5.04 117.38 113.30 3hu1 n GLN 458 Ca -0.02 -0.05 -0.29 0.00 -1.94 0.00 0.00 57.00 54.70 3hu1 n GLN 458 Cb 0.24 -1.54 0.20 0.00 0.11 0.00 0.00 30.24 29.25 3hu1 n GLN 458 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3hu1 s SER 459 N -3.67 2.16 -0.10 1.08 0.15 -0.91 -5.07 113.70 107.34 3hu1 s SER 459 Ca 0.03 1.71 -0.06 0.00 0.70 0.00 0.00 55.95 58.33 3hu1 s SER 459 Cb 0.15 -2.35 0.04 0.00 -1.71 0.00 0.00 66.02 62.15 3hu1 s SER 459 CO 0.85 -3.50 0.25 0.21 1.20 0.00 0.00 173.24 172.25 3hu1 s ASN 460 N -2.79 -0.26 0.45 5.45 3.84 -1.26 -5.08 114.94 115.28 3hu1 s ASN 460 Ca 0.67 0.52 -0.21 0.00 0.21 0.00 0.00 52.86 54.05 3hu1 s ASN 460 Cb -0.23 0.43 -0.10 0.00 -0.55 0.00 0.00 41.25 40.81 3hu1 s ASN 460 CO 0.61 -0.15 1.00 -2.16 -2.79 0.00 0.00 177.10 173.61 3hu1 s PRO 461 N 1.00 4.04 0.00 0.43 0.04 -1.26 -4.93 135.00 134.32 3hu1 s PRO 461 Ca -0.07 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.24 3hu1 s PRO 461 Cb -0.08 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.26 3hu1 s PRO 461 CO -0.07 -0.22 0.00 -1.13 0.04 0.00 0.00 177.00 175.63